USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=33 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: A1046 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A1050 SER OG : rot 79:sc= 0.515 USER MOD Set 2.1: A 986 MET CE :methyl -153:sc= -0.269 (180deg=-1.07) USER MOD Set 2.2: A1034 ASN : amide:sc= -0.636 X(o=-0.91,f=-1) USER MOD Set 3.1: A 928 ASN : amide:sc= -0.26! K(o=-0.91!,f=-1.9) USER MOD Set 3.2: A 968 THR OG1 : rot -115:sc= -0.648! USER MOD Set 4.1: A 939 MET CE :methyl -153:sc= -0.235 (180deg=-1.29) USER MOD Set 4.2: A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= 0.726 K(o=0.73,f=-0.41) USER MOD Single : A 924 LYS NZ :NH3+ 167:sc= -0.114 (180deg=-0.525) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 76:sc= 1.21 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 941 SER OG : rot 170:sc= -1.64! USER MOD Single : A 942 LYS NZ :NH3+ 156:sc= 1.28 (180deg=1.22) USER MOD Single : A 944 GLN :FLIP amide:sc= -0.968 F(o=-1.5,f=-0.97) USER MOD Single : A 951 TYR OH : rot 180:sc= 0 USER MOD Single : A 954 MET CE :methyl 161:sc= -8.78! (180deg=-11.9!) USER MOD Single : A 956 LYS NZ :NH3+ -174:sc=-0.00334 (180deg=-0.063) USER MOD Single : A 964 THR OG1 : rot -76:sc= 1.19 USER MOD Single : A 972 SER OG : rot 35:sc= -0.578 USER MOD Single : A 979 SER OG : rot 13:sc= 0.608 USER MOD Single : A 980 THR OG1 : rot -41:sc= -1.21 USER MOD Single : A 981 HIS : no HD1:sc= -0.0228 X(o=-0.023,f=-0.048) USER MOD Single : A 988 GLN : amide:sc= -2.98! C(o=-3!,f=-9.4!) USER MOD Single : A 989 LYS NZ :NH3+ -123:sc= -1.88 (180deg=-2.76!) USER MOD Single : A 992 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.2!) USER MOD Single : A 993 SER OG : rot 79:sc= 0.335 USER MOD Single : A1000 ASN : amide:sc= -0.989 X(o=-0.99,f=-0.53) USER MOD Single : A1001 LYS NZ :NH3+ 172:sc= 1.18 (180deg=1.03) USER MOD Single : A1002 MET CE :methyl 149:sc= -3.55! (180deg=-4.61!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -0.307 K(o=-0.31,f=-1.9!) USER MOD Single : A1007 GLN :FLIP amide:sc= -0.298 F(o=-1.3,f=-0.3) USER MOD Single : A1008 TYR OH : rot -139:sc= 1.26 USER MOD Single : A1010 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1011 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 SER OG : rot 19:sc= 0.947 USER MOD Single : A1014 GLN : amide:sc= -7.45! C(o=-7.4!,f=-10!) USER MOD Single : A1015 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1018 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1019 LYS NZ :NH3+ -169:sc= 1.3 (180deg=1.2) USER MOD Single : A1020 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A1021 MET CE :methyl -133:sc= -0.271 (180deg=-4.27!) USER MOD Single : A1023 THR OG1 : rot 79:sc= 1.18 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1041 GLN : amide:sc= -0.569 K(o=-0.57,f=-1.1) USER MOD Single : A1045 LYS NZ :NH3+ 158:sc= -1.79! (180deg=-2.83!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.527 X(o=-0.53,f=-0.17) USER MOD Single : A1053 HIS : no HD1:sc= -0.0674 X(o=-0.067,f=-0.067) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.215 -20.502 -1.741 1.00 0.00 N ATOM 2 CA ARG A 920 -8.067 -19.444 -0.755 1.00 0.00 C ATOM 3 C ARG A 920 -8.830 -18.206 -1.204 1.00 0.00 C ATOM 4 O ARG A 920 -8.571 -17.673 -2.281 1.00 0.00 O ATOM 5 CB ARG A 920 -6.586 -19.129 -0.596 1.00 0.00 C ATOM 6 CG ARG A 920 -6.252 -18.054 0.420 1.00 0.00 C ATOM 7 CD ARG A 920 -6.569 -18.458 1.849 1.00 0.00 C ATOM 8 NE ARG A 920 -6.538 -19.904 2.070 1.00 0.00 N ATOM 9 CZ ARG A 920 -6.863 -20.471 3.234 1.00 0.00 C ATOM 10 NH1 ARG A 920 -7.193 -19.707 4.267 1.00 0.00 N ATOM 11 NH2 ARG A 920 -6.851 -21.791 3.370 1.00 0.00 N ATOM 0 HA ARG A 920 -8.475 -19.767 0.203 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.066 -20.045 -0.314 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -6.191 -18.824 -1.565 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -5.192 -17.810 0.345 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -6.806 -17.148 0.175 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -5.854 -17.981 2.520 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -7.556 -18.080 2.114 1.00 0.00 H new ATOM 0 HE ARG A 920 -6.255 -20.507 1.298 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -7.198 -18.692 4.170 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -7.442 -20.135 5.159 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -6.592 -22.383 2.581 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -7.101 -22.214 4.264 1.00 0.00 H new ATOM 25 N SER A 921 -9.741 -17.739 -0.367 1.00 0.00 N ATOM 26 CA SER A 921 -10.665 -16.679 -0.749 1.00 0.00 C ATOM 27 C SER A 921 -10.082 -15.280 -0.524 1.00 0.00 C ATOM 28 O SER A 921 -10.733 -14.423 0.074 1.00 0.00 O ATOM 29 CB SER A 921 -11.960 -16.846 0.040 1.00 0.00 C ATOM 30 OG SER A 921 -12.438 -18.178 -0.062 1.00 0.00 O ATOM 0 H SER A 921 -9.862 -18.078 0.587 1.00 0.00 H new ATOM 0 HA SER A 921 -10.856 -16.767 -1.818 1.00 0.00 H new ATOM 0 HB2 SER A 921 -11.790 -16.594 1.087 1.00 0.00 H new ATOM 0 HB3 SER A 921 -12.713 -16.154 -0.336 1.00 0.00 H new ATOM 0 HG SER A 921 -13.268 -18.268 0.451 1.00 0.00 H new ATOM 36 N ASN A 922 -8.864 -15.067 -1.037 1.00 0.00 N ATOM 37 CA ASN A 922 -8.179 -13.761 -0.993 1.00 0.00 C ATOM 38 C ASN A 922 -8.342 -13.094 0.338 1.00 0.00 C ATOM 39 O ASN A 922 -8.720 -11.923 0.397 1.00 0.00 O ATOM 40 CB ASN A 922 -8.703 -12.812 -2.055 1.00 0.00 C ATOM 41 CG ASN A 922 -9.343 -13.538 -3.214 1.00 0.00 C ATOM 42 OD1 ASN A 922 -10.555 -13.763 -3.246 1.00 0.00 O ATOM 43 ND2 ASN A 922 -8.526 -13.916 -4.166 1.00 0.00 N ATOM 0 H ASN A 922 -8.320 -15.797 -1.497 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.126 -13.974 -1.175 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -9.432 -12.137 -1.607 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -7.883 -12.196 -2.424 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -8.886 -14.419 -4.977 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -7.530 -13.707 -4.096 1.00 0.00 H new ATOM 50 N ASP A 923 -8.005 -13.848 1.369 1.00 0.00 N ATOM 51 CA ASP A 923 -8.138 -13.456 2.770 1.00 0.00 C ATOM 52 C ASP A 923 -7.604 -12.045 3.044 1.00 0.00 C ATOM 53 O ASP A 923 -7.315 -11.274 2.142 1.00 0.00 O ATOM 54 CB ASP A 923 -7.406 -14.478 3.649 1.00 0.00 C ATOM 55 CG ASP A 923 -8.015 -14.608 5.031 1.00 0.00 C ATOM 56 OD1 ASP A 923 -8.928 -15.445 5.202 1.00 0.00 O ATOM 57 OD2 ASP A 923 -7.579 -13.885 5.950 1.00 0.00 O ATOM 0 H ASP A 923 -7.617 -14.784 1.255 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.201 -13.439 3.010 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.422 -15.451 3.157 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -6.360 -14.186 3.744 1.00 0.00 H new ATOM 62 N LYS A 924 -7.540 -11.707 4.308 1.00 0.00 N ATOM 63 CA LYS A 924 -7.026 -10.415 4.795 1.00 0.00 C ATOM 64 C LYS A 924 -5.836 -9.898 3.957 1.00 0.00 C ATOM 65 O LYS A 924 -5.539 -8.704 3.953 1.00 0.00 O ATOM 66 CB LYS A 924 -6.607 -10.598 6.255 1.00 0.00 C ATOM 67 CG LYS A 924 -7.068 -9.489 7.182 1.00 0.00 C ATOM 68 CD LYS A 924 -6.118 -8.309 7.177 1.00 0.00 C ATOM 69 CE LYS A 924 -6.586 -7.227 8.133 1.00 0.00 C ATOM 70 NZ LYS A 924 -6.850 -7.770 9.496 1.00 0.00 N ATOM 0 H LYS A 924 -7.847 -12.326 5.059 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.813 -9.666 4.703 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.003 -11.547 6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.520 -10.667 6.303 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -8.061 -9.155 6.881 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -7.156 -9.878 8.196 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -5.119 -8.641 7.460 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -6.045 -7.901 6.169 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -5.830 -6.444 8.194 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -7.493 -6.765 7.