USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1101 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 928 ASN : amide:sc= -1.62! C(o=-3.5!,f=-6.1!) USER MOD Set 1.2: A 968 THR OG1 : rot -120:sc= -1.85! USER MOD Set 2.1: A 939 MET CE :methyl 173:sc= 0 (180deg=-0.0193) USER MOD Set 2.2: A1001 LYS NZ :NH3+ 178:sc= 1.29 (180deg=1.07) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN :FLIP amide:sc= -0.566 F(o=-2.6,f=-0.57) USER MOD Single : A 924 LYS NZ :NH3+ 167:sc= -0.0221 (180deg=-0.174) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 74:sc= 1.25 USER MOD Single : A 934 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.041) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -174:sc= -1.47 (180deg=-1.57) USER MOD Single : A 944 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 951 TYR OH : rot 180:sc= 0 USER MOD Single : A 954 MET CE :methyl -111:sc= -0.688 (180deg=-3.96!) USER MOD Single : A 956 LYS NZ :NH3+ -137:sc= -0.146 (180deg=-0.705) USER MOD Single : A 964 THR OG1 : rot 80:sc= 1.25 USER MOD Single : A 972 SER OG : rot 28:sc= -2.96! USER MOD Single : A 979 SER OG : rot 31:sc= 1.15 USER MOD Single : A 980 THR OG1 : rot 174:sc= -2.28 USER MOD Single : A 981 HIS : no HE2:sc= 0.198 K(o=0.2,f=-1.5!) USER MOD Single : A 986 MET CE :methyl -104:sc= -0.0172 (180deg=-2.78!) USER MOD Single : A 988 GLN : amide:sc= -0.126 K(o=-0.13,f=-1.2) USER MOD Single : A 989 LYS NZ :NH3+ -169:sc=-0.00446 (180deg=-0.166) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= 0.53 K(o=0.53,f=-0.0055) USER MOD Single : A1002 MET CE :methyl -120:sc= -0.181 (180deg=-1.82!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -5.27 K(o=-5.3,f=-12!) USER MOD Single : A1007 GLN :FLIP amide:sc= -0.382 F(o=-1.4,f=-0.38) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl 166:sc= -0.0388 (180deg=-0.351) USER MOD Single : A1011 THR OG1 : rot 180:sc= 0.012 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1014 GLN : amide:sc= -2.55 K(o=-2.5,f=-6.1!) USER MOD Single : A1015 GLN : amide:sc= 0 X(o=0,f=-0.36) 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+ 172:sc=-0.00577 (180deg=-0.107) USER MOD Single : A1020 GLN : amide:sc= 0.276 X(o=0.28,f=0) USER MOD Single : A1021 MET CE :methyl -112:sc= -3.74! (180deg=-6.32!) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A1033 LYS NZ :NH3+ 165:sc= -0.0417 (180deg=-0.315) USER MOD Single : A1034 ASN :FLIP amide:sc= 0 F(o=-0.69!,f=0) USER MOD Single : A1041 GLN : amide:sc= -0.75 X(o=-0.75,f=-0.36) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN :FLIP amide:sc= -0.0942 F(o=-0.62,f=-0.094) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS :FLIP no HD1:sc= -0.273 F(o=-2!,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.947 -19.768 -2.831 1.00 0.00 N ATOM 2 CA ARG A 920 -8.761 -19.158 -1.520 1.00 0.00 C ATOM 3 C ARG A 920 -9.853 -18.154 -1.159 1.00 0.00 C ATOM 4 O ARG A 920 -10.372 -18.188 -0.042 1.00 0.00 O ATOM 5 CB ARG A 920 -7.412 -18.449 -1.447 1.00 0.00 C ATOM 6 CG ARG A 920 -7.214 -17.714 -0.134 1.00 0.00 C ATOM 7 CD ARG A 920 -7.373 -18.679 1.034 1.00 0.00 C ATOM 8 NE ARG A 920 -7.405 -18.038 2.347 1.00 0.00 N ATOM 9 CZ ARG A 920 -7.293 -18.723 3.491 1.00 0.00 C ATOM 10 NH1 ARG A 920 -7.155 -20.042 3.457 1.00 0.00 N ATOM 11 NH2 ARG A 920 -7.353 -18.096 4.659 1.00 0.00 N ATOM 0 HA ARG A 920 -8.809 -19.978 -0.804 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.613 -19.180 -1.575 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -7.332 -17.741 -2.272 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -6.224 -17.259 -0.108 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -7.939 -16.904 -0.048 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -8.294 -19.247 0.898 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -6.551 -19.395 1.013 1.00 0.00 H new ATOM 0 HE ARG A 920 -7.518 -17.025 2.393 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -7.135 -20.530 2.561 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -7.069 -20.568 4.326 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -7.485 -17.085 4.689 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -7.267 -18.625 5.527 1.00 0.00 H new ATOM 25 N SER A 921 -10.184 -17.276 -2.106 1.00 0.00 N ATOM 26 CA SER A 921 -10.874 -16.024 -1.804 1.00 0.00 C ATOM 27 C SER A 921 -9.881 -15.104 -1.093 1.00 0.00 C ATOM 28 O SER A 921 -9.520 -15.330 0.059 1.00 0.00 O ATOM 29 CB SER A 921 -12.143 -16.247 -0.969 1.00 0.00 C ATOM 30 OG SER A 921 -13.079 -17.047 -1.676 1.00 0.00 O ATOM 0 H SER A 921 -9.983 -17.412 -3.097 1.00 0.00 H new ATOM 0 HA SER A 921 -11.215 -15.562 -2.730 1.00 0.00 H new ATOM 0 HB2 SER A 921 -11.883 -16.730 -0.027 1.00 0.00 H new ATOM 0 HB3 SER A 921 -12.594 -15.286 -0.721 1.00 0.00 H new ATOM 0 HG SER A 921 -13.879 -17.178 -1.125 1.00 0.00 H new ATOM 36 N ASN A 922 -9.410 -14.110 -1.841 1.00 0.00 N ATOM 37 CA ASN A 922 -8.267 -13.274 -1.494 1.00 0.00 C ATOM 38 C ASN A 922 -8.354 -12.624 -0.134 1.00 0.00 C ATOM 39 O ASN A 922 -8.694 -11.446 -0.010 1.00 0.00 O ATOM 40 CB ASN A 922 -8.044 -12.220 -2.572 1.00 0.00 C ATOM 41 CG ASN A 922 -9.021 -12.392 -3.707 1.00 0.00 C ATOM 42 OD1 ASN A 922 -8.785 -13.414 -4.505 1.00 0.00 O flip ATOM 43 ND2 ASN A 922 -10.005 -11.666 -3.825 1.00 0.00 N flip ATOM 0 H ASN A 922 -9.829 -13.857 -2.736 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.412 -13.948 -1.439 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -8.154 -11.225 -2.141 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -7.025 -12.292 -2.951 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -10.144 -10.887 -3.182 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -10.683 -11.843 -4.566 1.00 0.00 H new ATOM 50 N ASP A 923 -7.915 -13.410 0.840 1.00 0.00 N ATOM 51 CA ASP A 923 -7.975 -13.122 2.271 1.00 0.00 C ATOM 52 C ASP A 923 -7.496 -11.716 2.623 1.00 0.00 C ATOM 53 O ASP A 923 -7.206 -10.898 1.762 1.00 0.00 O ATOM 54 CB ASP A 923 -7.130 -14.165 3.016 1.00 0.00 C ATOM 55 CG ASP A 923 -7.683 -14.512 4.384 1.00 0.00 C ATOM 56 OD1 ASP A 923 -7.605 -13.673 5.302 1.00 0.00 O ATOM 57 OD2 ASP A 923 -8.193 -15.635 4.545 1.00 0.00 O ATOM 0 H ASP A 923 -7.484 -14.314 0.645 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.020 -13.173 2.575 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.070 -15.072 2.414 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -6.113 -13.788 3.127 1.00 0.00 H new ATOM 62 N LYS A 924 -7.431 -11.454 3.915 1.00 0.00 N ATOM 63 CA LYS A 924 -7.026 -10.155 4.470 1.00 0.00 C ATOM 64 C LYS A 924 -5.828 -9.568 3.708 1.00 0.00 C ATOM 65 O LYS A 924 -5.614 -8.355 3.703 1.00 0.00 O ATOM 66 CB LYS A 924 -6.696 -10.335 5.961 1.00 0.00 C ATOM 67 CG LYS A 924 -6.793 -9.066 6.804 1.00 0.00 C ATOM 68 CD LYS A 924 -5.526 -8.224 6.741 1.00 0.00 C ATOM 69 CE LYS A 924 -5.613 -7.018 7.661 1.00 0.00 C ATOM 70 NZ LYS A 924 -5.654 -7.406 9.098 1.00 0.00 N ATOM 0 H LYS A 924 -7.660 -12.144 4.630 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.848 -9.447 4.360 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.371 -11.082 6.379 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.685 -10.734 6.048 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -7.639 -8.470 6.461 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -6.994 -9.337 7.841 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -4.668 -8.835 7.020 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -5.360 -7.890 5.717 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -4.756 -6.368 7.487 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -6.505 -6.441 7.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -5.492 -6.566 9.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -6.585 -7.812 9.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -4.914 -8.111 9.288 1.00 0.00 H new ATOM 84 N VAL A 925 -5.067 -10.441 3.053 1.00 0.00 N ATOM 85 CA VAL A 925 -3.999 -10.026 2.168 1.00 0.00 C ATOM 86 C VAL A 925 -4.497 -9.093 1.067 1.00 0.00 C ATOM 87 O VAL A 925 -4.024 -7.968 0.991 1.00 0.00 O ATOM 88 CB VAL A 925 -3.296 -11.237 1.512 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.277 -11.841 2.467 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.308 -12.293 1.096 1.00 0.00 C ATOM 0 H VAL A 925 -5.178 -11.452 3.125 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.286 -9.489 2.793 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.780 -10.884 0.620 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -1.791 -12.692 1.990 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.528 -11.091 2.721 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -2.781 -12.173 3.375 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.788 -13.134 0.637 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -4.855 -12.639 1.973 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -5.008 -11.864 0.379 1.00 0.00 H new ATOM 100 N TYR A 926 -5.510 -9.483 0.274 1.00 0.00 N ATOM 101 CA TYR A 926 -5.902 -8.626 -0.840 1.00 0.00 C ATOM 102 C TYR A 926 -6.652 -7.435 -0.272 1.00 0.00 C ATOM 103 O TYR A 926 -6.542 -6.300 -0.742 1.00 0.00 O ATOM 104 CB TYR A 926 -6.792 -9.383 -1.827 1.00 0.00 C ATOM 105 CG TYR A 926 -7.611 -8.477 -2.721 1.00 0.00 C ATOM 106 CD1 TYR A 926 -7.052 -7.876 -3.840 1.00 0.00 C ATOM 107 CD2 TYR A 926 -8.944 -8.209 -2.426 1.00 0.00 C ATOM 108 CE1 TYR A 926 -7.798 -7.030 -4.643 1.00 0.00 C ATOM 109 CE2 TYR A 926 -9.698 -7.370 -3.223 1.00 0.00 C ATOM 110 CZ TYR A 926 -9.121 -6.781 -4.330 1.00 0.00 C ATOM 111 OH TYR A 926 -9.868 -5.930 -5.118 1.00 0.00 O ATOM 0 H TYR A 926 -6.045 -10.345 0.380 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.014 -8.299 -1.381 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.167 -10.025 -2.448 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.465 -10.035 -1.270 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -6.019 -8.071 -4.088 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -9.397 -8.665 -1.558 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -7.349 -6.567 -5.509 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -10.733 -7.176 -2.982 1.00 0.00 H new ATOM 0 HH TYR A 926 -10.778 -5.866 -4.759 1.00 0.00 H new ATOM 121 N GLU A 927 -7.384 -7.739 0.783 1.00 0.00 N ATOM 122 CA GLU A 927 -8.248 -6.799 1.461 1.00 0.00 C ATOM 123 C GLU A 927 -7.501 -5.580 1.985 1.00 0.00 C ATOM 124 O GLU A 927 -7.834 -4.447 1.637 1.00 0.00 O ATOM 125 CB GLU A 927 -8.938 -7.532 2.605 1.00 0.00 C ATOM 126 CG GLU A 927 -10.108 -8.382 2.146 1.00 0.00 C ATOM 127 CD GLU A 927 -11.246 -7.544 1.605 1.00 0.00 C ATOM 128 OE1 GLU A 927 -11.247 -7.235 0.396 1.00 0.00 O ATOM 129 OE2 GLU A 927 -12.138 -7.179 2.396 1.00 0.00 O ATOM 0 H GLU A 927 -7.393 -8.670 1.200 1.00 0.00 H new ATOM 0 HA GLU A 927 -8.976 -6.420 0.744 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -8.212 -8.167 3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.290 -6.804 3.336 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -9.771 -9.075 1.375 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -10.467 -8.984 2.981 1.00 0.00 H new ATOM 136 N ASN A 928 -6.498 -5.804 2.818 1.00 0.00 N ATOM 137 CA ASN A 928 -5.845 -4.702 3.511 1.00 0.00 C ATOM 138 C ASN A 928 -4.954 -3.891 2.577 1.00 0.00 C ATOM 139 O ASN A 928 -4.833 -2.681 2.739 1.00 0.00 O ATOM 140 CB ASN A 928 -5.037 -5.205 4.698 1.00 0.00 C ATOM 141 CG ASN A 928 -4.621 -4.084 5.631 1.00 0.00 C ATOM 142 OD1 ASN A 928 -3.547 -4.122 6.216 1.00 0.00 O ATOM 143 ND2 ASN A 928 -5.490 -3.100 5.807 1.00 0.00 N ATOM 0 H ASN A 928 -6.120 -6.727 3.030 1.00 0.00 H new ATOM 0 HA ASN A 928 -6.634 -4.045 3.876 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.627 -5.935 5.252 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -4.148 -5.722 4.336 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -5.274 -2.338 6.449 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -6.375 -3.105 5.300 1.00 0.00 H new ATOM 150 N VAL A 929 -4.304 -4.544 1.615 1.00 0.00 N ATOM 151 CA VAL A 929 -3.523 -3.802 0.625 1.00 0.00 C ATOM 152 C VAL A 929 -4.431 -2.870 -0.173 1.00 0.00 C ATOM 153 O VAL A 929 -4.049 -1.750 -0.522 1.00 0.00 O ATOM 154 CB VAL A 929 -2.746 -4.713 -0.344 1.00 0.00 C ATOM 155 CG1 VAL A 929 -1.678 -3.903 -1.056 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.118 -5.875 0.387 1.00 0.00 C ATOM 0 H VAL A 929 -4.300 -5.557 1.500 1.00 0.00 H new ATOM 0 HA VAL A 929 -2.787 -3.226 1.186 1.00 0.00 H new ATOM 0 HB VAL A 929 -3.445 -5.117 -1.076 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.129 -4.548 -1.741 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.148 -3.095 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -0.990 -3.484 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.576 -6.501 -0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -1.427 -5.499 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -2.897 -6.465 0.870 1.00 0.00 H new ATOM 166 N THR A 930 -5.647 -3.321 -0.440 1.00 0.00 N ATOM 167 CA THR A 930 -6.644 -2.455 -1.037 1.00 0.00 C ATOM 168 C THR A 930 -7.005 -1.358 -0.038 1.00 0.00 C ATOM 169 O THR A 930 -7.196 -0.201 -0.404 1.00 0.00 O ATOM 170 CB THR A 930 -7.906 -3.240 -1.447 1.00 0.00 C ATOM 171 OG1 THR A 930 -7.538 -4.329 -2.303 1.00 0.00 O ATOM 172 CG2 THR A 930 -8.898 -2.344 -2.173 1.00 0.00 C ATOM 0 H THR A 930 -5.963 -4.273 -0.254 1.00 0.00 H new ATOM 0 HA THR A 930 -6.228 -2.015 -1.943 1.00 0.00 H new ATOM 0 HB THR A 930 -8.380 -3.619 -0.541 1.00 0.00 H new ATOM 0 HG1 THR A 930 -7.113 -5.034 -1.771 1.00 0.00 H new ATOM 0 HG21 THR A 930 -9.778 -2.925 -2.450 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.195 -1.525 -1.518 1.00 0.00 H new ATOM 0 HG23 THR A 930 -8.433 -1.939 -3.072 1.00 0.00 H new ATOM 180 N GLY A 931 -7.059 -1.743 1.233 1.00 0.00 N ATOM 181 CA GLY A 931 -7.269 -0.793 2.313 1.00 0.00 C ATOM 182 C GLY A 931 -6.202 0.293 2.356 1.00 0.00 C ATOM 183 O GLY A 931 -6.482 1.419 2.763 1.00 0.00 O ATOM 0 H GLY A 931 -6.959 -2.711 1.538 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.249 -0.330 2.198 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.278 -1.326 3.264 1.00 0.00 H new ATOM 187 N LEU A 932 -4.983 -0.036 1.925 1.00 0.00 N ATOM 188 CA LEU A 932 -3.921 0.955 1.799 1.00 0.00 C ATOM 189 C LEU A 932 -4.341 2.021 0.789 1.00 0.00 C ATOM 190 O LEU A 932 -4.122 3.217 0.995 1.00 0.00 O ATOM 191 CB LEU A 932 -2.610 0.262 1.387 1.00 0.00 C ATOM 192 CG LEU A 932 -1.477 1.172 0.896 1.00 0.00 C ATOM 193 CD1 LEU A 932 -1.131 2.224 1.931 1.00 0.00 C ATOM 194 CD2 LEU A 932 -0.249 0.339 0.568 1.00 0.00 C ATOM 0 H LEU A 932 -4.710 -0.982 1.658 1.00 0.00 H new ATOM 0 HA LEU A 932 -3.749 1.446 2.757 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -2.243 -0.308 2.240 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -2.837 -0.455 0.598 1.00 0.00 H new ATOM 0 HG LEU A 932 -1.817 1.684 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -0.325 2.854 1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -2.008 2.839 2.132 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.811 1.737 2.852 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.551 0.992 0.220 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.079 -0.193 1.461 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -0.495 -0.381 -0.213 1.00 0.00 H new ATOM 206 N VAL A 933 -4.989 1.580 -0.281 1.00 0.00 N ATOM 207 CA VAL A 933 -5.575 2.493 -1.253 1.00 0.00 C ATOM 208 C VAL A 933 -6.728 3.287 -0.622 1.00 0.00 C ATOM 209 O VAL A 933 -6.873 4.478 -0.854 1.00 0.00 O ATOM 210 CB VAL A 933 -6.086 1.739 -2.501 1.00 0.00 C ATOM 211 CG1 VAL A 933 -6.632 2.709 -3.541 1.00 0.00 C ATOM 212 CG2 VAL A 933 -4.979 0.882 -3.099 1.00 0.00 C ATOM 0 H VAL A 933 -5.122 0.592 -0.498 1.00 0.00 H new ATOM 0 HA VAL A 933 -4.791 3.183 -1.565 1.00 0.00 H new ATOM 0 HB VAL A 933 -6.900 1.085 -2.189 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -6.985 2.152 -4.409 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -7.459 3.275 -3.112 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -5.843 3.396 -3.847 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.358 0.359 -3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.143 1.518 -3.389 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -4.643 0.155 -2.360 1.00 0.00 H new ATOM 222 N LYS A 934 -7.544 2.619 0.187 1.00 0.00 N ATOM 223 CA LYS A 934 -8.663 3.278 0.876 1.00 0.00 C ATOM 224 C LYS A 934 -8.169 4.371 1.819 1.00 0.00 C ATOM 225 O LYS A 934 -8.836 5.388 2.012 1.00 0.00 O ATOM 226 CB LYS A 934 -9.499 2.267 1.672 1.00 0.00 C ATOM 227 CG LYS A 934 -10.593 1.558 0.876 1.00 0.00 C ATOM 228 CD LYS A 934 -10.033 0.603 -0.166 1.00 0.00 C ATOM 229 CE LYS A 934 -9.888 1.257 -1.531 1.00 0.00 C ATOM 230 NZ LYS A 934 -11.204 1.433 -2.199 1.00 0.00 N ATOM 0 H LYS A 934 -7.457 1.622 0.386 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.287 3.729 0.104 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -8.830 1.515 2.089 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -9.961 2.784 2.513 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -11.236 1.006 1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -11.218 2.302 0.383 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -9.061 0.238 0.164 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -10.688 -0.265 -0.249 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.404 2.227 -1.420 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.239 0.647 -2.