USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1027 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 979 SER OG : rot 2:sc= 1.06 USER MOD Set 1.2: A1048 SER OG : rot 180:sc= 0 USER MOD Set 1.3: A1049 GLN : amide:sc= -0.292 X(o=0.77,f=0.76) USER MOD Set 2.1: A1002 MET CE :methyl -112:sc= -2.73 (180deg=-3.69!) USER MOD Set 2.2: A1021 MET CE :methyl -157:sc= -1.27 (180deg=-2.94!) USER MOD Set 3.1: A 928 ASN : amide:sc= -0.759 K(o=-3.5,f=-4.6) USER MOD Set 3.2: A 968 THR OG1 : rot -133:sc= -2.72! USER MOD Single : A 921 SER OG : rot -39:sc= 0.561 USER MOD Single : A 922 ASN : amide:sc= -1.49 K(o=-1.5,f=-0.12) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 94:sc= 1.24 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl -137:sc= -0.723 (180deg=-1.24) USER MOD Single : A 940 SER OG : rot 18:sc= 1.19 USER MOD Single : A 941 SER OG : rot 180:sc= -0.614 USER MOD Single : A 942 LYS NZ :NH3+ 173:sc= 1.21 (180deg=1.14) USER MOD Single : A 944 GLN : amide:sc= -0.954 K(o=-0.95,f=-0.25) USER MOD Single : A 951 TYR OH : rot 180:sc= 0 USER MOD Single : A 954 MET CE :methyl 158:sc= -8.89! (180deg=-12!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 26:sc= 0.228 USER MOD Single : A 972 SER OG : rot -154:sc= -2.51! USER MOD Single : A 980 THR OG1 : rot -178:sc= -1.32 USER MOD Single : A 981 HIS : no HD1:sc= -0.395 X(o=-0.39,f=0) USER MOD Single : A 986 MET CE :methyl 170:sc= -0.0185 (180deg=-0.271) USER MOD Single : A 988 GLN : amide:sc= -1.77 K(o=-1.8,f=0) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 993 SER OG : rot 23:sc= 0.876 USER MOD Single : A1000 ASN : amide:sc= -0.571 K(o=-0.57,f=-0.027) USER MOD Single : A1001 LYS NZ :NH3+ 151:sc= 1 (180deg=0.397) USER MOD Single : A1003 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0075) USER MOD Single : A1006 GLN : amide:sc= -5.45 K(o=-5.4,f=-8.2!) USER MOD Single : A1007 GLN : amide:sc= -0.69 X(o=-0.69,f=-0.24) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1014 GLN : amide:sc= -6.14! C(o=-6.1!,f=-2.9!) USER MOD Single : A1015 GLN : amide:sc= -0.847 K(o=-0.85,f=0) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1018 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1019 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0677) USER MOD Single : A1020 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0 USER MOD Single : A1026 HIS : no HD1:sc= -0.815 K(o=-0.81,f=0.14) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A1041 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1045 LYS NZ :NH3+ -130:sc= 0.0901 (180deg=-0.771) USER MOD Single : A1046 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.373 -19.233 -0.942 1.00 0.00 N ATOM 2 CA ARG A 920 -8.280 -18.566 0.364 1.00 0.00 C ATOM 3 C ARG A 920 -9.378 -17.526 0.565 1.00 0.00 C ATOM 4 O ARG A 920 -9.416 -16.872 1.604 1.00 0.00 O ATOM 5 CB ARG A 920 -6.946 -17.853 0.500 1.00 0.00 C ATOM 6 CG ARG A 920 -5.751 -18.709 0.167 1.00 0.00 C ATOM 7 CD ARG A 920 -5.502 -19.799 1.201 1.00 0.00 C ATOM 8 NE ARG A 920 -6.423 -20.928 1.100 1.00 0.00 N ATOM 9 CZ ARG A 920 -6.338 -22.021 1.863 1.00 0.00 C ATOM 10 NH1 ARG A 920 -5.433 -22.096 2.834 1.00 0.00 N ATOM 11 NH2 ARG A 920 -7.166 -23.035 1.655 1.00 0.00 N ATOM 0 HA ARG A 920 -8.387 -19.350 1.114 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.946 -16.979 -0.152 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -6.844 -17.488 1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -5.899 -19.168 -0.810 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -4.866 -18.077 0.091 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -4.481 -20.164 1.092 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -5.581 -19.366 2.198 1.00 0.00 H new ATOM 0 HE ARG A 920 -7.172 -20.879 0.409 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -4.798 -21.316 3.000 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -5.374 -22.934 3.413 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -7.865 -22.979 0.914 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -7.104 -23.871 2.236 1.00 0.00 H new ATOM 25 N SER A 921 -10.241 -17.357 -0.441 1.00 0.00 N ATOM 26 CA SER A 921 -11.151 -16.212 -0.493 1.00 0.00 C ATOM 27 C SER A 921 -10.317 -14.933 -0.595 1.00 0.00 C ATOM 28 O SER A 921 -10.808 -13.823 -0.401 1.00 0.00 O ATOM 29 CB SER A 921 -12.072 -16.184 0.741 1.00 0.00 C ATOM 30 OG SER A 921 -13.025 -15.138 0.663 1.00 0.00 O ATOM 0 H SER A 921 -10.328 -17.999 -1.229 1.00 0.00 H new ATOM 0 HA SER A 921 -11.797 -16.293 -1.367 1.00 0.00 H new ATOM 0 HB2 SER A 921 -12.588 -17.140 0.831 1.00 0.00 H new ATOM 0 HB3 SER A 921 -11.470 -16.061 1.641 1.00 0.00 H new ATOM 0 HG SER A 921 -12.604 -14.340 0.280 1.00 0.00 H new ATOM 36 N ASN A 922 -9.045 -15.132 -0.960 1.00 0.00 N ATOM 37 CA ASN A 922 -8.041 -14.070 -1.005 1.00 0.00 C ATOM 38 C ASN A 922 -7.958 -13.400 0.332 1.00 0.00 C ATOM 39 O ASN A 922 -8.335 -12.237 0.470 1.00 0.00 O ATOM 40 CB ASN A 922 -8.336 -13.034 -2.089 1.00 0.00 C ATOM 41 CG ASN A 922 -8.915 -13.641 -3.355 1.00 0.00 C ATOM 42 OD1 ASN A 922 -9.761 -13.040 -4.018 1.00 0.00 O ATOM 43 ND2 ASN A 922 -8.447 -14.827 -3.715 1.00 0.00 N ATOM 0 H ASN A 922 -8.683 -16.045 -1.235 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.086 -14.532 -1.253 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -9.034 -12.295 -1.696 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -7.416 -12.504 -2.336 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -8.787 -15.272 -4.567 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -7.746 -15.295 -3.140 1.00 0.00 H new ATOM 50 N ASP A 923 -7.372 -14.155 1.261 1.00 0.00 N ATOM 51 CA ASP A 923 -7.358 -13.871 2.698 1.00 0.00 C ATOM 52 C ASP A 923 -7.000 -12.417 3.019 1.00 0.00 C ATOM 53 O ASP A 923 -6.856 -11.586 2.139 1.00 0.00 O ATOM 54 CB ASP A 923 -6.370 -14.831 3.377 1.00 0.00 C ATOM 55 CG ASP A 923 -6.651 -15.041 4.855 1.00 0.00 C ATOM 56 OD1 ASP A 923 -7.460 -15.930 5.191 1.00 0.00 O ATOM 57 OD2 ASP A 923 -6.055 -14.331 5.687 1.00 0.00 O ATOM 0 H ASP A 923 -6.875 -15.014 1.026 1.00 0.00 H new ATOM 0 HA ASP A 923 -8.367 -14.023 3.081 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -6.403 -15.794 2.868 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -5.358 -14.443 3.259 1.00 0.00 H new ATOM 62 N LYS A 924 -6.866 -12.127 4.297 1.00 0.00 N ATOM 63 CA LYS A 924 -6.597 -10.768 4.805 1.00 0.00 C ATOM 64 C LYS A 924 -5.463 -10.063 4.024 1.00 0.00 C ATOM 65 O LYS A 924 -5.222 -8.870 4.183 1.00 0.00 O ATOM 66 CB LYS A 924 -6.247 -10.851 6.297 1.00 0.00 C ATOM 67 CG LYS A 924 -6.855 -9.752 7.169 1.00 0.00 C ATOM 68 CD LYS A 924 -6.371 -8.370 6.771 1.00 0.00 C ATOM 69 CE LYS A 924 -6.661 -7.328 7.834 1.00 0.00 C ATOM 70 NZ LYS A 924 -8.116 -7.074 8.009 1.00 0.00 N ATOM 0 H LYS A 924 -6.939 -12.828 5.034 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.496 -10.168 4.663 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -6.575 -11.818 6.678 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.163 -10.818 6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -7.942 -9.790 7.093 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -6.602 -9.937 8.213 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -5.298 -8.404 6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -6.849 -8.075 5.837 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -6.237 -7.656 8.783 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -6.163 -6.396 7.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -8.257 -6.354 8.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -8.519 -6.734 7.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -8.591 -7.955 8.290 1.00 0.00 H new ATOM 84 N VAL A 925 -4.801 -10.805 3.156 1.00 0.00 N ATOM 85 CA VAL A 925 -3.791 -10.265 2.280 1.00 0.00 C ATOM 86 C VAL A 925 -4.424 -9.412 1.177 1.00 0.00 C ATOM 87 O VAL A 925 -4.042 -8.261 1.001 1.00 0.00 O ATOM 88 CB VAL A 925 -2.942 -11.390 1.651 1.00 0.00 C ATOM 89 CG1 VAL A 925 -1.734 -11.697 2.523 1.00 0.00 C ATOM 90 CG2 VAL A 925 -3.770 -12.646 1.463 1.00 0.00 C ATOM 0 H VAL A 925 -4.954 -11.807 3.042 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.139 -9.633 2.882 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.598 -11.047 0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -1.147 -12.493 2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.119 -10.802 2.621 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -2.069 -12.016 3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.152 -13.426 1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -4.142 -12.985 2.430 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -4.612 -12.431 0.805 1.00 0.00 H new ATOM 100 N TYR A 926 -5.444 -9.931 0.481 1.00 0.00 N ATOM 101 CA TYR A 926 -6.060 -9.168 -0.602 1.00 0.00 C ATOM 102 C TYR A 926 -6.896 -8.048 0.012 1.00 0.00 C ATOM 103 O TYR A 926 -7.116 -6.996 -0.583 1.00 0.00 O ATOM 104 CB TYR A 926 -6.933 -10.107 -1.447 1.00 0.00 C ATOM 105 CG TYR A 926 -7.998 -9.420 -2.273 1.00 0.00 C ATOM 106 CD1 TYR A 926 -7.698 -8.869 -3.509 1.00 0.00 C ATOM 107 CD2 TYR A 926 -9.308 -9.326 -1.815 1.00 0.00 C ATOM 108 CE1 TYR A 926 -8.669 -8.242 -4.263 1.00 0.00 C ATOM 109 CE2 TYR A 926 -10.284 -8.700 -2.567 1.00 0.00 C ATOM 110 CZ TYR A 926 -9.957 -8.161 -3.791 1.00 0.00 C ATOM 111 OH TYR A 926 -10.923 -7.531 -4.543 1.00 0.00 O ATOM 0 H TYR A 926 -5.849 -10.853 0.645 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.301 -8.731 -1.250 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.287 -10.676 -2.116 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.416 -10.825 -0.784 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -6.689 -8.931 -3.888 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -9.567 -9.749 -0.856 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -8.417 -7.816 -5.223 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -11.296 -8.634 -2.197 1.00 0.00 H new ATOM 0 HH TYR A 926 -11.779 -7.562 -4.068 1.00 0.00 H new ATOM 121 N GLU A 927 -7.326 -8.300 1.236 1.00 0.00 N ATOM 122 CA GLU A 927 -8.177 -7.388 1.977 1.00 0.00 C ATOM 123 C GLU A 927 -7.417 -6.160 2.475 1.00 0.00 C ATOM 124 O GLU A 927 -7.774 -5.028 2.158 1.00 0.00 O ATOM 125 CB GLU A 927 -8.771 -8.136 3.171 1.00 0.00 C ATOM 126 CG GLU A 927 -9.696 -9.279 2.796 1.00 0.00 C ATOM 127 CD GLU A 927 -10.110 -10.102 4.002 1.00 0.00 C ATOM 128 OE1 GLU A 927 -9.643 -9.802 5.121 1.00 0.00 O ATOM 129 OE2 GLU A 927 -10.905 -11.054 3.838 1.00 0.00 O ATOM 0 H GLU A 927 -7.092 -9.151 1.747 1.00 0.00 H new ATOM 0 HA GLU A 927 -8.960 -7.035 1.306 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -7.957 -8.528 3.780 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.321 -7.428 3.791 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -10.585 -8.879 2.309 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -9.198 -9.924 2.072 1.00 0.00 H new ATOM 136 N ASN A 928 -6.366 -6.393 3.247 1.00 0.00 N ATOM 137 CA ASN A 928 -5.660 -5.311 3.935 1.00 0.00 C ATOM 138 C ASN A 928 -4.968 -4.387 2.953 1.00 0.00 C ATOM 139 O ASN A 928 -4.849 -3.189 3.194 1.00 0.00 O ATOM 140 CB ASN A 928 -4.635 -5.887 4.897 1.00 0.00 C ATOM 141 CG ASN A 928 -4.266 -4.946 6.028 1.00 0.00 C ATOM 142 OD1 ASN A 928 -4.325 -3.728 5.898 1.00 0.00 O ATOM 143 ND2 ASN A 928 -3.865 -5.521 7.151 1.00 0.00 N ATOM 0 H ASN A 928 -5.979 -7.322 3.416 1.00 0.00 H new ATOM 0 HA ASN A 928 -6.400 -4.731 4.487 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.026 -6.813 5.319 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -3.733 -6.145 4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -3.591 -4.947 7.948 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -3.830 -6.538 7.219 1.00 0.00 H new ATOM 150 N VAL A 929 -4.508 -4.937 1.846 1.00 0.00 N ATOM 151 CA VAL A 929 -3.891 -4.119 0.825 1.00 0.00 C ATOM 152 C VAL A 929 -4.942 -3.201 0.190 1.00 0.00 C ATOM 153 O VAL A 929 -4.674 -2.035 -0.094 1.00 0.00 O ATOM 154 CB VAL A 929 -3.177 -4.979 -0.237 1.00 0.00 C ATOM 155 CG1 VAL A 929 -4.157 -5.879 -0.968 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.403 -4.089 -1.198 1.00 0.00 C ATOM 0 H VAL A 929 -4.549 -5.934 1.634 1.00 0.00 H new ATOM 0 HA VAL A 929 -3.126 -3.500 1.293 1.00 0.00 H new ATOM 0 HB VAL A 929 -2.465 -5.632 0.267 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -3.622 -6.472 -1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -4.643 -6.544 -0.254 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -4.910 -5.268 -1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.903 -4.707 -1.944 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -3.091 -3.406 -1.696 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -1.660 -3.516 -0.644 1.00 0.00 H new ATOM 166 N THR A 930 -6.135 -3.741 -0.049 1.00 0.00 N ATOM 167 CA THR A 930 -7.294 -2.921 -0.377 1.00 0.00 C ATOM 168 C THR A 930 -7.510 -1.839 0.686 1.00 0.00 C ATOM 169 O THR A 930 -7.943 -0.732 0.378 1.00 0.00 O ATOM 170 CB THR A 930 -8.562 -3.790 -0.521 1.00 0.00 C ATOM 171 OG1 THR A 930 -8.334 -4.810 -1.501 1.00 0.00 O ATOM 172 CG2 THR A 930 -9.766 -2.955 -0.936 1.00 0.00 C ATOM 0 H THR A 930 -6.322 -4.743 -0.021 1.00 0.00 H new ATOM 0 HA THR A 930 -7.101 -2.435 -1.333 1.00 0.00 H new ATOM 0 HB THR A 930 -8.775 -4.239 0.449 1.00 0.00 H new ATOM 0 HG1 THR A 930 -8.032 -5.629 -1.056 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.641 -3.599 -1.028 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.956 -2.190 -0.183 1.00 0.00 H new ATOM 0 HG23 THR A 930 -9.564 -2.477 -1.895 1.00 0.00 H new ATOM 180 N GLY A 931 -7.157 -2.158 1.929 1.00 0.00 N ATOM 181 CA GLY A 931 -7.235 -1.192 3.010 1.00 0.00 C ATOM 182 C GLY A 931 -6.236 -0.064 2.823 1.00 0.00 C ATOM 183 O GLY A 931 -6.492 1.073 3.207 1.00 0.00 O ATOM 0 H GLY A 931 -6.815 -3.078 2.207 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.243 -0.781 3.060 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.047 -1.692 3.960 1.00 0.00 H new ATOM 187 N LEU A 932 -5.102 -0.387 2.217 1.00 0.00 N ATOM 188 CA LEU A 932 -4.107 0.613 1.852 1.00 0.00 C ATOM 189 C LEU A 932 -4.709 1.605 0.861 1.00 0.00 C ATOM 190 O LEU A 932 -4.654 2.819 1.068 1.00 0.00 O ATOM 191 CB LEU A 932 -2.868 -0.079 1.271 1.00 0.00 C ATOM 192 CG LEU A 932 -1.833 0.824 0.588 1.00 0.00 C ATOM 193 CD1 LEU A 932 -1.393 1.954 1.496 1.00 0.00 C ATOM 194 CD2 LEU A 932 -0.627 0.007 0.167 1.00 0.00 C ATOM 0 H LEU A 932 -4.846 -1.342 1.966 1.00 0.00 H new ATOM 0 HA LEU A 932 -3.800 1.168 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -2.370 -0.619 2.077 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -3.201 -0.823 0.547 1.00 0.00 H new ATOM 0 HG LEU A 932 -2.305 1.262 -0.292 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -0.660 2.572 0.978 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -2.257 2.563 1.764 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.946 1.541 2.400 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.102 0.657 -0.317 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -0.175 -0.454 1.045 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -0.939 -0.770 -0.531 1.00 0.00 H new ATOM 206 N VAL A 933 -5.313 1.081 -0.202 1.00 0.00 N ATOM 207 CA VAL A 933 -6.037 1.914 -1.163 1.00 0.00 C ATOM 208 C VAL A 933 -7.202 2.653 -0.481 1.00 0.00 C ATOM 209 O VAL A 933 -7.561 3.762 -0.860 1.00 0.00 O ATOM 210 CB VAL A 933 -6.567 1.081 -2.350 1.00 0.00 C ATOM 211 CG1 VAL A 933 -7.244 1.975 -3.379 1.00 0.00 C ATOM 212 CG2 VAL A 933 -5.439 0.288 -2.993 1.00 0.00 C ATOM 0 H VAL A 933 -5.317 0.085 -0.421 1.00 0.00 H new ATOM 0 HA VAL A 933 -5.330 2.648 -1.550 1.00 0.00 H new ATOM 0 HB VAL A 933 -7.308 0.379 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -7.609 1.366 -4.206 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -8.081 2.495 -2.914 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -6.527 2.705 -3.755 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.832 -0.293 -3.827 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.674 0.974 -3.357 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -5.002 -0.386 -2.256 1.00 0.00 H new ATOM 222 N LYS A 934 -7.774 2.025 0.534 1.00 0.00 N ATOM 223 CA LYS A 934 -8.911 2.590 1.258 1.00 0.00 C ATOM 224 C LYS A 934 -8.474 3.771 2.132 1.00 0.00 C ATOM 225 O LYS A 934 -9.133 4.812 2.173 1.00 0.00 O ATOM 226 CB LYS A 934 -9.584 1.507 2.111 1.00 0.00 C ATOM 227 CG LYS A 934 -10.938 1.017 1.590 1.00 0.00 C ATOM 228 CD LYS A 934 -10.855 0.228 0.281 1.00 0.00 C ATOM 229 CE LYS A 934 -10.490 1.097 -0.912 1.00 0.00 C ATOM 230 NZ LYS A 934 -10.806 0.433 -2.205 1.00 0.00 N ATOM 0 H LYS A 934 -7.469 1.115 0.880 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.632 2.962 0.530 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -8.910 0.653 2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -9.719 1.894 3.121 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -11.403 0.390 2.351 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -11.591 1.877 1.443 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -10.114 -0.565 0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -11.814 -0.255 0.092 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -11.028 2.043 -0.849 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.426 1.333 -0.