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -6.952 -6.984 10.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -7.726 -8.330 9.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -6.056 -8.375 9.788 1.00 0.00 H new ATOM 84 N VAL A 925 -5.176 -10.807 3.252 1.00 0.00 N ATOM 85 CA VAL A 925 -4.106 -10.479 2.341 1.00 0.00 C ATOM 86 C VAL A 925 -4.568 -9.548 1.206 1.00 0.00 C ATOM 87 O VAL A 925 -4.014 -8.467 1.039 1.00 0.00 O ATOM 88 CB VAL A 925 -3.505 -11.779 1.748 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.785 -12.572 2.831 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.573 -12.652 1.105 1.00 0.00 C ATOM 0 H VAL A 925 -5.378 -11.806 3.303 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.346 -9.943 2.909 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.795 -11.485 0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -2.368 -13.482 2.399 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.980 -11.968 3.250 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.490 -12.834 3.620 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -4.112 -13.553 0.701 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.316 -12.929 1.853 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -5.057 -12.100 0.299 1.00 0.00 H new ATOM 100 N TYR A 926 -5.620 -9.918 0.471 1.00 0.00 N ATOM 101 CA TYR A 926 -6.079 -9.087 -0.637 1.00 0.00 C ATOM 102 C TYR A 926 -6.913 -7.934 -0.079 1.00 0.00 C ATOM 103 O TYR A 926 -6.852 -6.800 -0.545 1.00 0.00 O ATOM 104 CB TYR A 926 -6.888 -9.964 -1.603 1.00 0.00 C ATOM 105 CG TYR A 926 -7.740 -9.221 -2.610 1.00 0.00 C ATOM 106 CD1 TYR A 926 -7.198 -8.732 -3.791 1.00 0.00 C ATOM 107 CD2 TYR A 926 -9.097 -9.029 -2.381 1.00 0.00 C ATOM 108 CE1 TYR A 926 -7.984 -8.064 -4.713 1.00 0.00 C ATOM 109 CE2 TYR A 926 -9.890 -8.366 -3.298 1.00 0.00 C ATOM 110 CZ TYR A 926 -9.330 -7.887 -4.464 1.00 0.00 C ATOM 111 OH TYR A 926 -10.119 -7.226 -5.381 1.00 0.00 O ATOM 0 H TYR A 926 -6.159 -10.771 0.621 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.240 -8.659 -1.185 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.196 -10.608 -2.146 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.536 -10.615 -1.017 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -6.147 -8.875 -3.993 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -9.540 -9.405 -1.470 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -7.546 -7.683 -5.624 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -10.943 -8.224 -3.103 1.00 0.00 H new ATOM 0 HH TYR A 926 -11.041 -7.189 -5.052 1.00 0.00 H new ATOM 121 N GLU A 927 -7.674 -8.258 0.950 1.00 0.00 N ATOM 122 CA GLU A 927 -8.567 -7.320 1.610 1.00 0.00 C ATOM 123 C GLU A 927 -7.838 -6.101 2.158 1.00 0.00 C ATOM 124 O GLU A 927 -8.184 -4.963 1.840 1.00 0.00 O ATOM 125 CB GLU A 927 -9.275 -8.053 2.742 1.00 0.00 C ATOM 126 CG GLU A 927 -10.339 -9.019 2.258 1.00 0.00 C ATOM 127 CD GLU A 927 -10.856 -9.914 3.359 1.00 0.00 C ATOM 128 OE1 GLU A 927 -11.131 -9.405 4.464 1.00 0.00 O ATOM 129 OE2 GLU A 927 -10.990 -11.131 3.123 1.00 0.00 O ATOM 0 H GLU A 927 -7.690 -9.193 1.357 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.280 -6.950 0.873 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -8.537 -8.600 3.329 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.734 -7.322 3.408 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -11.170 -8.455 1.833 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -9.929 -9.634 1.457 1.00 0.00 H new ATOM 136 N ASN A 928 -6.832 -6.337 2.974 1.00 0.00 N ATOM 137 CA ASN A 928 -6.163 -5.260 3.682 1.00 0.00 C ATOM 138 C ASN A 928 -5.275 -4.436 2.758 1.00 0.00 C ATOM 139 O ASN A 928 -5.116 -3.238 2.968 1.00 0.00 O ATOM 140 CB ASN A 928 -5.364 -5.824 4.837 1.00 0.00 C ATOM 141 CG ASN A 928 -4.869 -4.767 5.791 1.00 0.00 C ATOM 142 OD1 ASN A 928 -5.471 -3.704 5.943 1.00 0.00 O ATOM 143 ND2 ASN A 928 -3.784 -5.075 6.467 1.00 0.00 N ATOM 0 H ASN A 928 -6.457 -7.266 3.165 1.00 0.00 H new ATOM 0 HA ASN A 928 -6.927 -4.586 4.071 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.982 -6.537 5.384 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -4.511 -6.377 4.444 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -3.407 -4.420 7.152 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -3.320 -5.969 6.306 1.00 0.00 H new ATOM 150 N VAL A 929 -4.675 -5.060 1.745 1.00 0.00 N ATOM 151 CA VAL A 929 -3.956 -4.276 0.743 1.00 0.00 C ATOM 152 C VAL A 929 -4.913 -3.349 0.000 1.00 0.00 C ATOM 153 O VAL A 929 -4.547 -2.239 -0.390 1.00 0.00 O ATOM 154 CB VAL A 929 -3.195 -5.133 -0.278 1.00 0.00 C ATOM 155 CG1 VAL A 929 -2.325 -4.242 -1.138 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.349 -6.173 0.413 1.00 0.00 C ATOM 0 H VAL A 929 -4.670 -6.069 1.598 1.00 0.00 H new ATOM 0 HA VAL A 929 -3.216 -3.698 1.297 1.00 0.00 H new ATOM 0 HB VAL A 929 -3.920 -5.651 -0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.785 -4.851 -1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.951 -3.521 -1.664 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -1.612 -3.711 -0.507 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.820 -6.766 -0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -1.626 -5.681 1.063 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -2.988 -6.825 1.009 1.00 0.00 H new ATOM 166 N THR A 930 -6.151 -3.793 -0.181 1.00 0.00 N ATOM 167 CA THR A 930 -7.186 -2.913 -0.700 1.00 0.00 C ATOM 168 C THR A 930 -7.364 -1.755 0.278 1.00 0.00 C ATOM 169 O THR A 930 -7.591 -0.612 -0.114 1.00 0.00 O ATOM 170 CB THR A 930 -8.527 -3.655 -0.887 1.00 0.00 C ATOM 171 OG1 THR A 930 -8.338 -4.802 -1.726 1.00 0.00 O ATOM 172 CG2 THR A 930 -9.584 -2.749 -1.505 1.00 0.00 C ATOM 0 H THR A 930 -6.458 -4.744 0.021 1.00 0.00 H new ATOM 0 HA THR A 930 -6.880 -2.547 -1.680 1.00 0.00 H new ATOM 0 HB THR A 930 -8.874 -3.967 0.098 1.00 0.00 H new ATOM 0 HG1 THR A 930 -7.901 -5.514 -1.213 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.515 -3.304 -1.622 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.753 -1.890 -0.855 1.00 0.00 H new ATOM 0 HG23 THR A 930 -9.242 -2.404 -2.481 1.00 0.00 H new ATOM 180 N GLY A 931 -7.223 -2.082 1.559 1.00 0.00 N ATOM 181 CA GLY A 931 -7.226 -1.088 2.616 1.00 0.00 C ATOM 182 C GLY A 931 -6.133 -0.045 2.459 1.00 0.00 C ATOM 183 O GLY A 931 -6.329 1.108 2.840 1.00 0.00 O ATOM 0 H GLY A 931 -7.104 -3.040 1.888 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.195 -0.589 2.634 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.107 -1.588 3.577 1.00 0.00 H new ATOM 187 N LEU A 932 -4.984 -0.430 1.891 1.00 0.00 N ATOM 188 CA LEU A 932 -3.917 0.525 1.631 1.00 0.00 C ATOM 189 C LEU A 932 -4.417 1.544 0.613 1.00 0.00 C ATOM 190 O LEU A 932 -4.150 2.744 0.717 1.00 0.00 O ATOM 191 CB LEU A 932 -2.673 -0.206 1.106 1.00 0.00 C ATOM 192 CG LEU A 932 -1.317 0.378 1.529 1.00 0.00 C ATOM 193 CD1 LEU A 932 -0.190 -0.548 1.103 1.00 0.00 C ATOM 194 CD2 LEU A 932 -1.105 1.768 0.943 1.00 0.00 C ATOM 0 H LEU A 932 -4.777 -1.388 1.608 1.00 0.00 H new ATOM 0 HA LEU A 932 -3.639 1.039 2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -2.719 -1.243 1.439 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -2.716 -0.218 0.017 1.00 0.00 H new ATOM 0 HG LEU A 932 -1.315 0.467 2.615 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.766 -0.122 1.409 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -0.321 -1.522 1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.205 -0.665 0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -0.136 2.153 1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -1.134 1.712 -0.145 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -1.893 2.435 1.293 1.00 0.00 H new ATOM 206 N VAL A 933 -5.182 1.049 -0.351 1.00 0.00 N ATOM 207 CA VAL A 933 -5.805 1.895 -1.354 1.00 0.00 C ATOM 208 C VAL A 933 -6.901 2.743 -0.712 1.00 0.00 C ATOM 209 O VAL A 933 -7.047 3.921 -1.010 1.00 0.00 O ATOM 210 CB VAL A 933 -6.412 1.061 -2.503 1.00 0.00 C ATOM 211 CG1 VAL A 933 -6.894 1.965 -3.631 1.00 0.00 C ATOM 212 CG2 VAL A 933 -5.404 0.048 -3.019 1.00 0.00 C ATOM 0 H VAL A 933 -5.386 0.055 -0.458 1.00 0.00 H new ATOM 0 HA VAL A 933 -5.031 2.539 -1.770 1.00 0.00 H new ATOM 0 HB VAL A 933 -7.273 0.518 -2.113 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -7.318 1.356 -4.430 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -7.655 2.646 -3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -6.054 2.540 -4.020 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.851 -0.530 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.521 0.569 -3.390 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -5.116 -0.623 -2.210 1.00 0.00 H new ATOM 222 N LYS A 934 -7.671 2.126 0.173 1.00 0.00 N ATOM 223 CA LYS A 934 -8.721 2.826 0.912 1.00 0.00 C ATOM 224 C LYS A 934 -8.122 3.980 1.712 1.00 0.00 C ATOM 225 O LYS A 934 -8.732 5.037 1.855 1.00 0.00 O ATOM 226 CB LYS A 934 -9.453 1.866 1.865 1.00 0.00 C ATOM 227 CG LYS A 934 -10.001 0.587 1.220 1.00 0.00 C ATOM 228 CD LYS A 934 -11.047 0.865 0.148 1.00 0.00 C ATOM 229 CE LYS A 934 -10.415 1.205 -1.192 1.00 0.00 C ATOM 230 NZ LYS A 934 -11.434 1.452 -2.242 1.00 0.00 N ATOM 0 H LYS A 934 -7.590 1.135 0.400 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.438 3.218 0.191 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -8.769 1.584 2.665 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -10.281 2.402 2.328 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.177 0.026 0.779 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -10.439 -0.045 1.993 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -11.690 -0.008 0.034 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -11.683 1.690 0.468 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.786 2.089 -1.082 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.765 0.388 -1.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -10.960 1.680 -3.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -12.018 0.601 -2.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -12.039 2.249 -1.958 1.00 0.00 H new ATOM 244 N ALA A 935 -6.916 3.768 2.213 1.00 0.00 N ATOM 245 CA ALA A 935 -6.223 4.772 3.001 1.00 0.00 C ATOM 246 C ALA A 935 -5.583 5.841 2.120 1.00 0.00 C ATOM 247 O ALA A 935 -5.328 6.951 2.573 1.00 0.00 O ATOM 248 CB ALA A 935 -5.195 4.122 3.896 1.00 0.00 C ATOM 0 H ALA A 935 -6.394 2.901 2.086 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.962 5.272 3.627 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -4.685 4.888 4.480 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -5.689 3.422 4.569 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.468 3.586 3.286 1.00 0.00 H new ATOM 254 N VAL A 936 -5.280 5.515 0.874 1.00 0.00 N ATOM 255 CA VAL A 936 -4.841 6.554 -0.044 1.00 0.00 C ATOM 256 C VAL A 936 -6.061 7.263 -0.629 1.00 0.00 C ATOM 257 O VAL A 936 -5.965 8.362 -1.178 1.00 0.00 O ATOM 258 CB VAL A 936 -3.884 6.034 -1.143 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.591 5.112 -2.119 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.229 7.193 -1.881 1.00 0.00 C ATOM 0 H VAL A 936 -5.327 4.574 0.484 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.250 7.273 0.523 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.107 5.452 -0.647 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -3.883 4.770 -2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -4.993 4.253 -1.582 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.406 5.650 -2.603 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.560 6.804 -2.649 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -3.998 7.809 -2.347 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.659 7.798 -1.176 1.00 0.00 H new ATOM 270 N ILE A 937 -7.221 6.636 -0.472 1.00 0.00 N ATOM 271 CA ILE A 937 -8.483 7.322 -0.683 1.00 0.00 C ATOM 272 C ILE A 937 -8.660 8.349 0.434 1.00 0.00 C ATOM 273 O ILE A 937 -9.155 9.453 0.211 1.00 0.00 O ATOM 274 CB ILE A 937 -9.685 6.345 -0.712 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.575 5.387 -1.905 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.004 7.106 -0.762 1.00 0.00 C ATOM 277 CD1 ILE A 937 -9.510 6.084 -3.250 1.00 0.00 C ATOM 0 H ILE A 937 -7.310 5.657 -0.200 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.457 7.811 -1.657 1.00 0.00 H new ATOM 0 HB ILE A 937 -9.664 5.759 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -8.684 4.771 -1.783 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -10.432 4.713 -1.897 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -11.832 6.398 -0.782 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.091 7.742 0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.034 7.724 -1.659 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -9.433 5.339 -4.042 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -10.412 6.678 -3.396 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -8.637 6.737 -3.280 1.00 0.00 H new ATOM 289 N GLU A 938 -8.233 7.962 1.641 1.00 0.00 N ATOM 290 CA GLU A 938 -8.124 8.891 2.771 1.00 0.00 C ATOM 291 C GLU A 938 -7.310 10.115 2.385 1.00 0.00 C ATOM 292 O GLU A 938 -7.611 11.218 2.810 1.00 0.00 O ATOM 293 CB GLU A 938 -7.465 8.224 3.979 1.00 0.00 C ATOM 294 CG GLU A 938 -8.315 7.145 4.630 1.00 0.00 C ATOM 295 CD GLU A 938 -9.560 7.707 5.283 1.00 0.00 C ATOM 296 OE1 GLU A 938 -9.487 8.086 6.472 1.00 0.00 O ATOM 297 OE2 GLU A 938 -10.610 7.786 4.615 1.00 0.00 O ATOM 0 H GLU A 938 -7.956 7.005 1.861 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.138 9.191 3.037 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.517 7.786 3.667 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.234 8.988 4.722 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.603 6.410 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -7.721 6.620 5.378 1.00 0.00 H new ATOM 304 N MET A 939 -6.281 9.914 1.575 1.00 0.00 N ATOM 305 CA MET A 939 -5.476 11.028 1.088 1.00 0.00 C ATOM 306 C MET A 939 -6.353 11.981 0.279 1.00 0.00 C ATOM 307 O MET A 939 -6.276 13.199 0.435 1.00 0.00 O ATOM 308 CB MET A 939 -4.293 10.510 0.254 1.00 0.00 C ATOM 309 CG MET A 939 -3.450 11.596 -0.407 1.00 0.00 C ATOM 310 SD MET A 939 -4.143 12.186 -1.971 1.00 0.00 S ATOM 311 CE MET A 939 -4.059 10.701 -2.970 1.00 0.00 C ATOM 0 H MET A 939 -5.984 8.997 1.242 1.00 0.00 H new ATOM 0 HA MET A 939 -5.066 11.576 1.936 1.00 0.00 H new ATOM 0 HB2 MET A 939 -3.648 9.911 0.897 1.00 0.00 H new ATOM 0 HB3 MET A 939 -4.676 9.846 -0.521 1.00 0.00 H new ATOM 0 HG2 MET A 939 -3.351 12.437 0.279 1.00 0.00 H new ATOM 0 HG3 MET A 939 -2.446 11.210 -0.585 1.00 0.00 H new ATOM 0 HE1 MET A 939 -3.981 10.974 -4.022 1.00 0.00 H new ATOM 0 HE2 MET A 939 -3.185 10.117 -2.681 1.00 0.00 H new ATOM 0 HE3 MET A 939 -4.960 10.107 -2.816 1.00 0.00 H new ATOM 321 N SER A 940 -7.223 11.411 -0.545 1.00 0.00 N ATOM 322 CA SER A 940 -8.114 12.198 -1.385 1.00 0.00 C ATOM 323 C SER A 940 -9.244 12.835 -0.572 1.00 0.00 C ATOM 324 O SER A 940 -9.711 13.928 -0.900 1.00 0.00 O ATOM 325 CB SER A 940 -8.681 11.325 -2.504 1.00 0.00 C ATOM 326 OG SER A 940 -7.636 10.784 -3.298 1.00 0.00 O ATOM 0 H SER A 940 -7.330 10.402 -0.649 1.00 0.00 H new ATOM 0 HA SER A 940 -7.534 13.010 -1.824 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.275 10.517 -2.076 1.00 0.00 H new ATOM 0 HB3 SER A 940 -9.350 11.916 -3.129 1.00 0.00 H new ATOM 0 HG SER A 940 -8.019 10.227 -4.008 1.00 0.00 H new ATOM 332 N SER A 941 -9.676 12.178 0.496 1.00 0.00 N ATOM 333 CA SER A 941 -10.741 12.726 1.317 1.00 0.00 C ATOM 334 C SER A 941 -10.155 13.822 2.181 1.00 0.00 C ATOM 335 O SER A 941 -10.714 14.916 2.316 1.00 0.00 O ATOM 336 CB SER A 941 -11.391 11.632 2.168 1.00 0.00 C ATOM 337 OG SER A 941 -10.420 10.885 2.874 1.00 0.00 O ATOM 0 H SER A 941 -9.311 11.279 0.809 1.00 0.00 H new ATOM 0 HA SER A 941 -11.526 13.141 0.684 1.00 0.00 H new ATOM 0 HB2 SER A 941 -12.089 12.083 2.873 1.00 0.00 H new ATOM 0 HB3 SER A 941 -11.970 10.966 1.528 1.00 0.00 H new ATOM 0 HG SER A 941 -10.865 10.305 3.527 1.00 0.00 H new ATOM 343 N LYS A 942 -8.987 13.510 2.719 1.00 0.00 N ATOM 344 CA LYS A 942 -8.198 14.446 3.487 1.00 0.00 C ATOM 345 C LYS A 942 -7.975 15.728 2.722 1.00 0.00 C ATOM 346 O LYS A 942 -8.283 16.797 3.218 1.00 0.00 O ATOM 347 CB LYS A 942 -6.852 13.820 3.844 1.00 0.00 C ATOM 348 CG LYS A 942 -6.797 13.308 5.263 1.00 0.00 C ATOM 349 CD LYS A 942 -6.772 14.472 6.219 1.00 0.00 C ATOM 350 CE LYS A 942 -7.415 14.124 7.553 1.00 0.00 C ATOM 351 NZ LYS A 942 -6.645 13.098 8.304 1.00 0.00 N ATOM 0 H LYS A 942 -8.560 12.588 2.631 1.00 0.00 H new ATOM 0 HA LYS A 942 -8.746 14.682 4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -6.647 12.998 3.159 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -6.064 14.559 3.700 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -7.662 12.676 5.466 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -5.910 12.690 5.403 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -5.741 14.785 6.384 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.295 15.319 5.774 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -7.499 15.026 8.159 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -8.428 13.760 7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -6.855 13.180 9.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -6.913 12.150 7.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -5.627 13.245 8.148 1.00 0.00 H new ATOM 365 N ILE A 943 -7.469 15.616 1.504 1.00 0.00 N ATOM 366 CA ILE A 943 -7.084 16.791 0.739 1.00 0.00 C ATOM 367 C ILE A 943 -8.289 17.684 0.427 1.00 0.00 C ATOM 368 O ILE A 943 -8.129 18.885 0.190 1.00 0.00 O ATOM 369 CB ILE A 943 -6.352 16.407 -0.575 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.756 17.648 -1.244 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.293 15.695 -1.536 1.00 0.00 C ATOM 372 CD1 ILE A 943 -4.972 17.349 -2.506 1.00 0.00 C ATOM 0 H ILE A 943 -7.316 14.728 1.026 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.392 17.355 1.364 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.542 15.724 -0.318 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -6.562 18.341 -1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -5.102 18.153 -0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.755 15.437 -2.448 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.671 14.786 -1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -8.128 16.351 -1.781 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.582 18.278 -2.921 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -4.144 16.681 -2.270 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -5.626 16.872 -3.236 1.00 0.00 H new ATOM 384 N GLN A 944 -9.488 17.104 0.427 1.00 0.00 N ATOM 385 CA GLN A 944 -10.703 17.882 0.202 1.00 0.00 C ATOM 386 C GLN A 944 -10.814 19.048 1.201 1.00 0.00 C ATOM 387 O GLN A 944 -10.802 20.205 0.780 1.00 0.00 O ATOM 388 CB GLN A 944 -11.946 16.989 0.241 1.00 0.00 C ATOM 389 CG GLN A 944 -11.975 15.947 -0.865 1.00 0.00 C ATOM 390 CD GLN A 944 -13.082 14.928 -0.687 1.00 0.00 C ATOM 391 OE1 GLN A 944 -12.837 13.709 -1.145 1.00 0.00 O flip ATOM 392 NE2 GLN A 944 -14.141 15.230 -0.137 1.00 0.00 N flip ATOM 0 H GLN A 944 -9.643 16.107 0.579 1.00 0.00 H new ATOM 0 HA GLN A 944 -10.640 18.314 -0.797 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -11.992 16.485 1.206 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -12.836 17.614 0.165 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -12.100 16.447 -1.825 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -11.015 15.431 -0.897 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -14.287 16.181 0.201 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -14.872 14.529 -0.019 1.00 0.00 H new ATOM 401 N PRO A 945 -10.917 18.802 2.529 1.00 0.00 N ATOM 402 CA PRO A 945 -10.952 19.886 3.509 1.00 0.00 C ATOM 403 C PRO A 945 -9.594 20.185 4.159 1.00 0.00 C ATOM 404 O PRO A 945 -9.545 20.711 5.271 1.00 0.00 O ATOM 405 CB PRO A 945 -11.912 19.322 4.548 1.00 0.00 C ATOM 406 CG PRO A 945 -11.615 17.859 4.566 1.00 0.00 C ATOM 407 CD PRO A 945 -11.085 17.505 3.196 1.00 0.00 C ATOM 0 HA PRO A 945 -11.240 20.836 3.058 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -11.749 19.773 5.527 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -12.950 19.514 4.277 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -10.882 17.623 5.337 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -12.513 17.285 4.793 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -10.140 16.966 3.262 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -11.780 16.865 2.653 1.00 0.00 H new ATOM 415 N ALA A 946 -8.495 19.871 3.479 1.00 0.00 N ATOM 416 CA ALA A 946 -7.177 20.021 4.093 1.00 0.00 C ATOM 417 C ALA A 946 -6.320 21.095 3.439 1.00 0.00 C ATOM 418 O ALA A 946 -6.285 21.235 2.215 1.00 0.00 O ATOM 419 CB ALA A 946 -6.420 18.710 4.066 1.00 0.00 C ATOM 0 H ALA A 946 -8.487 19.518 2.522 1.00 0.00 H new ATOM 0 HA ALA A 946 -7.368 20.332 5.120 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -5.442 18.845 4.528 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -6.981 17.955 4.617 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -6.292 18.385 3.033 1.00 0.00 H new ATOM 425 N PRO A 947 -5.619 21.867 4.279 1.00 0.00 N ATOM 426 CA PRO A 947 -4.528 22.736 3.856 1.00 0.00 C ATOM 427 C PRO A 947 -3.203 21.960 3.872 1.00 0.00 C ATOM 428 O PRO A 947 -3.213 20.749 4.106 1.00 0.00 O ATOM 429 CB PRO A 947 -4.556 23.819 4.935 1.00 0.00 C ATOM 430 CG PRO A 947 -4.976 23.103 6.173 1.00 0.00 C ATOM 431 CD PRO A 947 -5.863 21.967 5.732 1.00 0.00 C ATOM 0 HA PRO A 947 -4.624 23.131 2.845 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -3.577 24.282 5.057 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -5.256 24.615 4.680 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -4.109 22.729 6.718 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -5.510 23.773 6.846 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -5.608 21.039 6.244 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -6.912 22.172 5.948 1.00 0.00 H new ATOM 439 N PRO A 948 -2.045 22.617 3.628 1.00 0.00 N ATOM 440 CA PRO A 948 -0.731 21.954 3.699 1.00 0.00 C ATOM 441 C PRO A 948 -0.527 21.208 5.016 1.00 0.00 C ATOM 442 O PRO A 948 0.108 20.136 5.059 1.00 0.00 O ATOM 443 CB PRO A 948 0.279 23.105 3.563 1.00 0.00 C ATOM 444 CG PRO A 948 -0.518 24.365 3.678 1.00 0.00 C ATOM 445 CD PRO A 948 -1.910 24.026 3.228 1.00 0.00 C ATOM 0 HA PRO A 948 -0.623 21.195 2.924 1.00 0.00 H new