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -11.056 1.705 -3.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.735 0.540 -2.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -11.743 2.177 -1.713 1.00 0.00 H new ATOM 244 N ALA A 935 -7.008 4.155 2.411 1.00 0.00 N ATOM 245 CA ALA A 935 -6.437 5.123 3.331 1.00 0.00 C ATOM 246 C ALA A 935 -5.741 6.256 2.583 1.00 0.00 C ATOM 247 O ALA A 935 -5.630 7.367 3.094 1.00 0.00 O ATOM 248 CB ALA A 935 -5.490 4.448 4.298 1.00 0.00 C ATOM 0 H ALA A 935 -6.442 3.318 2.271 1.00 0.00 H new ATOM 0 HA ALA A 935 -7.253 5.561 3.905 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.074 5.191 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.031 3.695 4.871 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.682 3.971 3.743 1.00 0.00 H new ATOM 254 N VAL A 936 -5.268 5.992 1.373 1.00 0.00 N ATOM 255 CA VAL A 936 -4.763 7.078 0.551 1.00 0.00 C ATOM 256 C VAL A 936 -5.950 7.830 -0.061 1.00 0.00 C ATOM 257 O VAL A 936 -5.828 8.967 -0.514 1.00 0.00 O ATOM 258 CB VAL A 936 -3.749 6.609 -0.527 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.416 5.822 -1.639 1.00 0.00 C ATOM 260 CG2 VAL A 936 -2.976 7.790 -1.096 1.00 0.00 C ATOM 0 H VAL A 936 -5.224 5.065 0.950 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.195 7.755 1.190 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.047 5.938 -0.032 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -3.666 5.516 -2.368 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -4.898 4.938 -1.221 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.164 6.446 -2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.272 7.435 -1.849 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -3.672 8.494 -1.552 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.430 8.287 -0.295 1.00 0.00 H new ATOM 270 N ILE A 937 -7.120 7.192 -0.031 1.00 0.00 N ATOM 271 CA ILE A 937 -8.361 7.892 -0.319 1.00 0.00 C ATOM 272 C ILE A 937 -8.625 8.903 0.800 1.00 0.00 C ATOM 273 O ILE A 937 -9.086 10.016 0.551 1.00 0.00 O ATOM 274 CB ILE A 937 -9.569 6.930 -0.465 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.360 5.986 -1.655 1.00 0.00 C ATOM 276 CG2 ILE A 937 -10.864 7.716 -0.633 1.00 0.00 C ATOM 277 CD1 ILE A 937 -10.528 5.057 -1.911 1.00 0.00 C ATOM 0 H ILE A 937 -7.229 6.202 0.188 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.249 8.399 -1.278 1.00 0.00 H new ATOM 0 HB ILE A 937 -9.644 6.333 0.444 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -9.177 6.580 -2.550 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -8.465 5.389 -1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -11.700 7.023 -0.734 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.021 8.349 0.240 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -10.799 8.338 -1.526 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -10.306 4.421 -2.768 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -10.698 4.436 -1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -11.422 5.645 -2.118 1.00 0.00 H new ATOM 289 N GLU A 938 -8.306 8.502 2.037 1.00 0.00 N ATOM 290 CA GLU A 938 -8.343 9.412 3.187 1.00 0.00 C ATOM 291 C GLU A 938 -7.540 10.672 2.914 1.00 0.00 C ATOM 292 O GLU A 938 -7.952 11.768 3.294 1.00 0.00 O ATOM 293 CB GLU A 938 -7.798 8.745 4.453 1.00 0.00 C ATOM 294 CG GLU A 938 -8.743 7.728 5.067 1.00 0.00 C ATOM 295 CD GLU A 938 -10.088 8.334 5.406 1.00 0.00 C ATOM 296 OE1 GLU A 938 -10.131 9.275 6.226 1.00 0.00 O ATOM 297 OE2 GLU A 938 -11.105 7.891 4.837 1.00 0.00 O ATOM 0 H GLU A 938 -8.019 7.551 2.267 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.390 9.672 3.344 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.855 8.253 4.216 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.579 9.515 5.192 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.884 6.899 4.373 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.294 7.315 5.970 1.00 0.00 H new ATOM 304 N MET A 939 -6.405 10.517 2.237 1.00 0.00 N ATOM 305 CA MET A 939 -5.566 11.665 1.919 1.00 0.00 C ATOM 306 C MET A 939 -6.344 12.639 1.034 1.00 0.00 C ATOM 307 O MET A 939 -6.295 13.845 1.236 1.00 0.00 O ATOM 308 CB MET A 939 -4.241 11.245 1.252 1.00 0.00 C ATOM 309 CG MET A 939 -4.203 11.423 -0.260 1.00 0.00 C ATOM 310 SD MET A 939 -2.559 11.180 -0.959 1.00 0.00 S ATOM 311 CE MET A 939 -2.939 11.262 -2.709 1.00 0.00 C ATOM 0 H MET A 939 -6.050 9.621 1.903 1.00 0.00 H new ATOM 0 HA MET A 939 -5.301 12.163 2.852 1.00 0.00 H new ATOM 0 HB2 MET A 939 -3.429 11.824 1.692 1.00 0.00 H new ATOM 0 HB3 MET A 939 -4.049 10.198 1.485 1.00 0.00 H new ATOM 0 HG2 MET A 939 -4.895 10.718 -0.720 1.00 0.00 H new ATOM 0 HG3 MET A 939 -4.554 12.424 -0.511 1.00 0.00 H new ATOM 0 HE1 MET A 939 -2.013 11.254 -3.283 1.00 0.00 H new ATOM 0 HE2 MET A 939 -3.547 10.402 -2.990 1.00 0.00 H new ATOM 0 HE3 MET A 939 -3.489 12.180 -2.919 1.00 0.00 H new ATOM 321 N SER A 940 -7.099 12.097 0.086 1.00 0.00 N ATOM 322 CA SER A 940 -7.902 12.917 -0.811 1.00 0.00 C ATOM 323 C SER A 940 -9.124 13.467 -0.078 1.00 0.00 C ATOM 324 O SER A 940 -9.588 14.571 -0.356 1.00 0.00 O ATOM 325 CB SER A 940 -8.341 12.094 -2.027 1.00 0.00 C ATOM 326 OG SER A 940 -8.939 12.912 -3.020 1.00 0.00 O ATOM 0 H SER A 940 -7.172 11.093 -0.081 1.00 0.00 H new ATOM 0 HA SER A 940 -7.295 13.755 -1.153 1.00 0.00 H new ATOM 0 HB2 SER A 940 -7.478 11.579 -2.450 1.00 0.00 H new ATOM 0 HB3 SER A 940 -9.048 11.326 -1.712 1.00 0.00 H new ATOM 0 HG SER A 940 -9.207 12.358 -3.783 1.00 0.00 H new ATOM 332 N SER A 941 -9.618 12.710 0.887 1.00 0.00 N ATOM 333 CA SER A 941 -10.824 13.088 1.601 1.00 0.00 C ATOM 334 C SER A 941 -10.540 14.272 2.519 1.00 0.00 C ATOM 335 O SER A 941 -11.205 15.320 2.453 1.00 0.00 O ATOM 336 CB SER A 941 -11.338 11.890 2.408 1.00 0.00 C ATOM 337 OG SER A 941 -12.529 12.199 3.116 1.00 0.00 O ATOM 0 H SER A 941 -9.202 11.830 1.193 1.00 0.00 H new ATOM 0 HA SER A 941 -11.590 13.386 0.886 1.00 0.00 H new ATOM 0 HB2 SER A 941 -11.523 11.052 1.736 1.00 0.00 H new ATOM 0 HB3 SER A 941 -10.570 11.570 3.112 1.00 0.00 H new ATOM 0 HG SER A 941 -12.826 11.410 3.616 1.00 0.00 H new ATOM 343 N LYS A 942 -9.514 14.116 3.339 1.00 0.00 N ATOM 344 CA LYS A 942 -9.203 15.091 4.362 1.00 0.00 C ATOM 345 C LYS A 942 -8.445 16.284 3.772 1.00 0.00 C ATOM 346 O LYS A 942 -8.282 17.303 4.438 1.00 0.00 O ATOM 347 CB LYS A 942 -8.428 14.409 5.501 1.00 0.00 C ATOM 348 CG LYS A 942 -6.950 14.210 5.236 1.00 0.00 C ATOM 349 CD LYS A 942 -6.141 15.329 5.863 1.00 0.00 C ATOM 350 CE LYS A 942 -5.800 15.040 7.321 1.00 0.00 C ATOM 351 NZ LYS A 942 -6.999 14.754 8.157 1.00 0.00 N ATOM 0 H LYS A 942 -8.881 13.317 3.313 1.00 0.00 H new ATOM 0 HA LYS A 942 -10.129 15.491 4.777 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -8.543 15.004 6.407 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -8.881 13.437 5.699 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -6.628 13.250 5.641 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.768 14.180 4.162 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -5.221 15.472 5.297 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -6.702 16.261 5.800 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -5.121 14.188 7.367 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -5.268 15.894 7.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -6.715 14.666 9.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -7.684 15.531 8.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -7.437 13.865 7.843 1.00 0.00 H new ATOM 365 N ILE A 943 -7.994 16.158 2.522 1.00 0.00 N ATOM 366 CA ILE A 943 -7.376 17.283 1.815 1.00 0.00 C ATOM 367 C ILE A 943 -8.473 18.208 1.281 1.00 0.00 C ATOM 368 O ILE A 943 -8.281 19.412 1.116 1.00 0.00 O ATOM 369 CB ILE A 943 -6.445 16.795 0.658 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.341 17.819 0.337 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.242 16.479 -0.602 1.00 0.00 C ATOM 372 CD1 ILE A 943 -5.790 19.008 -0.491 1.00 0.00 C ATOM 0 H ILE A 943 -8.044 15.295 1.981 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.749 17.833 2.516 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.968 15.880 1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -4.923 18.186 1.274 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -4.537 17.309 -0.193 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.564 16.143 -1.386 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.966 15.693 -0.387 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -7.766 17.375 -0.935 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.943 19.671 -0.664 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -6.179 18.659 -1.447 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -6.571 19.549 0.043 1.00 0.00 H new ATOM 384 N GLN A 944 -9.641 17.631 1.033 1.00 0.00 N ATOM 385 CA GLN A 944 -10.770 18.392 0.524 1.00 0.00 C ATOM 386 C GLN A 944 -11.213 19.511 1.478 1.00 0.00 C ATOM 387 O GLN A 944 -11.341 20.659 1.045 1.00 0.00 O ATOM 388 CB GLN A 944 -11.940 17.464 0.194 1.00 0.00 C ATOM 389 CG GLN A 944 -11.680 16.586 -1.019 1.00 0.00 C ATOM 390 CD GLN A 944 -12.812 15.620 -1.306 1.00 0.00 C ATOM 391 OE1 GLN A 944 -13.979 15.909 -1.042 1.00 0.00 O ATOM 392 NE2 GLN A 944 -12.472 14.462 -1.847 1.00 0.00 N ATOM 0 H GLN A 944 -9.830 16.639 1.176 1.00 0.00 H new ATOM 0 HA GLN A 944 -10.435 18.879 -0.392 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -12.148 16.830 1.056 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -12.833 18.064 0.017 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -11.521 17.220 -1.892 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -10.760 16.023 -0.862 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -11.493 14.262 -2.050 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -13.189 13.769 -2.061 1.00 0.00 H new ATOM 401 N PRO A 945 -11.466 19.237 2.779 1.00 0.00 N ATOM 402 CA PRO A 945 -11.960 20.264 3.692 1.00 0.00 C ATOM 403 C PRO A 945 -10.880 20.941 4.555 1.00 0.00 C ATOM 404 O PRO A 945 -11.208 21.583 5.557 1.00 0.00 O ATOM 405 CB PRO A 945 -12.908 19.459 4.575 1.00 0.00 C ATOM 406 CG PRO A 945 -12.311 18.085 4.639 1.00 0.00 C ATOM 407 CD PRO A 945 -11.352 17.954 3.474 1.00 0.00 C ATOM 0 HA PRO A 945 -12.402 21.099 3.149 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -12.991 19.899 5.569 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -13.913 19.433 4.153 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -11.789 17.937 5.584 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -13.090 17.325 4.582 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -10.332 17.773 3.814 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -11.624 17.122 2.824 1.00 0.00 H new ATOM 415 N ALA A 946 -9.608 20.827 4.181 1.00 0.00 N ATOM 416 CA ALA A 946 -8.534 21.371 5.014 1.00 0.00 C ATOM 417 C ALA A 946 -7.545 22.234 4.212 1.00 0.00 C ATOM 418 O ALA A 946 -7.612 22.285 2.985 1.00 0.00 O ATOM 419 CB ALA A 946 -7.807 20.230 5.708 1.00 0.00 C ATOM 0 H ALA A 946 -9.297 20.372 3.323 1.00 0.00 H new ATOM 0 HA ALA A 946 -8.988 22.028 5.756 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -7.007 20.633 6.329 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -8.509 19.678 6.333 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -7.384 19.560 4.960 1.00 0.00 H new ATOM 425 N PRO A 947 -6.671 22.993 4.920 1.00 0.00 N ATOM 426 CA PRO A 947 -5.519 23.688 4.329 1.00 0.00 C ATOM 427 C PRO A 947 -4.251 22.808 4.342 1.00 0.00 C ATOM 428 O PRO A 947 -4.229 21.801 5.046 1.00 0.00 O ATOM 429 CB PRO A 947 -5.344 24.914 5.250 1.00 0.00 C ATOM 430 CG PRO A 947 -6.261 24.708 6.421 1.00 0.00 C ATOM 431 CD PRO A 947 -6.765 23.293 6.349 1.00 0.00 C ATOM 0 HA PRO A 947 -5.676 23.947 3.282 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -4.309 25.006 5.580 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -5.592 25.834 4.721 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -5.732 24.881 7.358 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -7.091 25.414 6.388 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -6.156 22.615 6.946 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.788 23.208 6.715 1.00 0.00 H new ATOM 439 N PRO A 948 -3.153 23.234 3.642 1.00 0.00 N ATOM 440 CA PRO A 948 -1.959 22.389 3.324 1.00 0.00 C ATOM 441 C PRO A 948 -1.397 21.581 4.511 1.00 0.00 C ATOM 442 O PRO A 948 -0.805 20.482 4.341 1.00 0.00 O ATOM 443 CB PRO A 948 -0.916 23.416 2.844 1.00 0.00 C ATOM 444 CG PRO A 948 -1.506 24.762 3.106 1.00 0.00 C ATOM 445 CD PRO A 948 -2.991 24.579 3.080 1.00 0.00 C ATOM 0 HA PRO A 948 -2.224 21.622 2.596 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.026 23.293 3.379 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -0.700 23.285 1.784 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -1.178 25.150 4.071 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -1.189 25.480 2.350 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -3.504 25.333 3.677 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.391 24.647 2.068 1.00 0.00 H new ATOM 453 N GLU A 949 -1.622 22.092 5.711 1.00 0.00 N ATOM 454 CA GLU A 949 -1.345 21.365 6.947 1.00 0.00 C ATOM 455 C GLU A 949 -2.000 19.980 6.955 1.00 0.00 C ATOM 456 O GLU A 949 -1.897 19.257 7.935 1.00 0.00 O ATOM 457 CB GLU A 949 -1.825 22.167 8.156 1.00 0.00 C ATOM 458 CG GLU A 949 -0.840 23.231 8.606 1.00 0.00 C ATOM 459 CD GLU A 949 0.429 22.632 9.174 1.00 0.00 C ATOM 460 OE1 GLU A 949 1.349 22.320 8.388 1.00 0.00 O ATOM 461 OE2 GLU A 949 0.514 22.466 10.408 1.00 0.00 O ATOM 0 H GLU A 949 -2.003 23.026 5.859 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.265 21.227 7.005 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -2.775 22.642 7.913 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -2.013 21.484 8.984 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -0.590 23.873 7.761 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -1.310 23.864 9.359 1.00 0.00 H new ATOM 468 N GLU A 950 -2.691 19.636 5.874 1.00 0.00 N ATOM 469 CA GLU A 950 -3.341 18.349 5.760 1.00 0.00 C ATOM 470 C GLU A 950 -2.579 17.476 4.787 1.00 0.00 C ATOM 471 O GLU A 950 -2.658 16.265 4.877 1.00 0.00 O ATOM 472 CB GLU A 950 -4.806 18.446 5.322 1.00 0.00 C ATOM 473 CG GLU A 950 -5.039 18.437 3.811 1.00 0.00 C ATOM 474 CD GLU A 950 -4.630 19.715 3.108 1.00 0.00 C ATOM 475 OE1 GLU A 950 -3.419 19.972 2.991 1.00 0.00 O ATOM 476 OE2 GLU A 950 -5.522 20.459 2.667 1.00 0.00 O ATOM 0 H GLU A 950 -2.812 20.241 5.061 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.337 17.908 6.757 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -5.355 17.614 5.763 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.231 19.362 5.733 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -4.487 17.604 3.375 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -6.096 18.254 3.620 1.00 0.00 H new ATOM 483 N TYR A 951 -1.847 18.098 3.857 1.00 0.00 N ATOM 484 CA TYR A 951 -0.962 17.364 2.963 1.00 0.00 C ATOM 485 C TYR A 951 -0.157 16.400 3.780 1.00 0.00 C ATOM 486 O TYR A 951 0.031 15.244 3.403 1.00 0.00 O ATOM 