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -10.541 1.060 -2.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -10.273 -0.457 -2.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -11.825 0.231 -2.252 1.00 0.00 H new ATOM 244 N ALA A 935 -7.358 3.617 2.821 1.00 0.00 N ATOM 245 CA ALA A 935 -6.851 4.675 3.679 1.00 0.00 C ATOM 246 C ALA A 935 -6.205 5.790 2.863 1.00 0.00 C ATOM 247 O ALA A 935 -6.136 6.930 3.310 1.00 0.00 O ATOM 248 CB ALA A 935 -5.888 4.121 4.707 1.00 0.00 C ATOM 0 H ALA A 935 -6.786 2.773 2.804 1.00 0.00 H new ATOM 0 HA ALA A 935 -7.698 5.108 4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.522 4.932 5.337 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.400 3.384 5.325 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -5.047 3.648 4.200 1.00 0.00 H new ATOM 254 N VAL A 936 -5.724 5.480 1.667 1.00 0.00 N ATOM 255 CA VAL A 936 -5.234 6.534 0.794 1.00 0.00 C ATOM 256 C VAL A 936 -6.420 7.287 0.179 1.00 0.00 C ATOM 257 O VAL A 936 -6.269 8.374 -0.381 1.00 0.00 O ATOM 258 CB VAL A 936 -4.260 6.020 -0.299 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.970 5.168 -1.332 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.543 7.180 -0.973 1.00 0.00 C ATOM 0 H VAL A 936 -5.663 4.535 1.288 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.648 7.220 1.406 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.521 5.391 0.198 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -4.252 4.828 -2.079 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -5.421 4.304 -0.843 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.748 5.758 -1.818 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.866 6.795 -1.735 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -4.276 7.840 -1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.973 7.737 -0.229 1.00 0.00 H new ATOM 270 N ILE A 937 -7.618 6.712 0.310 1.00 0.00 N ATOM 271 CA ILE A 937 -8.846 7.433 -0.012 1.00 0.00 C ATOM 272 C ILE A 937 -9.087 8.505 1.052 1.00 0.00 C ATOM 273 O ILE A 937 -9.624 9.577 0.763 1.00 0.00 O ATOM 274 CB ILE A 937 -10.075 6.495 -0.115 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.918 5.529 -1.293 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.362 7.294 -0.265 1.00 0.00 C ATOM 277 CD1 ILE A 937 -9.777 6.216 -2.637 1.00 0.00 C ATOM 0 H ILE A 937 -7.761 5.756 0.635 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.720 7.893 -0.992 1.00 0.00 H new ATOM 0 HB ILE A 937 -10.133 5.919 0.809 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -9.042 4.903 -1.122 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -10.783 4.866 -1.324 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -12.208 6.611 -0.335 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.490 7.943 0.601 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.310 7.901 -1.169 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -9.670 5.465 -3.420 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -10.663 6.820 -2.832 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -8.896 6.858 -2.627 1.00 0.00 H new ATOM 289 N GLU A 938 -8.647 8.221 2.278 1.00 0.00 N ATOM 290 CA GLU A 938 -8.655 9.223 3.349 1.00 0.00 C ATOM 291 C GLU A 938 -7.839 10.431 2.920 1.00 0.00 C ATOM 292 O GLU A 938 -8.218 11.569 3.158 1.00 0.00 O ATOM 293 CB GLU A 938 -8.059 8.661 4.639 1.00 0.00 C ATOM 294 CG GLU A 938 -8.882 7.546 5.261 1.00 0.00 C ATOM 295 CD GLU A 938 -10.177 8.054 5.850 1.00 0.00 C ATOM 296 OE1 GLU A 938 -11.185 8.129 5.115 1.00 0.00 O ATOM 297 OE2 GLU A 938 -10.191 8.391 7.050 1.00 0.00 O ATOM 0 H GLU A 938 -8.282 7.310 2.555 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.691 9.507 3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -7.056 8.287 4.432 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.955 9.470 5.362 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -9.100 6.792 4.505 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.298 7.056 6.040 1.00 0.00 H new ATOM 304 N MET A 939 -6.719 10.147 2.275 1.00 0.00 N ATOM 305 CA MET A 939 -5.843 11.193 1.753 1.00 0.00 C ATOM 306 C MET A 939 -6.612 12.115 0.807 1.00 0.00 C ATOM 307 O MET A 939 -6.520 13.340 0.905 1.00 0.00 O ATOM 308 CB MET A 939 -4.651 10.587 1.015 1.00 0.00 C ATOM 309 CG MET A 939 -3.660 11.623 0.502 1.00 0.00 C ATOM 310 SD MET A 939 -2.481 10.933 -0.675 1.00 0.00 S ATOM 311 CE MET A 939 -3.555 10.600 -2.069 1.00 0.00 C ATOM 0 H MET A 939 -6.391 9.198 2.098 1.00 0.00 H new ATOM 0 HA MET A 939 -5.476 11.773 2.600 1.00 0.00 H new ATOM 0 HB2 MET A 939 -4.132 9.900 1.683 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.016 9.998 0.174 1.00 0.00 H new ATOM 0 HG2 MET A 939 -4.206 12.439 0.028 1.00 0.00 H new ATOM 0 HG3 MET A 939 -3.118 12.050 1.345 1.00 0.00 H new ATOM 0 HE1 MET A 939 -3.313 9.624 -2.490 1.00 0.00 H new ATOM 0 HE2 MET A 939 -4.593 10.605 -1.738 1.00 0.00 H new ATOM 0 HE3 MET A 939 -3.413 11.368 -2.829 1.00 0.00 H new ATOM 321 N SER A 940 -7.400 11.527 -0.086 1.00 0.00 N ATOM 322 CA SER A 940 -8.151 12.310 -1.057 1.00 0.00 C ATOM 323 C SER A 940 -9.336 13.044 -0.413 1.00 0.00 C ATOM 324 O SER A 940 -9.690 14.149 -0.830 1.00 0.00 O ATOM 325 CB SER A 940 -8.621 11.423 -2.216 1.00 0.00 C ATOM 326 OG SER A 940 -9.251 10.241 -1.750 1.00 0.00 O ATOM 0 H SER A 940 -7.534 10.518 -0.157 1.00 0.00 H new ATOM 0 HA SER A 940 -7.479 13.072 -1.452 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.315 11.982 -2.844 1.00 0.00 H new ATOM 0 HB3 SER A 940 -7.768 11.159 -2.841 1.00 0.00 H new ATOM 0 HG SER A 940 -9.518 10.359 -0.814 1.00 0.00 H new ATOM 332 N SER A 941 -9.926 12.463 0.625 1.00 0.00 N ATOM 333 CA SER A 941 -11.089 13.077 1.242 1.00 0.00 C ATOM 334 C SER A 941 -10.618 14.206 2.133 1.00 0.00 C ATOM 335 O SER A 941 -11.194 15.294 2.161 1.00 0.00 O ATOM 336 CB SER A 941 -11.898 12.043 2.027 1.00 0.00 C ATOM 337 OG SER A 941 -11.056 11.222 2.817 1.00 0.00 O ATOM 0 H SER A 941 -9.624 11.585 1.048 1.00 0.00 H new ATOM 0 HA SER A 941 -11.750 13.477 0.474 1.00 0.00 H new ATOM 0 HB2 SER A 941 -12.618 12.552 2.668 1.00 0.00 H new ATOM 0 HB3 SER A 941 -12.469 11.423 1.335 1.00 0.00 H new ATOM 0 HG SER A 941 -11.600 10.572 3.308 1.00 0.00 H new ATOM 343 N LYS A 942 -9.527 13.920 2.824 1.00 0.00 N ATOM 344 CA LYS A 942 -8.837 14.881 3.657 1.00 0.00 C ATOM 345 C LYS A 942 -8.521 16.154 2.892 1.00 0.00 C ATOM 346 O LYS A 942 -8.773 17.252 3.375 1.00 0.00 O ATOM 347 CB LYS A 942 -7.544 14.250 4.161 1.00 0.00 C ATOM 348 CG LYS A 942 -7.593 13.827 5.611 1.00 0.00 C ATOM 349 CD LYS A 942 -7.209 14.986 6.498 1.00 0.00 C ATOM 350 CE LYS A 942 -7.677 14.782 7.932 1.00 0.00 C ATOM 351 NZ LYS A 942 -7.038 13.607 8.585 1.00 0.00 N ATOM 0 H LYS A 942 -9.092 12.998 2.819 1.00 0.00 H new ATOM 0 HA LYS A 942 -9.484 15.149 4.493 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -7.312 13.380 3.547 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -6.728 14.961 4.027 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -8.595 13.481 5.864 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.915 12.990 5.778 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -6.126 15.111 6.484 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.641 15.905 6.102 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -7.458 15.678 8.512 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -8.759 14.653 7.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -7.300 13.584 9.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -7.362 12.734 8.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -6.004 13.681 8.498 1.00 0.00 H new ATOM 365 N ILE A 943 -7.982 16.006 1.692 1.00 0.00 N ATOM 366 CA ILE A 943 -7.553 17.158 0.913 1.00 0.00 C ATOM 367 C ILE A 943 -8.747 17.966 0.402 1.00 0.00 C ATOM 368 O ILE A 943 -8.609 19.145 0.076 1.00 0.00 O ATOM 369 CB ILE A 943 -6.630 16.753 -0.268 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.939 17.984 -0.865 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.409 16.015 -1.345 1.00 0.00 C ATOM 372 CD1 ILE A 943 -4.911 17.651 -1.928 1.00 0.00 C ATOM 0 H ILE A 943 -7.832 15.105 1.238 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.974 17.789 1.587 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.867 16.080 0.124 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -6.695 18.640 -1.296 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -5.453 18.541 -0.064 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.737 15.744 -2.159 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.849 15.112 -0.922 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -8.201 16.659 -1.727 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.465 18.572 -2.304 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -4.133 17.020 -1.497 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -5.395 17.121 -2.749 1.00 0.00 H new ATOM 384 N GLN A 944 -9.917 17.329 0.311 1.00 0.00 N ATOM 385 CA GLN A 944 -11.120 18.027 -0.135 1.00 0.00 C ATOM 386 C GLN A 944 -11.406 19.269 0.727 1.00 0.00 C ATOM 387 O GLN A 944 -11.406 20.386 0.203 1.00 0.00 O ATOM 388 CB GLN A 944 -12.342 17.096 -0.169 1.00 0.00 C ATOM 389 CG GLN A 944 -12.226 15.950 -1.167 1.00 0.00 C ATOM 390 CD GLN A 944 -11.888 16.421 -2.564 1.00 0.00 C ATOM 391 OE1 GLN A 944 -12.767 16.772 -3.352 1.00 0.00 O ATOM 392 NE2 GLN A 944 -10.612 16.394 -2.889 1.00 0.00 N ATOM 0 H GLN A 944 -10.054 16.344 0.537 1.00 0.00 H new ATOM 0 HA GLN A 944 -10.930 18.361 -1.155 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -12.497 16.681 0.827 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -13.227 17.685 -0.410 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -11.458 15.255 -0.827 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -13.166 15.399 -1.192 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -9.917 16.096 -2.204 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -10.318 16.671 -3.826 1.00 0.00 H new ATOM 401 N PRO A 945 -11.657 19.128 2.053 1.00 0.00 N ATOM 402 CA PRO A 945 -11.938 20.275 2.909 1.00 0.00 C ATOM 403 C PRO A 945 -10.700 20.855 3.605 1.00 0.00 C ATOM 404 O PRO A 945 -10.622 22.062 3.844 1.00 0.00 O ATOM 405 CB PRO A 945 -12.905 19.700 3.953 1.00 0.00 C ATOM 406 CG PRO A 945 -12.808 18.204 3.847 1.00 0.00 C ATOM 407 CD PRO A 945 -11.748 17.892 2.824 1.00 0.00 C ATOM 0 HA PRO A 945 -12.331 21.108 2.327 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -12.638 20.036 4.955 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -13.924 20.037 3.765 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -12.551 17.767 4.812 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -13.766 17.778 3.549 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -10.797 17.639 3.293 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -12.029 17.046 2.197 1.00 0.00 H new ATOM 415 N ALA A 946 -9.731 20.006 3.917 1.00 0.00 N ATOM 416 CA ALA A 946 -8.616 20.401 4.769 1.00 0.00 C ATOM 417 C ALA A 946 -7.506 21.107 3.986 1.00 0.00 C ATOM 418 O ALA A 946 -7.301 20.852 2.799 1.00 0.00 O ATOM 419 CB ALA A 946 -8.074 19.186 5.504 1.00 0.00 C ATOM 0 H ALA A 946 -9.694 19.039 3.594 1.00 0.00 H new ATOM 0 HA ALA A 946 -8.991 21.123 5.494 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -7.241 19.487 6.139 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -8.862 18.752 6.120 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -7.730 18.447 4.781 1.00 0.00 H new ATOM 425 N PRO A 947 -6.779 22.015 4.658 1.00 0.00 N ATOM 426 CA PRO A 947 -5.713 22.812 4.041 1.00 0.00 C ATOM 427 C PRO A 947 -4.359 22.075 3.986 1.00 0.00 C ATOM 428 O PRO A 947 -4.261 20.917 4.388 1.00 0.00 O ATOM 429 CB PRO A 947 -5.645 24.019 4.978 1.00 0.00 C ATOM 430 CG PRO A 947 -5.971 23.467 6.318 1.00 0.00 C ATOM 431 CD PRO A 947 -6.952 22.351 6.086 1.00 0.00 C ATOM 0 HA PRO A 947 -5.917 23.054 2.998 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -4.655 24.475 4.967 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -6.355 24.791 4.683 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -5.074 23.099 6.816 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -6.400 24.235 6.961 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -6.741 21.494 6.726 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.973 22.666 6.301 1.00 0.00 H new ATOM 439 N PRO A 948 -3.300 22.746 3.474 1.00 0.00 N ATOM 440 CA PRO A 948 -1.932 22.194 3.380 1.00 0.00 C ATOM 441 C PRO A 948 -1.423 21.568 4.682 1.00 0.00 C ATOM 442 O PRO A 948 -0.726 20.524 4.677 1.00 0.00 O ATOM 443 CB PRO A 948 -1.076 23.422 3.024 1.00 0.00 C ATOM 444 CG PRO A 948 -1.977 24.604 3.120 1.00 0.00 C ATOM 445 CD PRO A 948 -3.356 24.086 2.877 1.00 0.00 C ATOM 0 HA PRO A 948 -1.893 21.382 2.654 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -0.233 23.519 3.708 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -0.662 23.329 2.020 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -1.903 25.073 4.101 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -1.708 25.361 2.383 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -4.114 24.710 3.351 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.594 24.047 1.814 1.00 0.00 H new ATOM 453 N GLU A 949 -1.799 22.186 5.792 1.00 0.00 N ATOM 454 CA GLU A 949 -1.442 21.693 7.116 1.00 0.00 C ATOM 455 