ATOM 0 HB2 PRO A 948 1.040 23.051 4.342 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.799 23.058 2.606 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -0.520 24.732 4.704 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -0.090 25.153 3.059 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -2.656 24.657 3.710 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -2.031 24.155 2.152 1.00 0.00 H new ATOM 453 N GLU A 949 -1.132 21.752 6.071 1.00 0.00 N ATOM 454 CA GLU A 949 -1.049 21.172 7.402 1.00 0.00 C ATOM 455 C GLU A 949 -1.448 19.707 7.377 1.00 0.00 C ATOM 456 O GLU A 949 -0.835 18.889 8.053 1.00 0.00 O ATOM 457 CB GLU A 949 -1.973 21.909 8.369 1.00 0.00 C ATOM 458 CG GLU A 949 -1.617 23.366 8.596 1.00 0.00 C ATOM 459 CD GLU A 949 -2.492 24.001 9.654 1.00 0.00 C ATOM 460 OE1 GLU A 949 -3.647 24.349 9.345 1.00 0.00 O ATOM 461 OE2 GLU A 949 -2.037 24.132 10.812 1.00 0.00 O ATOM 0 H GLU A 949 -1.691 22.604 6.023 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.015 21.265 7.736 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -2.993 21.853 7.990 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -1.960 21.392 9.328 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -0.572 23.442 8.895 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -1.721 23.915 7.660 1.00 0.00 H new ATOM 468 N GLU A 950 -2.461 19.375 6.577 1.00 0.00 N ATOM 469 CA GLU A 950 -2.950 18.007 6.505 1.00 0.00 C ATOM 470 C GLU A 950 -2.500 17.314 5.234 1.00 0.00 C ATOM 471 O GLU A 950 -2.907 16.185 4.967 1.00 0.00 O ATOM 472 CB GLU A 950 -4.461 17.950 6.635 1.00 0.00 C ATOM 473 CG GLU A 950 -4.948 18.459 7.979 1.00 0.00 C ATOM 474 CD GLU A 950 -6.432 18.276 8.180 1.00 0.00 C ATOM 475 OE1 GLU A 950 -7.202 19.171 7.782 1.00 0.00 O ATOM 476 OE2 GLU A 950 -6.830 17.249 8.766 1.00 0.00 O ATOM 0 H GLU A 950 -2.954 20.034 5.974 1.00 0.00 H new ATOM 0 HA GLU A 950 -2.515 17.472 7.349 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -4.913 18.543 5.840 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -4.796 16.922 6.496 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -4.413 17.938 8.773 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -4.703 19.517 8.070 1.00 0.00 H new ATOM 483 N TYR A 951 -1.647 17.972 4.459 1.00 0.00 N ATOM 484 CA TYR A 951 -1.011 17.307 3.337 1.00 0.00 C ATOM 485 C TYR A 951 -0.084 16.234 3.868 1.00 0.00 C ATOM 486 O TYR A 951 0.007 15.140 3.316 1.00 0.00 O ATOM 487 CB TYR A 951 -0.241 18.289 2.447 1.00 0.00 C ATOM 488 CG TYR A 951 -1.121 19.063 1.492 1.00 0.00 C ATOM 489 CD1 TYR A 951 -2.346 18.560 1.081 1.00 0.00 C ATOM 490 CD2 TYR A 951 -0.724 20.292 0.996 1.00 0.00 C ATOM 491 CE1 TYR A 951 -3.147 19.258 0.204 1.00 0.00 C ATOM 492 CE2 TYR A 951 -1.521 20.998 0.117 1.00 0.00 C ATOM 493 CZ TYR A 951 -2.733 20.478 -0.274 1.00 0.00 C ATOM 494 OH TYR A 951 -3.530 21.176 -1.149 1.00 0.00 O ATOM 0 H TYR A 951 -1.385 18.950 4.586 1.00 0.00 H new ATOM 0 HA TYR A 951 -1.786 16.860 2.714 1.00 0.00 H new ATOM 0 HB2 TYR A 951 0.299 18.993 3.080 1.00 0.00 H new ATOM 0 HB3 TYR A 951 0.505 17.738 1.874 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.678 17.603 1.455 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.225 20.706 1.302 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -4.097 18.848 -0.107 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.194 21.955 -0.262 1.00 0.00 H new ATOM 0 HH TYR A 951 -3.092 22.019 -1.389 1.00 0.00 H new ATOM 504 N VAL A 952 0.589 16.531 4.969 1.00 0.00 N ATOM 505 CA VAL A 952 1.402 15.504 5.610 1.00 0.00 C ATOM 506 C VAL A 952 0.541 14.478 6.392 1.00 0.00 C ATOM 507 O VAL A 952 0.743 13.284 6.238 1.00 0.00 O ATOM 508 CB VAL A 952 2.577 16.082 6.456 1.00 0.00 C ATOM 509 CG1 VAL A 952 2.213 17.394 7.140 1.00 0.00 C ATOM 510 CG2 VAL A 952 3.075 15.063 7.476 1.00 0.00 C ATOM 0 H VAL A 952 0.592 17.442 5.427 1.00 0.00 H new ATOM 0 HA VAL A 952 1.880 14.953 4.800 1.00 0.00 H new ATOM 0 HB VAL A 952 3.386 16.298 5.758 1.00 0.00 H new ATOM 0 HG11 VAL A 952 3.066 17.753 7.716 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.946 18.135 6.387 1.00 0.00 H new ATOM 0 HG13 VAL A 952 1.366 17.234 7.808 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.894 15.494 8.051 1.00 0.00 H new ATOM 0 HG22 VAL A 952 2.261 14.795 8.149 1.00 0.00 H new ATOM 0 HG23 VAL A 952 3.426 14.171 6.957 1.00 0.00 H new ATOM 520 N PRO A 953 -0.431 14.887 7.236 1.00 0.00 N ATOM 521 CA PRO A 953 -1.368 13.935 7.858 1.00 0.00 C ATOM 522 C PRO A 953 -2.132 13.048 6.876 1.00 0.00 C ATOM 523 O PRO A 953 -2.568 11.963 7.246 1.00 0.00 O ATOM 524 CB PRO A 953 -2.363 14.825 8.569 1.00 0.00 C ATOM 525 CG PRO A 953 -1.584 16.040 8.897 1.00 0.00 C ATOM 526 CD PRO A 953 -0.639 16.233 7.744 1.00 0.00 C ATOM 0 HA PRO A 953 -0.814 13.241 8.489 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.217 15.058 7.933 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -2.755 14.348 9.467 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.237 16.904 9.018 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.041 15.917 9.834 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.065 16.886 6.983 1.00 0.00 H new ATOM 0 HD3 PRO A 953 0.298 16.688 8.066 1.00 0.00 H new ATOM 534 N MET A 954 -2.340 13.494 5.645 1.00 0.00 N ATOM 535 CA MET A 954 -3.034 12.642 4.689 1.00 0.00 C ATOM 536 C MET A 954 -2.112 11.519 4.244 1.00 0.00 C ATOM 537 O MET A 954 -2.549 10.394 4.001 1.00 0.00 O ATOM 538 CB MET A 954 -3.566 13.420 3.482 1.00 0.00 C ATOM 539 CG MET A 954 -2.506 13.921 2.526 1.00 0.00 C ATOM 540 SD MET A 954 -3.212 14.846 1.158 1.00 0.00 S ATOM 541 CE MET A 954 -4.164 16.059 2.065 1.00 0.00 C ATOM 0 H MET A 954 -2.051 14.407 5.293 1.00 0.00 H new ATOM 0 HA MET A 954 -3.905 12.223 5.192 1.00 0.00 H new ATOM 0 HB2 MET A 954 -4.257 12.780 2.932 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.140 14.273 3.843 1.00 0.00 H new ATOM 0 HG2 MET A 954 -1.802 14.554 3.066 1.00 0.00 H new ATOM 0 HG3 MET A 954 -1.940 13.074 2.137 1.00 0.00 H new ATOM 0 HE1 MET A 954 -4.391 16.904 1.415 1.00 0.00 H new ATOM 0 HE2 MET A 954 -5.094 15.607 2.411 1.00 0.00 H new ATOM 0 HE3 MET A 954 -3.588 16.406 2.923 1.00 0.00 H new ATOM 551 N VAL A 955 -0.829 11.823 4.116 1.00 0.00 N ATOM 552 CA VAL A 955 0.143 10.761 3.911 1.00 0.00 C ATOM 553 C VAL A 955 0.192 9.845 5.124 1.00 0.00 C ATOM 554 O VAL A 955 0.539 8.673 5.010 1.00 0.00 O ATOM 555 CB VAL A 955 1.565 11.262 3.577 1.00 0.00 C ATOM 556 CG1 VAL A 955 2.418 11.471 4.821 1.00 0.00 C ATOM 557 CG2 VAL A 955 2.228 10.283 2.626 1.00 0.00 C ATOM 0 H VAL A 955 -0.445 12.767 4.149 1.00 0.00 H new ATOM 0 HA VAL A 955 -0.202 10.212 3.035 1.00 0.00 H new ATOM 0 HB VAL A 955 1.476 12.238 3.100 1.00 0.00 H new ATOM 0 HG11 VAL A 955 3.407 11.823 4.529 1.00 0.00 H new ATOM 0 HG12 VAL A 955 1.945 12.211 5.466 1.00 0.00 H new ATOM 0 HG13 VAL A 955 2.513 10.528 5.360 1.00 0.00 H new ATOM 0 HG21 VAL A 955 3.233 10.632 2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 955 2.287 9.302 3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 955 1.641 10.211 1.710 1.00 0.00 H new ATOM 567 N LYS A 956 -0.137 10.383 6.293 1.00 0.00 N ATOM 568 CA LYS A 956 -0.217 9.556 7.493 1.00 0.00 C ATOM 569 C LYS A 956 -1.238 8.444 7.271 1.00 0.00 C ATOM 570 O LYS A 956 -1.043 7.307 7.695 1.00 0.00 O ATOM 571 CB LYS A 956 -0.614 10.397 8.707 1.00 0.00 C ATOM 572 CG LYS A 956 -0.618 9.629 10.018 1.00 0.00 C ATOM 573 CD LYS A 956 -1.286 10.420 11.137 1.00 0.00 C ATOM 574 CE LYS A 956 -0.655 11.793 11.328 1.00 0.00 C ATOM 575 NZ LYS A 956 0.800 11.711 11.618 1.00 0.00 N ATOM 0 H LYS A 956 -0.349 11.370 6.436 1.00 0.00 H new ATOM 0 HA LYS A 956 0.763 9.121 7.688 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.073 11.239 8.793 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.607 10.813 8.539 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.139 8.681 9.882 1.00 0.00 H new ATOM 0 HG3 LYS A 956 0.407 9.391 10.303 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -2.346 10.537 10.913 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -1.217 9.858 12.068 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -0.811 12.390 10.429 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -1.157 12.310 12.