487 CB TYR A 951 0.028 18.270 2.227 1.00 0.00 C ATOM 488 CG TYR A 951 -0.572 19.264 1.266 1.00 0.00 C ATOM 489 CD1 TYR A 951 -1.746 18.999 0.577 1.00 0.00 C ATOM 490 CD2 TYR A 951 0.061 20.474 1.047 1.00 0.00 C ATOM 491 CE1 TYR A 951 -2.271 19.924 -0.305 1.00 0.00 C ATOM 492 CE2 TYR A 951 -0.450 21.400 0.172 1.00 0.00 C ATOM 493 CZ TYR A 951 -1.618 21.124 -0.504 1.00 0.00 C ATOM 494 OH TYR A 951 -2.136 22.049 -1.383 1.00 0.00 O ATOM 0 H TYR A 951 -1.854 19.107 3.708 1.00 0.00 H new ATOM 0 HA TYR A 951 -1.591 16.870 2.223 1.00 0.00 H new ATOM 0 HB2 TYR A 951 0.609 18.818 2.969 1.00 0.00 H new ATOM 0 HB3 TYR A 951 0.727 17.640 1.677 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.255 18.059 0.732 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.977 20.695 1.576 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -3.187 19.710 -0.836 1.00 0.00 H new ATOM 0 HE2 TYR A 951 0.060 22.339 0.015 1.00 0.00 H new ATOM 0 HH TYR A 951 -1.556 22.839 -1.406 1.00 0.00 H new ATOM 504 N VAL A 952 0.306 16.879 4.921 1.00 0.00 N ATOM 505 CA VAL A 952 1.072 16.003 5.796 1.00 0.00 C ATOM 506 C VAL A 952 0.187 14.954 6.535 1.00 0.00 C ATOM 507 O VAL A 952 0.409 13.759 6.352 1.00 0.00 O ATOM 508 CB VAL A 952 2.065 16.767 6.727 1.00 0.00 C ATOM 509 CG1 VAL A 952 1.519 18.109 7.196 1.00 0.00 C ATOM 510 CG2 VAL A 952 2.480 15.912 7.918 1.00 0.00 C ATOM 0 H VAL A 952 0.174 17.833 5.257 1.00 0.00 H new ATOM 0 HA VAL A 952 1.714 15.417 5.138 1.00 0.00 H new ATOM 0 HB VAL A 952 2.949 16.974 6.124 1.00 0.00 H new ATOM 0 HG11 VAL A 952 2.252 18.595 7.840 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.319 18.742 6.332 1.00 0.00 H new ATOM 0 HG13 VAL A 952 0.595 17.951 7.752 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.171 16.474 8.546 1.00 0.00 H new ATOM 0 HG22 VAL A 952 1.597 15.645 8.499 1.00 0.00 H new ATOM 0 HG23 VAL A 952 2.968 15.005 7.562 1.00 0.00 H new ATOM 520 N PRO A 953 -0.839 15.330 7.342 1.00 0.00 N ATOM 521 CA PRO A 953 -1.711 14.339 8.013 1.00 0.00 C ATOM 522 C PRO A 953 -2.547 13.475 7.061 1.00 0.00 C ATOM 523 O PRO A 953 -3.061 12.434 7.463 1.00 0.00 O ATOM 524 CB PRO A 953 -2.637 15.185 8.882 1.00 0.00 C ATOM 525 CG PRO A 953 -1.927 16.479 9.024 1.00 0.00 C ATOM 526 CD PRO A 953 -1.200 16.677 7.727 1.00 0.00 C ATOM 0 HA PRO A 953 -1.099 13.622 8.561 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.612 15.316 8.413 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -2.809 14.718 9.851 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.627 17.293 9.210 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.233 16.457 9.864 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.833 17.154 6.979 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -0.321 17.310 7.850 1.00 0.00 H new ATOM 534 N MET A 954 -2.722 13.901 5.818 1.00 0.00 N ATOM 535 CA MET A 954 -3.449 13.084 4.855 1.00 0.00 C ATOM 536 C MET A 954 -2.593 11.879 4.496 1.00 0.00 C ATOM 537 O MET A 954 -3.080 10.751 4.410 1.00 0.00 O ATOM 538 CB MET A 954 -3.835 13.875 3.588 1.00 0.00 C ATOM 539 CG MET A 954 -2.684 14.178 2.640 1.00 0.00 C ATOM 540 SD MET A 954 -3.231 14.897 1.079 1.00 0.00 S ATOM 541 CE MET A 954 -1.666 15.113 0.237 1.00 0.00 C ATOM 0 H MET A 954 -2.378 14.791 5.457 1.00 0.00 H new ATOM 0 HA MET A 954 -4.384 12.760 5.312 1.00 0.00 H new ATOM 0 HB2 MET A 954 -4.594 13.312 3.045 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.292 14.817 3.892 1.00 0.00 H new ATOM 0 HG2 MET A 954 -1.990 14.863 3.127 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.135 13.258 2.438 1.00 0.00 H new ATOM 0 HE1 MET A 954 -1.443 16.176 0.151 1.00 0.00 H new ATOM 0 HE2 MET A 954 -0.876 14.621 0.805 1.00 0.00 H new ATOM 0 HE3 MET A 954 -1.725 14.673 -0.759 1.00 0.00 H new ATOM 551 N VAL A 955 -1.310 12.131 4.288 1.00 0.00 N ATOM 552 CA VAL A 955 -0.352 11.057 4.101 1.00 0.00 C ATOM 553 C VAL A 955 -0.161 10.277 5.393 1.00 0.00 C ATOM 554 O VAL A 955 0.162 9.095 5.369 1.00 0.00 O ATOM 555 CB VAL A 955 0.998 11.568 3.570 1.00 0.00 C ATOM 556 CG1 VAL A 955 2.025 10.447 3.513 1.00 0.00 C ATOM 557 CG2 VAL A 955 0.806 12.191 2.198 1.00 0.00 C ATOM 0 H VAL A 955 -0.910 13.068 4.245 1.00 0.00 H new ATOM 0 HA VAL A 955 -0.762 10.388 3.344 1.00 0.00 H new ATOM 0 HB VAL A 955 1.377 12.326 4.255 1.00 0.00 H new ATOM 0 HG11 VAL A 955 2.969 10.838 3.134 1.00 0.00 H new ATOM 0 HG12 VAL A 955 2.176 10.040 4.513 1.00 0.00 H new ATOM 0 HG13 VAL A 955 1.667 9.659 2.851 1.00 0.00 H new ATOM 0 HG21 VAL A 955 1.764 12.552 1.825 1.00 0.00 H new ATOM 0 HG22 VAL A 955 0.408 11.444 1.512 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.108 13.025 2.272 1.00 0.00 H new ATOM 567 N LYS A 956 -0.369 10.938 6.523 1.00 0.00 N ATOM 568 CA LYS A 956 -0.387 10.244 7.809 1.00 0.00 C ATOM 569 C LYS A 956 -1.362 9.076 7.723 1.00 0.00 C ATOM 570 O LYS A 956 -1.065 7.953 8.151 1.00 0.00 O ATOM 571 CB LYS A 956 -0.827 11.210 8.912 1.00 0.00 C ATOM 572 CG LYS A 956 -1.233 10.554 10.222 1.00 0.00 C ATOM 573 CD LYS A 956 -0.045 10.051 11.018 1.00 0.00 C ATOM 574 CE LYS A 956 -0.489 9.561 12.387 1.00 0.00 C ATOM 575 NZ LYS A 956 -1.167 10.632 13.167 1.00 0.00 N ATOM 0 H LYS A 956 -0.527 11.944 6.579 1.00 0.00 H new ATOM 0 HA LYS A 956 0.611 9.874 8.044 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.012 11.906 9.110 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.667 11.799 8.543 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.792 11.270 10.824 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.904 9.721 10.014 1.00 0.00 H new ATOM 0 HD2 LYS A 956 0.446 9.242 10.477 1.00 0.00 H new ATOM 0 HD3 LYS A 956 0.688 10.849 11.131 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -1.166 8.715 12.268 1.00 0.00 H new ATOM 0 HE3 LYS A 956 0.377 9.201 12.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -0.831 10.611 14.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -0.950 11.558 12.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.195 10.477 13.149 1.00 0.00 H new ATOM 589 N GLU A 957 -2.521 9.370 7.149 1.00 0.00 N ATOM 590 CA GLU A 957 -3.554 8.377 6.933 1.00 0.00 C ATOM 591 C GLU A 957 -3.042 7.184 6.116 1.00 0.00 C ATOM 592 O GLU A 957 -3.255 6.031 6.498 1.00 0.00 O ATOM 593 CB GLU A 957 -4.770 9.017 6.254 1.00 0.00 C ATOM 594 CG GLU A 957 -5.387 10.139 7.075 1.00 0.00 C ATOM 595 CD GLU A 957 -5.947 9.663 8.403 1.00 0.00 C ATOM 596 OE1 GLU A 957 -5.191 9.070 9.205 1.00 0.00 O ATOM 597 OE2 GLU A 957 -7.146 9.896 8.660 1.00 0.00 O ATOM 0 H GLU A 957 -2.767 10.304 6.822 1.00 0.00 H new ATOM 0 HA GLU A 957 -3.853 7.993 7.908 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.472 9.408 5.281 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.523 8.250 6.073 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.633 10.905 7.258 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -6.184 10.608 6.498 1.00 0.00 H new ATOM 604 N VAL A 958 -2.337 7.451 5.018 1.00 0.00 N ATOM 605 CA VAL A 958 -1.840 6.373 4.167 1.00 0.00 C ATOM 606 C VAL A 958 -0.533 5.761 4.702 1.00 0.00 C ATOM 607 O VAL A 958 -0.194 4.622 4.379 1.00 0.00 O ATOM 608 CB VAL A 958 -1.642 6.840 2.707 1.00 0.00 C ATOM 609 CG1 VAL A 958 -0.440 7.756 2.570 1.00 0.00 C ATOM 610 CG2 VAL A 958 -1.510 5.646 1.781 1.00 0.00 C ATOM 0 H VAL A 958 -2.100 8.391 4.700 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.607 5.599 4.184 1.00 0.00 H new ATOM 0 HB VAL A 958 -2.525 7.411 2.420 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.333 8.063 1.530 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.581 8.637 3.196 1.00 0.00 H new ATOM 0 HG13 VAL A 958 0.459 7.226 2.886 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -1.371 5.993 0.757 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -0.650 5.047 2.081 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -2.413 5.039 1.839 1.00 0.00 H new ATOM 620 N GLY A 959 0.202 6.502 5.521 1.00 0.00 N ATOM 621 CA GLY A 959 1.446 5.974 6.053 1.00 0.00 C ATOM 622 C GLY A 959 1.209 4.872 7.061 1.00 0.00 C ATOM 623 O GLY A 959 1.851 3.824 7.012 1.00 0.00 O ATOM 0 H GLY A 959 -0.035 7.447 5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 959 2.057 5.592 5.235 1.00 0.00 H new ATOM 0 HA3 GLY A 959 2.010 6.780 6.523 1.00 0.00 H new ATOM 627 N LEU A 960 0.269 5.102 7.967 1.00 0.00 N ATOM 628 CA LEU A 960 -0.194 4.051 8.862 1.00 0.00 C ATOM 629 C LEU A 960 -0.906 2.962 8.078 1.00 0.00 C ATOM 630 O LEU A 960 -0.984 1.821 8.521 1.00 0.00 O ATOM 631 CB LEU A 960 -1.120 4.624 9.936 1.00 0.00 C ATOM 632 CG LEU A 960 -0.462 5.608 10.905 1.00 0.00 C ATOM 633 CD1 LEU A 960 -1.476 6.119 11.914 1.00 0.00 C ATOM 634 CD2 LEU A 960 0.713 4.954 11.617 1.00 0.00 C ATOM 0 H LEU A 960 -0.187 6.004 8.102 1.00 0.00 H new ATOM 0 HA LEU A 960 0.675 3.615 9.355 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -1.954 5.125 9.445 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -1.539 3.798 10.511 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.087 6.456 10.331 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -0.991 6.818 12.595 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -2.286 6.626 11.390 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -1.879 5.280 12.481 1.00 0.00 H new ATOM 0 HD21 LEU A 960 1.168 5.670 12.302 1.00 0.00 H new ATOM 0 HD22 LEU A 960 0.362 4.088 12.178 1.00 0.00 H new ATOM 0 HD23 LEU A 960 1.452 4.635 10.882 1.00 0.00 H new ATOM 646 N ALA A 961 -1.427 3.325 6.915 1.00 0.00 N ATOM 647 CA ALA A 961 -2.056 2.356 6.030 1.00 0.00 C ATOM 648 C ALA A 961 -1.068 1.288 5.571 1.00 0.00 C ATOM 649 O ALA A 961 -1.321 0.105 5.768 1.00 0.00 O ATOM 650 CB ALA A 961 -2.680 3.041 4.837 1.00 0.00 C ATOM 0 H ALA A 961 -1.427 4.282 6.563 1.00 0.00 H new ATOM 0 HA ALA A 961 -2.843 1.861 6.599 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.144 2.296 4.191 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.437 3.747 5.178 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -1.910 3.575 4.280 1.00 0.00 H new ATOM 656 N LEU A 962 0.061 1.686 4.972 1.00 0.00 N ATOM 657 CA LEU A 962 1.042 0.710 4.522 1.00 0.00 C ATOM 658 C LEU A 962 1.671 -0.016 5.718 1.00 0.00 C ATOM 659 O LEU A 962 2.114 -1.153 5.593 1.00 0.00 O ATOM 660 CB LEU A 962 2.107 1.365 3.622 1.00 0.00 C ATOM 661 CG LEU A 962 3.201 0.422 3.115 1.00 0.00 C ATOM 662 CD1 LEU A 962 3.547 0.752 1.676 1.00 0.00 C ATOM 663 CD2 LEU A 962 4.447 0.517 3.988 1.00 0.00 C ATOM 0 H LEU A 962 0.309 2.659 4.793 1.00 0.00 H new ATOM 0 HA LEU A 962 0.529 -0.037 3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 962 1.608 1.812 2.762 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.578 2.177 4.176 1.00 0.00 H new ATOM 0 HG LEU A 962 2.824 -0.599 3.166 1.00 0.00 H new ATOM 0 HD11 LEU A 962 4.326 0.076 1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 962 2.660 0.638 1.053 1.00 0.00 H new ATOM 0 HD13 LEU A 962 3.904 1.780 1.614 1.00 0.00 H new ATOM 0 HD21 LEU A 962 5.210 -0.162 3.608 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.828 1.538 3.969 1.00 0.00 H new ATOM 0 HD23 LEU A 962 4.195 0.243 5.013 1.00 0.00 H new ATOM 675 N ARG A 963 1.720 0.636 6.878 1.00 0.00 N ATOM 676 CA ARG A 963 2.123 -0.048 8.111 1.00 0.00 C ATOM 677 C ARG A 963 1.107 -1.123 8.508 1.00 0.00 C ATOM 678 O ARG A 963 1.475 -2.251 8.828 1.00 0.00 O ATOM 679 CB ARG A 963 2.306 0.958 9.247 1.00 0.00 C ATOM 680 CG ARG A 963 3.523 1.850 9.072 1.00 0.00 C ATOM 681 CD ARG A 963 3.666 2.831 10.221 1.00 0.00 C ATOM 682 NE ARG A 963 3.729 2.153 11.514 1.00 0.00 N ATOM 683 CZ ARG A 963 4.579 2.472 12.486 1.00 0.00 C ATOM 684 NH1 ARG A 963 5.466 3.445 12.315 1.00 0.00 N ATOM 685 NH2 ARG A 963 4.547 1.813 13.633 1.00 0.00 N ATOM 0 H ARG A 963 1.490 1.623 6.993 1.00 0.00 H new ATOM 0 HA ARG A 963 3.077 -0.541 7.923 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.415 1.582 9.317 1.00 0.00 H new ATOM 0 HB3 ARG A 963 2.393 0.418 10.190 1.00 0.00 H new ATOM 0 HG2 ARG A 963 4.420 1.234 9.005 1.00 0.00 H new ATOM 0 HG3 ARG A 963 3.442 2.398 8.133 1.00 0.00 H new ATOM 0 HD2 ARG A 963 4.568 3.426 10.079 1.00 0.00 H new ATOM 0 HD3 ARG A 963 2.823 3.522 10.215 1.00 0.00 H new ATOM 0 HE ARG A 963 3.079 1.385 11.682 1.00 0.00 H new ATOM 0 HH11 ARG A 963 5.500 3.955 11.432 1.00 0.00 H new ATOM 0 HH12 ARG A 963 6.114 3.682 13.066 1.00 0.00 H new ATOM 0 HH21 ARG A 963 3.871 1.062 13.771 1.00 0.00 H new ATOM 0 HH22 ARG A 963 5.198 2.056 14.379 1.00 0.00 H new ATOM 699 N THR A 964 -0.170 -0.769 8.504 1.00 0.00 N ATOM 700 CA THR A 964 -1.230 -1.762 8.682 1.00 0.00 C ATOM 701 C THR A 964 -1.091 -2.859 7.625 1.00 0.00 C ATOM 702 O THR A 964 -1.233 -4.051 7.905 1.00 0.00 O ATOM 703 CB THR A 964 -2.627 -1.120 8.581 1.00 0.00 C ATOM 704 OG1 THR A 964 -2.692 0.029 9.436 1.00 0.00 O ATOM 705 CG2 THR A 964 -3.711 -2.106 8.984 1.00 0.00 C ATOM 0 H THR A 964 -0.500 0.188 8.381 1.00 0.00 H new ATOM 0 HA THR A 964 -1.126 -2.191 9.679 1.00 0.00 H new ATOM 0 HB THR A 964 -2.793 -0.825 7.545 1.00 0.00 H new ATOM 0 HG1 THR A 964 -2.257 0.789 8.996 1.00 0.00 H new ATOM 0 HG21 THR A 964 -4.687 -1.627 8.904 1.00 0.00 H new ATOM 0 HG22 THR A 964 -3.677 -2.973 8.325 1.00 0.00 H new ATOM 0 HG23 THR A 964 -3.548 -2.426 10.013 1.00 0.00 H new ATOM 713 N LEU A 965 -0.770 -2.425 6.420 1.00 0.00 N ATOM 714 CA LEU A 965 -0.490 -3.308 5.300 1.00 0.00 C ATOM 715 C LEU A 965 0.693 -4.237 5.629 1.00 0.00 C ATOM 716 O LEU A 965 0.769 -5.371 5.154 1.00 0.00 O ATOM 717 CB LEU A 965 -0.226 -2.418 4.066 1.00 0.00 C ATOM 718 CG LEU A 965 0.315 -3.086 2.803 1.00 0.00 C ATOM 719 CD1 LEU A 965 1.825 -3.248 2.879 1.00 0.00 C ATOM 720 CD2 LEU A 965 -0.363 -4.418 2.580 1.00 0.00 C ATOM 0 H LEU A 965 -0.695 -1.435 6.187 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.334 -3.965 5.091 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -1.161 -1.921 3.807 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.478 -1.640 4.360 1.00 0.00 H new ATOM 0 HG LEU A 965 0.093 -2.443 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 965 2.186 -3.726 1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 965 2.291 -2.268 2.984 1.00 0.00 H new ATOM 0 HD13 LEU A 965 2.082 -3.866 3.739 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.033 -4.881 1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -0.176 -5.069 3.434 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.437 -4.266 2.469 1.00 0.00 H new ATOM 732 N LEU A 966 1.586 -3.761 6.480 1.00 0.00 N ATOM 733 CA LEU A 966 2.743 -4.548 6.893 1.00 0.00 C ATOM 734 C LEU A 966 2.292 -5.730 7.749 1.00 0.00 C ATOM 735 O LEU A 966 2.969 -6.756 7.819 1.00 0.00 O ATOM 736 CB LEU A 966 3.755 -3.686 7.655 1.00 0.00 C ATOM 737 CG LEU A 966 5.125 -3.538 6.983 1.00 0.00 C ATOM 738 CD1 LEU A 966 5.823 -4.885 6.884 1.00 0.00 C ATOM 739 CD2 LEU A 966 4.979 -2.913 5.603 1.00 0.00 C ATOM 0 H LEU A 966 1.535 -2.833 6.900 1.00 0.00 H new ATOM 0 HA LEU A 966 3.237 -4.927 5.998 1.00 0.00 H new ATOM 0 HB2 LEU A 966 3.328 -2.693 7.796 1.00 0.00 H new ATOM 0 HB3 LEU A 966 3.899 -4.115 8.647 1.00 0.00 H new ATOM 0 HG LEU A 966 5.737 -2.878 7.598 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.793 -4.758 6.404 1.00 0.00 H new ATOM 0 HD12 LEU A 966 5.964 -5.296 7.884 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.213 -5.568 6.293 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.962 -2.816 5.142 1.00 0.00 H new ATOM 0 HD22 LEU A 966 4.347 -3.547 4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.523 -1.927 5.696 1.00 0.00 H new ATOM 751 N ALA A 967 1.135 -5.586 8.390 1.00 0.00 N ATOM 752 CA ALA A 967 0.512 -6.698 9.097 1.00 0.00 C ATOM 753 C ALA A 967 0.023 -7.747 8.099 1.00 0.00 C ATOM 754 O ALA A 967 0.110 -8.945 8.352 1.00 0.00 O ATOM 755 CB ALA A 967 -0.634 -6.214 9.976 1.00 0.00 C ATOM 0 H ALA A 967 0.612 -4.711 8.434 1.00 0.00 H new ATOM 0 HA ALA A 967 1.259 -7.155 9.747 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.081 -7.064 10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -0.254 -5.503 10.710 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.388 -5.728 9.356 1.00 0.00 H new ATOM 761 N THR A 968 -0.479 -7.290 6.955 1.00 0.00 N ATOM 762 CA THR A 968 -0.837 -8.195 5.865 1.00 0.00 C ATOM 763 C THR A 968 0.408 -8.900 5.328 1.00 0.00 C ATOM 764 O THR A 968 0.380 -10.099 5.028 1.00 0.00 O ATOM 765 CB THR A 968 -1.567 -7.450 