C GLU A 949 -1.887 20.248 7.289 1.00 0.00 C ATOM 456 O GLU A 949 -1.371 19.521 8.135 1.00 0.00 O ATOM 457 CB GLU A 949 -2.107 22.552 8.180 1.00 0.00 C ATOM 458 CG GLU A 949 -1.781 24.028 8.066 1.00 0.00 C ATOM 459 CD GLU A 949 -2.455 24.847 9.141 1.00 0.00 C ATOM 460 OE1 GLU A 949 -3.696 24.770 9.262 1.00 0.00 O ATOM 461 OE2 GLU A 949 -1.750 25.579 9.866 1.00 0.00 O ATOM 0 H GLU A 949 -2.358 23.039 5.802 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.358 21.744 7.222 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -3.187 22.422 8.116 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -1.801 22.197 9.164 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -0.702 24.166 8.130 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -2.091 24.392 7.087 1.00 0.00 H new ATOM 468 N GLU A 950 -2.834 19.844 6.457 1.00 0.00 N ATOM 469 CA GLU A 950 -3.374 18.502 6.491 1.00 0.00 C ATOM 470 C GLU A 950 -2.896 17.694 5.297 1.00 0.00 C ATOM 471 O GLU A 950 -3.173 16.507 5.219 1.00 0.00 O ATOM 472 CB GLU A 950 -4.897 18.515 6.527 1.00 0.00 C ATOM 473 CG GLU A 950 -5.474 19.001 7.848 1.00 0.00 C ATOM 474 CD GLU A 950 -5.124 18.088 9.008 1.00 0.00 C ATOM 475 OE1 GLU A 950 -5.568 16.920 9.008 1.00 0.00 O ATOM 476 OE2 GLU A 950 -4.410 18.537 9.928 1.00 0.00 O ATOM 0 H GLU A 950 -3.247 20.441 5.740 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.011 18.032 7.405 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -5.265 19.153 5.723 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.265 17.508 6.329 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -5.103 20.005 8.055 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -6.558 19.074 7.762 1.00 0.00 H new ATOM 483 N TYR A 951 -2.170 18.326 4.373 1.00 0.00 N ATOM 484 CA TYR A 951 -1.558 17.590 3.268 1.00 0.00 C ATOM 485 C TYR A 951 -0.655 16.522 3.839 1.00 0.00 C ATOM 486 O TYR A 951 -0.624 15.390 3.368 1.00 0.00 O ATOM 487 CB TYR A 951 -0.715 18.481 2.352 1.00 0.00 C ATOM 488 CG TYR A 951 -1.481 19.430 1.459 1.00 0.00 C ATOM 489 CD1 TYR A 951 -2.868 19.428 1.393 1.00 0.00 C ATOM 490 CD2 TYR A 951 -0.792 20.344 0.682 1.00 0.00 C ATOM 491 CE1 TYR A 951 -3.540 20.316 0.572 1.00 0.00 C ATOM 492 CE2 TYR A 951 -1.448 21.231 -0.136 1.00 0.00 C ATOM 493 CZ TYR A 951 -2.824 21.218 -0.191 1.00 0.00 C ATOM 494 OH TYR A 951 -3.486 22.113 -1.002 1.00 0.00 O ATOM 0 H TYR A 951 -1.994 19.331 4.367 1.00 0.00 H new ATOM 0 HA TYR A 951 -2.369 17.170 2.673 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -0.036 19.066 2.972 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.098 17.840 1.722 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -3.429 18.724 1.990 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.287 20.360 0.720 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -4.619 20.304 0.528 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -0.888 21.935 -0.733 1.00 0.00 H new ATOM 0 HH TYR A 951 -2.834 22.676 -1.469 1.00 0.00 H new ATOM 504 N VAL A 952 0.089 16.886 4.868 1.00 0.00 N ATOM 505 CA VAL A 952 0.946 15.894 5.514 1.00 0.00 C ATOM 506 C VAL A 952 0.149 14.925 6.430 1.00 0.00 C ATOM 507 O VAL A 952 0.351 13.719 6.349 1.00 0.00 O ATOM 508 CB VAL A 952 2.188 16.516 6.223 1.00 0.00 C ATOM 509 CG1 VAL A 952 1.901 17.915 6.750 1.00 0.00 C ATOM 510 CG2 VAL A 952 2.698 15.621 7.346 1.00 0.00 C ATOM 0 H VAL A 952 0.123 17.824 5.267 1.00 0.00 H new ATOM 0 HA VAL A 952 1.352 15.285 4.706 1.00 0.00 H new ATOM 0 HB VAL A 952 2.970 16.597 5.468 1.00 0.00 H new ATOM 0 HG11 VAL A 952 2.793 18.311 7.236 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.621 18.565 5.922 1.00 0.00 H new ATOM 0 HG13 VAL A 952 1.084 17.872 7.470 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.564 16.086 7.817 1.00 0.00 H new ATOM 0 HG22 VAL A 952 1.911 15.484 8.088 1.00 0.00 H new ATOM 0 HG23 VAL A 952 2.984 14.652 6.937 1.00 0.00 H new ATOM 520 N PRO A 953 -0.767 15.394 7.310 1.00 0.00 N ATOM 521 CA PRO A 953 -1.655 14.483 8.061 1.00 0.00 C ATOM 522 C PRO A 953 -2.516 13.566 7.188 1.00 0.00 C ATOM 523 O PRO A 953 -2.874 12.472 7.611 1.00 0.00 O ATOM 524 CB PRO A 953 -2.554 15.423 8.849 1.00 0.00 C ATOM 525 CG PRO A 953 -1.736 16.650 9.012 1.00 0.00 C ATOM 526 CD PRO A 953 -0.950 16.780 7.738 1.00 0.00 C ATOM 0 HA PRO A 953 -1.060 13.798 8.665 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.481 15.630 8.315 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -2.830 14.996 9.813 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.367 17.524 9.175 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.075 16.569 9.875 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.489 17.363 6.991 1.00 0.00 H new ATOM 0 HD3 PRO A 953 0.005 17.279 7.904 1.00 0.00 H new ATOM 534 N MET A 954 -2.872 14.001 5.986 1.00 0.00 N ATOM 535 CA MET A 954 -3.680 13.157 5.112 1.00 0.00 C ATOM 536 C MET A 954 -2.827 12.032 4.547 1.00 0.00 C ATOM 537 O MET A 954 -3.306 10.921 4.303 1.00 0.00 O ATOM 538 CB MET A 954 -4.328 13.957 3.976 1.00 0.00 C ATOM 539 CG MET A 954 -3.366 14.416 2.896 1.00 0.00 C ATOM 540 SD MET A 954 -4.165 15.412 1.624 1.00 0.00 S ATOM 541 CE MET A 954 -4.808 16.756 2.614 1.00 0.00 C ATOM 0 H MET A 954 -2.622 14.911 5.600 1.00 0.00 H new ATOM 0 HA MET A 954 -4.488 12.736 5.711 1.00 0.00 H new ATOM 0 HB2 MET A 954 -5.105 13.346 3.516 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.821 14.832 4.401 1.00 0.00 H new ATOM 0 HG2 MET A 954 -2.563 14.995 3.353 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.905 13.544 2.432 1.00 0.00 H new ATOM 0 HE1 MET A 954 -4.977 17.626 1.980 1.00 0.00 H new ATOM 0 HE2 MET A 954 -5.749 16.452 3.072 1.00 0.00 H new ATOM 0 HE3 MET A 954 -4.090 17.009 3.394 1.00 0.00 H new ATOM 551 N VAL A 955 -1.555 12.319 4.351 1.00 0.00 N ATOM 552 CA VAL A 955 -0.626 11.299 3.940 1.00 0.00 C ATOM 553 C VAL A 955 -0.357 10.361 5.110 1.00 0.00 C ATOM 554 O VAL A 955 0.008 9.203 4.925 1.00 0.00 O ATOM 555 CB VAL A 955 0.684 11.881 3.377 1.00 0.00 C ATOM 556 CG1 VAL A 955 1.750 12.032 4.446 1.00 0.00 C ATOM 557 CG2 VAL A 955 1.157 11.009 2.238 1.00 0.00 C ATOM 0 H VAL A 955 -1.148 13.247 4.470 1.00 0.00 H new ATOM 0 HA VAL A 955 -1.080 10.739 3.122 1.00 0.00 H new ATOM 0 HB VAL A 955 0.490 12.887 3.005 1.00 0.00 H new ATOM 0 HG11 VAL A 955 2.655 12.446 4.001 1.00 0.00 H new ATOM 0 HG12 VAL A 955 1.390 12.702 5.227 1.00 0.00 H new ATOM 0 HG13 VAL A 955 1.972 11.057 4.879 1.00 0.00 H new ATOM 0 HG21 VAL A 955 2.085 11.412 1.832 1.00 0.00 H new ATOM 0 HG22 VAL A 955 1.331 9.997 2.603 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.398 10.988 1.456 1.00 0.00 H new ATOM 567 N LYS A 956 -0.530 10.876 6.326 1.00 0.00 N ATOM 568 CA LYS A 956 -0.435 10.035 7.514 1.00 0.00 C ATOM 569 C LYS A 956 -1.464 8.916 7.413 1.00 0.00 C ATOM 570 O LYS A 956 -1.175 7.762 7.729 1.00 0.00 O ATOM 571 CB LYS A 956 -0.675 10.853 8.786 1.00 0.00 C ATOM 572 CG LYS A 956 -0.659 10.031 10.071 1.00 0.00 C ATOM 573 CD LYS A 956 0.695 9.390 10.334 1.00 0.00 C ATOM 574 CE LYS A 956 1.760 10.426 10.647 1.00 0.00 C ATOM 575 NZ LYS A 956 3.083 9.803 10.904 1.00 0.00 N ATOM 0 H LYS A 956 -0.734 11.858 6.512 1.00 0.00 H new ATOM 0 HA LYS A 956 0.569 9.614 7.570 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.088 11.629 8.855 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.637 11.358 8.703 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -0.924 10.672 10.912 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.420 9.253 10.011 1.00 0.00 H new ATOM 0 HD2 LYS A 956 0.611 8.693 11.167 1.00 0.00 H new ATOM 0 HD3 LYS A 956 0.998 8.810 9.462 1.00 0.00 H new ATOM 0 HE2 LYS A 956 1.843 11.123 9.814 1.00 0.00 H new ATOM 0 HE3 LYS A 956 1.457 11.006 11.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 3.781 10.545 11.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 3.011 9.157 11.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 3.385 9.271 10.063 1.00 0.00 H new ATOM 589 N GLU A 957 -2.662 9.277 6.950 1.00 0.00 N ATOM 590 CA GLU A 957 -3.730 8.311 6.710 1.00 0.00 C ATOM 591 C GLU A 957 -3.242 7.169 5.813 1.00 0.00 C ATOM 592 O GLU A 957 -3.483 5.995 6.107 1.00 0.00 O ATOM 593 CB GLU A 957 -4.928 9.009 6.040 1.00 0.00 C ATOM 594 CG GLU A 957 -5.308 10.347 6.669 1.00 0.00 C ATOM 595 CD GLU A 957 -6.242 10.230 7.856 1.00 0.00 C ATOM 596 OE1 GLU A 957 -5.964 9.438 8.779 1.00 0.00 O ATOM 597 OE2 GLU A 957 -7.255 10.962 7.880 1.00 0.00 O ATOM 0 H GLU A 957 -2.916 10.241 6.733 1.00 0.00 H new ATOM 0 HA GLU A 957 -4.035 7.896 7.671 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.698 9.168 4.987 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.790 8.344 6.081 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.399 10.859 6.985 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.779 10.972 5.910 1.00 0.00 H new ATOM 604 N VAL A 958 -2.540 7.507 4.727 1.00 0.00 N ATOM 605 CA VAL A 958 -1.997 6.480 3.832 1.00 0.00 C ATOM 606 C VAL A 958 -0.906 5.660 4.533 1.00 0.00 C ATOM 607 O VAL A 958 -0.721 4.484 4.235 1.00 0.00 O ATOM 608 CB VAL A 958 -1.442 7.071 2.504 1.00 0.00 C ATOM 609 CG1 VAL A 958 -2.228 8.301 2.101 1.00 0.00 C ATOM 610 CG2 VAL A 958 0.044 7.394 2.590 1.00 0.00 C ATOM 0 H VAL A 958 -2.337 8.467 4.449 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.832 5.827 3.576 1.00 0.00 H new ATOM 0 HB VAL A 958 -1.561 6.304 1.738 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.826 8.701 1.170 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.275 8.033 1.959 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.150 9.055 2.884 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.383 7.804 1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 958 0.212 8.125 3.380 1.00 0.00 H new ATOM 0 HG23 VAL A 958 0.602 6.484 2.813 1.00 0.00 H new ATOM 620 N GLY A 959 -0.197 6.280 5.475 1.00 0.00 N ATOM 621 CA GLY A 959 0.855 5.582 6.199 1.00 0.00 C ATOM 622 C GLY A 959 0.299 4.490 7.091 1.00 0.00 C ATOM 623 O GLY A 959 0.847 3.389 7.158 1.00 0.00 O ATOM 0 H GLY A 959 -0.332 7.253 5.750 1.00 0.00 H new ATOM 0 HA2 GLY A 959 1.558 5.147 5.488 1.00 0.00 H new ATOM 0 HA3 GLY A 959 1.414 6.296 6.804 1.00 0.00 H new ATOM 627 N LEU A 960 -0.805 4.801 7.759 1.00 0.00 N ATOM 628 CA LEU A 960 -1.513 3.816 8.575 1.00 0.00 C ATOM 629 C LEU A 960 -1.957 2.647 7.707 1.00 0.00 C ATOM 630 O LEU A 960 -1.908 1.491 8.128 1.00 0.00 O ATOM 631 CB LEU A 960 -2.726 4.438 9.276 1.00 0.00 C ATOM 632 CG LEU A 960 -2.441 5.126 10.618 1.00 0.00 C ATOM 633 CD1 LEU A 960 -1.491 6.300 10.449 1.00 0.00 C ATOM 634 CD2 LEU A 960 -3.739 5.587 11.263 1.00 0.00 C ATOM 0 H LEU A 960 -1.232 5.728 7.753 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.827 3.459 9.344 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -3.176 5.168 8.603 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -3.468 3.656 9.440 1.00 0.00 H new ATOM 0 HG LEU A 960 -1.960 4.397 11.270 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -1.311 6.765 11.418 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -0.547 5.947 10.034 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -1.933 7.032 9.773 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -3.520 6.073 12.214 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -4.243 6.292 10.602 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -4.385 4.726 11.436 1.00 0.00 H new ATOM 646 N ALA A 961 -2.424 2.975 6.510 1.00 0.00 N ATOM 647 CA ALA A 961 -2.769 1.971 5.511 1.00 0.00 C ATOM 648 C ALA A 961 -1.680 0.912 5.314 1.00 0.00 C ATOM 649 O ALA A 961 -1.955 -0.271 5.488 1.00 0.00 O ATOM 650 CB ALA A 961 -3.073 2.646 4.192 1.00 0.00 C ATOM 0 H ALA A 961 -2.574 3.937 6.205 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.650 1.448 5.883 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.330 1.892 3.448 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.911 3.332 4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -2.197 3.202 3.857 1.00 0.00 H new ATOM 656 N LEU A 962 -0.448 1.300 4.963 1.00 0.00 N ATOM 657 CA LEU A 962 0.606 0.295 4.835 1.00 0.00 C ATOM 658 C LEU A 962 1.019 -0.265 6.195 1.00 0.00 C ATOM 659 O LEU A 962 1.457 -1.404 6.285 1.00 0.00 O ATOM 660 CB LEU A 962 1.812 0.851 4.074 1.00 0.00 C ATOM 661 CG LEU A 962 3.080 -0.014 4.069 1.00 0.00 C ATOM 662 CD1 LEU A 962 3.828 0.170 2.764 1.00 0.00 C ATOM 663 CD2 LEU A 962 3.992 0.356 5.233 1.00 0.00 C ATOM 0 H LEU A 962 -0.166 2.261 4.770 1.00 0.00 H new ATOM 0 HA LEU A 962 0.198 -0.532 4.254 1.00 0.00 H new ATOM 0 HB2 LEU A 962 1.513 1.023 3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.064 1.823 4.498 1.00 0.00 H new ATOM 0 HG LEU A 962 2.781 -1.057 4.175 1.00 0.00 H new ATOM 0 HD11 LEU A 962 4.726 -0.447 2.769 1.00 0.00 H new ATOM 0 HD12 LEU A 962 3.188 -0.127 1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 962 4.108 1.217 2.650 1.00 0.00 H new ATOM 0 HD21 LEU A 962 4.884 -0.270 5.209 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.281 1.404 5.150 1.00 0.00 H new ATOM 0 HD23 LEU A 962 3.464 0.199 6.173 1.00 0.00 H new ATOM 675 N ARG A 963 0.889 0.532 7.248 1.00 0.00 N ATOM 676 CA ARG A 963 1.166 0.051 8.604 1.00 0.00 C ATOM 677 C ARG A 963 0.303 -1.173 8.933 1.00 0.00 C ATOM 678 O ARG A 963 0.825 -2.240 9.272 1.00 0.00 O ATOM 679 CB ARG A 963 0.929 1.160 9.634 1.00 0.00 C ATOM 680 CG ARG A 963 1.152 0.717 11.070 1.00 0.00 C ATOM 681 CD ARG A 963 2.574 0.227 11.294 1.00 0.00 C ATOM 682 NE ARG A 963 2.724 -0.404 12.603 1.00 0.00 N ATOM 683 CZ ARG A 963 3.877 -0.519 13.260 1.00 0.00 C ATOM 684 NH1 ARG A 963 5.002 -0.053 12.731 1.00 0.00 N ATOM 685 NH2 ARG A 963 3.896 -1.100 14.453 1.00 0.00 N ATOM 0 H ARG A 963 0.596 1.508 7.195 1.00 0.00 H new ATOM 0 HA ARG A 963 2.215 -0.243 8.649 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.593 1.996 9.414 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -0.092 1.528 9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 963 0.943 1.548 11.744 1.00 0.00 H new ATOM 0 HG3 ARG A 963 0.450 -0.079 11.318 1.00 0.00 H new ATOM 0 HD2 ARG A 963 2.842 -0.485 10.513 1.00 0.00 H new ATOM 0 HD3 ARG A 963 3.266 1.065 11.212 1.00 0.00 H new ATOM 0 HE ARG A 963 1.887 -0.783 13.045 1.00 0.00 H new ATOM 0 HH11 ARG A 963 4.987 0.397 11.816 1.00 0.00 H new ATOM 0 HH12 ARG A 963 5.881 -0.145 13.240 1.00 0.00 H new ATOM 0 HH21 ARG A 963 3.031 -1.455 14.861 1.00 0.00 H new ATOM 0 HH22 ARG A 963 4.775 -1.191 14.962 1.00 0.00 H new ATOM 699 N THR A 964 -1.013 -1.016 8.835 1.00 0.00 N ATOM 700 CA THR A 964 -1.926 -2.143 9.013 1.00 0.00 C ATOM 701 C THR A 964 -1.616 -3.242 8.002 1.00 0.00 C ATOM 702 O THR A 964 -1.593 -4.425 8.335 1.00 0.00 O ATOM 703 CB THR A 964 -3.402 -1.717 8.862 1.00 0.00 C ATOM 704 OG1 THR A 964 -3.535 -0.727 7.833 1.00 0.00 O ATOM 705 CG2 THR A 964 -3.958 -1.175 10.164 1.00 0.00 C ATOM 0 H THR A 964 -1.470 -0.127 8.635 1.00 0.00 H new ATOM 0 HA THR A 964 -1.779 -2.518 10.026 1.00 0.00 H new ATOM 0 HB THR A 964 -3.973 -2.604 8.587 1.00 0.00 H new ATOM 0 HG1 THR A 964 -2.806 -0.827 7.186 1.00 0.00 H new ATOM 0 HG21 THR A 964 -4.999 -0.884 10.022 1.00 0.00 H new ATOM 0 HG22 THR A 964 -3.898 -1.944 10.934 1.00 0.00 H new ATOM 0 HG23 THR A 964 -3.378 -0.306 10.474 1.00 0.00 H new ATOM 713 N LEU A 965 -1.406 -2.822 6.766 1.00 0.00 N ATOM 714 CA LEU A 965 -0.997 -3.725 5.697 