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 1.164 12.660 11.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 0.957 11.081 12.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 1.299 11.335 10.787 1.00 0.00 H new ATOM 589 N GLU A 957 -2.321 8.802 6.589 1.00 0.00 N ATOM 590 CA GLU A 957 -3.380 7.857 6.248 1.00 0.00 C ATOM 591 C GLU A 957 -2.832 6.677 5.428 1.00 0.00 C ATOM 592 O GLU A 957 -3.094 5.521 5.757 1.00 0.00 O ATOM 593 CB GLU A 957 -4.486 8.574 5.465 1.00 0.00 C ATOM 594 CG GLU A 957 -4.906 9.908 6.072 1.00 0.00 C ATOM 595 CD GLU A 957 -5.772 9.781 7.311 1.00 0.00 C ATOM 596 OE1 GLU A 957 -5.499 8.915 8.166 1.00 0.00 O ATOM 597 OE2 GLU A 957 -6.728 10.575 7.445 1.00 0.00 O ATOM 0 H GLU A 957 -2.490 9.752 6.258 1.00 0.00 H new ATOM 0 HA GLU A 957 -3.792 7.459 7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.144 8.742 4.444 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.358 7.922 5.406 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.012 10.478 6.324 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.448 10.482 5.320 1.00 0.00 H new ATOM 604 N VAL A 958 -2.041 6.961 4.382 1.00 0.00 N ATOM 605 CA VAL A 958 -1.426 5.890 3.586 1.00 0.00 C ATOM 606 C VAL A 958 -0.283 5.216 4.353 1.00 0.00 C ATOM 607 O VAL A 958 0.083 4.079 4.061 1.00 0.00 O ATOM 608 CB VAL A 958 -0.903 6.388 2.210 1.00 0.00 C ATOM 609 CG1 VAL A 958 -1.978 7.173 1.495 1.00 0.00 C ATOM 610 CG2 VAL A 958 0.351 7.230 2.358 1.00 0.00 C ATOM 0 H VAL A 958 -1.815 7.906 4.072 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.217 5.164 3.399 1.00 0.00 H new ATOM 0 HB VAL A 958 -0.645 5.511 1.617 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.599 7.516 0.532 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -2.848 6.536 1.336 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.263 8.034 2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.686 7.560 1.375 1.00 0.00 H new ATOM 0 HG22 VAL A 958 0.134 8.100 2.978 1.00 0.00 H new ATOM 0 HG23 VAL A 958 1.135 6.636 2.828 1.00 0.00 H new ATOM 620 N GLY A 959 0.288 5.917 5.327 1.00 0.00 N ATOM 621 CA GLY A 959 1.330 5.320 6.143 1.00 0.00 C ATOM 622 C GLY A 959 0.762 4.304 7.110 1.00 0.00 C ATOM 623 O GLY A 959 1.303 3.208 7.266 1.00 0.00 O ATOM 0 H GLY A 959 0.051 6.880 5.565 1.00 0.00 H new ATOM 0 HA2 GLY A 959 2.067 4.839 5.500 1.00 0.00 H new ATOM 0 HA3 GLY A 959 1.851 6.100 6.698 1.00 0.00 H new ATOM 627 N LEU A 960 -0.343 4.673 7.749 1.00 0.00 N ATOM 628 CA LEU A 960 -1.115 3.742 8.566 1.00 0.00 C ATOM 629 C LEU A 960 -1.634 2.590 7.712 1.00 0.00 C ATOM 630 O LEU A 960 -1.861 1.489 8.208 1.00 0.00 O ATOM 631 CB LEU A 960 -2.278 4.470 9.249 1.00 0.00 C ATOM 632 CG LEU A 960 -1.867 5.589 10.210 1.00 0.00 C ATOM 633 CD1 LEU A 960 -3.094 6.301 10.754 1.00 0.00 C ATOM 634 CD2 LEU A 960 -1.028 5.029 11.349 1.00 0.00 C ATOM 0 H LEU A 960 -0.727 5.617 7.716 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.463 3.333 9.337 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -2.925 4.892 8.480 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -2.871 3.739 9.799 1.00 0.00 H new ATOM 0 HG LEU A 960 -1.265 6.312 9.660 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -2.783 7.093 11.435 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -3.659 6.734 9.929 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -3.721 5.588 11.289 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -0.744 5.837 12.023 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -1.608 4.286 11.897 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -0.130 4.562 10.944 1.00 0.00 H new ATOM 646 N ALA A 961 -1.810 2.867 6.427 1.00 0.00 N ATOM 647 CA ALA A 961 -2.193 1.844 5.462 1.00 0.00 C ATOM 648 C ALA A 961 -1.113 0.778 5.350 1.00 0.00 C ATOM 649 O ALA A 961 -1.388 -0.404 5.508 1.00 0.00 O ATOM 650 CB ALA A 961 -2.455 2.459 4.105 1.00 0.00 C ATOM 0 H ALA A 961 -1.693 3.798 6.026 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.111 1.376 5.816 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -2.739 1.678 3.400 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.262 3.187 4.185 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -1.552 2.956 3.751 1.00 0.00 H new ATOM 656 N LEU A 962 0.117 1.196 5.072 1.00 0.00 N ATOM 657 CA LEU A 962 1.234 0.268 5.016 1.00 0.00 C ATOM 658 C LEU A 962 1.446 -0.398 6.390 1.00 0.00 C ATOM 659 O LEU A 962 1.783 -1.578 6.461 1.00 0.00 O ATOM 660 CB LEU A 962 2.483 1.012 4.497 1.00 0.00 C ATOM 661 CG LEU A 962 3.774 0.195 4.303 1.00 0.00 C ATOM 662 CD1 LEU A 962 4.468 -0.090 5.628 1.00 0.00 C ATOM 663 CD2 LEU A 962 3.481 -1.099 3.561 1.00 0.00 C ATOM 0 H LEU A 962 0.363 2.168 4.883 1.00 0.00 H new ATOM 0 HA LEU A 962 1.025 -0.542 4.317 1.00 0.00 H new ATOM 0 HB2 LEU A 962 2.228 1.468 3.541 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.701 1.825 5.190 1.00 0.00 H new ATOM 0 HG LEU A 962 4.455 0.797 3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 962 5.374 -0.668 5.447 1.00 0.00 H new ATOM 0 HD12 LEU A 962 4.729 0.851 6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 962 3.799 -0.657 6.275 1.00 0.00 H new ATOM 0 HD21 LEU A 962 4.405 -1.663 3.433 1.00 0.00 H new ATOM 0 HD22 LEU A 962 2.769 -1.694 4.134 1.00 0.00 H new ATOM 0 HD23 LEU A 962 3.058 -0.870 2.583 1.00 0.00 H new ATOM 675 N ARG A 963 1.252 0.354 7.480 1.00 0.00 N ATOM 676 CA ARG A 963 1.276 -0.227 8.832 1.00 0.00 C ATOM 677 C ARG A 963 0.265 -1.370 8.984 1.00 0.00 C ATOM 678 O ARG A 963 0.644 -2.504 9.303 1.00 0.00 O ATOM 679 CB ARG A 963 1.012 0.854 9.889 1.00 0.00 C ATOM 680 CG ARG A 963 2.125 1.885 9.991 1.00 0.00 C ATOM 681 CD ARG A 963 3.448 1.238 10.366 1.00 0.00 C ATOM 682 NE ARG A 963 4.571 2.169 10.275 1.00 0.00 N ATOM 683 CZ ARG A 963 5.850 1.796 10.329 1.00 0.00 C ATOM 684 NH1 ARG A 963 6.167 0.528 10.571 1.00 0.00 N ATOM 685 NH2 ARG A 963 6.813 2.694 10.171 1.00 0.00 N ATOM 0 H ARG A 963 1.078 1.359 7.456 1.00 0.00 H new ATOM 0 HA ARG A 963 2.272 -0.643 8.986 1.00 0.00 H new ATOM 0 HB2 ARG A 963 0.077 1.362 9.652 1.00 0.00 H new ATOM 0 HB3 ARG A 963 0.879 0.377 10.860 1.00 0.00 H new ATOM 0 HG2 ARG A 963 2.230 2.405 9.039 1.00 0.00 H new ATOM 0 HG3 ARG A 963 1.861 2.635 10.736 1.00 0.00 H new ATOM 0 HD2 ARG A 963 3.384 0.849 11.382 1.00 0.00 H new ATOM 0 HD3 ARG A 963 3.632 0.387 9.710 1.00 0.00 H new ATOM 0 HE ARG A 963 4.364 3.162 10.164 1.00 0.00 H new ATOM 0 HH11 ARG A 963 5.431 -0.163 10.716 1.00 0.00 H new ATOM 0 HH12 ARG A 963 7.146 0.246 10.612 1.00 0.00 H new ATOM 0 HH21 ARG A 963 6.576 3.673 10.008 1.00 0.00 H new ATOM 0 HH22 ARG A 963 7.791 2.406 10.213 1.00 0.00 H new ATOM 699 N THR A 964 -1.018 -1.067 8.785 1.00 0.00 N ATOM 700 CA THR A 964 -2.051 -2.106 8.798 1.00 0.00 C ATOM 701 C THR A 964 -1.680 -3.229 7.838 1.00 0.00 C ATOM 702 O THR A 964 -1.836 -4.411 8.148 1.00 0.00 O ATOM 703 CB THR A 964 -3.450 -1.563 8.429 1.00 0.00 C ATOM 704 OG1 THR A 964 -3.353 -0.581 7.395 1.00 0.00 O ATOM 705 CG2 THR A 964 -4.148 -0.969 9.637 1.00 