4.728 1.00 0.00 C ATOM 766 OG1 THR A 968 -2.940 -7.266 5.085 1.00 0.00 O ATOM 767 CG2 THR A 968 -1.485 -8.204 3.411 1.00 0.00 C ATOM 0 H THR A 968 -0.647 -6.303 6.758 1.00 0.00 H new ATOM 0 HA THR A 968 -1.522 -8.943 6.265 1.00 0.00 H new ATOM 0 HB THR A 968 -1.077 -6.486 4.592 1.00 0.00 H new ATOM 0 HG1 THR A 968 -3.512 -7.711 4.426 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.012 -7.644 2.638 1.00 0.00 H new ATOM 0 HG22 THR A 968 -0.440 -8.323 3.124 1.00 0.00 H new ATOM 0 HG23 THR A 968 -1.944 -9.186 3.525 1.00 0.00 H new ATOM 775 N VAL A 969 1.497 -8.152 5.210 1.00 0.00 N ATOM 776 CA VAL A 969 2.792 -8.731 4.874 1.00 0.00 C ATOM 777 C VAL A 969 3.152 -9.838 5.872 1.00 0.00 C ATOM 778 O VAL A 969 3.783 -10.829 5.517 1.00 0.00 O ATOM 779 CB VAL A 969 3.904 -7.655 4.867 1.00 0.00 C ATOM 780 CG1 VAL A 969 5.269 -8.266 4.579 1.00 0.00 C ATOM 781 CG2 VAL A 969 3.589 -6.566 3.855 1.00 0.00 C ATOM 0 H VAL A 969 1.510 -7.141 5.342 1.00 0.00 H new ATOM 0 HA VAL A 969 2.718 -9.154 3.872 1.00 0.00 H new ATOM 0 HB VAL A 969 3.939 -7.211 5.862 1.00 0.00 H new ATOM 0 HG11 VAL A 969 6.026 -7.482 4.582 1.00 0.00 H new ATOM 0 HG12 VAL A 969 5.507 -9.003 5.346 1.00 0.00 H new ATOM 0 HG13 VAL A 969 5.252 -8.751 3.603 1.00 0.00 H new ATOM 0 HG21 VAL A 969 4.383 -5.819 3.865 1.00 0.00 H new ATOM 0 HG22 VAL A 969 3.516 -7.004 2.860 1.00 0.00 H new ATOM 0 HG23 VAL A 969 2.642 -6.092 4.113 1.00 0.00 H new ATOM 791 N ASP A 970 2.711 -9.668 7.110 1.00 0.00 N ATOM 792 CA ASP A 970 2.966 -10.641 8.169 1.00 0.00 C ATOM 793 C ASP A 970 2.010 -11.823 8.093 1.00 0.00 C ATOM 794 O ASP A 970 2.363 -12.913 8.500 1.00 0.00 O ATOM 795 CB ASP A 970 2.880 -9.963 9.538 1.00 0.00 C ATOM 796 CG ASP A 970 3.047 -10.929 10.691 1.00 0.00 C ATOM 797 OD1 ASP A 970 4.203 -11.229 11.063 1.00 0.00 O ATOM 798 OD2 ASP A 970 2.024 -11.386 11.239 1.00 0.00 O ATOM 0 H ASP A 970 2.169 -8.858 7.410 1.00 0.00 H new ATOM 0 HA ASP A 970 3.974 -11.031 8.029 1.00 0.00 H new ATOM 0 HB2 ASP A 970 3.648 -9.192 9.604 1.00 0.00 H new ATOM 0 HB3 ASP A 970 1.916 -9.462 9.629 1.00 0.00 H new ATOM 803 N GLU A 971 0.809 -11.604 7.591 1.00 0.00 N ATOM 804 CA GLU A 971 -0.103 -12.711 7.288 1.00 0.00 C ATOM 805 C GLU A 971 0.512 -13.568 6.186 1.00 0.00 C ATOM 806 O GLU A 971 0.633 -14.800 6.285 1.00 0.00 O ATOM 807 CB GLU A 971 -1.456 -12.169 6.827 1.00 0.00 C ATOM 808 CG GLU A 971 -2.060 -11.169 7.793 1.00 0.00 C ATOM 809 CD GLU A 971 -2.565 -11.814 9.067 1.00 0.00 C ATOM 810 OE1 GLU A 971 -1.735 -12.180 9.924 1.00 0.00 O ATOM 811 OE2 GLU A 971 -3.793 -11.961 9.216 1.00 0.00 O ATOM 0 H GLU A 971 0.436 -10.678 7.382 1.00 0.00 H new ATOM 0 HA GLU A 971 -0.257 -13.312 8.184 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.338 -11.696 5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -2.148 -13.001 6.696 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.313 -10.416 8.044 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -2.884 -10.650 7.303 1.00 0.00 H new ATOM 818 N SER A 972 0.919 -12.884 5.142 1.00 0.00 N ATOM 819 CA SER A 972 1.597 -13.502 4.031 1.00 0.00 C ATOM 820 C SER A 972 2.949 -14.079 4.456 1.00 0.00 C ATOM 821 O SER A 972 3.490 -14.931 3.771 1.00 0.00 O ATOM 822 CB SER A 972 1.742 -12.508 2.888 1.00 0.00 C ATOM 823 OG SER A 972 2.484 -13.064 1.825 1.00 0.00 O ATOM 0 H SER A 972 0.787 -11.878 5.041 1.00 0.00 H new ATOM 0 HA SER A 972 0.994 -14.338 3.678 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.755 -12.212 2.532 1.00 0.00 H new ATOM 0 HB3 SER A 972 2.235 -11.605 3.247 1.00 0.00 H new ATOM 0 HG SER A 972 2.373 -14.038 1.822 1.00 0.00 H new ATOM 829 N LEU A 973 3.517 -13.565 5.541 1.00 0.00 N ATOM 830 CA LEU A 973 4.809 -14.043 6.037 1.00 0.00 C ATOM 831 C LEU A 973 4.803 -15.553 6.330 1.00 0.00 C ATOM 832 O LEU A 973 5.675 -16.248 5.839 1.00 0.00 O ATOM 833 CB LEU A 973 5.252 -13.254 7.274 1.00 0.00 C ATOM 834 CG LEU A 973 6.615 -13.644 7.846 1.00 0.00 C ATOM 835 CD1 LEU A 973 7.715 -13.371 6.830 1.00 0.00 C ATOM 836 CD2 LEU A 973 6.878 -12.891 9.141 1.00 0.00 C ATOM 0 H LEU A 973 3.105 -12.816 6.097 1.00 0.00 H new ATOM 0 HA LEU A 973 5.532 -13.873 5.239 1.00 0.00 H new ATOM 0 HB2 LEU A 973 5.273 -12.194 7.020 1.00 0.00 H new ATOM 0 HB3 LEU A 973 4.500 -13.380 8.053 1.00 0.00 H new ATOM 0 HG LEU A 973 6.610 -14.712 8.065 1.00 0.00 H new ATOM 0 HD11 LEU A 973 8.679 -13.654 7.253 1.00 0.00 H new ATOM 0 HD12 LEU A 973 7.529 -13.953 5.927 1.00 0.00 H new ATOM 0 HD13 LEU A 973 7.725 -12.310 6.581 1.00 0.00 H new ATOM 0 HD21 LEU A 973 7.852 -13.178 9.538 1.00 0.00 H new ATOM 0 HD22 LEU A 973 6.867 -11.818 8.947 1.00 0.00 H new ATOM 0 HD23 LEU A 973 6.104 -13.136 9.868 1.00 0.00 H new ATOM 848 N PRO A 974 3.860 -16.110 7.132 1.00 0.00 N ATOM 849 CA PRO A 974 3.713 -17.569 7.227 1.00 0.00 C ATOM 850 C PRO A 974 3.433 -18.179 5.864 1.00 0.00 C ATOM 851 O PRO A 974 3.785 -19.331 5.586 1.00 0.00 O ATOM 852 CB PRO A 974 2.513 -17.764 8.154 1.00 0.00 C ATOM 853 CG PRO A 974 2.441 -16.512 8.943 1.00 0.00 C ATOM 854 CD PRO A 974 2.938 -15.427 8.035 1.00 0.00 C ATOM 0 HA PRO A 974 4.618 -18.052 7.597 1.00 0.00 H new ATOM 0 HB2 PRO A 974 1.597 -17.928 7.587 1.00 0.00 H new ATOM 0 HB3 PRO A 974 2.648 -18.632 8.800 1.00 0.00 H new ATOM 0 HG2 PRO A 974 1.420 -16.313 9.268 1.00 0.00 H new ATOM 0 HG3 PRO A 974 3.054 -16.581 9.842 1.00 0.00 H new ATOM 0 HD2 PRO A 974 2.119 -14.959 7.489 1.00 0.00 H new ATOM 0 HD3 PRO A 974 3.440 -14.638 8.595 1.00 0.00 H new ATOM 862 N VAL A 975 2.816 -17.396 4.994 1.00 0.00 N ATOM 863 CA VAL A 975 2.571 -17.869 3.635 1.00 0.00 C ATOM 864 C VAL A 975 3.854 -17.768 2.789 1.00 0.00 C ATOM 865 O VAL A 975 3.921 -18.282 1.676 1.00 0.00 O ATOM 866 CB VAL A 975 1.412 -17.112 2.959 1.00 0.00 C ATOM 867 CG1 VAL A 975 0.901 -17.895 1.764 1.00 0.00 C ATOM 868 CG2 VAL A 975 0.283 -16.862 3.945 1.00 0.00 C ATOM 0 H VAL A 975 2.482 -16.453 5.193 1.00 0.00 H new ATOM 0 HA VAL A 975 2.276 -18.916 3.703 1.00 0.00 H new ATOM 0 HB VAL A 975 1.787 -16.148 2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.082 -17.350 1.295 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.708 -18.028 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 975 0.545 -18.871 2.094 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -0.524 -16.326 3.446 1.00 0.00 H new ATOM 0 HG22 VAL A 975 -0.091 -17.815 4.319 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.653 -16.265 4.778 1.00 0.00 H new ATOM 878 N LEU A 976 4.880 -17.128 3.345 1.00 0.00 N ATOM 879 CA LEU A 976 6.180 -17.000 2.690 1.00 0.00 C ATOM 880 C LEU A 976 6.915 -18.346 2.655 1.00 0.00 C ATOM 881 O LEU A 976 7.327 -18.773 1.574 1.00 0.00 O ATOM 882 CB LEU A 976 7.012 -15.877 3.356 1.00 0.00 C ATOM 883 CG LEU A 976 8.506 -15.792 3.010 1.00 0.00 C ATOM 884 CD1 LEU A 976 9.002 -14.366 3.173 1.00 0.00 C ATOM 885 CD2 LEU A 976 9.341 -16.711 3.891 1.00 0.00 C ATOM 0 H LEU A 976 4.834 -16.684 4.262 1.00 0.00 H new ATOM 0 HA LEU A 976 6.026 -16.709 1.651 1.00 0.00 H new ATOM 0 HB2 LEU A 976 6.554 -14.922 3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 976 6.924 -15.991 4.436 1.00 0.00 H new ATOM 0 HG LEU A 976 8.617 -16.111 1.974 1.00 0.00 H new ATOM 0 HD11 LEU A 976 10.062 -14.319 2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.444 -13.708 2.507 1.00 0.00 H new ATOM 0 HD13 LEU A 976 8.856 -14.046 4.205 1.00 0.00 H new ATOM 0 HD21 LEU A 976 10.392 -16.623 3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 976 9.214 -16.427 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 976 9.015 -17.742 3.753 1.00 0.00 H new ATOM 897 N PRO A 977 7.092 -19.058 3.804 1.00 0.00 N ATOM 898 CA PRO A 977 7.654 -20.410 3.782 1.00 0.00 C ATOM 899 C PRO A 977 6.712 -21.384 3.091 1.00 0.00 C ATOM 900 O PRO A 977 7.112 -22.478 2.692 1.00 0.00 O ATOM 901 CB PRO A 977 7.825 -20.777 5.258 1.00 0.00 C ATOM 902 CG PRO A 977 6.886 -19.886 5.982 1.00 0.00 C ATOM 903 CD PRO A 977 6.821 -18.620 5.181 1.00 0.00 C ATOM 0 HA PRO A 977 8.592 -20.455 3.229 1.00 0.00 H new ATOM 0 HB2 PRO A 977 7.590 -21.827 5.434 1.00 0.00 H new ATOM 0 HB3 PRO A 977 8.852 -20.621 5.588 1.00 0.00 H new ATOM 0 HG2 PRO A 977 5.901 -20.344 6.069 1.00 0.00 H new ATOM 0 HG3 PRO A 977 7.237 -19.690 6.995 1.00 0.00 H new ATOM 0 HD2 PRO A 977 5.844 -18.145 5.264 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.559 -17.893 5.522 1.00 0.00 H new ATOM 911 N ALA A 978 5.448 -20.988 2.981 1.00 0.00 N ATOM 912 CA ALA A 978 4.490 -21.734 2.185 1.00 0.00 C ATOM 913 C ALA A 978 4.810 -21.601 0.695 1.00 0.00 C ATOM 914 O ALA A 978 5.001 -22.606 0.011 1.00 0.00 O ATOM 915 CB ALA A 978 3.071 -21.267 2.472 1.00 0.00 C ATOM 0 H ALA A 978 5.068 -20.157 3.433 1.00 0.00 H new ATOM 0 HA ALA A 978 4.564 -22.786 2.460 1.00 0.00 H new ATOM 0 HB1 ALA A 978 2.370 -21.839 1.865 1.00 0.00 H new ATOM 0 HB2 ALA A 978 2.845 -21.418 3.527 1.00 0.00 H new ATOM 0 HB3 ALA A 978 2.980 -20.208 2.230 1.00 0.00 H new ATOM 921 N SER A 979 4.886 -20.359 0.200 1.00 0.00 N ATOM 922 CA SER A 979 5.103 -20.114 -1.229 1.00 0.00 C ATOM 923 C SER A 979 5.370 -18.630 -1.557 1.00 0.00 C ATOM 924 O SER A 979 6.179 -18.316 -2.433 1.00 0.00 O ATOM 925 CB SER A 979 3.884 -20.603 -2.017 1.00 0.00 C ATOM 926 OG SER A 979 3.963 -21.992 -2.283 1.00 0.00 O ATOM 0 H SER A 979 4.801 -19.514 0.765 1.00 0.00 H new ATOM 0 HA SER A 979 5.998 -20.666 -1.517 1.00 0.00 H new ATOM 0 HB2 SER A 979 2.976 -20.390 -1.454 1.00 0.00 H new ATOM 0 HB3 SER A 979 3.812 -20.055 -2.956 1.00 0.00 H new ATOM 0 HG SER A 979 4.450 -22.437 -1.558 1.00 0.00 H new ATOM 932 N THR A 980 4.692 -17.734 -0.847 1.00 0.00 N ATOM 933 CA THR A 980 4.684 -16.295 -1.160 1.00 0.00 C ATOM 934 C THR A 980 6.062 -15.625 -1.173 1.00 0.00 C ATOM 935 O THR A 980 6.194 -14.532 -1.720 1.00 0.00 O ATOM 936 CB THR A 980 3.786 -15.517 -0.196 1.00 0.00 C ATOM 937 OG1 THR A 980 2.556 -16.217 -0.026 1.00 0.00 O ATOM 938 CG2 THR A 980 3.504 -14.125 -0.742 1.00 0.00 C ATOM 0 H THR A 980 4.128 -17.979 -0.033 1.00 0.00 H new ATOM 0 HA THR A 980 4.296 -16.257 -2.178 1.00 0.00 H new ATOM 0 HB THR A 980 4.295 -15.424 0.763 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.020 -15.773 0.664 1.00 0.00 H new ATOM 0 HG21 THR A 980 2.864 -13.584 -0.045 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.443 -13.586 -0.866 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.003 -14.207 -1.706 1.00 0.00 H new ATOM 946 N HIS A 981 7.077 -16.260 -0.580 1.00 0.00 N ATOM 947 CA HIS A 981 8.401 -15.631 -0.403 1.00 0.00 C ATOM 948 C HIS A 981 8.942 -14.979 -1.684 1.00 0.00 C ATOM 949 O HIS A 981 9.817 -14.128 -1.612 1.00 0.00 O ATOM 950 CB HIS A 981 9.432 -16.647 0.126 1.00 0.00 C ATOM 951 CG HIS A 981 9.679 -17.839 -0.757 1.00 0.00 C ATOM 952 ND1 HIS A 981 9.367 -19.129 -0.384 1.00 0.00 N ATOM 953 CD2 HIS A 981 10.236 -17.936 -1.990 1.00 0.00 C ATOM 954 CE1 HIS A 981 9.714 -19.963 -1.346 1.00 0.00 C ATOM 955 NE2 HIS A 981 10.240 -19.264 -2.331 1.00 0.00 N ATOM 0 H HIS A 981 7.013 -17.209 -0.212 1.00 0.00 H new ATOM 0 HA HIS A 981 8.252 -14.838 0.330 1.00 0.00 H new ATOM 0 HB2 HIS A 981 10.379 -16.130 0.282 1.00 0.00 H new ATOM 0 HB3 HIS A 981 9.099 -17.002 1.101 1.00 0.00 H new ATOM 0 HD1 HIS A 981 8.934 -19.398 0.500 1.00 0.00 H new ATOM 0 HD2 HIS A 981 10.607 -17.119 -2.591 1.00 0.00 H new ATOM 0 HE1 HIS A 981 9.588 -21.036 -1.329 1.00 0.00 H new ATOM 964 N ARG A 982 8.424 -15.364 -2.838 1.00 0.00 N ATOM 965 CA ARG A 982 8.872 -14.759 -4.089 1.00 0.00 C ATOM 966 C ARG A 982 8.282 -13.350 -4.258 1.00 0.00 C ATOM 967 O ARG A 982 9.017 -12.366 -4.423 1.00 0.00 O ATOM 968 CB ARG A 982 8.455 -15.628 -5.277 1.00 0.00 C ATOM 969 CG ARG A 982 8.943 -17.064 -5.195 1.00 0.00 C ATOM 970 CD ARG A 982 8.450 -17.882 -6.376 1.00 0.00 C ATOM 971 NE ARG A 982 8.992 -17.401 -7.645 1.00 0.00 N ATOM 972 CZ ARG A 982 8.310 -17.375 -8.791 1.00 0.00 C ATOM 973 NH1 ARG A 982 7.043 -17.765 -8.826 1.00 0.00 N ATOM 974 NH2 ARG A 982 8.894 -16.957 -9.907 1.00 0.00 N ATOM 0 H ARG A 982 7.705 -16.080 -2.939 1.00 0.00 H new ATOM 0 HA ARG A 982 9.959 -14.685 -4.055 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.367 -15.629 -5.349 1.00 0.00 H new ATOM 0 HB3 ARG A 982 8.835 -15.178 -6.194 1.00 0.00 H new ATOM 0 HG2 ARG A 982 10.033 -17.079 -5.169 1.00 0.00 H new ATOM 0 HG3 ARG A 982 8.595 -17.516 -4.266 1.00 0.00 H new ATOM 0 HD2 ARG A 982 8.731 -18.926 -6.235 1.00 0.00 H new ATOM 0 HD3 ARG A 982 7.361 -17.847 -6.411 1.00 0.00 H new ATOM 0 HE ARG A 982 9.954 -17.063 -7.655 1.00 0.00 H new ATOM 0 HH11 ARG A 982 6.585 -18.087 -7.974 1.00 0.00 H new ATOM 0 HH12 ARG A 982 6.527 -17.743 -9.705 1.00 0.00 H new ATOM 0 HH21 ARG A 982 9.868 -16.654 -9.890 1.00 0.00 H new ATOM 0 HH22 ARG A 982 8.369 -16.939 -10.781 1.00 0.00 H new ATOM 988 N GLU A 983 6.956 -13.237 -4.191 1.00 0.00 N ATOM 989 CA GLU A 983 6.316 -11.935 -4.357 1.00 0.00 C ATOM 990 C GLU A 983 6.372 -11.089 -3.115 1.00 0.00 C ATOM 991 O GLU A 983 6.545 -9.874 -3.203 1.00 0.00 O ATOM 992 CB GLU A 983 4.864 -12.025 -4.784 1.00 0.00 C ATOM 993 CG GLU A 983 4.661 -11.649 -6.229 1.00 0.00 C ATOM 994 CD GLU A 983 5.269 -12.656 -7.191 1.00 0.00 C ATOM 995 OE1 GLU A 983 6.487 -12.578 -7.457 1.00 0.00 O ATOM 996 OE2 GLU A 983 4.531 -13.541 -7.673 1.00 0.00 O ATOM 0 H GLU A 983 6.316 -14.014 -4.026 1.00 0.00 H new ATOM 0 HA GLU A 983 6.898 -11.466 -5.151 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.504 -13.041 -4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.262 -11.370 -4.154 1.00 0.00 H new ATOM 0 HG2 GLU A 983 3.593 -11.560 -6.430 1.00 0.00 H new ATOM 0 HG3 GLU A 983 5.102 -10.669 -6.410 1.00 0.00 H new ATOM 1003 N ILE A 984 6.176 -11.707 -1.962 1.00 0.00 N ATOM 1004 CA ILE A 984 6.058 -10.946 -0.737 1.00 0.00 C ATOM 1005 C ILE A 984 7.270 -10.049 -0.573 1.00 0.00 C ATOM 1006 O ILE A 984 7.151 -8.918 -0.130 1.00 0.00 O ATOM 1007 CB ILE A 984 5.863 -11.851 0.501 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.561 -11.010 1.743 1.00 0.00 C ATOM 1009 CG2 ILE A 984 7.084 -12.723 0.741 1.00 0.00 C ATOM 1010 CD1 ILE A 984 4.307 -10.170 1.621 1.00 0.00 C ATOM 0 H ILE A 984 6.097 -12.718 -1.852 1.00 0.00 H new ATOM 0 HA ILE A 984 5.163 -10.329 -0.811 1.00 0.00 H new ATOM 0 HB ILE A 984 5.012 -12.503 0.305 1.00 0.00 H new ATOM 0 HG12 ILE A 984 5.462 -11.672 2.603 1.00 0.00 H new ATOM 0 HG13 ILE A 984 6.409 -10.354 1.941 1.00 0.00 H new ATOM 0 HG21 ILE A 984 6.918 -13.349 1.618 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.255 -13.356 -0.129 1.00 0.00 H new ATOM 0 HG23 ILE A 984 7.956 -12.090 0.907 1.00 0.00 H new ATOM 0 HD11 ILE A 984 4.159 -9.602 2.539 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.410 -9.482 0.782 1.00 0.00 H new ATOM 0 HD13 ILE A 984 3.448 -10.820 1.454 1.00 0.00 H new ATOM 1022 N GLU A 985 8.427 -10.542 -0.991 1.00 0.00 N ATOM 1023 CA GLU A 985 9.630 -9.737 -0.943 1.00 0.00 C ATOM 1024 C GLU A 985 9.667 -8.699 -2.067 1.00 0.00 C ATOM 1025 O GLU A 985 10.100 -7.573 -1.832 1.00 0.00 O ATOM 1026 CB GLU A 985 10.898 -10.595 -0.946 1.00 0.00 C ATOM 1027 CG GLU A 985 11.129 -11.382 -2.221 1.00 0.00 C ATOM 1028 CD GLU A 985 12.516 -11.982 -2.267 1.00 0.00 C ATOM 1029 OE1 GLU A 985 12.705 -13.099 -1.750 1.00 0.00 O ATOM 1030 OE2 GLU A 985 13.432 -11.323 -2.799 1.00 0.00 O ATOM 0 H GLU A 985 8.554 -11.484 -1.362 1.00 0.00 H new ATOM 0 HA GLU A 985 9.603 -9.198 0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 985 11.758 -9.948 -0.774 1.00 0.00 H new ATOM 0 HB3 GLU A 985 10.851 -11.292 -0.109 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.387 -12.176 -2.297 1.00 0.00 H new ATOM 0 HG3 GLU A 985 10.987 -10.729 -3.082 1.00 0.00 H new ATOM 1037 N MET A 986 9.197 -9.053 -3.280 1.00 0.00 N ATOM 1038 CA MET A 986 9.336 -8.135 -4.419 1.00 0.00 C ATOM 1039 C MET A 986 8.633 -6.807 -4.136 1.00 0.00 C ATOM 1040 O MET A 986 9.221 -5.732 -4.277 1.00 0.00 O ATOM 1041 CB MET A 986 8.825 -8.737 -5.744 1.00 0.00 C ATOM 1042 CG MET A 986 7.318 -8.913 -5.829 1.00 0.00 C ATOM 1043 SD MET A 986 6.667 -8.680 -7.494 1.00 0.00 S ATOM 1044 CE MET A 986 7.615 -9.886 -8.414 1.00 0.00 C ATOM 0 H MET A 986 8.734 -9.937 -3.489 1.00 0.00 H new ATOM 0 HA MET A 986 10.405 -7.958 -4.541 1.00 0.00 H new ATOM 0 HB2 MET A 986 9.148 -8.097 -6.565 1.00 0.00 H new ATOM 0 HB3 MET A 986 9.298 -9.708 -5.891 1.00 0.00 H new ATOM 0 HG2 MET A 