1.00 0.00 C ATOM 715 C LEU A 965 0.217 -4.576 6.092 1.00 0.00 C ATOM 716 O LEU A 965 0.258 -5.766 5.787 1.00 0.00 O ATOM 717 CB LEU A 965 -0.686 -2.919 4.439 1.00 0.00 C ATOM 718 CG LEU A 965 -0.157 -3.719 3.256 1.00 0.00 C ATOM 719 CD1 LEU A 965 -1.155 -4.788 2.844 1.00 0.00 C ATOM 720 CD2 LEU A 965 0.139 -2.784 2.096 1.00 0.00 C ATOM 0 H LEU A 965 -1.513 -1.851 6.473 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.823 -4.410 5.505 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -1.594 -2.402 4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.047 -2.153 4.693 1.00 0.00 H new ATOM 0 HG LEU A 965 0.766 -4.218 3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.759 -5.349 1.997 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -1.327 -5.466 3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -2.096 -4.317 2.559 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.517 -3.360 1.252 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -0.775 -2.268 1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 965 0.887 -2.052 2.400 1.00 0.00 H new ATOM 732 N LEU A 966 1.197 -3.973 6.758 1.00 0.00 N ATOM 733 CA LEU A 966 2.352 -4.712 7.278 1.00 0.00 C ATOM 734 C LEU A 966 1.932 -5.875 8.174 1.00 0.00 C ATOM 735 O LEU A 966 2.570 -6.925 8.160 1.00 0.00 O ATOM 736 CB LEU A 966 3.300 -3.789 8.047 1.00 0.00 C ATOM 737 CG LEU A 966 4.059 -2.772 7.192 1.00 0.00 C ATOM 738 CD1 LEU A 966 4.945 -1.901 8.067 1.00 0.00 C ATOM 739 CD2 LEU A 966 4.889 -3.482 6.130 1.00 0.00 C ATOM 0 H LEU A 966 1.218 -2.972 6.953 1.00 0.00 H new ATOM 0 HA LEU A 966 2.874 -5.119 6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 966 2.724 -3.249 8.799 1.00 0.00 H new ATOM 0 HB3 LEU A 966 4.025 -4.403 8.581 1.00 0.00 H new ATOM 0 HG LEU A 966 3.334 -2.132 6.690 1.00 0.00 H new ATOM 0 HD11 LEU A 966 5.478 -1.183 7.444 1.00 0.00 H new ATOM 0 HD12 LEU A 966 4.329 -1.367 8.791 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.664 -2.528 8.595 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.422 -2.744 5.531 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.607 -4.145 6.613 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.232 -4.066 5.485 1.00 0.00 H new ATOM 751 N ALA A 967 0.873 -5.690 8.952 1.00 0.00 N ATOM 752 CA ALA A 967 0.338 -6.784 9.760 1.00 0.00 C ATOM 753 C ALA A 967 -0.082 -7.943 8.857 1.00 0.00 C ATOM 754 O ALA A 967 0.220 -9.103 9.134 1.00 0.00 O ATOM 755 CB ALA A 967 -0.831 -6.316 10.614 1.00 0.00 C ATOM 0 H ALA A 967 0.372 -4.806 9.042 1.00 0.00 H new ATOM 0 HA ALA A 967 1.122 -7.129 10.434 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.208 -7.151 11.204 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -0.499 -5.521 11.282 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.625 -5.940 9.969 1.00 0.00 H new ATOM 761 N THR A 968 -0.770 -7.620 7.769 1.00 0.00 N ATOM 762 CA THR A 968 -1.105 -8.600 6.748 1.00 0.00 C ATOM 763 C THR A 968 0.142 -9.167 6.066 1.00 0.00 C ATOM 764 O THR A 968 0.197 -10.356 5.749 1.00 0.00 O ATOM 765 CB THR A 968 -2.056 -7.988 5.710 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.400 -8.154 6.158 1.00 0.00 O ATOM 767 CG2 THR A 968 -1.890 -8.615 4.337 1.00 0.00 C ATOM 0 H THR A 968 -1.109 -6.678 7.572 1.00 0.00 H new ATOM 0 HA THR A 968 -1.608 -9.430 7.244 1.00 0.00 H new ATOM 0 HB THR A 968 -1.813 -6.930 5.612 1.00 0.00 H new ATOM 0 HG1 THR A 968 -3.950 -8.495 5.422 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.584 -8.149 3.638 1.00 0.00 H new ATOM 0 HG22 THR A 968 -0.868 -8.464 3.989 1.00 0.00 H new ATOM 0 HG23 THR A 968 -2.098 -9.683 4.397 1.00 0.00 H new ATOM 775 N VAL A 969 1.134 -8.322 5.818 1.00 0.00 N ATOM 776 CA VAL A 969 2.424 -8.788 5.323 1.00 0.00 C ATOM 777 C VAL A 969 3.005 -9.858 6.246 1.00 0.00 C ATOM 778 O VAL A 969 3.683 -10.772 5.793 1.00 0.00 O ATOM 779 CB VAL A 969 3.426 -7.617 5.182 1.00 0.00 C ATOM 780 CG1 VAL A 969 4.811 -8.116 4.791 1.00 0.00 C ATOM 781 CG2 VAL A 969 2.920 -6.608 4.162 1.00 0.00 C ATOM 0 H VAL A 969 1.071 -7.313 5.951 1.00 0.00 H new ATOM 0 HA VAL A 969 2.259 -9.223 4.337 1.00 0.00 H new ATOM 0 HB VAL A 969 3.508 -7.128 6.153 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.491 -7.269 4.700 1.00 0.00 H new ATOM 0 HG12 VAL A 969 5.181 -8.798 5.556 1.00 0.00 H new ATOM 0 HG13 VAL A 969 4.753 -8.639 3.836 1.00 0.00 H new ATOM 0 HG21 VAL A 969 3.635 -5.790 4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 969 2.805 -7.096 3.194 1.00 0.00 H new ATOM 0 HG23 VAL A 969 1.957 -6.214 4.487 1.00 0.00 H new ATOM 791 N ASP A 970 2.711 -9.751 7.535 1.00 0.00 N ATOM 792 CA ASP A 970 3.133 -10.756 8.507 1.00 0.00 C ATOM 793 C ASP A 970 2.332 -12.035 8.376 1.00 0.00 C ATOM 794 O ASP A 970 2.778 -13.080 8.821 1.00 0.00 O ATOM 795 CB ASP A 970 3.021 -10.230 9.938 1.00 0.00 C ATOM 796 CG ASP A 970 4.281 -9.556 10.428 1.00 0.00 C ATOM 797 OD1 ASP A 970 5.301 -10.253 10.586 1.00 0.00 O ATOM 798 OD2 ASP A 970 4.248 -8.335 10.704 1.00 0.00 O ATOM 0 H ASP A 970 2.181 -8.977 7.935 1.00 0.00 H new ATOM 0 HA ASP A 970 4.178 -10.976 8.291 1.00 0.00 H new ATOM 0 HB2 ASP A 970 2.194 -9.522 9.994 1.00 0.00 H new ATOM 0 HB3 ASP A 970 2.778 -11.058 10.604 1.00 0.00 H new ATOM 803 N GLU A 971 1.144 -11.949 7.802 1.00 0.00 N ATOM 804 CA GLU A 971 0.375 -13.144 7.469 1.00 0.00 C ATOM 805 C GLU A 971 1.008 -13.807 6.250 1.00 0.00 C ATOM 806 O GLU A 971 1.215 -15.025 6.196 1.00 0.00 O ATOM 807 CB GLU A 971 -1.077 -12.778 7.159 1.00 0.00 C ATOM 808 CG GLU A 971 -1.699 -11.830 8.169 1.00 0.00 C ATOM 809 CD GLU A 971 -1.874 -12.456 9.538 1.00 0.00 C ATOM 810 OE1 GLU A 971 -2.684 -13.397 9.666 1.00 0.00 O ATOM 811 OE2 GLU A 971 -1.205 -12.011 10.495 1.00 0.00 O ATOM 0 H GLU A 971 0.689 -11.070 7.556 1.00 0.00 H new ATOM 0 HA GLU A 971 0.383 -13.828 8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.124 -12.322 6.170 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -1.671 -13.691 7.118 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.073 -10.942 8.259 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -2.670 -11.500 7.800 1.00 0.00 H new ATOM 818 N SER A 972 1.345 -12.980 5.277 1.00 0.00 N ATOM 819 CA SER A 972 2.003 -13.433 4.076 1.00 0.00 C ATOM 820 C SER A 972 3.433 -13.885 4.375 1.00 0.00 C ATOM 821 O SER A 972 4.014 -14.641 3.610 1.00 0.00 O ATOM 822 CB SER A 972 1.976 -12.331 3.017 1.00 0.00 C ATOM 823 OG SER A 972 2.708 -12.704 1.866 1.00 0.00 O ATOM 0 H SER A 972 1.168 -11.976 5.302 1.00 0.00 H new ATOM 0 HA SER A 972 1.465 -14.296 3.685 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.944 -12.116 2.740 1.00 0.00 H new ATOM 0 HB3 SER A 972 2.392 -11.414 3.433 1.00 0.00 H new ATOM 0 HG SER A 972 3.027 -11.899 1.406 1.00 0.00 H new ATOM 829 N LEU A 973 4.007 -13.367 5.457 1.00 0.00 N ATOM 830 CA LEU A 973 5.375 -13.700 5.850 1.00 0.00 C ATOM 831 C LEU A 973 5.561 -15.199 6.116 1.00 0.00 C ATOM 832 O LEU A 973 6.496 -15.772 5.586 1.00 0.00 O ATOM 833 CB LEU A 973 5.811 -12.878 7.070 1.00 0.00 C ATOM 834 CG LEU A 973 7.258 -13.095 7.522 1.00 0.00 C ATOM 835 CD1 LEU A 973 8.225 -12.658 6.433 1.00 0.00 C ATOM 836 CD2 LEU A 973 7.532 -12.338 8.813 1.00 0.00 C ATOM 0 H LEU A 973 3.542 -12.709 6.083 1.00 0.00 H new ATOM 0 HA LEU A 973 6.015 -13.442 5.006 1.00 0.00 H new ATOM 0 HB2 LEU A 973 5.673 -11.821 6.843 1.00 0.00 H new ATOM 0 HB3 LEU A 973 5.148 -13.114 7.902 1.00 0.00 H new ATOM 0 HG LEU A 973 7.406 -14.159 7.709 1.00 0.00 H new ATOM 0 HD11 LEU A 973 9.249 -12.819 6.770 1.00 0.00 H new ATOM 0 HD12 LEU A 973 8.044 -13.242 5.530 1.00 0.00 H new ATOM 0 HD13 LEU A 973 8.076 -11.600 6.217 1.00 0.00 H new ATOM 0 HD21 LEU A 973 8.565 -12.504 9.120 1.00 0.00 H new ATOM 0 HD22 LEU A 973 7.368 -11.273 8.652 1.00 0.00 H new ATOM 0 HD23 LEU A 973 6.860 -12.695 9.594 1.00 0.00 H new ATOM 848 N PRO A 974 4.725 -15.880 6.937 1.00 0.00 N ATOM 849 CA PRO A 974 4.785 -17.341 7.014 1.00 0.00 C ATOM 850 C PRO A 974 4.480 -17.970 5.661 1.00 0.00 C ATOM 851 O PRO A 974 4.947 -19.070 5.344 1.00 0.00 O ATOM 852 CB PRO A 974 3.724 -17.727 8.047 1.00 0.00 C ATOM 853 CG PRO A 974 2.885 -16.514 8.226 1.00 0.00 C ATOM 854 CD PRO A 974 3.754 -15.338 7.876 1.00 0.00 C ATOM 0 HA PRO A 974 5.777 -17.694 7.296 1.00 0.00 H new ATOM 0 HB2 PRO A 974 3.126 -18.570 7.700 1.00 0.00 H new ATOM 0 HB3 PRO A 974 4.184 -18.029 8.988 1.00 0.00 H new ATOM 0 HG2 PRO A 974 2.006 -16.552 7.582 1.00 0.00 H new ATOM 0 HG3 PRO A 974 2.526 -16.439 9.252 1.00 0.00 H new ATOM 0 HD2 PRO A 974 3.173 -14.532 7.427 1.00 0.00 H new ATOM 0 HD3 PRO A 974 4.241 -14.926 8.760 1.00 0.00 H new ATOM 862 N VAL A 975 3.721 -17.253 4.835 1.00 0.00 N ATOM 863 CA VAL A 975 3.472 -17.734 3.475 1.00 0.00 C ATOM 864 C VAL A 975 4.701 -17.481 2.589 1.00 0.00 C ATOM 865 O VAL A 975 4.805 -18.011 1.491 1.00 0.00 O ATOM 866 CB VAL A 975 2.209 -17.105 2.842 1.00 0.00 C ATOM 867 CG1 VAL A 975 1.744 -17.945 1.668 1.00 0.00 C ATOM 868 CG2 VAL A 975 1.095 -16.977 3.868 1.00 0.00 C ATOM 0 H VAL A 975 3.279 -16.364 5.071 1.00 0.00 H new ATOM 0 HA VAL A 975 3.289 -18.806 3.543 1.00 0.00 H new ATOM 0 HB VAL A 975 2.463 -16.106 2.488 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.854 -17.495 1.228 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.534 -17.993 0.919 1.00 0.00 H new ATOM 0 HG13 VAL A 975 1.509 -18.952 2.012 1.00 0.00 H new ATOM 0 HG21 VAL A 975 0.218 -16.532 3.399 1.00 0.00 H new ATOM 0 HG22 VAL A 975 0.839 -17.964 4.253 1.00 0.00 H new ATOM 0 HG23 VAL A 975 1.428 -16.343 4.689 1.00 0.00 H new ATOM 878 N LEU A 976 5.646 -16.698 3.101 1.00 0.00 N ATOM 879 CA LEU A 976 6.887 -16.389 2.393 1.00 0.00 C ATOM 880 C LEU A 976 7.796 -17.619 2.283 1.00 0.00 C ATOM 881 O LEU A 976 8.197 -17.963 1.173 1.00 0.00 O ATOM 882 CB LEU A 976 7.583 -15.166 3.039 1.00 0.00 C ATOM 883 CG LEU A 976 9.062 -14.905 2.704 1.00 0.00 C ATOM 884 CD1 LEU A 976 9.381 -13.431 2.893 1.00 0.00 C ATOM 885 CD2 LEU A 976 9.993 -15.728 3.584 1.00 0.00 C ATOM 0 H LEU A 976 5.574 -16.259 4.019 1.00 0.00 H new ATOM 0 HA LEU A 976 6.648 -16.112 1.366 1.00 0.00 H new ATOM 0 HB2 LEU A 976 7.018 -14.277 2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 976 7.501 -15.270 4.121 1.00 0.00 H new ATOM 0 HG LEU A 976 9.220 -15.198 1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 976 10.429 -13.252 2.654 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.752 -12.835 2.232 1.00 0.00 H new ATOM 0 HD13 LEU A 976 9.191 -13.147 3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 976 11.028 -15.516 3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 976 9.828 -15.470 4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 976 9.790 -16.789 3.436 1.00 0.00 H new ATOM 897 N PRO A 977 8.136 -18.325 3.392 1.00 0.00 N ATOM 898 CA PRO A 977 8.907 -19.568 3.290 1.00 0.00 C ATOM 899 C PRO A 977 8.074 -20.674 2.661 1.00 0.00 C ATOM 900 O PRO A 977 8.605 -21.674 2.181 1.00 0.00 O ATOM 901 CB PRO A 977 9.260 -19.911 4.737 1.00 0.00 C ATOM 902 CG PRO A 977 8.210 -19.243 5.548 1.00 0.00 C ATOM 903 CD PRO A 977 7.838 -17.996 4.796 1.00 0.00 C ATOM 0 HA PRO A 977 9.789 -19.459 2.659 1.00 0.00 H new ATOM 0 HB2 PRO A 977 9.261 -20.989 4.900 1.00 0.00 H new ATOM 0 HB3 PRO A 977 10.254 -19.548 4.999 1.00 0.00 H new ATOM 0 HG2 PRO A 977 7.345 -19.893 5.678 1.00 0.00 H new ATOM 0 HG3 PRO A 977 8.581 -19.002 6.544 1.00 0.00 H new ATOM 0 HD2 PRO A 977 6.786 -17.746 4.933 1.00 0.00 H new ATOM 0 HD3 PRO A 977 8.416 -17.137 5.136 1.00 0.00 H new ATOM 911 N ALA A 978 6.756 -20.493 2.689 1.00 0.00 N ATOM 912 CA ALA A 978 5.861 -21.384 1.976 1.00 0.00 C ATOM 913 C ALA A 978 6.032 -21.226 0.465 1.00 0.00 C ATOM 914 O ALA A 978 6.313 -22.200 -0.234 1.00 0.00 O ATOM 915 CB ALA A 978 4.417 -21.128 2.384 1.00 0.00 C ATOM 0 H ALA A 978 6.291 -19.740 3.196 1.00 0.00 H new ATOM 0 HA ALA A 978 6.115 -22.410 2.241 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.759 -21.805 1.839 1.00 0.00 H new ATOM 0 HB2 ALA A 978 4.306 -21.298 3.455 1.00 0.00 H new ATOM 0 HB3 ALA A 978 4.150 -20.097 2.150 1.00 0.00 H new ATOM 921 N SER A 979 5.886 -19.996 -0.029 1.00 0.00 N ATOM 922 CA SER A 979 5.937 -19.734 -1.469 1.00 0.00 C ATOM 923 C SER A 979 6.088 -18.231 -1.797 1.00 0.00 C ATOM 924 O SER A 979 6.770 -17.860 -2.752 1.00 0.00 O ATOM 925 CB SER A 979 4.664 -20.281 -2.134 1.00 0.00 C ATOM 926 OG SER A 979 4.673 -21.701 -2.209 1.00 0.00 O ATOM 0 H SER A 979 5.732 -19.167 0.545 1.00 0.00 H new ATOM 0 HA SER A 979 6.820 -20.239 -1.860 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.790 -19.953 -1.571 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.571 -19.865 -3.137 1.00 0.00 H new ATOM 0 HG SER A 979 5.486 -22.046 -1.785 1.00 0.00 H new ATOM 932 N THR A 980 5.463 -17.380 -0.987 1.00 0.00 N ATOM 933 CA THR A 980 5.301 -15.950 -1.288 1.00 0.00 C ATOM 934 C THR A 980 6.613 -15.159 -1.363 1.00 0.00 C ATOM 935 O THR A 980 6.631 -14.071 -1.937 1.00 0.00 O ATOM 936 CB THR A 980 4.371 -15.278 -0.265 1.00 0.00 C ATOM 937 OG1 THR A 980 3.174 -16.041 -0.142 1.00 0.00 O ATOM 938 CG2 THR A 980 4.016 -13.863 -0.692 1.00 0.00 C ATOM 0 H THR A 980 5.050 -17.659 -0.097 1.00 0.00 H new ATOM 0 HA THR A 980 4.863 -15.926 -2.286 1.00 0.00 H new ATOM 0 HB THR A 980 4.892 -15.232 0.691 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.567 -15.598 0.487 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.357 -13.413 0.051 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.926 -13.269 -0.777 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.509 -13.890 -1.657 1.00 0.00 H new ATOM 946 N HIS A 981 7.697 -15.694 -0.803 1.00 0.00 N ATOM 947 CA HIS A 981 8.964 -14.951 -0.668 1.00 0.00 C ATOM 948 C HIS A 981 9.402 -14.271 -1.970 1.00 0.00 C ATOM 949 O HIS A 981 10.085 -13.255 -1.933 1.00 0.00 O ATOM 950 CB HIS A 981 10.075 -15.906 -0.190 1.00 0.00 C ATOM 951 CG HIS A 981 11.434 -15.274 -0.048 1.00 0.00 C ATOM 952 ND1 HIS A 981 12.600 -15.914 -0.407 1.00 0.00 N ATOM 953 CD2 HIS A 981 11.809 -14.061 0.426 1.00 0.00 C ATOM 954 CE1 HIS A 981 13.626 -15.123 -0.167 1.00 0.00 C ATOM 955 NE2 HIS A 981 13.175 -13.991 0.339 1.00 0.00 N ATOM 0 H HIS A 981 7.730 -16.643 -0.432 1.00 0.00 H new ATOM 0 HA HIS A 981 8.793 -14.162 0.064 1.00 0.00 H new ATOM 0 HB2 HIS A 981 9.783 -16.327 0.772 1.00 0.00 H new ATOM 0 HB3 HIS A 981 10.148 -16.736 -0.892 1.00 0.00 H new ATOM 0 HD2 HIS A 981 11.152 -13.291 0.803 1.00 0.00 H new ATOM 0 HE1 HIS A 981 14.663 -15.361 -0.353 1.00 0.00 H new ATOM 0 HE2 HIS A 981 13.748 -13.195 0.619 1.00 0.00 H new ATOM 964 N ARG A 982 8.997 -14.795 -3.106 1.00 0.00 N ATOM 965 CA ARG A 982 9.344 -14.148 -4.365 1.00 0.00 C ATOM 966 C ARG A 982 8.550 -12.847 -4.564 1.00 0.00 C ATOM 967 O ARG A 982 9.139 -11.769 -4.720 1.00 0.00 O ATOM 968 CB ARG A 982 9.099 -15.108 -5.534 1.00 0.00 C ATOM 969 CG ARG A 982 9.365 -14.503 -6.905 1.00 0.00 C ATOM 970 CD ARG A 982 10.757 -13.898 -6.999 1.00 0.00 C ATOM 971 NE ARG A 982 11.814 -14.875 -6.749 1.00 0.00 N ATOM 972 CZ ARG A 982 13.090 -14.552 -6.548 1.00 0.00 C ATOM 973 NH1 ARG A 982 13.455 -13.276 -6.506 1.00 0.00 N ATOM 974 NH2 ARG A 982 14.001 -15.502 -6.371 1.00 0.00 N ATOM 0 H ARG A 982 8.441 -15.646 -3.191 1.00 0.00 H new ATOM 0 HA ARG A 982 10.402 -13.889 -4.332 1.00 0.00 H new ATOM 0 HB2 ARG A 982 9.733 -15.986 -5.408 1.00 0.00 H new ATOM 0 HB3 ARG A 982 