0.00 C ATOM 0 H THR A 964 -1.365 -0.123 8.615 1.00 0.00 H new ATOM 0 HA THR A 964 -2.101 -2.482 9.820 1.00 0.00 H new ATOM 0 HB THR A 964 -4.043 -2.404 8.068 1.00 0.00 H new ATOM 0 HG1 THR A 964 -3.020 0.260 7.773 1.00 0.00 H new ATOM 0 HG21 THR A 964 -5.129 -0.596 9.343 1.00 0.00 H new ATOM 0 HG22 THR A 964 -4.265 -1.736 10.403 1.00 0.00 H new ATOM 0 HG23 THR A 964 -3.552 -0.148 10.034 1.00 0.00 H new ATOM 713 N LEU A 965 -1.157 -2.840 6.685 1.00 0.00 N ATOM 714 CA LEU A 965 -0.705 -3.775 5.665 1.00 0.00 C ATOM 715 C LEU A 965 0.351 -4.734 6.227 1.00 0.00 C ATOM 716 O LEU A 965 0.383 -5.910 5.871 1.00 0.00 O ATOM 717 CB LEU A 965 -0.168 -2.980 4.460 1.00 0.00 C ATOM 718 CG LEU A 965 0.379 -3.785 3.280 1.00 0.00 C ATOM 719 CD1 LEU A 965 1.811 -4.222 3.545 1.00 0.00 C ATOM 720 CD2 LEU A 965 -0.507 -4.987 2.998 1.00 0.00 C ATOM 0 H LEU A 965 -1.033 -1.860 6.429 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.543 -4.390 5.336 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -0.971 -2.342 4.091 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.624 -2.321 4.816 1.00 0.00 H new ATOM 0 HG LEU A 965 0.378 -3.144 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 965 2.181 -4.793 2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 965 2.438 -3.343 3.692 1.00 0.00 H new ATOM 0 HD13 LEU A 965 1.842 -4.844 4.440 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.102 -5.548 2.155 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -0.541 -5.629 3.878 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.515 -4.648 2.758 1.00 0.00 H new ATOM 732 N LEU A 966 1.189 -4.236 7.125 1.00 0.00 N ATOM 733 CA LEU A 966 2.259 -5.046 7.702 1.00 0.00 C ATOM 734 C LEU A 966 1.677 -6.194 8.523 1.00 0.00 C ATOM 735 O LEU A 966 2.289 -7.256 8.648 1.00 0.00 O ATOM 736 CB LEU A 966 3.184 -4.191 8.566 1.00 0.00 C ATOM 737 CG LEU A 966 4.409 -4.923 9.124 1.00 0.00 C ATOM 738 CD1 LEU A 966 5.307 -5.406 7.997 1.00 0.00 C ATOM 739 CD2 LEU A 966 5.182 -4.025 10.072 1.00 0.00 C ATOM 0 H LEU A 966 1.151 -3.277 7.471 1.00 0.00 H new ATOM 0 HA LEU A 966 2.846 -5.464 6.884 1.00 0.00 H new ATOM 0 HB2 LEU A 966 3.525 -3.341 7.975 1.00 0.00 H new ATOM 0 HB3 LEU A 966 2.609 -3.789 9.400 1.00 0.00 H new ATOM 0 HG LEU A 966 4.061 -5.793 9.681 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.170 -5.923 8.416 1.00 0.00 H new ATOM 0 HD12 LEU A 966 4.751 -6.090 7.356 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.645 -4.552 7.410 1.00 0.00 H new ATOM 0 HD21 LEU A 966 6.048 -4.563 10.458 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.516 -3.135 9.539 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.538 -3.732 10.901 1.00 0.00 H new ATOM 751 N ALA A 967 0.491 -5.977 9.080 1.00 0.00 N ATOM 752 CA ALA A 967 -0.234 -7.047 9.761 1.00 0.00 C ATOM 753 C ALA A 967 -0.615 -8.143 8.762 1.00 0.00 C ATOM 754 O ALA A 967 -0.496 -9.334 9.047 1.00 0.00 O ATOM 755 CB ALA A 967 -1.471 -6.500 10.459 1.00 0.00 C ATOM 0 H ALA A 967 0.012 -5.076 9.075 1.00 0.00 H new ATOM 0 HA ALA A 967 0.417 -7.480 10.521 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.996 -7.314 10.960 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -1.173 -5.753 11.195 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -2.131 -6.041 9.723 1.00 0.00 H new ATOM 761 N THR A 968 -1.053 -7.724 7.582 1.00 0.00 N ATOM 762 CA THR A 968 -1.325 -8.656 6.493 1.00 0.00 C ATOM 763 C THR A 968 -0.043 -9.351 6.048 1.00 0.00 C ATOM 764 O THR A 968 -0.052 -10.530 5.692 1.00 0.00 O ATOM 765 CB THR A 968 -1.975 -7.937 5.301 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.338 -7.671 5.612 1.00 0.00 O ATOM 767 CG2 THR A 968 -1.891 -8.761 4.028 1.00 0.00 C ATOM 0 H THR A 968 -1.228 -6.745 7.353 1.00 0.00 H new ATOM 0 HA THR A 968 -2.022 -9.407 6.864 1.00 0.00 H new ATOM 0 HB THR A 968 -1.434 -7.007 5.125 1.00 0.00 H new ATOM 0 HG1 THR A 968 -3.917 -8.175 5.002 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.362 -8.216 3.210 1.00 0.00 H new ATOM 0 HG22 THR A 968 -0.845 -8.948 3.784 1.00 0.00 H new ATOM 0 HG23 THR A 968 -2.405 -9.711 4.175 1.00 0.00 H new ATOM 775 N VAL A 969 1.054 -8.613 6.077 1.00 0.00 N ATOM 776 CA VAL A 969 2.363 -9.183 5.797 1.00 0.00 C ATOM 777 C VAL A 969 2.640 -10.377 6.711 1.00 0.00 C ATOM 778 O VAL A 969 3.308 -11.317 6.309 1.00 0.00 O ATOM 779 CB VAL A 969 3.492 -8.137 5.932 1.00 0.00 C ATOM 780 CG1 VAL A 969 4.861 -8.780 5.762 1.00 0.00 C ATOM 781 CG2 VAL A 969 3.302 -7.030 4.912 1.00 0.00 C ATOM 0 H VAL A 969 1.065 -7.616 6.292 1.00 0.00 H new ATOM 0 HA VAL A 969 2.349 -9.523 4.761 1.00 0.00 H new ATOM 0 HB VAL A 969 3.442 -7.712 6.934 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.635 -8.019 5.862 1.00 0.00 H new ATOM 0 HG12 VAL A 969 5.002 -9.544 6.527 1.00 0.00 H new ATOM 0 HG13 VAL A 969 4.928 -9.238 4.775 1.00 0.00 H new ATOM 0 HG21 VAL A 969 4.103 -6.298 5.016 1.00 0.00 H new ATOM 0 HG22 VAL A 969 3.325 -7.453 3.908 1.00 0.00 H new ATOM 0 HG23 VAL A 969 2.341 -6.543 5.079 1.00 0.00 H new ATOM 791 N ASP A 970 2.096 -10.351 7.923 1.00 0.00 N ATOM 792 CA ASP A 970 2.248 -11.468 8.859 1.00 0.00 C ATOM 793 C ASP A 970 1.369 -12.649 8.466 1.00 0.00 C ATOM 794 O ASP A 970 1.699 -13.790 8.751 1.00 0.00 O ATOM 795 CB ASP A 970 1.925 -11.013 10.284 1.00 0.00 C ATOM 796 CG ASP A 970 2.038 -12.132 11.300 1.00 0.00 C ATOM 797 OD1 ASP A 970 3.143 -12.329 11.848 1.00 0.00 O ATOM 798 OD2 ASP A 970 1.022 -12.810 11.566 1.00 0.00 O ATOM 0 H ASP A 970 1.546 -9.571 8.283 1.00 0.00 H new ATOM 0 HA ASP A 970 3.286 -11.799 8.819 1.00 0.00 H new ATOM 0 HB2 ASP A 970 2.601 -10.205 10.564 1.00 0.00 H new ATOM 0 HB3 ASP A 970 0.914 -10.606 10.310 1.00 0.00 H new ATOM 803 N GLU A 971 0.261 -12.370 7.808 1.00 0.00 N ATOM 804 CA GLU A 971 -0.577 -13.427 7.240 1.00 0.00 C ATOM 805 C GLU A 971 0.218 -14.143 6.145 1.00 0.00 C ATOM 806 O GLU A 971 0.426 -15.370 6.150 1.00 0.00 O ATOM 807 CB GLU A 971 -1.850 -12.822 6.640 1.00 0.00 C ATOM 808 CG GLU A 971 -2.594 -11.896 7.586 1.00 0.00 C ATOM 809 CD GLU A 971 -3.277 -12.640 8.709 1.00 0.00 C ATOM 810 OE1 GLU A 971 -4.218 -13.411 8.428 1.00 0.00 O ATOM 811 OE2 GLU A 971 -2.879 -12.458 9.878 1.00 0.00 O ATOM 0 H GLU A 971 -0.086 -11.424 7.649 1.00 0.00 H new ATOM 0 HA GLU A 971 -0.860 -14.133 8.021 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.588 -12.270 5.737 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -2.517 -13.629 6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.894 -11.174 8.006 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -3.338 -11.330 7.025 1.00 0.00 H new ATOM 818 N SER A 972 0.700 -13.339 5.226 1.00 0.00 N ATOM 819 CA SER A 972 1.511 -13.801 4.143 1.00 0.00 C ATOM 820 C SER A 972 2.866 -14.311 4.641 1.00 0.00 C ATOM 821 O SER A 972 3.534 -15.047 3.940 1.00 0.00 O ATOM 822 CB SER A 972 1.641 -12.685 3.119 1.00 0.00 C ATOM 823 OG SER A 972 1.945 -11.451 3.743 1.00 0.00 O ATOM 0 H SER A 972 0.533 -12.333 5.217 1.00 0.00 H new ATOM 0 HA SER A 972 1.035 -14.655 3.661 1.00 0.00 H new ATOM 0 HB2 SER A 972 2.423 -12.935 2.402 1.00 0.00 H new ATOM 0 HB3 SER A 972 0.711 -12.593 2.558 1.00 0.00 H new ATOM 0 HG SER A 972 2.523 -11.610 4.518 1.00 0.00 H new ATOM 829 N LEU A 973 3.292 -13.870 5.822 1.00 0.00 N ATOM 830 CA LEU A 973 4.586 -14.280 6.379 1.00 0.00 C ATOM 831 C LEU A 973 4.729 -15.811 6.447 1.00 0.00 C ATOM 832 O LEU A 973 5.690 -16.340 5.907 1.00 0.00 O ATOM 833 CB LEU A 973 4.820 -13.654 7.759 1.00 0.00 C ATOM 834 CG LEU A 973 6.199 -13.917 8.372 1.00 0.00 C ATOM 835 CD1 LEU A 973 7.296 -13.346 7.486 1.00 0.00 C ATOM 836 CD2 LEU A 973 6.281 -13.321 9.768 1.00 0.00 C