986 7.055 -9.912 -5.480 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.837 -8.203 -5.156 1.00 0.00 H new ATOM 0 HE1 MET A 986 8.391 -9.378 -8.987 1.00 0.00 H new ATOM 0 HE2 MET A 986 8.077 -10.590 -7.722 1.00 0.00 H new ATOM 0 HE3 MET A 986 6.956 -10.425 -9.094 1.00 0.00 H new ATOM 1054 N ALA A 987 7.383 -6.890 -3.716 1.00 0.00 N ATOM 1055 CA ALA A 987 6.583 -5.712 -3.486 1.00 0.00 C ATOM 1056 C ALA A 987 6.927 -5.059 -2.168 1.00 0.00 C ATOM 1057 O ALA A 987 6.929 -3.846 -2.068 1.00 0.00 O ATOM 1058 CB ALA A 987 5.115 -6.059 -3.525 1.00 0.00 C ATOM 0 H ALA A 987 6.902 -7.770 -3.528 1.00 0.00 H new ATOM 0 HA ALA A 987 6.804 -5.001 -4.282 1.00 0.00 H new ATOM 0 HB1 ALA A 987 4.524 -5.160 -3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.865 -6.473 -4.502 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.894 -6.795 -2.752 1.00 0.00 H new ATOM 1064 N GLN A 988 7.210 -5.867 -1.158 1.00 0.00 N ATOM 1065 CA GLN A 988 7.496 -5.332 0.169 1.00 0.00 C ATOM 1066 C GLN A 988 8.739 -4.437 0.152 1.00 0.00 C ATOM 1067 O GLN A 988 8.757 -3.385 0.795 1.00 0.00 O ATOM 1068 CB GLN A 988 7.655 -6.457 1.195 1.00 0.00 C ATOM 1069 CG GLN A 988 7.849 -5.979 2.627 1.00 0.00 C ATOM 1070 CD GLN A 988 9.240 -6.267 3.154 1.00 0.00 C ATOM 1071 OE1 GLN A 988 10.214 -6.290 2.400 1.00 0.00 O ATOM 1072 NE2 GLN A 988 9.338 -6.512 4.451 1.00 0.00 N ATOM 0 H GLN A 988 7.248 -6.884 -1.227 1.00 0.00 H new ATOM 0 HA GLN A 988 6.644 -4.720 0.465 1.00 0.00 H new ATOM 0 HB2 GLN A 988 6.773 -7.096 1.155 1.00 0.00 H new ATOM 0 HB3 GLN A 988 8.509 -7.073 0.912 1.00 0.00 H new ATOM 0 HG2 GLN A 988 7.660 -4.907 2.677 1.00 0.00 H new ATOM 0 HG3 GLN A 988 7.114 -6.462 3.270 1.00 0.00 H new ATOM 0 HE21 GLN A 988 8.506 -6.483 5.040 1.00 0.00 H new ATOM 0 HE22 GLN A 988 10.246 -6.730 4.862 1.00 0.00 H new ATOM 1081 N LYS A 989 9.772 -4.848 -0.589 1.00 0.00 N ATOM 1082 CA LYS A 989 10.947 -3.995 -0.777 1.00 0.00 C ATOM 1083 C LYS A 989 10.514 -2.693 -1.432 1.00 0.00 C ATOM 1084 O LYS A 989 10.970 -1.605 -1.068 1.00 0.00 O ATOM 1085 CB LYS A 989 11.998 -4.666 -1.670 1.00 0.00 C ATOM 1086 CG LYS A 989 12.570 -5.965 -1.128 1.00 0.00 C ATOM 1087 CD LYS A 989 13.275 -5.775 0.204 1.00 0.00 C ATOM 1088 CE LYS A 989 14.221 -6.933 0.496 1.00 0.00 C ATOM 1089 NZ LYS A 989 13.568 -8.258 0.311 1.00 0.00 N ATOM 0 H LYS A 989 9.819 -5.751 -1.061 1.00 0.00 H new ATOM 0 HA LYS A 989 11.392 -3.814 0.202 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.552 -4.862 -2.645 1.00 0.00 H new ATOM 0 HB3 LYS A 989 12.817 -3.965 -1.830 1.00 0.00 H new ATOM 0 HG2 LYS A 989 11.766 -6.692 -1.010 1.00 0.00 H new ATOM 0 HG3 LYS A 989 13.272 -6.380 -1.852 1.00 0.00 H new ATOM 0 HD2 LYS A 989 13.834 -4.839 0.193 1.00 0.00 H new ATOM 0 HD3 LYS A 989 12.536 -5.695 1.002 1.00 0.00 H new ATOM 0 HE2 LYS A 989 15.089 -6.864 -0.159 1.00 0.00 H new ATOM 0 HE3 LYS A 989 14.587 -6.851 1.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 14.182 -9.004 0.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 12.656 -8.268 0.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 13.410 -8.428 -0.703 1.00 0.00 H new ATOM 1103 N LEU A 990 9.610 -2.830 -2.389 1.00 0.00 N ATOM 1104 CA LEU A 990 9.089 -1.704 -3.140 1.00 0.00 C ATOM 1105 C LEU A 990 8.225 -0.798 -2.243 1.00 0.00 C ATOM 1106 O LEU A 990 8.279 0.424 -2.356 1.00 0.00 O ATOM 1107 CB LEU A 990 8.332 -2.267 -4.359 1.00 0.00 C ATOM 1108 CG LEU A 990 6.948 -1.697 -4.661 1.00 0.00 C ATOM 1109 CD1 LEU A 990 7.051 -0.289 -5.228 1.00 0.00 C ATOM 1110 CD2 LEU A 990 6.211 -2.603 -5.633 1.00 0.00 C ATOM 0 H LEU A 990 9.217 -3.730 -2.666 1.00 0.00 H new ATOM 0 HA LEU A 990 9.893 -1.062 -3.499 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.956 -2.117 -5.240 1.00 0.00 H new ATOM 0 HB3 LEU A 990 8.229 -3.343 -4.222 1.00 0.00 H new ATOM 0 HG LEU A 990 6.388 -1.646 -3.727 1.00 0.00 H new ATOM 0 HD11 LEU A 990 6.052 0.094 -5.435 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.546 0.359 -4.505 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.629 -0.310 -6.152 1.00 0.00 H new ATOM 0 HD21 LEU A 990 5.225 -2.187 -5.842 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.777 -2.678 -6.561 1.00 0.00 H new ATOM 0 HD23 LEU A 990 6.101 -3.595 -5.194 1.00 0.00 H new ATOM 1122 N LEU A 991 7.484 -1.403 -1.314 1.00 0.00 N ATOM 1123 CA LEU A 991 6.641 -0.655 -0.376 1.00 0.00 C ATOM 1124 C LEU A 991 7.488 0.291 0.455 1.00 0.00 C ATOM 1125 O LEU A 991 7.177 1.473 0.589 1.00 0.00 O ATOM 1126 CB LEU A 991 5.919 -1.601 0.584 1.00 0.00 C ATOM 1127 CG LEU A 991 5.077 -2.692 -0.060 1.00 0.00 C ATOM 1128 CD1 LEU A 991 4.774 -3.780 0.950 1.00 0.00 C ATOM 1129 CD2 LEU A 991 3.780 -2.126 -0.595 1.00 0.00 C ATOM 0 H LEU A 991 7.450 -2.415 -1.189 1.00 0.00 H new ATOM 0 HA LEU A 991 5.913 -0.098 -0.966 1.00 0.00 H new ATOM 0 HB2 LEU A 991 6.664 -2.075 1.224 1.00 0.00 H new ATOM 0 HB3 LEU A 991 5.274 -1.007 1.231 1.00 0.00 H new ATOM 0 HG LEU A 991 5.645 -3.113 -0.890 1.00 0.00 H new ATOM 0 HD11 LEU A 991 4.171 -4.556 0.479 1.00 0.00 H new ATOM 0 HD12 LEU A 991 5.707 -4.214 1.309 1.00 0.00 H new ATOM 0 HD13 LEU A 991 4.225 -3.354 1.790 1.00 0.00 H new ATOM 0 HD21 LEU A 991 3.195 -2.925 -1.051 1.00 0.00 H new ATOM 0 HD22 LEU A 991 3.212 -1.682 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.997 -1.363 -1.343 1.00 0.00 H new ATOM 1141 N ASN A 992 8.562 -0.254 1.016 1.00 0.00 N ATOM 1142 CA ASN A 992 9.460 0.504 1.876 1.00 0.00 C ATOM 1143 C ASN A 992 9.956 1.756 1.169 1.00 0.00 C ATOM 1144 O ASN A 992 9.996 2.838 1.753 1.00 0.00 O ATOM 1145 CB ASN A 992 10.646 -0.373 2.298 1.00 0.00 C ATOM 1146 CG ASN A 992 11.758 0.410 2.982 1.00 0.00 C ATOM 1147 OD1 ASN A 992 12.692 0.879 2.331 1.00 0.00 O ATOM 1148 ND2 ASN A 992 11.667 0.565 4.292 1.00 0.00 N ATOM 0 H ASN A 992 8.833 -1.229 0.888 1.00 0.00 H new ATOM 0 HA ASN A 992 8.910 0.811 2.766 1.00 0.00 H new ATOM 0 HB2 ASN A 992 10.291 -1.152 2.973 1.00 0.00 H new ATOM 0 HB3 ASN A 992 11.051 -0.873 1.418 1.00 0.00 H new ATOM 0 HD21 ASN A 992 12.385 1.087 4.795 1.00 0.00 H new ATOM 0 HD22 ASN A 992 10.879 0.163 4.800 1.00 0.00 H new ATOM 1155 N SER A 993 10.307 1.607 -0.096 1.00 0.00 N ATOM 1156 CA SER A 993 10.861 2.706 -0.863 1.00 0.00 C ATOM 1157 C SER A 993 9.795 3.727 -1.261 1.00 0.00 C ATOM 1158 O SER A 993 10.042 4.934 -1.218 1.00 0.00 O ATOM 1159 CB SER A 993 11.564 2.162 -2.105 1.00 0.00 C ATOM 1160 OG SER A 993 12.634 1.304 -1.743 1.00 0.00 O ATOM 0 H SER A 993 10.217 0.733 -0.614 1.00 0.00 H new ATOM 0 HA SER A 993 11.581 3.225 -0.230 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.850 1.619 -2.724 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.942 2.989 -2.706 1.00 0.00 H new ATOM 0 HG SER A 993 13.070 0.965 -2.553 1.00 0.00 H new ATOM 1166 N ASP A 994 8.609 3.261 -1.618 1.00 0.00 N ATOM 1167 CA ASP A 994 7.619 4.147 -2.219 1.00 0.00 C ATOM 1168 C ASP A 994 6.724 4.822 -1.174 1.00 0.00 C ATOM 1169 O ASP A 994 6.424 6.012 -1.298 1.00 0.00 O ATOM 1170 CB ASP A 994 6.814 3.403 -3.285 1.00 0.00 C ATOM 1171 CG ASP A 994 7.639 3.167 -4.543 1.00 0.00 C ATOM 1172 OD1 ASP A 994 8.740 2.581 -4.447 1.00 0.00 O ATOM 1173 OD2 ASP A 994 7.214 3.599 -5.633 1.00 0.00 O ATOM 0 H ASP A 994 8.309 2.292 -1.506 1.00 0.00 H new ATOM 0 HA ASP A 994 8.155 4.958 -2.712 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.476 2.447 -2.886 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.922 3.977 -3.536 1.00 0.00 H new ATOM 1178 N LEU A 995 6.321 4.095 -0.130 1.00 0.00 N ATOM 1179 CA LEU A 995 5.675 4.730 1.023 1.00 0.00 C ATOM 1180 C LEU A 995 6.650 5.731 1.655 1.00 0.00 C ATOM 1181 O LEU A 995 6.240 6.761 2.181 1.00 0.00 O ATOM 1182 CB LEU A 995 5.178 3.665 2.042 1.00 0.00 C ATOM 1183 CG LEU A 995 4.661 4.157 3.411 1.00 0.00 C ATOM 1184 CD1 LEU A 995 5.804 4.455 4.368 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.758 5.373 3.253 1.00 0.00 C ATOM 0 H LEU A 995 6.427 3.083 -0.057 1.00 0.00 H new ATOM 0 HA LEU A 995 4.790 5.274 0.694 1.00 0.00 H new ATOM 0 HB2 LEU A 995 4.378 3.097 1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 995 5.997 2.970 2.225 1.00 0.00 H new ATOM 0 HG LEU A 995 4.071 3.349 3.843 1.00 0.00 H new ATOM 0 HD11 LEU A 995 5.401 4.799 5.321 1.00 0.00 H new ATOM 0 HD12 LEU A 995 6.390 3.550 4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 995 6.442 5.230 3.943 1.00 0.00 H new ATOM 0 HD21 LEU A 995 3.409 5.697 4.234 1.00 0.00 H new ATOM 0 HD22 LEU A 995 4.316 6.182 2.781 1.00 0.00 H new ATOM 0 HD23 LEU A 995 2.902 5.112 2.631 1.00 0.00 H new ATOM 1197 N ALA A 996 7.944 5.440 1.572 1.00 0.00 N ATOM 1198 CA ALA A 996 8.958 6.372 2.062 1.00 0.00 C ATOM 1199 C ALA A 996 8.860 7.705 1.329 1.00 0.00 C ATOM 1200 O ALA A 996 8.834 8.769 1.953 1.00 0.00 O ATOM 1201 CB ALA A 996 10.352 5.797 1.919 1.00 0.00 C ATOM 0 H ALA A 996 8.314 4.577 1.175 1.00 0.00 H new ATOM 0 HA ALA A 996 8.769 6.538 3.123 1.00 0.00 H new ATOM 0 HB1 ALA A 996 11.082 6.515 2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 996 10.425 4.873 2.493 1.00 0.00 H new ATOM 0 HB3 ALA A 996 10.553 5.588 0.868 1.00 0.00 H new ATOM 1207 N GLU A 997 8.821 7.646 0.006 1.00 0.00 N ATOM 1208 CA GLU A 997 8.616 8.842 -0.798 1.00 0.00 C ATOM 1209 C GLU A 997 7.281 9.489 -0.472 1.00 0.00 C ATOM 1210 O GLU A 997 7.147 10.699 -0.553 1.00 0.00 O ATOM 1211 CB GLU A 997 8.731 8.546 -2.291 1.00 0.00 C ATOM 1212 CG GLU A 997 10.110 8.046 -2.679 1.00 0.00 C ATOM 1213 CD GLU A 997 10.307 7.903 -4.175 1.00 0.00 C ATOM 1214 OE1 GLU A 997 10.272 8.930 -4.884 1.00 0.00 O ATOM 1215 OE2 GLU A 997 10.515 6.768 -4.650 1.00 0.00 O ATOM 0 H GLU A 997 8.928 6.786 -0.532 1.00 0.00 H new ATOM 0 HA GLU A 997 9.408 9.547 -0.546 1.00 0.00 H new ATOM 0 HB2 GLU A 997 7.986 7.800 -2.569 1.00 0.00 H new ATOM 0 HB3 GLU A 997 8.503 9.450 -2.856 1.00 0.00 H new ATOM 0 HG2 GLU A 997 10.860 8.733 -2.287 1.00 0.00 H new ATOM 0 HG3 GLU A 997 10.283 7.080 -2.205 1.00 0.00 H new ATOM 1222 N LEU A 998 6.292 8.679 -0.120 1.00 0.00 N ATOM 1223 CA LEU A 998 4.998 9.207 0.303 1.00 0.00 C ATOM 1224 C LEU A 998 5.138 9.975 1.612 1.00 0.00 C ATOM 1225 O LEU A 998 4.466 10.983 1.828 1.00 0.00 O ATOM 1226 CB LEU A 998 3.971 8.085 0.447 1.00 0.00 C ATOM 1227 CG LEU A 998 2.696 8.280 -0.374 1.00 0.00 C ATOM 1228 CD1 LEU A 998 1.854 9.413 0.181 1.00 0.00 C ATOM 1229 CD2 LEU A 998 3.050 8.554 -1.821 1.00 0.00 C ATOM 0 H LEU A 998 6.357 7.661 -0.118 1.00 0.00 H new ATOM 0 HA LEU A 998 4.643 9.893 -0.466 1.00 0.00 H new ATOM 0 HB2 LEU A 998 4.436 7.144 0.153 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.700 7.991 1.499 1.00 0.00 H new ATOM 0 HG LEU A 998 2.109 7.363 -0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 998 0.954 9.528 -0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 998 1.574 9.188 1.210 1.00 0.00 H new ATOM 0 HD13 LEU A 998 2.428 10.339 0.156 1.00 0.00 H new ATOM 0 HD21 LEU A 998 2.136 8.692 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 998 3.658 9.457 -1.882 1.00 0.00 H new ATOM 0 HD23 LEU A 998 3.611 7.711 -2.224 1.00 0.00 H new ATOM 1241 N ILE A 999 6.034 9.510 2.472 1.00 0.00 N ATOM 1242 CA ILE A 999 6.345 10.225 3.710 1.00 0.00 C ATOM 1243 C ILE A 999 6.918 11.596 3.372 1.00 0.00 C ATOM 1244 O ILE A 999 6.655 12.588 4.048 1.00 0.00 O ATOM 1245 CB ILE A 999 7.354 9.446 4.590 1.00 0.00 C ATOM 1246 CG1 ILE A 999 6.751 8.113 5.034 1.00 0.00 C ATOM 1247 CG2 ILE A 999 7.770 10.271 5.805 1.00 0.00 C ATOM 1248 CD1 ILE A 999 7.697 7.257 5.848 1.00 0.00 C ATOM 0 H ILE A 999 6.558 8.645 2.339 1.00 0.00 H new ATOM 0 HA ILE A 999 5.420 10.329 4.277 1.00 0.00 H new ATOM 0 HB ILE A 999 8.244 9.248 3.993 1.00 0.00 H new ATOM 0 HG12 ILE A 999 5.855 8.308 5.623 1.00 0.00 H new ATOM 0 HG13 ILE A 999 6.438 7.554 4.152 1.00 0.00 H new ATOM 0 HG21 ILE A 999 8.479 9.701 6.406 1.00 0.00 H new ATOM 0 HG22 ILE A 999 8.238 11.197 5.473 1.00 0.00 H new ATOM 0 HG23 ILE A 999 6.890 10.504 6.405 1.00 0.00 H new ATOM 0 HD11 ILE A 999 7.199 6.328 6.127 1.00 0.00 H new ATOM 0 HD12 ILE A 999 8.583 7.030 5.256 1.00 0.00 H new ATOM 0 HD13 ILE A 999 7.991 7.795 6.749 1.00 0.00 H new ATOM 1260 N ASN A1000 7.682 11.640 2.297 1.00 0.00 N ATOM 1261 CA ASN A1000 8.242 12.886 1.805 1.00 0.00 C ATOM 1262 C ASN A1000 7.248 13.596 0.900 1.00 0.00 C ATOM 1263 O ASN A1000 7.431 14.743 0.566 1.00 0.00 O ATOM 1264 CB ASN A1000 9.550 12.625 1.057 1.00 0.00 C ATOM 1265 CG ASN A1000 10.677 12.215 1.984 1.00 0.00 C ATOM 1266 OD1 ASN A1000 11.422 13.062 2.479 1.00 0.00 O ATOM 1267 ND2 ASN A1000 10.809 10.920 2.232 1.00 0.00 N ATOM 0 H ASN A1000 7.931 10.820 1.743 1.00 0.00 H new ATOM 0 HA ASN A1000 8.453 13.530 2.659 1.00 0.00 H new ATOM 0 HB2 ASN A1000 9.391 11.842 0.316 1.00 0.00 H new ATOM 0 HB3 ASN A1000 9.840 13.524 0.514 1.00 0.00 H new ATOM 0 HD21 ASN A1000 11.549 10.593 2.853 1.00 0.00 H new ATOM 0 HD22 ASN A1000 10.171 10.251 1.802 1.00 0.00 H new ATOM 1274 N LYS A1001 6.207 12.900 0.491 1.00 0.00 N ATOM 1275 CA LYS A1001 5.137 13.491 -0.310 1.00 0.00 C ATOM 1276 C LYS A1001 4.339 14.487 0.527 1.00 0.00 C ATOM 1277 O LYS A1001 3.978 15.565 0.057 1.00 0.00 O ATOM 1278 CB LYS A1001 4.247 12.358 -0.857 1.00 0.00 C ATOM 1279 CG LYS A1001 3.074 12.784 -1.732 1.00 0.00 C ATOM 1280 CD LYS A1001 1.851 13.161 -0.909 1.00 0.00 C ATOM 1281 CE LYS A1001 0.562 12.667 -1.550 1.00 0.00 C ATOM 1282 NZ LYS A1001 0.382 13.195 -2.925 1.00 0.00 N ATOM 0 H LYS A1001 6.072 11.911 0.700 1.00 0.00 H new ATOM 0 HA LYS A1001 5.555 14.044 -1.151 1.00 0.00 H new ATOM 0 HB2 LYS A1001 4.874 11.678 -1.433 1.00 0.00 H new ATOM 0 HB3 LYS A1001 3.856 11.792 -0.012 1.00 0.00 H new ATOM 0 HG2 LYS A1001 3.371 13.633 -2.348 1.00 0.00 H new ATOM 0 HG3 LYS A1001 2.816 11.972 -2.412 1.00 0.00 H new ATOM 0 HD2 LYS A1001 1.943 12.740 0.092 1.00 0.00 H new ATOM 0 HD3 LYS A1001 1.809 14.244 -0.797 1.00 0.00 H new ATOM 0 HE2 LYS A1001 0.567 11.577 -1.579 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -0.286 12.966 -0.934 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -0.491 12.806 -3.335 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 0.317 14.232 -2.893 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 1.194 12.917 -3.513 1.00 0.00 H new ATOM 1296 N MET A1002 4.096 14.127 1.781 1.00 0.00 N ATOM 1297 CA MET A1002 3.391 14.992 2.704 1.00 0.00 C ATOM 1298 C MET A1002 4.356 16.034 3.200 1.00 0.00 C ATOM 1299 O MET A1002 4.005 17.188 3.434 1.00 0.00 O ATOM 1300 CB MET A1002 2.847 14.190 3.892 1.00 0.00 C ATOM 1301 CG MET A1002 3.915 13.538 4.759 1.00 0.00 C ATOM 1302 SD MET A1002 3.225 12.633 6.157 1.00 0.00 S ATOM 1303 CE MET A1002 4.717 12.076 6.971 1.00 0.00 C ATOM 0 H MET A1002 4.382 13.233 2.180 1.00 0.00 H new ATOM 0 HA MET A1002 2.548 15.458 2.195 1.00 0.00 H new ATOM 0 HB2 MET A1002 2.246 14.852 4.515 1.00 0.00 H new ATOM 0 HB3 MET A1002 2.180 13.414 3.515 1.00 0.00 H new ATOM 0 HG2 MET A1002 4.507 12.857 4.148 1.00 0.00 H new ATOM 0 HG3 MET A1002 4.594 14.306 5.129 1.00 0.00 H new ATOM 0 HE1 MET A1002 4.726 10.987 7.009 1.00 0.00 H new ATOM 0 HE2 MET A1002 5.587 12.426 6.416 1.00 0.00 H new ATOM 0 HE3 MET A1002 4.749 12.475 7.985 1.00 0.00 H new ATOM 1313 N LYS A1003 5.591 15.599 3.328 1.00 0.00 N ATOM 1314 CA LYS A1003 6.635 16.431 3.838 1.00 0.00 C ATOM 1315 C LYS A1003 7.048 17.471 2.815 1.00 0.00 C ATOM 1316 O LYS A1003 7.033 18.635 3.119 1.00 0.00 O ATOM 1317 CB LYS A1003 7.826 15.576 4.249 1.00 0.00 C ATOM 1318 CG LYS A1003 9.059 16.392 4.541 1.00 0.00 C ATOM 1319 CD LYS A1003 10.198 15.529 5.053 1.00 0.00 C ATOM 1320 CE LYS A1003 11.460 16.343 5.259 1.00 0.00 C ATOM 1321 NZ LYS A1003 12.570 15.522 5.803 1.00 0.00 N ATOM 0 H LYS A1003 5.890 14.656 3.078 1.00 0.00 H new ATOM 0 HA LYS A1003 6.262 16.959 4.716 1.00 0.00 H new ATOM 0 HB2 LYS A1003 7.563 14.995 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A1003 8.047 14.864 3.454 1.00 0.00 H new ATOM 0 HG2 LYS A1003 9.374 16.911 3.636 1.00 0.00 H new ATOM 0 HG3 LYS A1003 8.822 17.157 5.280 1.00 0.00 H new ATOM 0 HD2 LYS A1003 9.907 15.061 5.994 1.00 0.00 H new ATOM 0 HD3 LYS A1003 10.394 14.725 4.344 1.00 0.00 H new ATOM 0 HE2 LYS A1003 11.766 16.783 4.310 1.00 0.00 H new ATOM 0 HE3 LYS A1003 11.252 17.168 5.940 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 13.413 16.118 5.928 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 12.289 