8.066 -15.453 -5.496 1.00 0.00 H new ATOM 0 HG2 ARG A 982 9.251 -15.272 -7.669 1.00 0.00 H new ATOM 0 HG3 ARG A 982 8.621 -13.734 -7.113 1.00 0.00 H new ATOM 0 HD2 ARG A 982 10.895 -13.465 -7.990 1.00 0.00 H new ATOM 0 HD3 ARG A 982 10.844 -13.083 -6.281 1.00 0.00 H new ATOM 0 HE ARG A 982 11.560 -15.863 -6.727 1.00 0.00 H new ATOM 0 HH11 ARG A 982 12.758 -12.542 -6.628 1.00 0.00 H new ATOM 0 HH12 ARG A 982 14.433 -13.030 -6.352 1.00 0.00 H new ATOM 0 HH21 ARG A 982 13.724 -16.484 -6.389 1.00 0.00 H new ATOM 0 HH22 ARG A 982 14.977 -15.250 -6.217 1.00 0.00 H new ATOM 988 N GLU A 983 7.224 -12.928 -4.519 1.00 0.00 N ATOM 989 CA GLU A 983 6.401 -11.740 -4.729 1.00 0.00 C ATOM 990 C GLU A 983 6.434 -10.786 -3.551 1.00 0.00 C ATOM 991 O GLU A 983 6.499 -9.570 -3.739 1.00 0.00 O ATOM 992 CB GLU A 983 4.951 -12.113 -4.985 1.00 0.00 C ATOM 993 CG GLU A 983 4.334 -11.320 -6.118 1.00 0.00 C ATOM 994 CD GLU A 983 4.501 -12.013 -7.453 1.00 0.00 C ATOM 995 OE1 GLU A 983 4.171 -13.215 -7.540 1.00 0.00 O ATOM 996 OE2 GLU A 983 4.962 -11.374 -8.418 1.00 0.00 O ATOM 0 H GLU A 983 6.703 -13.787 -4.342 1.00 0.00 H new ATOM 0 HA GLU A 983 6.828 -11.243 -5.600 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.889 -13.176 -5.216 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.372 -11.950 -4.076 1.00 0.00 H new ATOM 0 HG2 GLU A 983 3.273 -11.169 -5.919 1.00 0.00 H new ATOM 0 HG3 GLU A 983 4.794 -10.333 -6.162 1.00 0.00 H new ATOM 1003 N ILE A 984 6.359 -11.322 -2.343 1.00 0.00 N ATOM 1004 CA ILE A 984 6.253 -10.479 -1.161 1.00 0.00 C ATOM 1005 C ILE A 984 7.448 -9.543 -1.075 1.00 0.00 C ATOM 1006 O ILE A 984 7.327 -8.421 -0.607 1.00 0.00 O ATOM 1007 CB ILE A 984 6.118 -11.306 0.139 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.799 -10.393 1.327 1.00 0.00 C ATOM 1009 CG2 ILE A 984 7.384 -12.105 0.409 1.00 0.00 C ATOM 1010 CD1 ILE A 984 5.643 -11.128 2.644 1.00 0.00 C ATOM 0 H ILE A 984 6.369 -12.325 -2.155 1.00 0.00 H new ATOM 0 HA ILE A 984 5.341 -9.890 -1.262 1.00 0.00 H new ATOM 0 HB ILE A 984 5.294 -12.007 0.009 1.00 0.00 H new ATOM 0 HG12 ILE A 984 6.593 -9.653 1.427 1.00 0.00 H new ATOM 0 HG13 ILE A 984 4.880 -9.847 1.116 1.00 0.00 H new ATOM 0 HG21 ILE A 984 7.264 -12.678 1.328 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.568 -12.786 -0.422 1.00 0.00 H new ATOM 0 HG23 ILE A 984 8.229 -11.424 0.514 1.00 0.00 H new ATOM 0 HD11 ILE A 984 5.418 -10.413 3.435 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.829 -11.849 2.564 1.00 0.00 H new ATOM 0 HD13 ILE A 984 6.569 -11.652 2.880 1.00 0.00 H new ATOM 1022 N GLU A 985 8.586 -9.994 -1.575 1.00 0.00 N ATOM 1023 CA GLU A 985 9.776 -9.162 -1.611 1.00 0.00 C ATOM 1024 C GLU A 985 9.657 -8.072 -2.669 1.00 0.00 C ATOM 1025 O GLU A 985 10.098 -6.946 -2.445 1.00 0.00 O ATOM 1026 CB GLU A 985 11.024 -10.002 -1.863 1.00 0.00 C ATOM 1027 CG GLU A 985 11.452 -10.821 -0.659 1.00 0.00 C ATOM 1028 CD GLU A 985 11.830 -9.960 0.530 1.00 0.00 C ATOM 1029 OE1 GLU A 985 12.966 -9.438 0.551 1.00 0.00 O ATOM 1030 OE2 GLU A 985 11.008 -9.818 1.456 1.00 0.00 O ATOM 0 H GLU A 985 8.711 -10.930 -1.961 1.00 0.00 H new ATOM 0 HA GLU A 985 9.869 -8.685 -0.635 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.838 -10.673 -2.702 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.843 -9.344 -2.156 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.641 -11.491 -0.374 1.00 0.00 H new ATOM 0 HG3 GLU A 985 12.301 -11.447 -0.934 1.00 0.00 H new ATOM 1037 N MET A 986 9.053 -8.384 -3.819 1.00 0.00 N ATOM 1038 CA MET A 986 8.982 -7.394 -4.889 1.00 0.00 C ATOM 1039 C MET A 986 8.084 -6.211 -4.506 1.00 0.00 C ATOM 1040 O MET A 986 8.542 -5.071 -4.474 1.00 0.00 O ATOM 1041 CB MET A 986 8.566 -7.994 -6.244 1.00 0.00 C ATOM 1042 CG MET A 986 7.117 -8.438 -6.353 1.00 0.00 C ATOM 1043 SD MET A 986 6.610 -8.705 -8.060 1.00 0.00 S ATOM 1044 CE MET A 986 7.780 -9.957 -8.579 1.00 0.00 C ATOM 0 H MET A 986 8.620 -9.284 -4.027 1.00 0.00 H new ATOM 0 HA MET A 986 9.998 -7.020 -5.018 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.760 -7.255 -7.022 1.00 0.00 H new ATOM 0 HB3 MET A 986 9.206 -8.852 -6.452 1.00 0.00 H new ATOM 0 HG2 MET A 986 6.978 -9.359 -5.787 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.473 -7.685 -5.899 1.00 0.00 H new ATOM 0 HE1 MET A 986 7.483 -10.352 -9.551 1.00 0.00 H new ATOM 0 HE2 MET A 986 8.774 -9.517 -8.654 1.00 0.00 H new ATOM 0 HE3 MET A 986 7.795 -10.766 -7.848 1.00 0.00 H new ATOM 1054 N ALA A 987 6.819 -6.478 -4.207 1.00 0.00 N ATOM 1055 CA ALA A 987 5.883 -5.423 -3.874 1.00 0.00 C ATOM 1056 C ALA A 987 6.196 -4.758 -2.548 1.00 0.00 C ATOM 1057 O ALA A 987 6.167 -3.547 -2.466 1.00 0.00 O ATOM 1058 CB ALA A 987 4.471 -5.953 -3.863 1.00 0.00 C ATOM 0 H ALA A 987 6.422 -7.417 -4.189 1.00 0.00 H new ATOM 0 HA ALA A 987 5.983 -4.662 -4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.782 -5.147 -3.611 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.223 -6.348 -4.848 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.386 -6.748 -3.122 1.00 0.00 H new ATOM 1064 N GLN A 988 6.484 -5.539 -1.513 1.00 0.00 N ATOM 1065 CA GLN A 988 6.705 -4.966 -0.179 1.00 0.00 C ATOM 1066 C GLN A 988 7.846 -3.949 -0.185 1.00 0.00 C ATOM 1067 O GLN A 988 7.737 -2.873 0.405 1.00 0.00 O ATOM 1068 CB GLN A 988 7.003 -6.052 0.848 1.00 0.00 C ATOM 1069 CG GLN A 988 7.172 -5.534 2.266 1.00 0.00 C ATOM 1070 CD GLN A 988 7.853 -6.540 3.172 1.00 0.00 C ATOM 1071 OE1 GLN A 988 8.531 -6.169 4.130 1.00 0.00 O ATOM 1072 NE2 GLN A 988 7.692 -7.819 2.871 1.00 0.00 N ATOM 0 H GLN A 988 6.570 -6.554 -1.563 1.00 0.00 H new ATOM 0 HA GLN A 988 5.782 -4.456 0.099 1.00 0.00 H new ATOM 0 HB2 GLN A 988 6.194 -6.783 0.833 1.00 0.00 H new ATOM 0 HB3 GLN A 988 7.912 -6.576 0.553 1.00 0.00 H new ATOM 0 HG2 GLN A 988 7.756 -4.614 2.246 1.00 0.00 H new ATOM 0 HG3 GLN A 988 6.194 -5.283 2.677 1.00 0.00 H new ATOM 0 HE21 GLN A 988 7.122 -8.086 2.068 1.00 0.00 H new ATOM 0 HE22 GLN A 988 8.138 -8.537 3.442 1.00 0.00 H new ATOM 1081 N LYS A 989 8.938 -4.301 -0.850 1.00 0.00 N ATOM 1082 CA LYS A 989 10.079 -3.405 -0.993 1.00 0.00 C ATOM 1083 C LYS A 989 9.660 -2.145 -1.745 1.00 0.00 C ATOM 1084 O LYS A 989 10.144 -1.042 -1.473 1.00 0.00 O ATOM 1085 CB LYS A 989 11.200 -4.133 -1.737 1.00 0.00 C ATOM 1086 CG LYS A 989 12.422 -3.287 -2.048 1.00 0.00 C ATOM 1087 CD LYS A 989 13.465 -4.117 -2.779 1.00 0.00 C ATOM 1088 CE LYS A 989 14.649 -3.282 -3.237 1.00 0.00 C ATOM 1089 NZ LYS A 989 15.649 -4.110 -3.964 1.00 0.00 N ATOM 0 H LYS A 989 9.058 -5.207 -1.302 1.00 0.00 H new ATOM 0 HA LYS A 989 10.442 -3.109 -0.009 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.513 -4.991 -1.141 1.00 0.00 H new ATOM 0 HB3 LYS A 989 10.800 -4.524 -2.673 1.00 0.00 H new ATOM 0 HG2 LYS A 989 12.135 -2.431 -2.659 1.00 0.00 H new ATOM 0 HG3 LYS A 989 12.844 -2.892 -1.124 1.00 0.00 H new ATOM 0 HD2 LYS A 989 13.817 -4.914 -2.123 1.00 0.00 H new ATOM 0 HD3 LYS A 989 13.005 -4.596 -3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 989 14.300 -2.478 -3.885 1.00 0.00 H new ATOM 0 HE3 LYS A 989 15.121 -2.813 -2.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 16.444 -3.511 -4.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 15.999 -4.862 -3.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 15.203 -4.537 -4.801 1.00 0.00 H new ATOM 1103 N LEU A 990 8.736 -2.331 -2.674 1.00 0.00 N ATOM 1104 CA LEU A 990 8.184 -1.246 -3.467 1.00 0.00 C ATOM 1105 C LEU A 990 7.224 -0.389 -2.615 1.00 0.00 C ATOM 1106 O LEU A 990 7.262 0.840 -2.673 1.00 0.00 O ATOM 1107 CB LEU A 990 7.517 -1.870 -4.714 1.00 0.00 C ATOM 1108 CG LEU A 990 6.204 -1.264 -5.199 1.00 0.00 C ATOM 1109 CD1 LEU A 990 6.404 0.154 -5.714 1.00 0.00 C ATOM 1110 CD2 LEU A 990 5.597 -2.136 -6.287 1.00 0.00 C ATOM 0 H LEU A 990 8.346 -3.246 -2.900 1.00 0.00 H new ATOM 0 HA LEU A 990 8.961 -0.559 -3.803 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.232 -1.821 -5.536 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.342 -2.926 -4.507 1.00 0.00 H new ATOM 0 HG LEU A 990 5.521 -1.219 -4.351 1.00 0.00 H new ATOM 0 HD11 LEU A 990 5.449 0.556 -6.052 1.00 0.00 H new ATOM 0 HD12 LEU A 990 6.799 0.780 -4.913 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.108 0.143 -6.546 1.00 0.00 H new ATOM 0 HD21 LEU A 990 4.660 -1.695 -6.626 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.290 -2.206 -7.126 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.406 -3.133 -5.890 1.00 0.00 H new ATOM 1122 N LEU A 991 6.394 -1.054 -1.815 1.00 0.00 N ATOM 1123 CA LEU A 991 5.505 -0.382 -0.861 1.00 0.00 C ATOM 1124 C LEU A 991 6.291 0.557 0.032 1.00 0.00 C ATOM 1125 O LEU A 991 6.011 1.752 0.100 1.00 0.00 O ATOM 1126 CB LEU A 991 4.808 -1.394 0.043 1.00 0.00 C ATOM 1127 CG LEU A 991 4.049 -2.507 -0.647 1.00 0.00 C ATOM 1128 CD1 LEU A 991 3.868 -3.663 0.316 1.00 0.00 C ATOM 1129 CD2 LEU A 991 2.695 -2.025 -1.122 1.00 0.00 C ATOM 0 H LEU A 991 6.316 -2.071 -1.807 1.00 0.00 H new ATOM 0 HA LEU A 991 4.770 0.171 -1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 991 5.558 -1.845 0.692 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.113 -0.855 0.686 1.00 0.00 H new ATOM 0 HG LEU A 991 4.622 -2.832 -1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 991 3.322 -4.466 -0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 991 4.845 -4.030 0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 991 3.307 -3.326 1.188 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.170 -2.843 -1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.111 -1.681 -0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 991 2.828 -1.203 -1.826 1.00 0.00 H new ATOM 1141 N ASN A 992 7.267 -0.017 0.735 1.00 0.00 N ATOM 1142 CA ASN A 992 8.105 0.726 1.674 1.00 0.00 C ATOM 1143 C ASN A 992 8.579 2.039 1.068 1.00 0.00 C ATOM 1144 O ASN A 992 8.440 3.101 1.680 1.00 0.00 O ATOM 1145 CB ASN A 992 9.322 -0.122 2.064 1.00 0.00 C ATOM 1146 CG ASN A 992 10.261 0.594 3.021 1.00 0.00 C ATOM 1147 OD1 ASN A 992 9.828 1.343 3.899 1.00 0.00 O ATOM 1148 ND2 ASN A 992 11.556 0.379 2.848 1.00 0.00 N ATOM 0 H ASN A 992 7.498 -1.008 0.669 1.00 0.00 H new ATOM 0 HA ASN A 992 7.507 0.949 2.558 1.00 0.00 H new ATOM 0 HB2 ASN A 992 8.980 -1.049 2.524 1.00 0.00 H new ATOM 0 HB3 ASN A 992 9.870 -0.397 1.163 1.00 0.00 H new ATOM 0 HD21 ASN A 992 12.235 0.841 3.453 1.00 0.00 H new ATOM 0 HD22 ASN A 992 11.875 -0.248 2.110 1.00 0.00 H new ATOM 1155 N SER A 993 9.087 1.967 -0.152 1.00 0.00 N ATOM 1156 CA SER A 993 9.633 3.133 -0.804 1.00 0.00 C ATOM 1157 C SER A 993 8.542 4.100 -1.254 1.00 0.00 C ATOM 1158 O SER A 993 8.640 5.297 -0.997 1.00 0.00 O ATOM 1159 CB SER A 993 10.497 2.707 -1.991 1.00 0.00 C ATOM 1160 OG SER A 993 9.883 1.659 -2.724 1.00 0.00 O ATOM 0 H SER A 993 9.130 1.111 -0.705 1.00 0.00 H new ATOM 0 HA SER A 993 10.251 3.663 -0.079 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.666 3.562 -2.646 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.474 2.381 -1.634 1.00 0.00 H new ATOM 0 HG SER A 993 8.916 1.669 -2.562 1.00 0.00 H new ATOM 1166 N ASP A 994 7.503 3.592 -1.911 1.00 0.00 N ATOM 1167 CA ASP A 994 6.528 4.470 -2.556 1.00 0.00 C ATOM 1168 C ASP A 994 5.473 5.010 -1.586 1.00 0.00 C ATOM 1169 O ASP A 994 5.088 6.178 -1.697 1.00 0.00 O ATOM 1170 CB ASP A 994 5.891 3.774 -3.760 1.00 0.00 C ATOM 1171 CG ASP A 994 6.879 3.607 -4.903 1.00 0.00 C ATOM 1172 OD1 ASP A 994 7.943 2.987 -4.691 1.00 0.00 O ATOM 1173 OD2 ASP A 994 6.611 4.098 -6.020 1.00 0.00 O ATOM 0 H ASP A 994 7.315 2.595 -2.011 1.00 0.00 H new ATOM 0 HA ASP A 994 7.073 5.344 -2.913 1.00 0.00 H new ATOM 0 HB2 ASP A 994 5.516 2.796 -3.458 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.033 4.353 -4.103 1.00 0.00 H new ATOM 1178 N LEU A 995 5.001 4.198 -0.638 1.00 0.00 N ATOM 1179 CA LEU A 995 4.143 4.714 0.433 1.00 0.00 C ATOM 1180 C LEU A 995 4.855 5.845 1.165 1.00 0.00 C ATOM 1181 O LEU A 995 4.359 6.973 1.225 1.00 0.00 O ATOM 1182 CB LEU A 995 3.774 3.628 1.449 1.00 0.00 C ATOM 1183 CG LEU A 995 2.862 4.100 2.585 1.00 0.00 C ATOM 1184 CD1 LEU A 995 1.473 3.538 2.404 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.446 3.730 3.942 1.00 0.00 C ATOM 0 H LEU A 995 5.193 3.198 -0.588 1.00 0.00 H new ATOM 0 HA LEU A 995 3.226 5.074 -0.034 1.00 0.00 H new ATOM 0 HB2 LEU A 995 3.283 2.809 0.923 1.00 0.00 H new ATOM 0 HB3 LEU A 995 4.691 3.226 1.880 1.00 0.00 H new ATOM 0 HG LEU A 995 2.793 5.187 2.551 1.00 0.00 H new ATOM 0 HD11 LEU A 995 0.833 3.880 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 995 1.064 3.878 1.453 1.00 0.00 H new ATOM 0 HD13 LEU A 995 1.517 2.449 2.411 1.00 0.00 H new ATOM 0 HD21 LEU A 995 2.779 4.076 4.732 1.00 0.00 H new ATOM 0 HD22 LEU A 995 3.555 2.648 4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 995 4.422 4.201 4.059 1.00 0.00 H new ATOM 1197 N ALA A 996 6.012 5.527 1.749 1.00 0.00 N ATOM 1198 CA ALA A 996 6.840 6.540 2.398 1.00 0.00 C ATOM 1199 C ALA A 996 7.203 7.669 1.448 1.00 0.00 C ATOM 1200 O ALA A 996 7.499 8.782 1.886 1.00 0.00 O ATOM 1201 CB ALA A 996 8.099 5.923 2.986 1.00 0.00 C ATOM 0 H ALA A 996 6.393 4.582 1.785 1.00 0.00 H new ATOM 0 HA ALA A 996 6.246 6.963 3.208 1.00 0.00 H new ATOM 0 HB1 ALA A 996 8.696 6.700 3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 996 7.824 5.171 3.726 1.00 0.00 H new ATOM 0 HB3 ALA A 996 8.680 5.455 2.191 1.00 0.00 H new ATOM 1207 N GLU A 997 7.175 7.394 0.154 1.00 0.00 N ATOM 1208 CA GLU A 997 7.459 8.443 -0.798 1.00 0.00 C ATOM 1209 C GLU A 997 6.306 9.419 -0.796 1.00 0.00 C ATOM 1210 O GLU A 997 6.516 10.618 -0.753 1.00 0.00 O ATOM 1211 CB GLU A 997 7.709 7.952 -2.216 1.00 0.00 C ATOM 1212 CG GLU A 997 8.447 8.994 -3.037 1.00 0.00 C ATOM 1213 CD GLU A 997 8.451 8.711 -4.519 1.00 0.00 C ATOM 1214 OE1 GLU A 997 8.893 7.613 -4.922 1.00 0.00 O ATOM 1215 OE2 GLU A 997 8.046 9.611 -5.288 1.00 0.00 O ATOM 0 H GLU A 997 6.965 6.480 -0.248 1.00 0.00 H new ATOM 0 HA GLU A 997 8.389 8.914 -0.480 1.00 0.00 H new ATOM 0 HB2 GLU A 997 8.290 7.030 -2.187 1.00 0.00 H new ATOM 0 HB3 GLU A 997 6.759 7.715 -2.694 1.00 0.00 H new ATOM 0 HG2 GLU A 997 7.991 9.969 -2.864 1.00 0.00 H new ATOM 0 HG3 GLU A 997 9.477 9.057 -2.686 1.00 0.00 H new ATOM 1222 N LEU A 998 5.091 8.893 -0.778 1.00 0.00 N ATOM 1223 CA LEU A 998 3.904 9.735 -0.781 1.00 0.00 C ATOM 1224 C LEU A 998 3.920 10.610 0.463 1.00 0.00 C ATOM 1225 O LEU A 998 3.744 11.827 0.387 1.00 0.00 O ATOM 1226 CB LEU A 998 2.631 8.880 -0.807 1.00 0.00 C ATOM 1227 CG LEU A 998 1.486 9.416 -1.679 1.00 0.00 C ATOM 1228 CD1 LEU A 998 0.212 8.637 -1.416 1.00 0.00 C ATOM 1229 CD2 LEU A 998 1.256 10.899 -1.446 1.00 0.00 C ATOM 0 H LEU A 998 4.901 7.891 -0.761 1.00 0.00 H new ATOM 0 HA LEU A 998 3.908 10.359 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 998 2.893 7.882 -1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 998 2.266 8.774 0.215 1.00 0.00 H new ATOM 0 HG LEU A 998 1.773 9.283 -2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.590 9.029 -2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 998 0.374 7.585 -1.651 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -0.065 8.736 -0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 998 0.439 11.244 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 998 1.000 11.068 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 998 2.163 11.451 -1.691 1.00 0.00 H new ATOM 1241 N ILE A 999 4.184 9.971 1.599 1.00 0.00 N ATOM 1242 CA ILE A 999 4.227 10.653 2.888 1.00 0.00 C ATOM 1243 C ILE A 999 5.215 11.805 2.844 1.00 0.00 C ATOM 1244 O ILE A 999 4.841 12.977 2.894 1.00 0.00 O ATOM 1245 CB ILE A 999 4.625 9.675 4.022 1.00 0.00 C ATOM 1246 CG1 ILE A 999 3.609 8.533 4.112 1.00 0.00 C ATOM 1247 CG2 ILE A 999 4.733 10.403 5.359 1.00 0.00 C ATOM 1248 CD1 ILE A 999 3.968 7.468 5.126 1.00 0.00 C ATOM 0 H ILE A 999 4.373 8.970 1.652 1.00 0.00 H new ATOM 0 HA ILE A 999 3.229 11.039 3.093 1.00 0.00 H new ATOM 0 HB ILE A 999 5.604 9.257 3.788 1.00 0.00 H new ATOM 0 HG12 ILE A 999 2.633 8.948 4.366 1.00 0.00 H new ATOM 0 HG13 ILE A 999 3.512 8.068 3.131 1.00 0.00 H new ATOM 0 HG21 ILE A 999 5.014 9.694 6.138 1.00 0.00 H new ATOM 0 HG22 ILE A 999 5.491 11.183 5.288 1.00 0.00 H new ATOM 0 HG23 ILE A 999 3.772 10.853 5.607 1.00 0.00 H new ATOM 0 HD11 ILE A 999 3.199 6.695 5.129 1.00 0.00 H new ATOM 0 HD12 ILE A 999 4.928 7.024 4.863 1.00 0.00 H new ATOM 0 HD13 ILE A 999 4.035 7.917 6.117 1.00 0.00 H new ATOM 1260 N ASN A1000 6.472 11.438 2.746 1.00 0.00 N ATOM 1261 CA ASN A1000 7.579 12.378 2.644 1.00 0.00 C ATOM 1262 C ASN A1000 7.411 13.380 1.505 1.00 0.00 C ATOM 1263 O ASN A1000 8.051 14.406 1.534 1.00 0.00 O ATOM 1264 CB ASN A1000 8.871 11.575 2.486 1.00 0.00 C ATOM 1265 CG ASN A1000 9.608 11.822 1.179 1.00 0.00 C ATOM 1266 OD1 ASN A1000 10.611 12.532 1.140 1.00 0.00 O ATOM 1267 ND2 ASN A1000 9.097 11.261 0.096 1.00 0.00 N ATOM 0 H ASN A1000 6.766 10.461 2.734 1.00 0.00 H new ATOM 0 HA ASN A1000 7.609 12.978 3.554 1.00 0.00 H new ATOM 0 HB2 ASN A1000 9.537 11.814 3.315 1.00 0.00 H new ATOM 0 HB3 ASN A1000 8.636 10.513 2.562 1.00 0.00 H new ATOM 0 HD21 ASN A1000 9.537 11.411 -0.812 1.00 0.00 H new ATOM 0 HD22 ASN A1000 8.263 10.678 0.169 1.00 0.00 H new ATOM 1274 N LYS A1001 6.554 13.100 0.522 1.00 0.00 N ATOM 1275 CA LYS A1001 6.365 14.014 -0.612 1.00 0.00 C ATOM 1276 C LYS A1001 5.347 15.095 -0.289 1.00 0.00 C ATOM 1277 O LYS A1001 5.502 16.238 -0.704 1.00 0.00 O ATOM 1278 CB LYS A1001 5.936 13.269 -1.880 1.00 0.00 C ATOM 1279 CG LYS A1001 7.092 12.692 -2.691 1.00 0.00 C ATOM 1280 CD LYS A1001 7.923 13.782 -3.343 1.00 0.00 C ATOM 1281 CE LYS A1001 9.068 13.202 -4.165 1.00 0.00 C ATOM 1282 NZ LYS A1001 8.589 12.371 -5.307 1.00 0.00 N ATOM 0 H LYS A1001 5.983 12.256 0.485 1.00 0.00 H new ATOM 0 HA LYS A1001 7.332 14.482 -0.797 1.00 0.00 H new ATOM 0 HB2 LYS A1001 5.263 12.458 -1.601 1.00 0.00 H new ATOM 0 HB3 LYS A1001 5.368 13.951 -2.513 1.00 0.00 H new ATOM 0 HG2 LYS A1001 7.727 12.090 -2.041 1.00 0.00 H new ATOM 0 HG3 LYS A1001 6.700 12.025 -3.459 1.00 0.00 H new ATOM 0 HD2 LYS A1001 7.286 14.391 -3.985 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.325 14.442 -2.574 1.00 0.00 H new ATOM 0 HE2 LYS A1001 9.686 14.015 -4.546 1.00 0.00 H new ATOM 0 HE3 LYS A1001 9.703 12.595 -3.520 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 9.285 12.408 -6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 8.471 11.386 -4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 7.677 12.739 -5.645 1.00 0.00 H new ATOM 1296 N MET A1002 4.300 14.736 0.439 1.00 0.00 N ATOM 1297 CA MET A1002 3.291 15.706 0.826 1.00 0.00 C ATOM 1298 C MET A1002 3.834 16.484 1.995 1.00 0.00 C ATOM 1299 O MET A1002 3.605 17.683 2.147 1.00 0.00 O ATOM 1300 CB MET A1002 1.984 15.010 1.192 1.00 0.00 C ATOM 1301 CG MET A1002 1.488 14.075 0.105 1.00 0.00 C ATOM 1302 SD MET A1002 -0.202 13.515 0.372 1.00 0.00 S ATOM 1303 CE MET A1002 -1.097 15.049 0.165 1.00 0.00 C ATOM 0 H MET A1002 4.129 13.787 0.771 1.00 0.00 H new ATOM 0 HA MET A1002 3.071 16.378 -0.004 1.00 0.00 H new ATOM 0 HB2 MET A1002 2.125 14.445 2.114 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.221 15.763 1.393 1.00 0.00 H new ATOM 0 HG2 MET A1002 1.548 14.582 -0.858 1.00 0.00 H new ATOM 0 HG3 MET A1002 2.147 13.209 0.051 1.00 0.00 H new ATOM 0 HE1 MET A1002 -1.522 15.354 1.121 1.00 0.00 H new ATOM 0 HE2 MET A1002 -0.417 15.822 -0.193 1.00 0.00 H new ATOM 0 HE3 MET A1002 -1.899 14.907 -0.560 1.00 0.00 H new ATOM 1313 N LYS A1003 4.585 15.764 2.804 1.00 0.00 N ATOM 1314 CA LYS A1003 5.368 16.346 3.865 1.00 0.00 C ATOM 1315 C LYS A1003 6.423 17.262 3.249 1.00 0.00 C ATOM 1316 O LYS A1003 6.702 18.327 3.772 1.00 0.00 O ATOM 1317 CB LYS A1003 6.024 15.216 4.664 1.00 0.00 C ATOM 1318 CG LYS A1003 6.584 15.632 6.007 1.00 0.00 C ATOM 1319 CD LYS A1003 7.038 14.416 6.801 1.00 0.00 C ATOM 1320 CE LYS A1003 7.306 14.750 8.261 1.00 0.00 C ATOM 1321 NZ LYS A1003 8.406 15.734 8.424 1.00 0.00 N ATOM 0 H LYS A1003 4.667 14.749 2.739 1.00 0.00 H new ATOM 0 HA LYS A1003 4.742 16.934 4.536 1.00 0.00 H new ATOM 0 HB2 LYS A1003 5.289 14.427 4.821 1.00 0.00 H new ATOM 0 HB3 LYS A1003 6.829 14.788 4.067 1.00 0.00 H new ATOM 0 HG2 LYS A1003 7.424 16.312 5.862 1.00 0.00 H new ATOM 0 HG3 LYS A1003 5.826 16.177 6.569 1.00 0.00 H new ATOM 0 HD2 LYS A1003 6.275 13.640 6.742 1.00 0.00 H new ATOM 0 HD3 LYS A1003 7.943 14.008 6.351 1.00 0.00 H new ATOM 0 HE2 LYS A1003 6.397 15.147 8.713 1.00 0.00 H new ATOM 0 HE3 LYS A1003 7.557 13.836 8.800 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 8.585 15.890 9.437 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 9.269 15.368 7.973 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 8.136 16.633 7.977 1.00 0.00 H new ATOM 1335 N LEU A1004 7.011 16.794 2.149 1.00 0.00 N ATOM 1336 CA LEU A1004 7.956 17.576 1.339 1.00 0.00 C ATOM 1337 C LEU A1004 7.315 18.842 0.773 1.00 0.00 C ATOM 1338 O LEU A1004 7.903 19.915 0.831 1.00 0.00 O ATOM 1339 CB LEU A1004 8.487 16.730 0.186 1.00 0.00 C ATOM 1340 CG LEU A1004 9.781 17.226 -0.459 1.00 0.00 C ATOM 1341 CD1 LEU A1004 10.906 17.271 0.563 1.00 0.00 C ATOM 1342 CD2 LEU A1004 10.163 16.337 -1.634 1.00 0.00 C ATOM 0 H LEU A1004 6.846 15.854 1.788 1.00 0.00 H new ATOM 0 HA LEU A1004 8.773 17.871 1.997 1.00 0.00 H new ATOM 0 HB2 LEU A1004 8.649 15.715 0.549 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.717 16.674 -0.584 1.00 0.00 H new ATOM 0 HG LEU A1004 9.615 18.237 -0.830 1.00 0.00 H new ATOM 0 HD11 LEU A1004 11.818 17.627 0.084 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.634 17.947 1.374 1.00 0.00 H new ATOM 0 HD13 LEU A1004 11.073 16.272 0.965 1.00 0.00 H new ATOM 0 HD21 LEU A1004 11.086 16.703 -2.082 1.00 0.00 H new ATOM 0 HD22 LEU A1004 10.310 15.315 -1.284 1.00 0.00 H new ATOM 0 HD23 LEU A1004 9.366 16.355 -2.378 1.00 0.00 H new ATOM 1354 N ALA A1005 6.122 18.712 0.206 1.00 0.00 N ATOM 1355 CA ALA A1005 5.396 19.870 -0.307 1.00 0.00 C ATOM 1356 C ALA A1005 5.156 20.865 0.807 1.00 0.00 C ATOM 1357 O ALA A1005 5.381 22.064 0.659 1.00 0.00 O ATOM 1358 CB ALA A1005 4.080 19.436 -0.931 1.00 0.00 C ATOM 0 H ALA A1005 5.638 17.822 0.089 1.00 0.00 H new ATOM 0 HA ALA A1005 5.997 20.350 -1.079 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.550 20.311 -1.309 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.277 18.748 -1.753 1.00 0.00 H new ATOM 0 HB3 ALA A1005 3.468 18.938 -0.179 1.00 0.00 H new ATOM 1364 N GLN A1006 4.731 20.340 1.934 1.00 0.00 N ATOM 1365 CA GLN A1006 4.497 21.131 3.120 1.00 0.00 C ATOM 1366 C GLN A1006 5.809 21.487 3.816 1.00 0.00 C ATOM 1367 O GLN A1006 5.837 22.252 4.779 1.00 0.00 O ATOM 1368 CB GLN A1006 3.502 20.393 4.016 1.00 0.00 C ATOM 1369 CG GLN A1006 2.153 20.352 3.355 1.00 0.00 C ATOM 1370 CD GLN A1006 1.716 21.746 2.956 1.00 0.00 C ATOM 1371 OE1 GLN A1006 1.159 21.949 1.890 1.00 0.00 O ATOM 1372 NE2 GLN A1006 1.934 22.715 3.835 1.00 0.00 N ATOM 0 H GLN A1006 4.537 19.346 2.054 1.00 0.00 H new ATOM 0 HA GLN A1006 4.052 22.090 2.854 1.00 0.00 H new ATOM 0 HB2 GLN A1006 3.854 19.379 4.208 1.00 0.00 H new ATOM 0 HB3 GLN A1006 3.429 20.893 4.982 1.00 0.00 H new ATOM 0 HG2 GLN A1006 2.192 19.711 2.475 1.00 0.00 H new ATOM 0 HG3 GLN A1006 1.421 19.916 4.035 1.00 0.00 H new ATOM 0 HE21 GLN A1006 2.403 22.508 4.717 1.00 0.00 H new ATOM 0 HE22 GLN A1006 1.633 23.667 3.629 1.00 0.00 H new ATOM 1381 N GLN A1007 6.893 20.913 3.312 1.00 0.00 N ATOM 1382 CA GLN A1007 8.229 21.215 3.778 1.00 0.00 C ATOM 1383 C GLN A1007 8.808 22.354 2.946 1.00 0.00 C ATOM 1384 O GLN A1007 9.710 23.070 3.373 1.00 0.00 O ATOM 1385 CB GLN A1007 9.100 19.962 3.641 1.00 0.00 C ATOM 1386 CG GLN A1007 10.114 19.777 4.751 1.00 0.00 C ATOM 1387 CD GLN A1007 9.450 19.633 6.106 1.00 0.00 C ATOM 1388 OE1 GLN A1007 10.009 20.021 7.132 1.00 0.00 O ATOM 1389 NE2 GLN A1007 8.248 19.070 6.118 1.00 0.00 N ATOM 0 H GLN A1007 6.864 20.221 2.563 1.00 0.00 H new ATOM 0 HA GLN A1007 8.202 21.520 4.824 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.452 19.086 3.609 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.627 20.004 2.688 1.00 0.00 H new ATOM 0 HG2 GLN A1007 10.718 18.893 4.547 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.793 20.630 4.768 1.00 0.00 H new ATOM 0 HE21 GLN A1007 7.820 18.762 5.245 1.00 0.00 H new ATOM 0 HE22 GLN A1007 7.752 18.945 7.001 1.00 0.00 H new ATOM 1398 N TYR A1008 8.255 22.511 1.756 1.00 0.00 N ATOM 1399 CA TYR A1008 8.715 23.497 0.792 1.00 0.00 C ATOM 1400 C TYR A1008 7.569 24.440 0.443 1.00 0.00 C ATOM 1401 O TYR A1008 7.569 25.099 -0.596 1.00 0.00 O ATOM 1402 CB TYR A1008 9.235 22.755 -0.444 1.00 0.00 C ATOM 1403 CG TYR A1008 9.779 23.614 -1.569 1.00 0.00 C ATOM 1404 CD1 TYR A1008 10.922 24.386 -1.405 1.00 0.00 C ATOM 1405 CD2 TYR A1008 9.158 23.617 -2.811 1.00 0.00 C ATOM 1406 CE1 TYR A1008 11.427 25.142 -2.448 1.00 0.00 C ATOM 1407 CE2 TYR A1008 9.660 24.362 -3.859 1.00 0.00 C ATOM 1408 CZ TYR A1008 10.793 25.123 -3.674 1.00 0.00 C ATOM 1409 OH TYR A1008 11.300 25.861 -4.720 1.00 0.00 O ATOM 0 H TYR A1008 7.467 21.953 1.428 1.00 0.00 H new ATOM 0 HA TYR A1008 9.523 24.100 1.205 1.00 0.00 H new ATOM 0 HB2 TYR A1008 10.022 22.071 -0.126 1.00 0.00 H new ATOM 0 HB3 TYR A1008 8.424 22.145 -0.842 1.00 0.00 H new ATOM 0 HD1 TYR A1008 11.424 24.396 -0.449 1.00 0.00 H new ATOM 0 HD2 TYR A1008 8.266 23.026 -2.960 1.00 0.00 H new ATOM 0 HE1 TYR A1008 12.312 25.744 -2.304 1.00 0.00 H new ATOM 0 HE2 TYR A1008 9.167 24.348 -4.820 1.00 0.00 H new ATOM 0 HH TYR A1008 10.736 25.736 -5.512 1.00 0.00 H new ATOM 1496 N GLN A1014 5.153 26.117 -3.681 1.00 0.00 N ATOM 1497 CA GLN A1014 4.626 24.931 -3.021 1.00 0.00 C ATOM 1498 C GLN A1014 4.096 23.931 -4.049 1.00 0.00 C ATOM 1499 O GLN A1014 4.384 22.733 -3.970 1.00 0.00 O ATOM 1500 CB GLN A1014 3.518 25.353 -2.039 1.00 0.00 C ATOM 1501 CG GLN A1014 3.093 24.281 -1.043 1.00 0.00 C ATOM 1502 CD GLN A1014 1.975 23.402 -1.563 1.00 0.00 C ATOM 1503 OE1 GLN A1014 0.795 23.704 -1.386 1.00 0.00 O ATOM 1504 NE2 GLN A1014 2.334 22.309 -2.200 1.00 0.00 N ATOM 0 HA GLN A1014 5.425 24.438 -2.468 1.00 0.00 H new ATOM 0 HB2 GLN A1014 3.859 26.227 -1.484 1.00 0.00 H new ATOM 0 HB3 GLN A1014 2.644 25.661 -2.613 1.00 0.00 H new ATOM 0 HG2 GLN A1014 3.954 23.658 -0.798 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.772 24.759 -0.118 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.323 22.094 -2.326 1.00 0.00 H new ATOM 0 HE22 GLN A1014 1.623 21.676 -2.568 1.00 0.00 H new ATOM 1513 N GLN A1015 3.331 24.437 -5.015 1.00 0.00 N ATOM 1514 CA GLN A1015 2.665 23.600 -6.012 1.00 0.00 C ATOM 1515 C GLN A1015 3.626 22.654 -6.743 1.00 0.00 C ATOM 1516 O GLN A1015 3.242 21.541 -7.087 1.00 0.00 O ATOM 1517 CB GLN A1015 1.937 24.474 -7.029 1.00 0.00 C ATOM 1518 CG GLN A1015 1.074 23.684 -8.000 1.00 0.00 C ATOM 1519 CD GLN A1015 0.359 24.555 -9.017 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -0.748 24.230 -9.452 1.00 0.00 O ATOM 1521 NE2 GLN A1015 0.982 25.654 -9.419 1.00 0.00 N ATOM 0 H GLN A1015 3.156 25.435 -5.129 1.00 0.00 H new ATOM 0 HA GLN A1015 1.953 22.978 -5.469 1.00 0.00 H new ATOM 0 HB2 GLN A1015 1.310 25.190 -6.498 1.00 0.00 H new ATOM 0 HB3 GLN A1015 2.671 25.050 -7.593 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.699 22.963 -8.526 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.335 23.114 -7.437 1.00 0.00 H new ATOM 0 HE21 GLN A1015 1.897 25.890 -9.036 1.00 0.00 H new ATOM 0 HE22 GLN A1015 0.546 26.263 -10.111 1.00 0.00 H new ATOM 1530 N GLU A1016 4.848 23.098 -7.008 1.00 0.00 N ATOM 1531 CA GLU A1016 5.867 22.232 -7.606 1.00 0.00 C ATOM 1532 C GLU A1016 6.008 20.919 -6.834 1.00 0.00 C ATOM 1533 O GLU A1016 5.822 19.832 -7.386 1.00 0.00 O ATOM 1534 CB GLU A1016 7.205 22.970 -7.645 1.00 0.00 C ATOM 1535 CG GLU A1016 8.364 22.132 -8.154 1.00 0.00 C ATOM 1536 CD GLU A1016 9.556 22.980 -8.529 1.00 0.00 C ATOM 1537 OE1 GLU A1016 10.311 23.387 -7.628 1.00 0.00 O ATOM 1538 OE2 GLU A1016 9.728 23.258 -9.732 1.00 0.00 O ATOM 0 H GLU A1016 5.161 24.050 -6.820 1.00 0.00 H new ATOM 0 HA GLU A1016 5.556 21.985 -8.621 1.00 0.00 H new ATOM 0 HB2 GLU A1016 7.103 23.851 -8.279 1.00 0.00 H new ATOM 0 HB3 GLU A1016 7.441 23.325 -6.642 1.00 0.00 H new ATOM 0 HG2 GLU A1016 8.657 21.415 -7.387 1.00 0.00 H new ATOM 0 HG3 GLU A1016 8.041 21.557 -9.022 1.00 0.00 H new ATOM 1545 N TYR A1017 6.342 21.038 -5.562 1.00 0.00 N ATOM 1546 CA TYR A1017 6.439 19.869 -4.692 1.00 0.00 C ATOM 1547 C TYR A1017 5.084 19.168 -4.568 1.00 0.00 C ATOM 1548 O TYR A1017 5.021 17.944 -4.474 1.00 0.00 O ATOM 1549 CB TYR A1017 6.995 20.231 -3.318 1.00 0.00 C ATOM 1550 CG TYR A1017 8.509 20.269 -3.268 1.00 0.00 C ATOM 1551 CD1 TYR A1017 9.258 20.529 -4.411 1.00 0.00 C ATOM 1552 CD2 TYR A1017 9.192 20.033 -2.079 1.00 0.00 C ATOM 1553 CE1 TYR A1017 10.638 20.552 -4.369 1.00 0.00 C ATOM 1554 CE2 TYR A1017 10.572 20.057 -2.034 1.00 0.00 C ATOM 1555 CZ TYR A1017 11.289 20.315 -3.178 1.00 0.00 C ATOM 1556 OH TYR A1017 12.664 20.334 -3.129 1.00 0.00 O ATOM 0 H TYR A1017 6.551 21.926 -5.105 1.00 0.00 H new ATOM 0 HA TYR A1017 7.142 19.175 -5.154 1.00 0.00 H new ATOM 0 HB2 TYR A1017 6.605 21.205 -3.023 1.00 0.00 H new ATOM 0 HB3 TYR A1017 6.634 19.508 -2.587 1.00 0.00 H new ATOM 0 HD1 TYR A1017 8.752 20.716 -5.347 1.00 0.00 H new ATOM 0 HD2 TYR A1017 8.634 19.828 -1.177 1.00 0.00 H new ATOM 0 HE1 TYR A1017 11.205 20.755 -5.266 1.00 0.00 H new ATOM 0 HE2 TYR A1017 11.087 19.874 -1.102 1.00 0.00 H new ATOM 0 HH TYR A1017 12.961 20.149 -2.214 1.00 0.00 H new ATOM 1566 N LYS A1018 4.009 19.950 -4.556 1.00 0.00 N ATOM 1567 CA LYS A1018 2.651 19.401 -4.614 1.00 0.00 C ATOM 1568 C LYS A1018 2.459 18.501 -5.839 1.00 0.00 C ATOM 1569 O LYS A1018 1.805 17.466 -5.759 1.00 0.00 O ATOM 1570 CB LYS A1018 1.631 20.543 -4.647 1.00 0.00 C ATOM 1571 CG LYS A1018 0.188 20.084 -4.732 1.00 0.00 C ATOM 1572 CD LYS A1018 -0.759 21.262 -4.886 1.00 0.00 C ATOM 1573 CE LYS A1018 -2.203 20.800 -4.966 1.00 0.00 C ATOM 1574 NZ LYS A1018 -3.141 21.930 -5.187 1.00 0.00 N ATOM 0 H LYS A1018 4.048 20.968 -4.507 1.00 0.00 H new ATOM 0 HA LYS A1018 2.497 18.793 -3.722 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.755 21.152 -3.752 1.00 0.00 H new ATOM 0 HB3 LYS A1018 1.848 21.184 -5.501 1.00 0.00 H new ATOM 0 HG2 LYS A1018 0.069 19.406 -5.577 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -0.070 19.522 -3.834 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -0.638 21.942 -4.042 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -0.503 21.822 -5.786 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -2.308 