15.122 6.721 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 12.787 14.750 5.141 1.00 0.00 H new ATOM 1335 N LEU A1004 7.430 17.038 1.618 1.00 0.00 N ATOM 1336 CA LEU A1004 7.847 17.949 0.548 1.00 0.00 C ATOM 1337 C LEU A1004 6.804 19.013 0.247 1.00 0.00 C ATOM 1338 O LEU A1004 7.141 20.189 0.115 1.00 0.00 O ATOM 1339 CB LEU A1004 8.191 17.178 -0.732 1.00 0.00 C ATOM 1340 CG LEU A1004 9.690 16.986 -0.993 1.00 0.00 C ATOM 1341 CD1 LEU A1004 10.347 16.230 0.152 1.00 0.00 C ATOM 1342 CD2 LEU A1004 9.910 16.254 -2.309 1.00 0.00 C ATOM 0 H LEU A1004 7.461 16.052 1.359 1.00 0.00 H new ATOM 0 HA LEU A1004 8.741 18.457 0.911 1.00 0.00 H new ATOM 0 HB2 LEU A1004 7.718 16.197 -0.685 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.754 17.702 -1.582 1.00 0.00 H new ATOM 0 HG LEU A1004 10.153 17.971 -1.060 1.00 0.00 H new ATOM 0 HD11 LEU A1004 11.410 16.106 -0.056 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.222 16.791 1.078 1.00 0.00 H new ATOM 0 HD13 LEU A1004 9.881 15.250 0.256 1.00 0.00 H new ATOM 0 HD21 LEU A1004 10.979 16.126 -2.480 1.00 0.00 H new ATOM 0 HD22 LEU A1004 9.429 15.277 -2.266 1.00 0.00 H new ATOM 0 HD23 LEU A1004 9.480 16.835 -3.125 1.00 0.00 H new ATOM 1354 N ALA A1005 5.543 18.617 0.149 1.00 0.00 N ATOM 1355 CA ALA A1005 4.477 19.578 -0.093 1.00 0.00 C ATOM 1356 C ALA A1005 4.447 20.619 1.023 1.00 0.00 C ATOM 1357 O ALA A1005 4.410 21.820 0.771 1.00 0.00 O ATOM 1358 CB ALA A1005 3.136 18.866 -0.200 1.00 0.00 C ATOM 0 H ALA A1005 5.235 17.648 0.232 1.00 0.00 H new ATOM 0 HA ALA A1005 4.669 20.087 -1.037 1.00 0.00 H new ATOM 0 HB1 ALA A1005 2.349 19.598 -0.381 1.00 0.00 H new ATOM 0 HB2 ALA A1005 3.167 18.155 -1.025 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.931 18.335 0.729 1.00 0.00 H new ATOM 1364 N GLN A1006 4.496 20.139 2.258 1.00 0.00 N ATOM 1365 CA GLN A1006 4.508 21.001 3.433 1.00 0.00 C ATOM 1366 C GLN A1006 5.887 21.600 3.691 1.00 0.00 C ATOM 1367 O GLN A1006 6.068 22.468 4.546 1.00 0.00 O ATOM 1368 CB GLN A1006 4.006 20.206 4.629 1.00 0.00 C ATOM 1369 CG GLN A1006 2.554 19.943 4.525 1.00 0.00 C ATOM 1370 CD GLN A1006 1.823 21.258 4.440 1.00 0.00 C ATOM 1371 OE1 GLN A1006 1.573 21.771 3.353 1.00 0.00 O ATOM 1372 NE2 GLN A1006 1.516 21.841 5.587 1.00 0.00 N ATOM 0 H GLN A1006 4.529 19.143 2.474 1.00 0.00 H new ATOM 0 HA GLN A1006 3.844 21.848 3.258 1.00 0.00 H new ATOM 0 HB2 GLN A1006 4.546 19.261 4.693 1.00 0.00 H new ATOM 0 HB3 GLN A1006 4.214 20.755 5.547 1.00 0.00 H new ATOM 0 HG2 GLN A1006 2.343 19.337 3.644 1.00 0.00 H new ATOM 0 HG3 GLN A1006 2.211 19.377 5.391 1.00 0.00 H new ATOM 0 HE21 GLN A1006 1.741 21.381 6.469 1.00 0.00 H new ATOM 0 HE22 GLN A1006 1.054 22.750 5.589 1.00 0.00 H new ATOM 1381 N GLN A1007 6.852 21.097 2.962 1.00 0.00 N ATOM 1382 CA GLN A1007 8.213 21.594 2.997 1.00 0.00 C ATOM 1383 C GLN A1007 8.304 22.877 2.187 1.00 0.00 C ATOM 1384 O GLN A1007 8.916 23.858 2.611 1.00 0.00 O ATOM 1385 CB GLN A1007 9.147 20.528 2.429 1.00 0.00 C ATOM 1386 CG GLN A1007 10.541 20.521 3.027 1.00 0.00 C ATOM 1387 CD GLN A1007 10.522 20.355 4.535 1.00 0.00 C ATOM 1388 OE1 GLN A1007 9.519 19.653 5.045 1.00 0.00 O flip ATOM 1389 NE2 GLN A1007 11.403 20.850 5.237 1.00 0.00 N flip ATOM 0 H GLN A1007 6.716 20.319 2.317 1.00 0.00 H new ATOM 0 HA GLN A1007 8.508 21.812 4.023 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.695 19.548 2.585 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.229 20.674 1.352 1.00 0.00 H new ATOM 0 HG2 GLN A1007 11.120 19.712 2.582 1.00 0.00 H new ATOM 0 HG3 GLN A1007 11.047 21.452 2.773 1.00 0.00 H new ATOM 0 HE21 GLN A1007 12.158 21.384 4.807 1.00 0.00 H new ATOM 0 HE22 GLN A1007 11.378 20.727 6.249 1.00 0.00 H new ATOM 1398 N TYR A1008 7.674 22.858 1.023 1.00 0.00 N ATOM 1399 CA TYR A1008 7.548 24.046 0.203 1.00 0.00 C ATOM 1400 C TYR A1008 6.489 24.952 0.820 1.00 0.00 C ATOM 1401 O TYR A1008 6.770 26.102 1.152 1.00 0.00 O ATOM 1402 CB TYR A1008 7.169 23.651 -1.226 1.00 0.00 C ATOM 1403 CG TYR A1008 7.211 24.781 -2.231 1.00 0.00 C ATOM 1404 CD1 TYR A1008 8.016 25.896 -2.034 1.00 0.00 C ATOM 1405 CD2 TYR A1008 6.455 24.717 -3.393 1.00 0.00 C ATOM 1406 CE1 TYR A1008 8.059 26.916 -2.964 1.00 0.00 C ATOM 1407 CE2 TYR A1008 6.493 25.733 -4.325 1.00 0.00 C ATOM 1408 CZ TYR A1008 7.296 26.829 -4.108 1.00 0.00 C ATOM 1409 OH TYR A1008 7.339 27.839 -5.042 1.00 0.00 O ATOM 0 H TYR A1008 7.240 22.025 0.625 1.00 0.00 H new ATOM 0 HA TYR A1008 8.496 24.582 0.162 1.00 0.00 H new ATOM 0 HB2 TYR A1008 7.842 22.862 -1.560 1.00 0.00 H new ATOM 0 HB3 TYR A1008 6.164 23.230 -1.217 1.00 0.00 H new ATOM 0 HD1 TYR A1008 8.617 25.966 -1.140 1.00 0.00 H new ATOM 0 HD2 TYR A1008 5.826 23.857 -3.571 1.00 0.00 H new ATOM 0 HE1 TYR A1008 8.688 27.778 -2.795 1.00 0.00 H new ATOM 0 HE2 TYR A1008 5.895 25.669 -5.222 1.00 0.00 H new ATOM 0 HH TYR A1008 6.743 27.620 -5.788 1.00 0.00 H new ATOM 1419 N VAL A1009 5.282 24.394 0.967 1.00 0.00 N ATOM 1420 CA VAL A1009 4.145 25.017 1.670 1.00 0.00 C ATOM 1421 C VAL A1009 4.009 26.526 1.397 1.00 0.00 C ATOM 1422 O VAL A1009 3.607 27.311 2.259 1.00 0.00 O ATOM 1423 CB VAL A1009 4.205 24.726 3.198 1.00 0.00 C ATOM 1424 CG1 VAL A1009 5.324 25.497 3.892 1.00 0.00 C ATOM 1425 CG2 VAL A1009 2.859 24.994 3.863 1.00 0.00 C ATOM 0 H VAL A1009 5.059 23.472 0.592 1.00 0.00 H new ATOM 0 HA VAL A1009 3.246 24.555 1.262 1.00 0.00 H new ATOM 0 HB VAL A1009 4.434 23.666 3.309 1.00 0.00 H new ATOM 0 HG11 VAL A1009 5.324 25.260 4.956 1.00 0.00 H new ATOM 0 HG12 VAL A1009 6.283 25.216 3.458 1.00 0.00 H new ATOM 0 HG13 VAL A1009 5.165 26.567 3.759 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.932 24.782 4.930 1.00 0.00 H new ATOM 0 HG22 VAL A1009 2.583 26.039 3.719 1.00 0.00 H new ATOM 0 HG23 VAL A1009 2.099 24.353 3.417 1.00 0.00 H new ATOM 1435 N MET A1010 4.315 26.932 0.179 1.00 0.00 N ATOM 1436 CA MET A1010 4.123 28.314 -0.207 1.00 0.00 C ATOM 1437 C MET A1010 2.694 28.496 -0.685 1.00 0.00 C ATOM 1438 O MET A1010 2.266 27.831 -1.622 1.00 0.00 O ATOM 1439 CB MET A1010 5.114 28.716 -1.301 1.00 0.00 C ATOM 1440 CG MET A1010 5.023 30.182 -1.687 1.00 0.00 C ATOM 1441 SD MET A1010 5.219 31.285 -0.275 1.00 0.00 S ATOM 1442 CE MET A1010 6.886 30.885 0.244 1.00 0.00 C ATOM 0 H MET A1010 4.694 26.330 -0.552 1.00 0.00 H new ATOM 0 HA MET A1010 4.305 28.958 0.653 1.00 0.00 H new ATOM 0 HB2 MET A1010 6.127 28.499 -0.961 1.00 0.00 H new ATOM 0 HB3 MET A1010 4.937 28.103 -2.185 1.00 0.00 H new ATOM 0 HG2 MET A1010 5.790 30.407 -2.428 1.00 0.00 H new ATOM 0 HG3 MET A1010 4.059 30.370 -2.159 1.00 0.00 H new ATOM 0 HE1 MET A1010 7.243 31.645 0.938 1.00 0.00 H new ATOM 0 HE2 MET A1010 6.890 29.913 0.737 1.00 0.00 H new ATOM 0 HE3 MET A1010 7.540 30.853 -0.627 1.00 0.00 H new ATOM 1452 N THR A1011 1.958 29.381 -0.025 1.00 0.00 N ATOM 1453 CA THR A1011 0.544 29.577 -0.313 1.00 0.00 C ATOM 1454 C THR A1011 0.290 29.798 -1.802 1.00 0.00 C ATOM 1455 O THR A1011 0.814 30.740 -2.397 1.00 0.00 O ATOM 1456 CB THR A1011 -0.014 30.758 0.499 1.00 0.00 C ATOM 1457 OG1 THR A1011 0.953 31.817 0.551 1.00 0.00 O ATOM 1458 CG2 THR A1011 -0.372 30.320 1.909 1.00 0.00 C ATOM 0 H THR A1011 2.321 29.978 0.718 1.00 0.00 H new ATOM 0 HA THR A1011 0.026 28.664 -0.020 1.00 0.00 H new ATOM 0 HB THR A1011 -0.918 31.117 0.007 1.00 0.00 H new ATOM 0 HG1 THR A1011 0.590 32.566 1.068 1.00 0.00 H new ATOM 0 HG21 THR A1011 -0.765 31.171 2.466 1.00 0.00 H new ATOM 0 HG22 THR A1011 -1.127 29.535 1.866 1.00 0.00 H new ATOM 0 HG23 THR A1011 0.519 29.939 2.409 1.00 0.00 H new ATOM 1466 N SER A1012 -0.472 28.872 -2.395 1.00 0.00 N ATOM 1467 CA SER A1012 -0.863 28.916 -3.810 1.00 0.00 C ATOM 1468 C SER A1012 0.280 28.475 -4.736 1.00 0.00 C ATOM 1469 O SER A1012 0.054 27.766 -5.717 1.00 0.00 O ATOM 1470 CB SER A1012 -1.372 30.310 -4.193 1.00 0.00 C ATOM 1471 OG SER A1012 -2.425 30.718 -3.327 1.00 0.00 O ATOM 0 H SER A1012 -0.840 28.060 -1.900 1.00 0.00 H new ATOM 0 HA SER A1012 -1.678 28.204 -3.943 1.00 0.00 H new ATOM 0 HB2 SER A1012 -0.554 31.028 -4.141 1.00 0.00 H new ATOM 0 HB3 SER A1012 -1.725 30.303 -5.224 1.00 0.00 H new ATOM 0 HG SER A1012 -2.735 31.611 -3.587 1.00 0.00 H new ATOM 1477 N LEU A1013 1.505 28.871 -4.414 1.00 0.00 N ATOM 1478 CA LEU A1013 2.670 28.502 -5.221 1.00 0.00 C ATOM 1479 C LEU A1013 3.089 27.063 -4.938 1.00 0.00 C ATOM 1480 O LEU A1013 3.941 26.502 -5.624 1.00 0.00 O ATOM 1481 CB LEU A1013 3.845 29.454 -4.955 1.00 0.00 C ATOM 1482 CG LEU A1013 3.738 30.849 -5.587 1.00 0.00 C ATOM 1483 CD1 LEU A1013 2.611 31.657 -4.961 1.00 0.00 C ATOM 1484 CD2 LEU A1013 5.058 31.587 -5.446 1.00 0.00 C ATOM 0 H LEU A1013 1.722 29.447 -3.601 1.00 0.00 H new ATOM 0 HA LEU A1013 2.388 28.584 -6.271 1.00 0.00 H new ATOM 0 HB2 LEU A1013 3.954 29.573 -3.877 1.00 0.00 H new ATOM 0 HB3 LEU A1013 4.758 28.982 -5.317 1.00 0.00 H new ATOM 0 HG LEU A1013 3.509 30.724 -6.645 1.00 0.00 H new ATOM 0 HD11 LEU A1013 2.563 32.639 -5.431 1.00 0.00 H new ATOM 0 HD12 LEU A1013 1.665 31.137 -5.109 1.00 0.00 H new ATOM 0 HD13 LEU A1013 2.797 31.775 -3.893 1.00 0.00 H new ATOM 0 HD21 LEU A1013 4.972 32.575 -5.897 1.00 0.00 H new ATOM 0 HD22 LEU A1013 5.306 31.691 -4.390 1.00 0.00 H new ATOM 0 HD23 LEU A1013 5.845 31.025 -5.950 1.00 0.00 H new ATOM 1496 N GLN A1014 2.458 26.480 -3.928 1.00 0.00 N ATOM 1497 CA GLN A1014 2.698 25.101 -3.502 1.00 0.00 C ATOM 1498 C GLN A1014 2.500 24.130 -4.673 1.00 0.00 C ATOM 1499 O GLN A1014 3.116 23.070 -4.733 1.00 0.00 O ATOM 1500 CB GLN A1014 1.700 24.779 -2.377 1.00 0.00 C ATOM 1501 CG GLN A1014 2.117 23.692 -1.389 1.00 0.00 C ATOM 1502 CD GLN A1014 2.628 22.431 -2.049 1.00 0.00 C ATOM 1503 OE1 GLN A1014 3.835 22.216 -2.137 1.00 0.00 O ATOM 1504 NE2 GLN A1014 1.722 21.639 -2.602 1.00 0.00 N ATOM 0 H GLN A1014 1.751 26.958 -3.369 1.00 0.00 H new ATOM 0 HA GLN A1014 3.724 24.992 -3.150 1.00 0.00 H new ATOM 0 HB2 GLN A1014 1.510 25.695 -1.817 1.00 0.00 H new ATOM 0 HB3 GLN A1014 0.756 24.482 -2.833 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.893 24.088 -0.734 1.00 0.00 H new ATOM 0 HG3 GLN A1014 1.264 23.441 -0.758 1.00 0.00 H new ATOM 0 HE21 GLN A1014 0.730 21.854 -2.505 1.00 0.00 H new ATOM 0 HE22 GLN A1014 2.017 20.814 -3.125 1.00 0.00 H new ATOM 1513 N GLN A1015 1.684 24.541 -5.631 1.00 0.00 N ATOM 1514 CA GLN A1015 1.214 23.656 -6.691 1.00 0.00 C ATOM 1515 C GLN A1015 2.371 22.990 -7.445 1.00 0.00 C ATOM 1516 O GLN A1015 2.239 21.859 -7.913 1.00 0.00 O ATOM 1517 CB GLN A1015 0.325 24.433 -7.652 1.00 0.00 C ATOM 1518 CG GLN A1015 1.067 25.488 -8.459 1.00 0.00 C ATOM 1519 CD GLN A1015 0.139 26.401 -9.229 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -0.963 26.007 -9.615 1.00 0.00 O ATOM 1521 NE2 GLN A1015 0.584 27.624 -9.466 1.00 0.00 N ATOM 0 H GLN A1015 1.328 25.495 -5.698 1.00 0.00 H new ATOM 0 HA GLN A1015 0.637 22.856 -6.227 1.00 0.00 H new ATOM 0 HB2 GLN A1015 -0.151 23.733 -8.338 1.00 0.00 H new ATOM 0 HB3 GLN A1015 -0.471 24.916 -7.086 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.682 26.086 -7.787 1.00 0.00 H new ATOM 0 HG3 GLN A1015 1.744 24.995 -9.156 1.00 0.00 H new ATOM 0 HE21 GLN A1015 1.503 27.907 -9.127 1.00 0.00 H new ATOM 0 HE22 GLN A1015 0.008 28.284 -9.988 1.00 0.00 H new ATOM 1530 N GLU A1016 3.479 23.709 -7.589 1.00 0.00 N ATOM 1531 CA GLU A1016 4.697 23.135 -8.161 1.00 0.00 C ATOM 1532 C GLU A1016 5.069 21.817 -7.470 1.00 0.00 C ATOM 1533 O GLU A1016 5.276 20.793 -8.128 1.00 0.00 O ATOM 1534 CB GLU A1016 5.859 24.122 -8.062 1.00 0.00 C ATOM 1535 CG GLU A1016 7.076 23.683 -8.858 1.00 0.00 C ATOM 1536 CD GLU A1016 6.739 23.420 -10.311 1.00 0.00 C ATOM 1537 OE1 GLU A1016 6.468 24.390 -11.049 1.00 0.00 O ATOM 1538 OE2 GLU A1016 6.718 22.242 -10.715 1.00 0.00 O ATOM 0 H GLU A1016 3.561 24.689 -7.319 1.00 0.00 H new ATOM 0 HA GLU A1016 4.499 22.927 -9.213 1.00 0.00 H new ATOM 0 HB2 GLU A1016 5.531 25.099 -8.418 1.00 0.00 H new ATOM 0 HB3 GLU A1016 6.139 24.242 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU A1016 7.845 24.453 -8.798 1.00 0.00 H new ATOM 0 HG3 GLU A1016 7.493 22.780 -8.413 1.00 0.00 H new ATOM 1545 N TYR A1017 5.127 21.833 -6.147 1.00 0.00 N ATOM 1546 CA TYR A1017 5.435 20.627 -5.395 1.00 0.00 C ATOM 1547 C TYR A1017 4.221 19.713 -5.333 1.00 0.00 C ATOM 1548 O TYR A1017 4.360 18.509 -5.131 1.00 0.00 O ATOM 1549 CB TYR A1017 5.934 20.959 -3.983 1.00 0.00 C ATOM 1550 CG TYR A1017 7.442 21.027 -3.876 1.00 0.00 C ATOM 1551 CD1 TYR A1017 8.219 21.447 -4.947 1.00 0.00 C ATOM 1552 CD2 TYR A1017 8.089 20.654 -2.707 1.00 0.00 C ATOM 1553 CE1 TYR A1017 9.596 21.489 -4.857 1.00 0.00 C ATOM 1554 CE2 TYR A1017 9.465 20.697 -2.607 1.00 0.00 C ATOM 1555 CZ TYR A1017 10.214 21.113 -3.686 1.00 0.00 C ATOM 1556 OH TYR A1017 11.589 21.154 -3.595 1.00 0.00 O ATOM 0 H TYR A1017 4.966 22.662 -5.575 1.00 0.00 H new ATOM 0 HA TYR A1017 6.238 20.105 -5.916 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.512 21.915 -3.673 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.562 20.206 -3.288 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.738 21.746 -5.867 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.506 20.324 -1.860 1.00 0.00 H new ATOM 0 HE1 TYR A1017 10.185 21.815 -5.701 1.00 0.00 H new ATOM 0 HE2 TYR A1017 9.952 20.406 -1.688 1.00 0.00 H new ATOM 0 HH TYR A1017 11.867 20.859 -2.703 1.00 0.00 H new ATOM 1566 N LYS A1018 3.035 20.281 -5.533 1.00 0.00 N ATOM 1567 CA LYS A1018 1.808 19.496 -5.547 1.00 0.00 C ATOM 1568 C LYS A1018 1.806 18.532 -6.730 1.00 0.00 C ATOM 1569 O LYS A1018 1.382 17.386 -6.599 1.00 0.00 O ATOM 1570 CB LYS A1018 0.572 20.405 -5.589 1.00 0.00 C ATOM 1571 CG LYS A1018 -0.741 19.637 -5.616 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.936 20.528 -5.313 1.00 0.00 C ATOM 1573 CE LYS A1018 -2.167 21.566 -6.397 1.00 0.00 C ATOM 1574 NZ LYS A1018 -3.344 22.417 -6.090 1.00 0.00 N ATOM 0 H LYS A1018 2.899 21.280 -5.687 1.00 0.00 H new ATOM 0 HA LYS A1018 1.766 18.916 -4.625 1.00 0.00 H new ATOM 0 HB2 LYS A1018 0.583 21.061 -4.719 1.00 0.00 H new ATOM 0 HB3 LYS A1018 0.629 21.044 -6.471 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -0.871 19.179 -6.596 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -0.701 18.827 -4.888 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -2.829 19.912 -5.206 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -1.780 21.031 -4.358 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -1.280 22.192 -6.499 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -2.317 21.067 -7.355 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -3.475 23.116 -6.849 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -4.193 21.821 -6.017 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -3.189 22.911 -5.188 1.00 0.00 H new ATOM 1588 N LYS A1019 2.291 18.995 -7.879 1.00 0.00 N ATOM 1589 CA LYS A1019 2.413 18.134 -9.052 1.00 0.00 C ATOM 1590 C LYS A1019 3.370 16.986 -8.755 1.00 0.00 C ATOM 1591 O LYS A1019 3.021 15.810 -8.886 1.00 0.00 O ATOM 1592 CB LYS A1019 2.942 18.927 -10.251 1.00 0.00 C ATOM 1593 CG LYS A1019 2.015 20.031 -10.730 1.00 0.00 C ATOM 1594 CD LYS A1019 2.654 20.821 -11.861 1.00 0.00 C ATOM 1595 CE LYS A1019 1.716 21.881 -12.414 1.00 0.00 C ATOM 1596 NZ LYS A1019 1.327 22.880 -11.386 1.00 0.00 N ATOM 0 H LYS A1019 2.604 19.955 -8.023 1.00 0.00 H new ATOM 0 HA LYS A1019 1.425 17.741 -9.291 1.00 0.00 H new ATOM 0 HB2 LYS A1019 3.904 19.366 -9.985 1.00 0.00 H new ATOM 0 HB3 LYS A1019 3.123 18.238 -11.076 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.073 19.599 -11.069 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.780 20.699 -9.902 1.00 0.00 H new ATOM 0 HD2 LYS A1019 3.567 21.296 -11.501 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.944 20.140 -12.661 1.00 0.00 H new ATOM 0 HE2 LYS A1019 2.198 22.390 -13.248 1.00 0.00 H new ATOM 0 HE3 LYS A1019 0.820 21.401 -12.808 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 0.800 23.655 -11.837 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 0.727 22.425 -10.669 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 2.181 23.261 -10.931 1.00 0.00 H new ATOM 1610 N GLN A1020 4.585 17.357 -8.371 1.00 0.00 N ATOM 1611 CA GLN A1020 5.612 16.401 -7.965 1.00 0.00 C ATOM 1612 C GLN A1020 5.093 15.382 -6.949 1.00 0.00 C ATOM 1613 O GLN A1020 5.262 14.177 -7.133 1.00 0.00 O ATOM 1614 