20.079 -5.777 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -2.469 20.284 -4.044 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -4.115 21.568 -5.235 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -3.061 22.606 -4.401 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -2.905 22.408 -6.080 1.00 0.00 H new ATOM 1588 N LYS A1019 3.022 18.891 -6.967 1.00 0.00 N ATOM 1589 CA LYS A1019 2.930 18.085 -8.173 1.00 0.00 C ATOM 1590 C LYS A1019 3.737 16.801 -7.990 1.00 0.00 C ATOM 1591 O LYS A1019 3.284 15.709 -8.338 1.00 0.00 O ATOM 1592 CB LYS A1019 3.439 18.878 -9.379 1.00 0.00 C ATOM 1593 CG LYS A1019 3.093 18.253 -10.720 1.00 0.00 C ATOM 1594 CD LYS A1019 1.589 18.143 -10.916 1.00 0.00 C ATOM 1595 CE LYS A1019 1.237 17.661 -12.317 1.00 0.00 C ATOM 1596 NZ LYS A1019 1.823 16.329 -12.617 1.00 0.00 N ATOM 0 H LYS A1019 3.547 19.759 -7.075 1.00 0.00 H new ATOM 0 HA LYS A1019 1.888 17.823 -8.355 1.00 0.00 H new ATOM 0 HB2 LYS A1019 3.023 19.885 -9.341 1.00 0.00 H new ATOM 0 HB3 LYS A1019 4.522 18.978 -9.305 1.00 0.00 H new ATOM 0 HG2 LYS A1019 3.522 18.853 -11.523 1.00 0.00 H new ATOM 0 HG3 LYS A1019 3.542 17.262 -10.787 1.00 0.00 H new ATOM 0 HD2 LYS A1019 1.176 17.454 -10.180 1.00 0.00 H new ATOM 0 HD3 LYS A1019 1.127 19.114 -10.739 1.00 0.00 H new ATOM 0 HE2 LYS A1019 0.153 17.611 -12.420 1.00 0.00 H new ATOM 0 HE3 LYS A1019 1.593 18.386 -13.049 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 1.462 15.989 -13.531 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 2.859 16.408 -12.662 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 1.559 15.657 -11.869 1.00 0.00 H new ATOM 1610 N GLN A1020 4.933 16.953 -7.436 1.00 0.00 N ATOM 1611 CA GLN A1020 5.776 15.812 -7.083 1.00 0.00 C ATOM 1612 C GLN A1020 5.072 14.858 -6.112 1.00 0.00 C ATOM 1613 O GLN A1020 5.293 13.644 -6.158 1.00 0.00 O ATOM 1614 CB GLN A1020 7.090 16.290 -6.471 1.00 0.00 C ATOM 1615 CG GLN A1020 7.974 17.052 -7.443 1.00 0.00 C ATOM 1616 CD GLN A1020 9.282 17.493 -6.817 1.00 0.00 C ATOM 1617 OE1 GLN A1020 9.797 16.848 -5.903 1.00 0.00 O ATOM 1618 NE2 GLN A1020 9.837 18.587 -7.316 1.00 0.00 N ATOM 0 H GLN A1020 5.345 17.860 -7.219 1.00 0.00 H new ATOM 0 HA GLN A1020 5.979 15.265 -8.004 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.871 16.929 -5.615 1.00 0.00 H new ATOM 0 HB3 GLN A1020 7.639 15.428 -6.093 1.00 0.00 H new ATOM 0 HG2 GLN A1020 8.183 16.423 -8.308 1.00 0.00 H new ATOM 0 HG3 GLN A1020 7.437 17.927 -7.808 1.00 0.00 H new ATOM 0 HE21 GLN A1020 9.377 19.092 -8.073 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.724 18.924 -6.943 1.00 0.00 H new ATOM 1627 N MET A1021 4.233 15.398 -5.233 1.00 0.00 N ATOM 1628 CA MET A1021 3.504 14.567 -4.279 1.00 0.00 C ATOM 1629 C MET A1021 2.361 13.838 -4.981 1.00 0.00 C ATOM 1630 O MET A1021 1.941 12.768 -4.547 1.00 0.00 O ATOM 1631 CB MET A1021 2.979 15.397 -3.094 1.00 0.00 C ATOM 1632 CG MET A1021 1.582 15.962 -3.289 1.00 0.00 C ATOM 1633 SD MET A1021 1.083 17.064 -1.952 1.00 0.00 S ATOM 1634 CE MET A1021 -0.594 17.450 -2.447 1.00 0.00 C ATOM 0 H MET A1021 4.042 16.397 -5.161 1.00 0.00 H new ATOM 0 HA MET A1021 4.196 13.827 -3.877 1.00 0.00 H new ATOM 0 HB2 MET A1021 2.983 14.773 -2.200 1.00 0.00 H new ATOM 0 HB3 MET A1021 3.668 16.221 -2.911 1.00 0.00 H new ATOM 0 HG2 MET A1021 1.542 16.503 -4.234 1.00 0.00 H new ATOM 0 HG3 MET A1021 0.869 15.140 -3.362 1.00 0.00 H new ATOM 0 HE1 MET A1021 -0.899 18.393 -1.994 1.00 0.00 H new ATOM 0 HE2 MET A1021 -0.642 17.537 -3.532 1.00 0.00 H new ATOM 0 HE3 MET A1021 -1.263 16.656 -2.116 1.00 0.00 H new ATOM 1644 N LEU A1022 1.876 14.410 -6.079 1.00 0.00 N ATOM 1645 CA LEU A1022 0.851 13.761 -6.883 1.00 0.00 C ATOM 1646 C LEU A1022 1.448 12.567 -7.617 1.00 0.00 C ATOM 1647 O LEU A1022 0.808 11.524 -7.758 1.00 0.00 O ATOM 1648 CB LEU A1022 0.232 14.746 -7.877 1.00 0.00 C ATOM 1649 CG LEU A1022 -0.505 15.930 -7.245 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -1.051 16.853 -8.323 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -1.630 15.439 -6.345 1.00 0.00 C ATOM 0 H LEU A1022 2.177 15.319 -6.430 1.00 0.00 H new ATOM 0 HA LEU A1022 0.059 13.411 -6.220 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.022 15.132 -8.522 1.00 0.00 H new ATOM 0 HB3 LEU A1022 -0.465 14.204 -8.516 1.00 0.00 H new ATOM 0 HG LEU A1022 0.203 16.491 -6.636 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -1.572 17.689 -7.856 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -0.228 17.231 -8.929 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -1.745 16.301 -8.957 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -2.143 16.294 -5.904 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -2.338 14.855 -6.933 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -1.216 14.816 -5.552 1.00 0.00 H new ATOM 1663 N THR A1023 2.685 12.724 -8.079 1.00 0.00 N ATOM 1664 CA THR A1023 3.435 11.611 -8.641 1.00 0.00 C ATOM 1665 C THR A1023 3.597 10.509 -7.595 1.00 0.00 C ATOM 1666 O THR A1023 3.457 9.326 -7.895 1.00 0.00 O ATOM 1667 CB THR A1023 4.824 12.066 -9.131 1.00 0.00 C ATOM 1668 OG1 THR A1023 4.675 13.052 -10.164 1.00 0.00 O ATOM 1669 CG2 THR A1023 5.636 10.891 -9.657 1.00 0.00 C ATOM 0 H THR A1023 3.187 13.612 -8.074 1.00 0.00 H new ATOM 0 HA THR A1023 2.877 11.227 -9.495 1.00 0.00 H new ATOM 0 HB THR A1023 5.358 12.497 -8.284 1.00 0.00 H new ATOM 0 HG1 THR A1023 5.560 13.340 -10.472 1.00 0.00 H new ATOM 0 HG21 THR A1023 6.610 11.244 -9.995 1.00 0.00 H new ATOM 0 HG22 THR A1023 5.772 10.158 -8.862 1.00 0.00 H new ATOM 0 HG23 THR A1023 5.108 10.428 -10.491 1.00 0.00 H new ATOM 1677 N ALA A1024 3.875 10.921 -6.367 1.00 0.00 N ATOM 1678 CA ALA A1024 3.995 9.992 -5.253 1.00 0.00 C ATOM 1679 C ALA A1024 2.661 9.304 -4.962 1.00 0.00 C ATOM 1680 O ALA A1024 2.626 8.118 -4.646 1.00 0.00 O ATOM 1681 CB ALA A1024 4.502 10.712 -4.020 1.00 0.00 C ATOM 0 H ALA A1024 4.022 11.899 -6.116 1.00 0.00 H new ATOM 0 HA ALA A1024 4.715 9.222 -5.530 1.00 0.00 H new ATOM 0 HB1 ALA A1024 4.587 10.005 -3.195 1.00 0.00 H new ATOM 0 HB2 ALA A1024 5.480 11.146 -4.228 1.00 0.00 H new ATOM 0 HB3 ALA A1024 3.804 11.504 -3.749 1.00 0.00 H new ATOM 1687 N ALA A1025 1.569 10.054 -5.075 1.00 0.00 N ATOM 1688 CA ALA A1025 0.233 9.493 -4.887 1.00 0.00 C ATOM 1689 C ALA A1025 -0.049 8.426 -5.937 1.00 0.00 C ATOM 1690 O ALA A1025 -0.668 7.401 -5.652 1.00 0.00 O ATOM 1691 CB ALA A1025 -0.821 10.590 -4.943 1.00 0.00 C ATOM 0 H ALA A1025 1.582 11.050 -5.295 1.00 0.00 H new ATOM 0 HA ALA A1025 0.191 9.027 -3.902 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -1.809 10.153 -4.801 1.00 0.00 H new ATOM 0 HB2 ALA A1025 -0.630 11.319 -4.155 1.00 0.00 H new ATOM 0 HB3 ALA A1025 -0.779 11.085 -5.913 1.00 0.00 H new ATOM 1697 N HIS A1026 0.409 8.683 -7.155 1.00 0.00 N ATOM 1698 CA HIS A1026 0.312 7.709 -8.237 1.00 0.00 C ATOM 1699 C HIS A1026 1.242 6.531 -7.947 1.00 0.00 C ATOM 1700 O HIS A1026 0.894 5.375 -8.177 1.00 0.00 O ATOM 1701 CB HIS A1026 0.685 8.381 -9.571 1.00 0.00 C ATOM 1702 CG HIS A1026 0.368 7.577 -10.807 1.00 0.00 C ATOM 1703 ND1 HIS A1026 0.147 8.157 -12.040 1.00 0.00 N ATOM 1704 CD2 HIS A1026 0.260 6.239 -11.007 1.00 0.00 C ATOM 1705 CE1 HIS A1026 -0.090 7.216 -12.934 1.00 0.00 C ATOM 1706 NE2 HIS A1026 -0.023 6.043 -12.336 1.00 0.00 N ATOM 0 H HIS A1026 0.854 9.562 -7.420 1.00 0.00 H new ATOM 0 HA HIS A1026 -0.710 7.337 -8.309 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.165 9.337 -9.636 1.00 0.00 H new ATOM 0 HB3 HIS A1026 1.753 8.599 -9.563 1.00 0.00 H new ATOM 0 HD2 HIS A1026 0.376 5.470 -10.258 1.00 0.00 H new ATOM 0 HE1 HIS A1026 -0.303 7.379 -13.980 1.00 0.00 H new ATOM 0 HE2 HIS A1026 -0.159 5.138 -12.787 1.00 0.00 H new ATOM 1715 N ALA A1027 2.417 6.846 -7.417 1.00 0.00 N ATOM 1716 CA ALA A1027 3.438 5.849 -7.124 1.00 0.00 C ATOM 1717 C ALA A1027 2.974 4.860 -6.064 1.00 0.00 C ATOM 1718 O ALA A1027 3.052 3.647 -6.264 1.00 0.00 O ATOM 1719 CB ALA A1027 4.720 6.535 -6.684 1.00 0.00 C ATOM 0 H ALA A1027 2.689 7.800 -7.178 1.00 0.00 H new ATOM 0 HA ALA A1027 3.626 5.284 -8.037 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.479 5.783 -6.467 1.00 0.00 H new ATOM 0 HB2 ALA A1027 5.075 7.189 -7.481 1.00 0.00 H new ATOM 0 HB3 ALA A1027 4.528 7.126 -5.788 1.00 0.00 H new ATOM 1725 N LEU A1028 2.495 5.380 -4.942 1.00 0.00 N ATOM 1726 CA LEU A1028 1.984 4.539 -3.868 1.00 0.00 C ATOM 1727 C LEU A1028 0.803 3.703 -4.348 1.00 0.00 C ATOM 1728 O LEU A1028 0.702 2.522 -4.037 1.00 0.00 O ATOM 1729 CB LEU A1028 1.623 5.394 -2.641 1.00 0.00 C ATOM 1730 CG LEU A1028 0.525 4.839 -1.716 1.00 0.00 C ATOM 1731 CD1 LEU A1028 0.739 5.335 -0.302 1.00 0.00 C ATOM 1732 CD2 LEU A1028 -0.859 5.257 -2.193 1.00 0.00 C ATOM 0 H LEU A1028 2.450 6.381 -4.752 1.00 0.00 H new ATOM 0 HA LEU A1028 2.767 3.844 -3.565 1.00 0.00 H new ATOM 0 HB2 LEU A1028 2.526 5.540 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.309 6.378 -2.991 1.00 0.00 H new ATOM 0 HG LEU A1028 0.586 3.751 -1.738 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -0.043 4.937 0.345 1.00 0.00 H new ATOM 0 HD12 LEU A1028 1.712 5.001 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A1028 0.701 6.424 -0.289 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -1.614 4.850 -1.520 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -0.928 6.345 -2.201 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -1.027 4.876 -3.200 1.00 0.00 H new ATOM 1744 N ALA A1029 -0.107 4.320 -5.088 1.00 0.00 N ATOM 1745 CA ALA A1029 -1.195 3.571 -5.707 1.00 0.00 C ATOM 1746 C ALA A1029 -0.675 2.399 -6.544 1.00 0.00 C ATOM 1747 O ALA A1029 -1.371 1.399 -6.709 1.00 0.00 O ATOM 1748 CB ALA A1029 -2.059 4.491 -6.556 1.00 0.00 C ATOM 0 H ALA A1029 -0.116 5.323 -5.274 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.805 3.155 -4.905 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -2.866 3.916 -7.010 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -2.482 5.275 -5.928 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -1.450 4.942 -7.339 1.00 0.00 H new ATOM 1754 N VAL A1030 0.536 2.524 -7.078 1.00 0.00 N ATOM 1755 CA VAL A1030 1.162 1.422 -7.796 1.00 0.00 C ATOM 1756 C VAL A1030 1.605 0.326 -6.826 1.00 0.00 C ATOM 1757 O VAL A1030 1.367 -0.854 -7.079 1.00 0.00 O ATOM 1758 CB VAL A1030 2.369 1.887 -8.647 1.00 0.00 C ATOM 1759 CG1 VAL A1030 3.075 0.701 -9.292 1.00 0.00 C ATOM 1760 CG2 VAL A1030 1.924 2.877 -9.713 1.00 0.00 C ATOM 0 H VAL A1030 1.100 3.373 -7.027 1.00 0.00 H new ATOM 0 HA VAL A1030 0.410 1.022 -8.476 1.00 0.00 H new ATOM 0 HB VAL A1030 3.075 2.383 -7.981 1.00 0.00 H new ATOM 0 HG11 VAL A1030 3.918 1.057 -9.883 1.00 0.00 H new ATOM 0 HG12 VAL A1030 3.436 0.026 -8.516 1.00 0.00 H new ATOM 0 HG13 VAL A1030 2.377 0.170 -9.939 1.00 0.00 H new ATOM 0 HG21 VAL A1030 2.787 3.192 -10.300 1.00 0.00 H new ATOM 0 HG22 VAL A1030 1.193 2.403 -10.368 1.00 0.00 H new ATOM 0 HG23 VAL A1030 1.473 3.747 -9.236 1.00 0.00 H new ATOM 1770 N ASP A1031 2.248 0.707 -5.723 1.00 0.00 N ATOM 1771 CA ASP A1031 2.670 -0.292 -4.740 1.00 0.00 C ATOM 1772 C ASP A1031 1.455 -0.979 -4.114 1.00 0.00 C ATOM 1773 O ASP A1031 1.403 -2.214 -4.051 1.00 0.00 O ATOM 1774 CB ASP A1031 3.618 0.297 -3.667 1.00 0.00 C ATOM 1775 CG ASP A1031 2.991 1.267 -2.676 1.00 0.00 C ATOM 1776 OD1 ASP A1031 2.137 0.850 -1.870 1.00 0.00 O ATOM 1777 OD2 ASP A1031 3.400 2.439 -2.671 1.00 0.00 O ATOM 0 H ASP A1031 2.483 1.672 -5.490 1.00 0.00 H new ATOM 0 HA ASP A1031 3.249 -1.048 -5.270 1.00 0.00 H new ATOM 0 HB2 ASP A1031 4.057 -0.529 -3.107 1.00 0.00 H new ATOM 0 HB3 ASP A1031 4.436 0.808 -4.175 1.00 0.00 H new ATOM 1782 N ALA A1032 0.469 -0.188 -3.697 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.832 -0.702 -3.272 1.00 0.00 C ATOM 1784 C ALA A1032 -1.471 -1.616 -4.316 1.00 0.00 C ATOM 1785 O ALA A1032 -2.210 -2.539 -3.978 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.767 0.462 -2.977 1.00 0.00 C ATOM 0 H ALA A1032 0.549 0.827 -3.644 1.00 0.00 H new ATOM 0 HA ALA A1032 -0.668 -1.298 -2.374 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -2.737 0.078 -2.660 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -1.343 1.077 -2.183 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.892 1.065 -3.876 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.163 -1.383 -5.578 1.00 0.00 N ATOM 1793 CA LYS A1033 -1.780 -2.153 -6.644 1.00 0.00 C ATOM 1794 C LYS A1033 -1.025 -3.459 -6.822 1.00 0.00 C ATOM 1795 O LYS A1033 -1.611 -4.540 -6.853 1.00 0.00 O ATOM 1796 CB LYS A1033 -1.798 -1.377 -7.963 1.00 0.00 C ATOM 1797 CG LYS A1033 -2.636 -2.047 -9.039 1.00 0.00 C ATOM 1798 CD LYS A1033 -2.482 -1.364 -10.390 1.00 0.00 C ATOM 1799 CE LYS A1033 -1.066 -1.503 -10.926 1.00 0.00 C ATOM 1800 NZ LYS A1033 -0.952 -1.027 -12.330 1.00 0.00 N ATOM 0 H LYS A1033 -0.497 -0.675 -5.889 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.814 -2.355 -6.365 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -2.185 -0.374 -7.782 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -0.776 -1.264 -8.325 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -2.344 -3.094 -9.127 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -3.685 -2.032 -8.743 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -3.185 -1.798 -11.101 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -2.735 -0.308 -10.296 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -0.382 -0.936 -10.294 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -0.759 -2.547 -10.871 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 0.029 -1.140 -12.656 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -1.585 -1.585 -12.938 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -1.220 -0.023 -12.379 1.00 0.00 H new ATOM 1814 N ASN A1034 0.289 -3.348 -6.907 1.00 0.00 N ATOM 1815 CA ASN A1034 1.130 -4.502 -7.143 1.00 0.00 C ATOM 1816 C ASN A1034 0.982 -5.506 -6.008 1.00 0.00 C ATOM 1817 O ASN A1034 0.768 -6.687 -6.251 1.00 0.00 O ATOM 1818 CB ASN A1034 2.594 -4.083 -7.293 1.00 0.00 C ATOM 1819 CG ASN A1034 3.382 -5.027 -8.186 1.00 0.00 C ATOM 1820 OD1 ASN A1034 3.492 -4.808 -9.391 1.00 0.00 O ATOM 1821 ND2 ASN A1034 3.936 -6.080 -7.607 1.00 0.00 N ATOM 0 H ASN A1034 0.795 -2.467 -6.815 1.00 0.00 H new ATOM 0 HA ASN A1034 0.811 -4.974 -8.072 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.639 -3.075 -7.706 1.00 0.00 H new ATOM 0 HB3 ASN A1034 3.060 -4.046 -6.309 1.00 0.00 H new ATOM 0 HD21 ASN A1034 4.476 -6.743 -8.163 1.00 0.00 H new ATOM 0 HD22 ASN A1034 3.823 -6.229 -6.604 1.00 0.00 H new ATOM 1828 N LEU A1035 1.062 -5.032 -4.764 1.00 0.00 N ATOM 1829 CA LEU A1035 0.988 -5.933 -3.613 1.00 0.00 C ATOM 1830 C LEU A1035 -0.403 -6.559 -3.469 1.00 0.00 C ATOM 1831 O LEU A1035 -0.517 -7.696 -3.043 1.00 0.00 O ATOM 1832 CB LEU A1035 1.377 -5.232 -2.310 1.00 0.00 C ATOM 1833 CG LEU A1035 1.326 -6.143 -1.081 1.00 0.00 C ATOM 1834 CD1 LEU A1035 2.596 -6.971 -0.973 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.096 -5.340 0.178 1.00 0.00 C ATOM 0 H LEU A1035 1.176 -4.046 -4.529 1.00 0.00 H new ATOM 0 HA LEU A1035 1.709 -6.728 -3.803 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.385 -4.830 -2.411 1.00 0.00 H new ATOM 0 HB3 LEU A1035 0.710 -4.385 -2.151 1.00 0.00 H new ATOM 0 HG LEU A1035 0.485 -6.826 -1.200 1.00 0.00 H new ATOM 