CB GLN A1020 6.814 17.153 -7.393 1.00 0.00 C ATOM 1615 CG GLN A1020 7.657 17.832 -8.458 1.00 0.00 C ATOM 1616 CD GLN A1020 8.630 18.840 -7.881 1.00 0.00 C ATOM 1617 OE1 GLN A1020 9.742 18.495 -7.482 1.00 0.00 O ATOM 1618 NE2 GLN A1020 8.227 20.101 -7.858 1.00 0.00 N ATOM 0 H GLN A1020 4.888 18.330 -8.332 1.00 0.00 H new ATOM 0 HA GLN A1020 5.911 15.841 -8.851 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.462 17.903 -6.685 1.00 0.00 H new ATOM 0 HB3 GLN A1020 7.438 16.456 -6.834 1.00 0.00 H new ATOM 0 HG2 GLN A1020 8.211 17.075 -9.013 1.00 0.00 H new ATOM 0 HG3 GLN A1020 7.001 18.333 -9.170 1.00 0.00 H new ATOM 0 HE21 GLN A1020 7.297 20.345 -8.198 1.00 0.00 H new ATOM 0 HE22 GLN A1020 8.847 20.828 -7.500 1.00 0.00 H new ATOM 1627 N MET A1021 4.441 15.854 -5.891 1.00 0.00 N ATOM 1628 CA MET A1021 3.975 14.956 -4.840 1.00 0.00 C ATOM 1629 C MET A1021 2.760 14.144 -5.296 1.00 0.00 C ATOM 1630 O MET A1021 2.445 13.105 -4.714 1.00 0.00 O ATOM 1631 CB MET A1021 3.699 15.717 -3.528 1.00 0.00 C ATOM 1632 CG MET A1021 2.556 16.726 -3.567 1.00 0.00 C ATOM 1633 SD MET A1021 0.935 15.984 -3.296 1.00 0.00 S ATOM 1634 CE MET A1021 -0.074 17.441 -3.036 1.00 0.00 C ATOM 0 H MET A1021 4.225 16.839 -5.739 1.00 0.00 H new ATOM 0 HA MET A1021 4.776 14.246 -4.635 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.487 14.988 -2.746 1.00 0.00 H new ATOM 0 HB3 MET A1021 4.610 16.241 -3.237 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.729 17.489 -2.808 1.00 0.00 H new ATOM 0 HG3 MET A1021 2.559 17.230 -4.533 1.00 0.00 H new ATOM 0 HE1 MET A1021 -0.412 17.469 -2.000 1.00 0.00 H new ATOM 0 HE2 MET A1021 0.514 18.334 -3.250 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.939 17.408 -3.699 1.00 0.00 H new ATOM 1644 N LEU A1022 2.083 14.607 -6.340 1.00 0.00 N ATOM 1645 CA LEU A1022 0.980 13.852 -6.923 1.00 0.00 C ATOM 1646 C LEU A1022 1.532 12.596 -7.596 1.00 0.00 C ATOM 1647 O LEU A1022 1.037 11.491 -7.372 1.00 0.00 O ATOM 1648 CB LEU A1022 0.211 14.724 -7.928 1.00 0.00 C ATOM 1649 CG LEU A1022 -1.169 14.204 -8.365 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -1.976 15.331 -8.985 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -1.045 13.057 -9.359 1.00 0.00 C ATOM 0 H LEU A1022 2.277 15.497 -6.799 1.00 0.00 H new ATOM 0 HA LEU A1022 0.283 13.555 -6.139 1.00 0.00 H new ATOM 0 HB2 LEU A1022 0.081 15.715 -7.492 1.00 0.00 H new ATOM 0 HB3 LEU A1022 0.828 14.846 -8.818 1.00 0.00 H new ATOM 0 HG LEU A1022 -1.680 13.830 -7.478 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -2.952 14.954 -9.292 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -2.109 16.129 -8.254 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -1.448 15.721 -9.855 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -2.039 12.715 -9.646 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -0.510 13.399 -10.245 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -0.497 12.235 -8.899 1.00 0.00 H new ATOM 1663 N THR A1023 2.577 12.774 -8.399 1.00 0.00 N ATOM 1664 CA THR A1023 3.236 11.654 -9.057 1.00 0.00 C ATOM 1665 C THR A1023 3.865 10.723 -8.020 1.00 0.00 C ATOM 1666 O THR A1023 3.886 9.502 -8.190 1.00 0.00 O ATOM 1667 CB THR A1023 4.321 12.149 -10.041 1.00 0.00 C ATOM 1668 OG1 THR A1023 3.746 13.078 -10.970 1.00 0.00 O ATOM 1669 CG2 THR A1023 4.937 10.991 -10.811 1.00 0.00 C ATOM 0 H THR A1023 2.985 13.685 -8.609 1.00 0.00 H new ATOM 0 HA THR A1023 2.481 11.106 -9.621 1.00 0.00 H new ATOM 0 HB THR A1023 5.104 12.636 -9.460 1.00 0.00 H new ATOM 0 HG1 THR A1023 4.437 13.390 -11.590 1.00 0.00 H new ATOM 0 HG21 THR A1023 5.696 11.371 -11.494 1.00 0.00 H new ATOM 0 HG22 THR A1023 5.396 10.292 -10.112 1.00 0.00 H new ATOM 0 HG23 THR A1023 4.161 10.478 -11.380 1.00 0.00 H new ATOM 1677 N ALA A1024 4.340 11.308 -6.927 1.00 0.00 N ATOM 1678 CA ALA A1024 4.940 10.542 -5.842 1.00 0.00 C ATOM 1679 C ALA A1024 3.918 9.598 -5.213 1.00 0.00 C ATOM 1680 O ALA A1024 4.254 8.497 -4.786 1.00 0.00 O ATOM 1681 CB ALA A1024 5.519 11.475 -4.790 1.00 0.00 C ATOM 0 H ALA A1024 4.321 12.315 -6.769 1.00 0.00 H new ATOM 0 HA ALA A1024 5.749 9.940 -6.257 1.00 0.00 H new ATOM 0 HB1 ALA A1024 5.963 10.887 -3.987 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.284 12.105 -5.244 1.00 0.00 H new ATOM 0 HB3 ALA A1024 4.726 12.103 -4.384 1.00 0.00 H new ATOM 1687 N ALA A1025 2.661 10.031 -5.178 1.00 0.00 N ATOM 1688 CA ALA A1025 1.584 9.217 -4.625 1.00 0.00 C ATOM 1689 C ALA A1025 1.296 8.028 -5.526 1.00 0.00 C ATOM 1690 O ALA A1025 0.902 6.960 -5.059 1.00 0.00 O ATOM 1691 CB ALA A1025 0.329 10.052 -4.422 1.00 0.00 C ATOM 0 H ALA A1025 2.363 10.942 -5.527 1.00 0.00 H new ATOM 0 HA ALA A1025 1.904 8.841 -3.653 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.462 9.426 -4.009 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.543 10.869 -3.732 1.00 0.00 H new ATOM 0 HB3 ALA A1025 0.005 10.461 -5.379 1.00 0.00 H new ATOM 1697 N HIS A1026 1.502 8.219 -6.820 1.00 0.00 N ATOM 1698 CA HIS A1026 1.331 7.141 -7.780 1.00 0.00 C ATOM 1699 C HIS A1026 2.354 6.044 -7.532 1.00 0.00 C ATOM 1700 O HIS A1026 2.060 4.866 -7.719 1.00 0.00 O ATOM 1701 CB HIS A1026 1.444 7.675 -9.214 1.00 0.00 C ATOM 1702 CG HIS A1026 1.532 6.606 -10.266 1.00 0.00 C ATOM 1703 ND1 HIS A1026 2.669 6.383 -11.011 1.00 0.00 N ATOM 1704 CD2 HIS A1026 0.619 5.706 -10.700 1.00 0.00 C ATOM 1705 CE1 HIS A1026 2.452 5.396 -11.858 1.00 0.00 C ATOM 1706 NE2 HIS A1026 1.217 4.967 -11.689 1.00 0.00 N ATOM 0 H HIS A1026 1.787 9.109 -7.228 1.00 0.00 H new ATOM 0 HA HIS A1026 0.335 6.717 -7.652 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.580 8.305 -9.424 1.00 0.00 H new ATOM 0 HB3 HIS A1026 2.326 8.311 -9.284 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -0.391 5.591 -10.336 1.00 0.00 H new ATOM 0 HE1 HIS A1026 3.165 5.005 -12.569 1.00 0.00 H new ATOM 0 HE2 HIS A1026 0.777 4.208 -12.210 1.00 0.00 H new ATOM 1715 N ALA A1027 3.546 6.440 -7.108 1.00 0.00 N ATOM 1716 CA ALA A1027 4.582 5.485 -6.749 1.00 0.00 C ATOM 1717 C ALA A1027 4.078 4.555 -5.653 1.00 0.00 C ATOM 1718 O ALA A1027 4.195 3.334 -5.759 1.00 0.00 O ATOM 1719 CB ALA A1027 5.837 6.218 -6.303 1.00 0.00 C ATOM 0 H ALA A1027 3.819 7.417 -7.005 1.00 0.00 H new ATOM 0 HA ALA A1027 4.830 4.882 -7.623 1.00 0.00 H new ATOM 0 HB1 ALA A1027 6.606 5.493 -6.036 1.00 0.00 H new ATOM 0 HB2 ALA A1027 6.198 6.848 -7.115 1.00 0.00 H new ATOM 0 HB3 ALA A1027 5.607 6.839 -5.437 1.00 0.00 H new ATOM 1725 N LEU A1028 3.468 5.148 -4.631 1.00 0.00 N ATOM 1726 CA LEU A1028 2.883 4.387 -3.534 1.00 0.00 C ATOM 1727 C LEU A1028 1.767 3.497 -4.040 1.00 0.00 C ATOM 1728 O LEU A1028 1.662 2.329 -3.689 1.00 0.00 O ATOM 1729 CB LEU A1028 2.300 5.317 -2.483 1.00 0.00 C ATOM 1730 CG LEU A1028 1.693 4.602 -1.266 1.00 0.00 C ATOM 1731 CD1 LEU A1028 2.443 4.951 0.002 1.00 0.00 C ATOM 1732 CD2 LEU A1028 0.221 4.952 -1.132 1.00 0.00 C ATOM 0 H LEU A1028 3.366 6.159 -4.541 1.00 0.00 H new ATOM 0 HA LEU A1028 3.678 3.783 -3.097 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.083 5.992 -2.139 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.530 5.933 -2.948 1.00 0.00 H new ATOM 0 HG LEU A1028 1.784 3.527 -1.421 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.991 4.431 0.847 1.00 0.00 H new ATOM 0 HD12 LEU A1028 3.485 4.647 -0.096 1.00 0.00 H new ATOM 0 HD13 LEU A1028 2.393 6.027 0.170 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -0.198 4.439 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A1028 0.113 6.029 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -0.311 4.639 -2.031 1.00 0.00 H new ATOM 1744 N ALA A1029 0.910 4.072 -4.855 1.00 0.00 N ATOM 1745 CA ALA A1029 -0.205 3.327 -5.400 1.00 0.00 C ATOM 1746 C ALA A1029 0.285 2.075 -6.129 1.00 0.00 C ATOM 1747 O ALA A1029 -0.363 1.032 -6.085 1.00 0.00 O ATOM 1748 CB ALA A1029 -1.039 4.203 -6.325 1.00 0.00 C ATOM 0 H ALA A1029 0.962 5.046 -5.154 1.00 0.00 H new ATOM 0 HA ALA A1029 -0.840 3.010 -4.573 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -1.871 3.623 -6.723 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -1.425 5.056 -5.768 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -0.418 4.558 -7.147 1.00 0.00 H new ATOM 1754 N VAL A1030 1.421 2.189 -6.810 1.00 0.00 N ATOM 1755 CA VAL A1030 2.068 1.036 -7.427 1.00 0.00 C ATOM 1756 C VAL A1030 2.575 0.029 -6.387 1.00 0.00 C ATOM 1757 O VAL A1030 2.504 -1.180 -6.617 1.00 0.00 O ATOM 1758 CB VAL A1030 3.238 1.469 -8.344 1.00 0.00 C ATOM 1759 CG1 VAL A1030 3.926 0.262 -8.962 1.00 0.00 C ATOM 1760 CG2 VAL A1030 2.745 2.406 -9.436 1.00 0.00 C ATOM 0 H VAL A1030 1.914 3.071 -6.949 1.00 0.00 H new ATOM 0 HA VAL A1030 1.305 0.545 -8.031 1.00 0.00 H new ATOM 0 HB VAL A1030 3.964 1.999 -7.728 1.00 0.00 H new ATOM 0 HG11 VAL A1030 4.743 0.597 -9.601 1.00 0.00 H new ATOM 0 HG12 VAL A1030 4.321 -0.376 -8.171 1.00 0.00 H new ATOM 0 HG13 VAL A1030 3.207 -0.301 -9.557 1.00 0.00 H new ATOM 0 HG21 VAL A1030 3.582 2.699 -10.070 1.00 0.00 H new ATOM 0 HG22 VAL A1030 1.993 1.897 -10.040 1.00 0.00 H new ATOM 0 HG23 VAL A1030 2.306 3.294 -8.982 1.00 0.00 H new ATOM 1770 N ASP A1031 3.057 0.506 -5.238 1.00 0.00 N ATOM 1771 CA ASP A1031 3.583 -0.415 -4.229 1.00 0.00 C ATOM 1772 C ASP A1031 2.426 -1.192 -3.611 1.00 0.00 C ATOM 1773 O ASP A1031 2.521 -2.406 -3.401 1.00 0.00 O ATOM 1774 CB ASP A1031 4.470 0.283 -3.164 1.00 0.00 C ATOM 1775 CG ASP A1031 3.747 1.141 -2.131 1.00 0.00 C ATOM 1776 OD1 ASP A1031 2.825 0.641 -1.457 1.00 0.00 O ATOM 1777 OD2 ASP A1031 4.130 2.317 -1.973 1.00 0.00 O ATOM 0 H ASP A1031 3.095 1.494 -4.987 1.00 0.00 H new ATOM 0 HA ASP A1031 4.256 -1.115 -4.724 1.00 0.00 H new ATOM 0 HB2 ASP A1031 5.035 -0.484 -2.635 1.00 0.00 H new ATOM 0 HB3 ASP A1031 5.194 0.911 -3.682 1.00 0.00 H new ATOM 1782 N ALA A1032 1.314 -0.498 -3.394 1.00 0.00 N ATOM 1783 CA ALA A1032 0.073 -1.127 -2.974 1.00 0.00 C ATOM 1784 C ALA A1032 -0.400 -2.113 -4.037 1.00 0.00 C ATOM 1785 O ALA A1032 -0.617 -3.288 -3.759 1.00 0.00 O ATOM 1786 CB ALA A1032 -0.994 -0.067 -2.742 1.00 0.00 C ATOM 0 H ALA A1032 1.250 0.514 -3.505 1.00 0.00 H new ATOM 0 HA ALA A1032 0.249 -1.666 -2.043 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -1.921 -0.547 -2.428 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.660 0.622 -1.966 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.166 0.484 -3.666 1.00 0.00 H new ATOM 1792 N LYS A1033 -0.514 -1.633 -5.270 1.00 0.00 N ATOM 1793 CA LYS A1033 -1.072 -2.424 -6.361 1.00 0.00 C ATOM 1794 C LYS A1033 -0.249 -3.687 -6.599 1.00 0.00 C ATOM 1795 O LYS A1033 -0.796 -4.786 -6.690 1.00 0.00 O ATOM 1796 CB LYS A1033 -1.131 -1.581 -7.641 1.00 0.00 C ATOM 1797 CG LYS A1033 -2.195 -2.018 -8.642 1.00 0.00 C ATOM 1798 CD LYS A1033 -1.885 -3.369 -9.270 1.00 0.00 C ATOM 1799 CE LYS A1033 -2.940 -3.761 -10.289 1.00 0.00 C ATOM 1800 NZ LYS A1033 -2.994 -2.801 -11.420 1.00 0.00 N ATOM 0 H LYS A1033 -0.225 -0.693 -5.541 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.082 -2.726 -6.084 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -1.314 -0.542 -7.368 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -0.157 -1.616 -8.128 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -3.162 -2.067 -8.141 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -2.281 -1.267 -9.427 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -0.908 -3.333 -9.751 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -1.829 -4.130 -8.491 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -2.725 -4.760 -10.669 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -3.915 -3.807 -9.804 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 -3.529 -3.221 -12.207 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -3.463 -1.926 -11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -2.028 -2.582 -11.736 1.00 0.00 H new ATOM 1814 N ASN A1034 1.062 -3.536 -6.683 1.00 0.00 N ATOM 1815 CA ASN A1034 1.928 -4.665 -6.994 1.00 0.00 C ATOM 1816 C ASN A1034 1.877 -5.710 -5.883 1.00 0.00 C ATOM 1817 O ASN A1034 1.877 -6.906 -6.156 1.00 0.00 O ATOM 1818 CB ASN A1034 3.367 -4.199 -7.238 1.00 0.00 C ATOM 1819 CG ASN A1034 4.233 -5.283 -7.856 1.00 0.00 C ATOM 1820 OD1 ASN A1034 4.977 -5.998 -7.029 1.00 0.00 O flip ATOM 1821 ND2 ASN A1034 4.247 -5.463 -9.073 1.00 0.00 N flip ATOM 0 H ASN A1034 1.549 -2.651 -6.542 1.00 0.00 H new ATOM 0 HA ASN A1034 1.563 -5.128 -7.911 1.00 0.00 H new ATOM 0 HB2 ASN A1034 3.357 -3.328 -7.894 1.00 0.00 H new ATOM 0 HB3 ASN A1034 3.808 -3.881 -6.293 1.00 0.00 H new ATOM 0 HD21 ASN A1034 3.659 -4.892 -9.680 1.00 0.00 H new ATOM 0 HD22 ASN A1034 4.847 -6.184 -9.475 1.00 0.00 H new ATOM 1828 N LEU A1035 1.775 -5.256 -4.635 1.00 0.00 N ATOM 1829 CA LEU A1035 1.729 -6.171 -3.493 1.00 0.00 C ATOM 1830 C LEU A1035 0.333 -6.768 -3.342 1.00 0.00 C ATOM 1831 O LEU A1035 0.206 -7.908 -2.941 1.00 0.00 O ATOM 1832 CB LEU A1035 2.118 -5.464 -2.185 1.00 0.00 C ATOM 1833 CG LEU A1035 2.005 -6.335 -0.932 1.00 0.00 C ATOM 1834 CD1 LEU A1035 3.198 -7.268 -0.810 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.875 -5.474 0.303 1.00 0.00 C ATOM 0 H LEU A1035 1.723 -4.268 -4.389 1.00 0.00 H new ATOM 0 HA LEU A1035 2.450 -6.965 -3.688 1.00 0.00 H new ATOM 0 HB2 LEU A1035 3.144 -5.107 -2.272 1.00 0.00 H new ATOM 0 HB3 LEU A1035 1.484 -4.586 -2.060 1.00 0.00 H new ATOM 0 HG LEU A1035 1.106 -6.945 -1.023 1.00 0.00 H new ATOM 0 HD11 LEU A1035 3.094 -7.876 0.088 1.00 0.00 H new ATOM 0 HD12 LEU A1035 3.243 -7.917 -1.684 1.00 0.00 H new ATOM 0 HD13 LEU A1035 4.114 -6.681 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.796 -6.111 1.184 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.753 -4.835 0.395 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.982 -4.854 0.222 1.00 0.00 H new ATOM 1847 N LEU A1036 -0.712 -6.012 -3.679 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.083 -6.514 -3.538 1.00 0.00 C ATOM 1849 C LEU A1036 -2.324 -7.638 -4.523 1.00 0.00 C ATOM 1850 O LEU A1036 -3.258 -8.409 -4.379 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.155 -5.404 -3.672 1.00 0.00 C ATOM 1852 CG LEU A1036 -3.301 -4.706 -5.034 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -4.095 -5.553 -6.021 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -3.969 -3.350 -4.852 1.00 0.00 C ATOM 0 H LEU A1036 -0.640 -5.063 -4.047 1.00 0.00 H new ATOM 0 HA LEU A1036 -2.185 -6.899 -2.523 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -4.121 -5.839 -3.414 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -2.940 -4.639 -2.926 1.00 0.00 H new ATOM 0 HG LEU A1036 -2.302 -4.568 -5.447 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -4.176 -5.025 -6.971 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -3.585 -6.504 -6.177 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -5.093 -5.737 -5.622 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -4.069 -2.861 -5.821 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -4.956 -3.487 -4.411 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -3.360 -2.730 -4.194 1.00 0.00 H new ATOM 1866 N ASP A1037 -1.472 -7.703 -5.530 1.00 0.00 N ATOM 1867 CA ASP A1037 -1.424 -8.837 -6.439 1.00 0.00 C ATOM 1868 C ASP A1037 -0.469 -9.888 -5.881 1.00 0.00 C ATOM 1869 O ASP A1037 -0.728 -11.083 -5.955 1.00 0.00 O ATOM 1870 CB ASP A1037 -0.976 -8.380 -7.829 1.00 0.00 C ATOM 1871 CG ASP A1037 -0.727 -9.533 -8.779 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -1.684 -10.269 -9.104 1.00 0.00 O ATOM 1873 OD2 ASP A1037 0.425 -9.691 -9.231 1.00 0.00 O ATOM 0 H ASP A1037 -0.793 -6.972 -5.742 1.00 0.00 H new ATOM 0 HA ASP A1037 -2.418 -9.274 -6.532 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -1.737 -7.725 -8.253 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.064 -7.790 -7.735 1.00 0.00 H new ATOM 1878 N VAL A1038 0.630 -9.407 -5.307 1.00 0.00 N ATOM 1879 CA VAL A1038 1.595 -10.242 -4.586 1.00 0.00 C ATOM 1880 C VAL A1038 0.915 -11.133 -3.547 1.00 0.00 C ATOM 1881 O VAL A1038 1.005 -12.353 -3.598 1.00 0.00 O ATOM 1882 CB VAL A1038 2.635 -9.355 -3.863 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.304 -10.095 -2.714 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.678 -8.838 -4.839 1.00 0.00 C ATOM 0 H VAL A1038 0.881 -8.419 -5.327 1.00 0.00 H new ATOM 0 HA VAL A1038 2.082 -10.876 -5.327 1.00 0.00 H new