0 HD11 LEU A1035 2.539 -7.611 -0.093 1.00 0.00 H new ATOM 0 HD12 LEU A1035 2.705 -7.588 -1.865 1.00 0.00 H new ATOM 0 HD13 LEU A1035 3.456 -6.308 -0.884 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.064 -6.011 1.037 1.00 0.00 H new ATOM 0 HD22 LEU A1035 1.908 -4.625 0.307 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.150 -4.805 0.100 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.454 -5.823 -3.836 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.827 -6.343 -3.790 1.00 0.00 C ATOM 1849 C LEU A1036 -2.932 -7.587 -4.657 1.00 0.00 C ATOM 1850 O LEU A1036 -3.703 -8.503 -4.377 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.846 -5.207 -4.152 1.00 0.00 C ATOM 1852 CG LEU A1036 -4.915 -5.417 -5.260 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -4.317 -5.702 -6.629 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -5.906 -6.494 -4.866 1.00 0.00 C ATOM 0 H LEU A1036 -1.383 -4.862 -4.170 1.00 0.00 H new ATOM 0 HA LEU A1036 -3.089 -6.658 -2.780 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -4.380 -4.953 -3.236 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -3.262 -4.331 -4.434 1.00 0.00 H new ATOM 0 HG LEU A1036 -5.446 -4.469 -5.351 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -5.119 -5.838 -7.355 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -3.690 -4.864 -6.934 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -3.713 -6.608 -6.581 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -6.642 -6.619 -5.660 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -5.378 -7.435 -4.709 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -6.412 -6.204 -3.945 1.00 0.00 H new ATOM 1866 N ASP A1037 -2.077 -7.634 -5.653 1.00 0.00 N ATOM 1867 CA ASP A1037 -1.995 -8.767 -6.553 1.00 0.00 C ATOM 1868 C ASP A1037 -0.952 -9.744 -6.016 1.00 0.00 C ATOM 1869 O ASP A1037 -1.106 -10.950 -6.113 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.620 -8.280 -7.957 1.00 0.00 C ATOM 1871 CG ASP A1037 -1.747 -9.352 -9.021 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -2.757 -10.088 -9.015 1.00 0.00 O ATOM 1873 OD2 ASP A1037 -0.861 -9.426 -9.899 1.00 0.00 O ATOM 0 H ASP A1037 -1.416 -6.887 -5.864 1.00 0.00 H new ATOM 0 HA ASP A1037 -2.958 -9.275 -6.616 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -2.258 -7.437 -8.223 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.594 -7.912 -7.944 1.00 0.00 H new ATOM 1878 N VAL A1038 0.092 -9.187 -5.405 1.00 0.00 N ATOM 1879 CA VAL A1038 1.189 -9.954 -4.808 1.00 0.00 C ATOM 1880 C VAL A1038 0.740 -10.836 -3.644 1.00 0.00 C ATOM 1881 O VAL A1038 1.033 -12.020 -3.621 1.00 0.00 O ATOM 1882 CB VAL A1038 2.295 -9.005 -4.309 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.234 -9.698 -3.334 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.065 -8.437 -5.488 1.00 0.00 C ATOM 0 H VAL A1038 0.203 -8.178 -5.308 1.00 0.00 H new ATOM 0 HA VAL A1038 1.566 -10.607 -5.596 1.00 0.00 H new ATOM 0 HB VAL A1038 1.818 -8.186 -3.770 1.00 0.00 H new ATOM 0 HG11 VAL A1038 4.000 -8.996 -3.005 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.668 -10.049 -2.471 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.708 -10.547 -3.826 1.00 0.00 H new ATOM 0 HG21 VAL A1038 3.845 -7.767 -5.125 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.520 -9.251 -6.052 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.384 -7.884 -6.135 1.00 0.00 H new ATOM 1894 N ILE A1039 0.069 -10.251 -2.663 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.385 -11.000 -1.499 1.00 0.00 C ATOM 1896 C ILE A1039 -1.689 -11.736 -1.790 1.00 0.00 C ATOM 1897 O ILE A1039 -1.953 -12.781 -1.200 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.496 -10.135 -0.228 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -1.250 -8.836 -0.492 1.00 0.00 C ATOM 1900 CG2 ILE A1039 0.894 -9.851 0.325 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -1.183 -7.861 0.662 1.00 0.00 C ATOM 0 H ILE A1039 -0.173 -9.260 -2.649 1.00 0.00 H new ATOM 0 HA ILE A1039 0.386 -11.743 -1.292 1.00 0.00 H new ATOM 0 HB ILE A1039 -1.069 -10.692 0.513 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -0.841 -8.361 -1.384 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.294 -9.067 -0.704 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.810 -9.239 1.223 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.387 -10.792 0.571 1.00 0.00 H new ATOM 0 HG23 ILE A1039 1.481 -9.319 -0.423 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.739 -6.959 0.409 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.618 -8.318 1.550 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.143 -7.602 0.860 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.538 -11.201 -2.667 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.510 -12.081 -3.329 1.00 0.00 C ATOM 1915 C ASP A1040 -2.800 -13.265 -3.999 1.00 0.00 C ATOM 1916 O ASP A1040 -3.347 -14.354 -4.132 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.360 -11.336 -4.354 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.358 -12.244 -5.052 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -5.913 -13.153 -4.398 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -5.586 -12.057 -6.266 1.00 0.00 O ATOM 0 H ASP A1040 -2.578 -10.216 -2.929 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.179 -12.453 -2.553 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -4.895 -10.527 -3.858 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.708 -10.878 -5.098 1.00 0.00 H new ATOM 1925 N GLN A1041 -1.580 -13.081 -4.431 1.00 0.00 N ATOM 1926 CA GLN A1041 -0.821 -14.233 -4.859 1.00 0.00 C ATOM 1927 C GLN A1041 -0.229 -14.929 -3.657 1.00 0.00 C ATOM 1928 O GLN A1041 -0.028 -16.120 -3.695 1.00 0.00 O ATOM 1929 CB GLN A1041 0.264 -13.904 -5.885 1.00 0.00 C ATOM 1930 CG GLN A1041 -0.274 -13.506 -7.249 1.00 0.00 C ATOM 1931 CD GLN A1041 0.832 -13.227 -8.243 1.00 0.00 C ATOM 1932 OE1 GLN A1041 1.334 -12.111 -8.336 1.00 0.00 O ATOM 1933 NE2 GLN A1041 1.202 -14.238 -9.013 1.00 0.00 N ATOM 0 H GLN A1041 -1.102 -12.182 -4.496 1.00 0.00 H new ATOM 0 HA GLN A1041 -1.517 -14.900 -5.368 1.00 0.00 H new ATOM 0 HB2 GLN A1041 0.881 -13.093 -5.498 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.914 -14.771 -6.001 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -0.912 -14.303 -7.632 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.899 -12.619 -7.146 1.00 0.00 H new ATOM 0 HE21 GLN A1041 0.760 -15.151 -8.904 1.00 0.00 H new ATOM 0 HE22 GLN A1041 1.929 -14.104 -9.715 1.00 0.00 H new ATOM 1942 N ALA A1042 0.044 -14.185 -2.591 1.00 0.00 N ATOM 1943 CA ALA A1042 0.546 -14.772 -1.360 1.00 0.00 C ATOM 1944 C ALA A1042 -0.385 -15.868 -0.864 1.00 0.00 C ATOM 1945 O ALA A1042 0.043 -16.986 -0.607 1.00 0.00 O ATOM 1946 CB ALA A1042 0.718 -13.726 -0.274 1.00 0.00 C ATOM 0 H ALA A1042 -0.075 -13.173 -2.557 1.00 0.00 H new ATOM 0 HA ALA A1042 1.522 -15.203 -1.585 1.00 0.00 H new ATOM 0 HB1 ALA A1042 1.095 -14.201 0.632 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.426 -12.968 -0.608 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.244 -13.257 -0.065 1.00 0.00 H new ATOM 1952 N ARG A1043 -1.664 -15.554 -0.724 1.00 0.00 N ATOM 1953 CA ARG A1043 -2.622 -16.570 -0.314 1.00 0.00 C ATOM 1954 C ARG A1043 -2.735 -17.722 -1.319 1.00 0.00 C ATOM 1955 O ARG A1043 -2.978 -18.858 -0.926 1.00 0.00 O ATOM 1956 CB ARG A1043 -4.010 -15.994 0.021 1.00 0.00 C ATOM 1957 CG ARG A1043 -4.510 -14.820 -0.800 1.00 0.00 C ATOM 1958 CD ARG A1043 -4.948 -15.199 -2.197 1.00 0.00 C ATOM 1959 NE ARG A1043 -5.509 -16.538 -2.321 1.00 0.00 N ATOM 1960 CZ ARG A1043 -5.978 -17.013 -3.474 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -6.063 -16.213 -4.533 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -6.348 -18.285 -3.578 1.00 0.00 N ATOM 0 H ARG A1043 -2.057 -14.626 -0.884 1.00 0.00 H new ATOM 0 HA ARG A1043 -2.215 -16.982 0.610 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -4.738 -16.800 -0.071 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.002 -15.690 1.068 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.347 -14.354 -0.280 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -3.720 -14.072 -0.867 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -5.690 -14.477 -2.538 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -4.091 -15.116 -2.866 1.00 0.00 H new ATOM 0 HE ARG A1043 -5.544 -17.134 -1.494 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -5.770 -15.239 -4.461 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -6.422 -16.574 -5.417 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -6.274 -18.905 -2.772 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -6.706 -18.641 -4.464 1.00 0.00 H new ATOM 1976 N LEU A1044 -2.578 -17.454 -2.603 1.00 0.00 N ATOM 1977 CA LEU A1044 -2.571 -18.535 -3.587 1.00 0.00 C ATOM 1978 C LEU A1044 -1.207 -19.237 -3.604 1.00 0.00 C ATOM 1979 O LEU A1044 -1.092 -20.386 -4.016 1.00 0.00 O ATOM 1980 CB LEU A1044 -2.971 -17.994 -4.956 1.00 0.00 C ATOM 1981 CG LEU A1044 -2.432 -18.745 -6.177 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -3.204 -20.037 -6.408 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -2.490 -17.861 -7.411 1.00 0.00 C ATOM 0 H LEU A1044 -2.455 -16.518 -2.989 1.00 0.00 H new ATOM 0 HA LEU A1044 -3.307 -19.289 -3.308 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -4.059 -17.987 -5.014 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.641 -16.957 -5.022 1.00 0.00 H new ATOM 0 HG LEU A1044 -1.391 -19.005 -5.984 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -2.801 -20.551 -7.281 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -3.108 -20.679 -5.533 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -4.256 -19.807 -6.576 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -2.103 -18.409 -8.270 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -3.523 -17.569 -7.602 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -1.885 -16.969 -7.248 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.180 -18.539 -3.143 1.00 0.00 N ATOM 1996 CA LYS A1045 1.107 -19.149 -2.837 1.00 0.00 C ATOM 1997 C LYS A1045 0.911 -20.157 -1.722 1.00 0.00 C ATOM 1998 O LYS A1045 1.528 -21.219 -1.694 1.00 0.00 O ATOM 1999 CB LYS A1045 2.112 -18.082 -2.390 1.00 0.00 C ATOM 2000 CG LYS A1045 3.146 -17.700 -3.432 1.00 0.00 C ATOM 2001 CD LYS A1045 2.530 -17.136 -4.703 1.00 0.00 C ATOM 2002 CE LYS A1045 3.606 -16.768 -5.706 1.00 0.00 C ATOM 2003 NZ LYS A1045 3.047 -16.208 -6.965 1.00 0.00 N ATOM 0 H LYS A1045 -0.214 -17.534 -2.970 1.00 0.00 H new ATOM 0 HA LYS A1045 1.497 -19.640 -3.729 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.563 -17.186 -2.099 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.630 -18.442 -1.501 1.00 0.00 H new ATOM 0 HG2 LYS A1045 3.827 -16.963 -3.007 1.00 0.00 H new ATOM 0 HG3 LYS A1045 3.742 -18.577 -3.682 1.00 0.00 H new ATOM 0 HD2 LYS A1045 1.854 -17.870 -5.141 1.00 0.00 H new ATOM 0 HD3 LYS A1045 1.933 -16.256 -4.464 1.00 0.00 H new ATOM 0 HE2 LYS A1045 4.282 -16.040 -5.257 1.00 0.00 H new ATOM 0 HE3 LYS A1045 4.199 -17.653 -5.938 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 3.464 -16.702 -7.780 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 2.015 -16.336 -6.974 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 3.270 -15.194 -7.023 1.00 0.00 H new ATOM 2017 N MET A1046 0.034 -19.804 -0.800 1.00 0.00 N ATOM 2018 CA MET A1046 -0.357 -20.706 0.261 1.00 0.00 C ATOM 2019 C MET A1046 -1.151 -21.865 -0.328 1.00 0.00 C ATOM 2020 O MET A1046 -1.028 -22.995 0.119 1.00 0.00 O ATOM 2021 CB MET A1046 -1.181 -19.961 1.304 1.00 0.00 C ATOM 2022 CG MET A1046 -1.450 -20.769 2.556 1.00 0.00 C ATOM 2023 SD MET A1046 -2.548 -19.916 3.705 1.00 0.00 S ATOM 2024 CE MET A1046 -2.563 -21.064 5.080 1.00 0.00 C ATOM 0 H MET A1046 -0.422 -18.892 -0.767 1.00 0.00 H new ATOM 0 HA MET A1046 0.533 -21.101 0.751 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.660 -19.044 1.579 1.00 0.00 H new ATOM 0 HB3 MET A1046 -2.132 -19.667 0.861 1.00 0.00 H new ATOM 0 HG2 MET A1046 -1.892 -21.726 2.279 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.505 -20.986 3.054 1.00 0.00 H new ATOM 0 HE1 MET A1046 -3.202 -20.674 5.873 1.00 0.00 H new ATOM 0 HE2 MET A1046 -2.947 -22.028 4.745 1.00 0.00 H new ATOM 0 HE3 MET A1046 -1.549 -21.190 5.460 1.00 0.00 H new ATOM 2034 N ILE A1047 -1.954 -21.564 -1.349 1.00 0.00 N ATOM 2035 CA ILE A1047 -2.659 -22.589 -2.125 1.00 0.00 C ATOM 2036 C ILE A1047 -1.651 -23.527 -2.784 1.00 0.00 C ATOM 2037 O ILE A1047 -1.826 -24.748 -2.790 1.00 0.00 O ATOM 2038 CB ILE A1047 -3.552 -21.949 -3.220 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -4.733 -21.218 -2.589 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -4.044 -22.989 -4.224 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.665 -22.129 -1.827 1.00 0.00 C ATOM 0 H ILE A1047 -2.134 -20.610 -1.661 1.00 0.00 H new ATOM 0 HA ILE A1047 -3.296 -23.149 -1.440 1.00 0.00 H new ATOM 0 HB ILE A1047 -2.941 -21.228 -3.762 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -4.356 -20.449 -1.914 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -5.295 -20.708 -3.371 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -4.666 -22.503 -4.976 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -3.189 -23.459 -4.710 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -4.629 -23.748 -3.704 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -6.482 -21.543 -1.405 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -6.070 -22.882 -2.502 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -5.117 -22.620 -1.023 1.00 0.00 H new ATOM 2053 N SER A1048 -0.605 -22.928 -3.350 1.00 0.00 N ATOM 2054 CA SER A1048 0.513 -23.670 -3.932 1.00 0.00 C ATOM 2055 C SER A1048 1.014 -24.766 -2.984 1.00 0.00 C ATOM 2056 O SER A1048 1.368 -25.859 -3.423 1.00 0.00 O ATOM 2057 CB SER A1048 1.650 -22.695 -4.281 1.00 0.00 C ATOM 2058 OG SER A1048 2.803 -23.369 -4.762 1.00 0.00 O ATOM 0 H SER A1048 -0.508 -21.915 -3.418 1.00 0.00 H new ATOM 0 HA SER A1048 0.166 -24.161 -4.841 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.303 -21.989 -5.035 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.913 -22.114 -3.397 1.00 0.00 H new ATOM 0 HG SER A1048 3.501 -22.714 -4.973 1.00 0.00 H new ATOM 2064 N GLN A1049 1.033 -24.475 -1.688 1.00 0.00 N ATOM 2065 CA GLN A1049 1.463 -25.456 -0.697 1.00 0.00 C ATOM 2066 C GLN A1049 0.280 -26.261 -0.164 1.00 0.00 C ATOM 2067 O GLN A1049 0.291 -27.489 -0.201 1.00 0.00 O ATOM 2068 CB GLN A1049 2.195 -24.766 0.458 1.00 0.00 C ATOM 2069 CG GLN A1049 3.498 -24.098 0.043 1.00 0.00 C ATOM 2070 CD GLN A1049 4.469 -25.063 -0.613 1.00 0.00 C ATOM 2071 OE1 GLN A1049 5.278 -25.704 0.056 1.00 0.00 O ATOM 2072 NE2 GLN A1049 4.400 -25.163 -1.930 1.00 0.00 N ATOM 0 H GLN A1049 0.757 -23.573 -1.300 1.00 0.00 H new ATOM 0 HA GLN A1049 2.149 -26.146 -1.188 1.00 0.00 H new ATOM 0 HB2 GLN A1049 1.537 -24.017 0.898 1.00 0.00 H new ATOM 0 HB3 GLN A1049 2.405 -25.501 1.235 1.00 0.00 H new ATOM 0 HG2 GLN A1049 3.280 -23.283 -0.647 1.00 0.00 H new ATOM 0 HG3 GLN A1049 3.970 -23.655 0.920 1.00 0.00 H new ATOM 0 HE21 GLN A1049 3.714 -24.614 -2.448 1.00 0.00 H new ATOM 0 HE22 GLN A1049 5.033 -25.790 -2.428 1.00 0.00 H new