ATOM 0 HB VAL A1038 2.099 -8.504 -3.443 1.00 0.00 H new ATOM 0 HG11 VAL A1038 4.028 -9.439 -2.231 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.549 -10.399 -1.989 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.815 -10.978 -3.098 1.00 0.00 H new ATOM 0 HG21 VAL A1038 4.398 -8.217 -4.307 1.00 0.00 H new ATOM 0 HG22 VAL A1038 4.195 -9.680 -5.299 1.00 0.00 H new ATOM 0 HG23 VAL A1038 3.190 -8.246 -5.613 1.00 0.00 H new ATOM 1894 N ILE A1039 0.273 -10.497 -2.589 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.393 -11.193 -1.502 1.00 0.00 C ATOM 1896 C ILE A1039 -1.742 -11.765 -1.927 1.00 0.00 C ATOM 1897 O ILE A1039 -2.246 -12.699 -1.306 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.536 -10.317 -0.232 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -0.989 -8.894 -0.552 1.00 0.00 C ATOM 1900 CG2 ILE A1039 0.786 -10.269 0.511 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -2.331 -8.796 -1.231 1.00 0.00 C ATOM 0 H ILE A1039 0.197 -9.481 -2.540 1.00 0.00 H new ATOM 0 HA ILE A1039 0.255 -12.030 -1.243 1.00 0.00 H new ATOM 0 HB ILE A1039 -1.305 -10.776 0.390 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.024 -8.322 0.375 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -0.240 -8.424 -1.189 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.680 -9.652 1.403 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.077 -11.279 0.801 1.00 0.00 H new ATOM 0 HG23 ILE A1039 1.552 -9.842 -0.136 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.568 -7.749 -1.418 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -2.300 -9.336 -2.177 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -3.096 -9.232 -0.589 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.353 -11.190 -2.956 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.454 -11.878 -3.611 1.00 0.00 C ATOM 1915 C ASP A1040 -2.934 -13.198 -4.136 1.00 0.00 C ATOM 1916 O ASP A1040 -3.602 -14.218 -4.111 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.058 -11.062 -4.750 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.105 -11.832 -5.527 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -5.952 -12.503 -4.900 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -5.099 -11.759 -6.775 1.00 0.00 O ATOM 0 H ASP A1040 -2.114 -10.278 -3.344 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.251 -12.031 -2.884 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -4.506 -10.155 -4.344 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.264 -10.749 -5.429 1.00 0.00 H new ATOM 1925 N GLN A1041 -1.712 -13.190 -4.592 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.076 -14.440 -4.920 1.00 0.00 C ATOM 1927 C GLN A1041 -0.731 -15.180 -3.656 1.00 0.00 C ATOM 1928 O GLN A1041 -0.879 -16.380 -3.618 1.00 0.00 O ATOM 1929 CB GLN A1041 0.166 -14.269 -5.792 1.00 0.00 C ATOM 1930 CG GLN A1041 -0.139 -13.905 -7.237 1.00 0.00 C ATOM 1931 CD GLN A1041 -0.931 -14.983 -7.953 1.00 0.00 C ATOM 1932 OE1 GLN A1041 -0.361 -15.902 -8.544 1.00 0.00 O ATOM 1933 NE2 GLN A1041 -2.248 -14.870 -7.919 1.00 0.00 N ATOM 0 H GLN A1041 -1.146 -12.355 -4.743 1.00 0.00 H new ATOM 0 HA GLN A1041 -1.788 -15.018 -5.509 1.00 0.00 H new ATOM 0 HB2 GLN A1041 0.798 -13.494 -5.358 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.740 -15.195 -5.775 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -0.699 -12.970 -7.262 1.00 0.00 H new ATOM 0 HG3 GLN A1041 0.796 -13.731 -7.770 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -2.681 -14.094 -7.418 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -2.831 -15.559 -8.393 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.327 -14.459 -2.607 1.00 0.00 N ATOM 1943 CA ALA A1042 0.001 -15.080 -1.330 1.00 0.00 C ATOM 1944 C ALA A1042 -1.122 -15.990 -0.855 1.00 0.00 C ATOM 1945 O ALA A1042 -0.896 -17.155 -0.540 1.00 0.00 O ATOM 1946 CB ALA A1042 0.271 -14.031 -0.267 1.00 0.00 C ATOM 0 H ALA A1042 -0.221 -13.445 -2.621 1.00 0.00 H new ATOM 0 HA ALA A1042 0.901 -15.675 -1.486 1.00 0.00 H new ATOM 0 HB1 ALA A1042 0.513 -14.522 0.676 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.109 -13.407 -0.577 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.615 -13.410 -0.135 1.00 0.00 H new ATOM 1952 N ARG A1043 -2.329 -15.449 -0.796 1.00 0.00 N ATOM 1953 CA ARG A1043 -3.495 -16.249 -0.438 1.00 0.00 C ATOM 1954 C ARG A1043 -3.606 -17.509 -1.305 1.00 0.00 C ATOM 1955 O ARG A1043 -3.966 -18.574 -0.810 1.00 0.00 O ATOM 1956 CB ARG A1043 -4.788 -15.409 -0.484 1.00 0.00 C ATOM 1957 CG ARG A1043 -5.114 -14.750 -1.815 1.00 0.00 C ATOM 1958 CD ARG A1043 -5.802 -15.698 -2.793 1.00 0.00 C ATOM 1959 NE ARG A1043 -6.085 -15.045 -4.072 1.00 0.00 N ATOM 1960 CZ ARG A1043 -6.436 -15.678 -5.188 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -6.612 -16.992 -5.194 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -6.606 -14.982 -6.303 1.00 0.00 N ATOM 0 H ARG A1043 -2.528 -14.468 -0.989 1.00 0.00 H new ATOM 0 HA ARG A1043 -3.359 -16.581 0.591 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -5.624 -16.051 -0.206 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.718 -14.630 0.276 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.757 -13.887 -1.640 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -4.194 -14.376 -2.265 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -5.169 -16.569 -2.961 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -6.732 -16.060 -2.355 1.00 0.00 H new ATOM 0 HE ARG A1043 -6.007 -14.029 -4.110 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -6.478 -17.528 -4.337 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -6.881 -17.467 -6.056 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -6.468 -13.971 -6.299 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -6.875 -15.457 -7.165 1.00 0.00 H new ATOM 1976 N LEU A1044 -3.296 -17.393 -2.593 1.00 0.00 N ATOM 1977 CA LEU A1044 -3.321 -18.554 -3.481 1.00 0.00 C ATOM 1978 C LEU A1044 -2.043 -19.395 -3.336 1.00 0.00 C ATOM 1979 O LEU A1044 -2.039 -20.582 -3.650 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.532 -18.114 -4.931 1.00 0.00 C ATOM 1981 CG LEU A1044 -3.663 -19.249 -5.950 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -4.925 -20.059 -5.695 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -3.661 -18.692 -7.365 1.00 0.00 C ATOM 0 H LEU A1044 -3.027 -16.518 -3.043 1.00 0.00 H new ATOM 0 HA LEU A1044 -4.161 -19.185 -3.190 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -4.431 -17.500 -4.979 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.696 -17.479 -5.225 1.00 0.00 H new ATOM 0 HG LEU A1044 -2.806 -19.913 -5.838 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -4.998 -20.860 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -4.886 -20.488 -4.694 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -5.797 -19.410 -5.778 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -3.755 -19.511 -8.078 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -4.499 -18.006 -7.487 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -2.727 -18.159 -7.545 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.962 -18.774 -2.868 1.00 0.00 N ATOM 1996 CA LYS A1045 0.290 -19.481 -2.605 1.00 0.00 C ATOM 1997 C LYS A1045 0.058 -20.510 -1.520 1.00 0.00 C ATOM 1998 O LYS A1045 0.540 -21.641 -1.588 1.00 0.00 O ATOM 1999 CB LYS A1045 1.397 -18.530 -2.130 1.00 0.00 C ATOM 2000 CG LYS A1045 1.738 -17.388 -3.070 1.00 0.00 C ATOM 2001 CD LYS A1045 1.859 -17.812 -4.530 1.00 0.00 C ATOM 2002 CE LYS A1045 3.078 -18.678 -4.788 1.00 0.00 C ATOM 2003 NZ LYS A1045 3.274 -18.921 -6.242 1.00 0.00 N ATOM 0 H LYS A1045 -0.928 -17.776 -2.662 1.00 0.00 H new ATOM 0 HA LYS A1045 0.608 -19.947 -3.538 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.100 -18.108 -1.170 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.301 -19.114 -1.956 1.00 0.00 H new ATOM 0 HG2 LYS A1045 0.970 -16.619 -2.987 1.00 0.00 H new ATOM 0 HG3 LYS A1045 2.678 -16.936 -2.753 1.00 0.00 H new ATOM 0 HD2 LYS A1045 0.962 -18.358 -4.821 1.00 0.00 H new ATOM 0 HD3 LYS A1045 1.910 -16.923 -5.159 1.00 0.00 H new ATOM 0 HE2 LYS A1045 3.964 -18.194 -4.376 1.00 0.00 H new ATOM 0 HE3 LYS A1045 2.965 -19.631 -4.270 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 4.115 -19.516 -6.384 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 2.438 -19.405 -6.629 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 3.406 -18.013 -6.731 1.00 0.00 H new ATOM 2017 N MET A1046 -0.679 -20.090 -0.509 1.00 0.00 N ATOM 2018 CA MET A1046 -1.066 -20.980 0.570 1.00 0.00 C ATOM 2019 C MET A1046 -1.917 -22.110 0.006 1.00 0.00 C ATOM 2020 O MET A1046 -1.772 -23.272 0.393 1.00 0.00 O ATOM 2021 CB MET A1046 -1.821 -20.201 1.651 1.00 0.00 C ATOM 2022 CG MET A1046 -2.104 -21.003 2.913 1.00 0.00 C ATOM 2023 SD MET A1046 -3.520 -22.112 2.756 1.00 0.00 S ATOM 2024 CE MET A1046 -3.549 -22.859 4.385 1.00 0.00 C ATOM 0 H MET A1046 -1.023 -19.135 -0.412 1.00 0.00 H new ATOM 0 HA MET A1046 -0.177 -21.410 1.032 1.00 0.00 H new ATOM 0 HB2 MET A1046 -1.242 -19.317 1.918 1.00 0.00 H new ATOM 0 HB3 MET A1046 -2.766 -19.850 1.237 1.00 0.00 H new ATOM 0 HG2 MET A1046 -1.220 -21.588 3.168 1.00 0.00 H new ATOM 0 HG3 MET A1046 -2.281 -20.315 3.740 1.00 0.00 H new ATOM 0 HE1 MET A1046 -4.372 -23.571 4.444 1.00 0.00 H new ATOM 0 HE2 MET A1046 -2.607 -23.378 4.564 1.00 0.00 H new ATOM 0 HE3 MET A1046 -3.685 -22.083 5.139 1.00 0.00 H new ATOM 2034 N ILE A1047 -2.780 -21.759 -0.941 1.00 0.00 N ATOM 2035 CA ILE A1047 -3.562 -22.747 -1.669 1.00 0.00 C ATOM 2036 C ILE A1047 -2.639 -23.698 -2.426 1.00 0.00 C ATOM 2037 O ILE A1047 -2.902 -24.883 -2.503 1.00 0.00 O ATOM 2038 CB ILE A1047 -4.550 -22.085 -2.653 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -5.599 -21.282 -1.884 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -5.222 -23.124 -3.541 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -6.406 -22.112 -0.906 1.00 0.00 C ATOM 0 H ILE A1047 -2.955 -20.794 -1.222 1.00 0.00 H new ATOM 0 HA ILE A1047 -4.143 -23.308 -0.937 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.987 -21.409 -3.297 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -5.102 -20.478 -1.341 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -6.278 -20.813 -2.596 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -5.912 -22.628 -4.223 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -4.464 -23.657 -4.115 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -5.771 -23.832 -2.921 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -7.129 -21.474 -0.398 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -6.932 -22.900 -1.445 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -5.738 -22.560 -0.171 1.00 0.00 H new ATOM 2053 N SER A1048 -1.540 -23.171 -2.950 1.00 0.00 N ATOM 2054 CA SER A1048 -0.564 -23.975 -3.681 1.00 0.00 C ATOM 2055 C SER A1048 0.056 -25.042 -2.777 1.00 0.00 C ATOM 2056 O SER A1048 0.581 -26.050 -3.256 1.00 0.00 O ATOM 2057 CB SER A1048 0.534 -23.071 -4.260 1.00 0.00 C ATOM 2058 OG SER A1048 1.407 -23.794 -5.109 1.00 0.00 O ATOM 0 H SER A1048 -1.299 -22.182 -2.882 1.00 0.00 H new ATOM 0 HA SER A1048 -1.081 -24.480 -4.497 1.00 0.00 H new ATOM 0 HB2 SER A1048 0.077 -22.253 -4.817 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.104 -22.623 -3.446 1.00 0.00 H new ATOM 0 HG SER A1048 2.093 -23.191 -5.463 1.00 0.00 H new ATOM 2064 N GLN A1049 -0.001 -24.817 -1.469 1.00 0.00 N ATOM 2065 CA GLN A1049 0.527 -25.771 -0.504 1.00 0.00 C ATOM 2066 C GLN A1049 -0.514 -26.842 -0.162 1.00 0.00 C ATOM 2067 O GLN A1049 -0.179 -28.020 -0.008 1.00 0.00 O ATOM 2068 CB GLN A1049 0.988 -25.037 0.758 1.00 0.00 C ATOM 2069 CG GLN A1049 1.529 -25.955 1.841 1.00 0.00 C ATOM 2070 CD GLN A1049 2.223 -25.192 2.950 1.00 0.00 C ATOM 2071 OE1 GLN A1049 3.523 -25.000 2.804 1.00 0.00 O flip ATOM 2072 NE2 GLN A1049 1.598 -24.782 3.930 1.00 0.00 N flip ATOM 0 H GLN A1049 -0.409 -23.980 -1.053 1.00 0.00 H new ATOM 0 HA GLN A1049 1.385 -26.275 -0.949 1.00 0.00 H new ATOM 0 HB2 GLN A1049 1.760 -24.317 0.486 1.00 0.00 H new ATOM 0 HB3 GLN A1049 0.150 -24.468 1.162 1.00 0.00 H new ATOM 0 HG2 GLN A1049 0.710 -26.538 2.262 1.00 0.00 H new ATOM 0 HG3 GLN A1049 2.229 -26.663 1.397 1.00 0.00 H new ATOM 0 HE21 GLN A1049 0.595 -24.952 4.003 1.00 0.00 H new ATOM 0 HE22 GLN A1049 2.084 -24.273 4.668 1.00 0.00 H new ATOM 2081 N SER A1050 -1.774 -26.436 -0.053 1.00 0.00 N ATOM 2082 CA SER A1050 -2.858 -27.368 0.252 1.00 0.00 C ATOM 2083 C SER A1050 -3.336 -28.066 -1.026 1.00 0.00 C ATOM 2084 O SER A1050 -3.848 -29.187 -0.990 1.00 0.00 O ATOM 2085 CB SER A1050 -4.013 -26.616 0.922 1.00 0.00 C ATOM 2086 OG SER A1050 -5.028 -27.504 1.366 1.00 0.00 O ATOM 0 H SER A1050 -2.072 -25.468 -0.171 1.00 0.00 H new ATOM 0 HA SER A1050 -2.491 -28.131 0.938 1.00 0.00 H new ATOM 0 HB2 SER A1050 -3.633 -26.045 1.769 1.00 0.00 H new ATOM 0 HB3 SER A1050 -4.438 -25.900 0.219 1.00 0.00 H new ATOM 0 HG SER A1050 -5.748 -26.992 1.790 1.00 0.00 H new ATOM 2092 N ARG A1051 -3.157 -27.387 -2.144 1.00 0.00 N ATOM 2093 CA ARG A1051 -3.517 -27.896 -3.456 1.00 0.00 C ATOM 2094 C ARG A1051 -2.271 -27.922 -4.344 1.00 0.00 C ATOM 2095 O ARG A1051 -1.945 -26.939 -5.008 1.00 0.00 O ATOM 2096 CB ARG A1051 -4.619 -27.008 -4.066 1.00 0.00 C ATOM 2097 CG ARG A1051 -4.854 -27.204 -5.559 1.00 0.00 C ATOM 2098 CD ARG A1051 -5.330 -28.605 -5.888 1.00 0.00 C ATOM 2099 NE ARG A1051 -6.672 -28.872 -5.378 1.00 0.00 N ATOM 2100 CZ ARG A1051 -7.271 -30.055 -5.462 1.00 0.00 C ATOM 2101 NH1 ARG A1051 -6.665 -31.068 -6.073 1.00 0.00 N ATOM 2102 NH2 ARG A1051 -8.489 -30.218 -4.965 1.00 0.00 N ATOM 0 H ARG A1051 -2.751 -26.452 -2.167 1.00 0.00 H new ATOM 0 HA ARG A1051 -3.904 -28.912 -3.375 1.00 0.00 H new ATOM 0 HB2 ARG A1051 -5.553 -27.201 -3.538 1.00 0.00 H new ATOM 0 HB3 ARG A1051 -4.362 -25.964 -3.888 1.00 0.00 H new ATOM 0 HG2 ARG A1051 -5.592 -26.481 -5.906 1.00 0.00 H new ATOM 0 HG3 ARG A1051 -3.930 -27.000 -6.100 1.00 0.00 H new ATOM 0 HD2 ARG A1051 -5.321 -28.744 -6.969 1.00 0.00 H new ATOM 0 HD3 ARG A1051 -4.634 -29.330 -5.467 1.00 0.00 H new ATOM 0 HE ARG A1051 -7.178 -28.107 -4.932 1.00 0.00 H new ATOM 0 HH11 ARG A1051 -5.738 -30.938 -6.479 1.00 0.00 H new ATOM 0 HH12 ARG A1051 -7.127 -31.975 -6.136 1.00 0.00 H new ATOM 0 HH21 ARG A1051 -8.966 -29.435 -4.518 1.00 0.00 H new ATOM 0 HH22 ARG A1051 -8.949 -31.126 -5.030 1.00 0.00 H new ATOM 2116 N PRO A1052 -1.527 -29.037 -4.315 1.00 0.00 N ATOM 2117 CA PRO A1052 -0.304 -29.187 -5.102 1.00 0.00 C ATOM 2118 C PRO A1052 -0.582 -29.578 -6.553 1.00 0.00 C ATOM 2119 O PRO A1052 0.237 -29.334 -7.441 1.00 0.00 O ATOM 2120 CB PRO A1052 0.439 -30.302 -4.369 1.00 0.00 C ATOM 2121 CG PRO A1052 -0.631 -31.140 -3.754 1.00 0.00 C ATOM 2122 CD PRO A1052 -1.803 -30.229 -3.489 1.00 0.00 C ATOM 0 HA PRO A1052 0.257 -28.255 -5.175 1.00 0.00 H new ATOM 0 HB2 PRO A1052 1.052 -30.886 -5.056 1.00 0.00 H new ATOM 0 HB3 PRO A1052 1.109 -29.897 -3.610 1.00 0.00 H new ATOM 0 HG2 PRO A1052 -0.917 -31.953 -4.422 1.00 0.00 H new ATOM 0 HG3 PRO A1052 -0.280 -31.597 -2.829 1.00 0.00 H new ATOM 0 HD2 PRO A1052 -2.745 -30.699 -3.770 1.00 0.00 H new ATOM 0 HD3 PRO A1052 -1.878 -29.973 -2.432 1.00 0.00 H new ATOM 2130 N HIS A1053 -1.740 -30.180 -6.789 1.00 0.00 N ATOM 2131 CA HIS A1053 -2.137 -30.590 -8.127 1.00 0.00 C ATOM 2132 C HIS A1053 -3.635 -30.380 -8.311 1.00 0.00 C ATOM 2133 O HIS A1053 -4.019 -29.574 -9.184 1.00 0.00 O ATOM 2134 CB HIS A1053 -1.741 -32.055 -8.406 1.00 0.00 C ATOM 2135 CG HIS A1053 -2.388 -33.075 -7.510 1.00 0.00 C ATOM 2136 ND1 HIS A1053 -2.108 -33.447 -6.238 1.00 0.00 N flip ATOM 2137 CD2 HIS A1053 -3.443 -33.866 -7.911 1.00 0.00 C flip ATOM 2138 CE1 HIS A1053 -2.993 -34.441 -5.902 1.00 0.00 C flip ATOM 2139 NE2 HIS A1053 -3.786 -34.675 -6.928 1.00 0.00 N flip ATOM 2140 OXT HIS A1053 -4.419 -30.978 -7.548 1.00 0.00 O ATOM 0 H HIS A1053 -2.425 -30.396 -6.064 1.00 0.00 H new ATOM 0 HA HIS A1053 -1.607 -29.970 -8.850 1.00 0.00 H new ATOM 0 HB2 HIS A1053 -1.992 -32.292 -9.440 1.00 0.00 H new ATOM 0 HB3 HIS A1053 -0.659 -32.146 -8.312 1.00 0.00 H new ATOM 0 HD2 HIS A1053 -3.916 -33.829 -8.881 1.00 0.00 H new ATOM 0 HE1 HIS A1053 -3.033 -34.949 -4.950 1.00 0.00 H new ATOM 0 HE2 HIS A1053 -4.537 -35.364 -6.957 1.00 0.00 H new TER 2149 HIS A1053