ATOM 0 H LEU A 973 2.763 -13.229 6.414 1.00 0.00 H new ATOM 0 HA LEU A 973 5.353 -13.910 5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 973 4.675 -12.577 7.680 1.00 0.00 H new ATOM 0 HB3 LEU A 973 4.059 -14.029 8.443 1.00 0.00 H new ATOM 0 HG LEU A 973 6.343 -14.995 8.446 1.00 0.00 H new ATOM 0 HD11 LEU A 973 8.268 -13.543 7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 973 7.251 -13.815 6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 973 7.156 -12.270 7.381 1.00 0.00 H new ATOM 0 HD21 LEU A 973 7.267 -13.516 10.190 1.00 0.00 H new ATOM 0 HD22 LEU A 973 6.116 -12.245 9.714 1.00 0.00 H new ATOM 0 HD23 LEU A 973 5.519 -13.774 10.402 1.00 0.00 H new ATOM 848 N PRO A 974 3.800 -16.568 7.089 1.00 0.00 N ATOM 849 CA PRO A 974 3.815 -18.035 6.998 1.00 0.00 C ATOM 850 C PRO A 974 3.606 -18.493 5.562 1.00 0.00 C ATOM 851 O PRO A 974 4.057 -19.572 5.161 1.00 0.00 O ATOM 852 CB PRO A 974 2.650 -18.484 7.881 1.00 0.00 C ATOM 853 CG PRO A 974 2.401 -17.329 8.779 1.00 0.00 C ATOM 854 CD PRO A 974 2.732 -16.111 7.969 1.00 0.00 C ATOM 0 HA PRO A 974 4.768 -18.458 7.317 1.00 0.00 H new ATOM 0 HB2 PRO A 974 1.769 -18.722 7.285 1.00 0.00 H new ATOM 0 HB3 PRO A 974 2.903 -19.380 8.447 1.00 0.00 H new ATOM 0 HG2 PRO A 974 1.363 -17.308 9.113 1.00 0.00 H new ATOM 0 HG3 PRO A 974 3.022 -17.386 9.673 1.00 0.00 H new ATOM 0 HD2 PRO A 974 1.869 -15.758 7.404 1.00 0.00 H new ATOM 0 HD3 PRO A 974 3.058 -15.285 8.601 1.00 0.00 H new ATOM 862 N VAL A 975 2.950 -17.645 4.774 1.00 0.00 N ATOM 863 CA VAL A 975 2.789 -17.925 3.346 1.00 0.00 C ATOM 864 C VAL A 975 4.116 -17.708 2.600 1.00 0.00 C ATOM 865 O VAL A 975 4.275 -18.135 1.460 1.00 0.00 O ATOM 866 CB VAL A 975 1.677 -17.049 2.727 1.00 0.00 C ATOM 867 CG1 VAL A 975 1.474 -17.387 1.262 1.00 0.00 C ATOM 868 CG2 VAL A 975 0.375 -17.223 3.493 1.00 0.00 C ATOM 0 H VAL A 975 2.527 -16.772 5.091 1.00 0.00 H new ATOM 0 HA VAL A 975 2.495 -18.969 3.242 1.00 0.00 H new ATOM 0 HB VAL A 975 1.989 -16.007 2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.686 -16.757 0.849 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.401 -17.213 0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 975 1.188 -18.435 1.166 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -0.398 -16.599 3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 975 0.066 -18.268 3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.522 -16.927 4.532 1.00 0.00 H new ATOM 878 N LEU A 976 5.079 -17.073 3.261 1.00 0.00 N ATOM 879 CA LEU A 976 6.381 -16.791 2.660 1.00 0.00 C ATOM 880 C LEU A 976 7.244 -18.053 2.569 1.00 0.00 C ATOM 881 O LEU A 976 7.704 -18.383 1.477 1.00 0.00 O ATOM 882 CB LEU A 976 7.075 -15.626 3.397 1.00 0.00 C ATOM 883 CG LEU A 976 8.545 -15.346 3.059 1.00 0.00 C ATOM 884 CD1 LEU A 976 8.862 -13.885 3.326 1.00 0.00 C ATOM 885 CD2 LEU A 976 9.482 -16.221 3.877 1.00 0.00 C ATOM 0 H LEU A 976 4.982 -16.741 4.221 1.00 0.00 H new ATOM 0 HA LEU A 976 6.229 -16.466 1.631 1.00 0.00 H new ATOM 0 HB2 LEU A 976 6.506 -14.717 3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 976 7.007 -15.818 4.468 1.00 0.00 H new ATOM 0 HG LEU A 976 8.696 -15.577 2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 976 9.907 -13.689 3.085 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.223 -13.255 2.707 1.00 0.00 H new ATOM 0 HD13 LEU A 976 8.684 -13.660 4.378 1.00 0.00 H new ATOM 0 HD21 LEU A 976 10.515 -15.996 3.611 1.00 0.00 H new ATOM 0 HD22 LEU A 976 9.329 -16.025 4.938 1.00 0.00 H new ATOM 0 HD23 LEU A 976 9.275 -17.271 3.668 1.00 0.00 H new ATOM 897 N PRO A 977 7.479 -18.802 3.678 1.00 0.00 N ATOM 898 CA PRO A 977 8.175 -20.091 3.589 1.00 0.00 C ATOM 899 C PRO A 977 7.381 -21.073 2.742 1.00 0.00 C ATOM 900 O PRO A 977 7.924 -22.041 2.206 1.00 0.00 O ATOM 901 CB PRO A 977 8.259 -20.575 5.040 1.00 0.00 C ATOM 902 CG PRO A 977 8.078 -19.346 5.855 1.00 0.00 C ATOM 903 CD PRO A 977 7.138 -18.483 5.069 1.00 0.00 C ATOM 0 HA PRO A 977 9.155 -20.004 3.120 1.00 0.00 H new ATOM 0 HB2 PRO A 977 7.486 -21.312 5.257 1.00 0.00 H new ATOM 0 HB3 PRO A 977 9.219 -21.049 5.245 1.00 0.00 H new ATOM 0 HG2 PRO A 977 7.667 -19.582 6.836 1.00 0.00 H new ATOM 0 HG3 PRO A 977 9.030 -18.841 6.021 1.00 0.00 H new ATOM 0 HD2 PRO A 977 6.096 -18.714 5.292 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.284 -17.425 5.287 1.00 0.00 H new ATOM 911 N ALA A 978 6.083 -20.811 2.636 1.00 0.00 N ATOM 912 CA ALA A 978 5.222 -21.572 1.754 1.00 0.00 C ATOM 913 C ALA A 978 5.526 -21.263 0.285 1.00 0.00 C ATOM 914 O ALA A 978 5.999 -22.130 -0.447 1.00 0.00 O ATOM 915 CB ALA A 978 3.759 -21.295 2.069 1.00 0.00 C ATOM 0 H ALA A 978 5.607 -20.073 3.155 1.00 0.00 H new ATOM 0 HA ALA A 978 5.418 -22.631 1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.126 -21.875 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 978 3.549 -21.579 3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 978 3.553 -20.233 1.935 1.00 0.00 H new ATOM 921 N SER A 979 5.280 -20.022 -0.142 1.00 0.00 N ATOM 922 CA SER A 979 5.386 -19.679 -1.561 1.00 0.00 C ATOM 923 C SER A 979 5.520 -18.163 -1.830 1.00 0.00 C ATOM 924 O SER A 979 6.188 -17.757 -2.782 1.00 0.00 O ATOM 925 CB SER A 979 4.161 -20.235 -2.296 1.00 0.00 C ATOM 926 OG SER A 979 4.246 -21.641 -2.455 1.00 0.00 O ATOM 0 H SER A 979 5.010 -19.248 0.465 1.00 0.00 H new ATOM 0 HA SER A 979 6.307 -20.129 -1.932 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.257 -19.984 -1.741 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.076 -19.761 -3.274 1.00 0.00 H new ATOM 0 HG SER A 979 4.965 -21.991 -1.889 1.00 0.00 H new ATOM 932 N THR A 980 4.898 -17.330 -0.998 1.00 0.00 N ATOM 933 CA THR A 980 4.839 -15.879 -1.239 1.00 0.00 C ATOM 934 C THR A 980 6.207 -15.194 -1.152 1.00 0.00 C ATOM 935 O THR A 980 6.336 -14.049 -1.573 1.00 0.00 O ATOM 936 CB THR A 980 3.830 -15.148 -0.327 1.00 0.00 C ATOM 937 OG1 THR A 980 3.403 -13.947 -0.974 1.00 0.00 O ATOM 938 CG2 THR A 980 4.434 -14.785 1.014 1.00 0.00 C ATOM 0 H THR A 980 4.424 -17.631 -0.146 1.00 0.00 H new ATOM 0 HA THR A 980 4.485 -15.796 -2.267 1.00 0.00 H new ATOM 0 HB THR A 980 2.992 -15.822 -0.151 1.00 0.00 H new ATOM 0 HG1 THR A 980 4.170 -13.520 -1.410 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.688 -14.273 1.622 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.758 -15.692 1.525 1.00 0.00 H new ATOM 0 HG23 THR A 980 5.291 -14.129 0.861 1.00 0.00 H new ATOM 946 N HIS A 981 7.216 -15.886 -0.606 1.00 0.00 N ATOM 947 CA HIS A 981 8.555 -15.299 -0.362 1.00 0.00 C ATOM 948 C HIS A 981 9.108 -14.588 -1.603 1.00 0.00 C ATOM 949 O HIS A 981 9.963 -13.708 -1.498 1.00 0.00 O ATOM 950 CB HIS A 981 9.519 -16.421 0.083 1.00 0.00 C ATOM 951 CG HIS A 981 10.986 -16.095 -0.025 1.00 0.00 C ATOM 952 ND1 HIS A 981 11.702 -15.425 0.951 1.00 0.00 N ATOM 953 CD2 HIS A 981 11.874 -16.362 -1.015 1.00 0.00 C ATOM 954 CE1 HIS A 981 12.956 -15.295 0.560 1.00 0.00 C ATOM 955 NE2 HIS A 981 13.084 -15.856 -0.624 1.00 0.00 N ATOM 0 H HIS A 981 7.136 -16.862 -0.320 1.00 0.00 H new ATOM 0 HA HIS A 981 8.462 -14.547 0.421 1.00 0.00 H new ATOM 0 HB2 HIS A 981 9.297 -16.678 1.119 1.00 0.00 H new ATOM 0 HB3 HIS A 981 9.317 -17.309 -0.516 1.00 0.00 H new ATOM 0 HD2 HIS A 981 11.665 -16.878 -1.940 1.00 0.00 H new ATOM 0 HE1 HIS A 981 13.744 -14.810 1.117 1.00 0.00 H new ATOM 0 HE2 HIS A 981 13.948 -15.906 -1.164 1.00 0.00 H new ATOM 964 N ARG A 982 8.600 -14.952 -2.763 1.00 0.00 N ATOM 965 CA ARG A 982 9.008 -14.288 -3.991 1.00 0.00 C ATOM 966 C ARG A 982 8.293 -12.937 -4.139 1.00 0.00 C ATOM 967 O ARG A 982 8.933 -11.891 -4.290 1.00 0.00 O ATOM 968 CB ARG A 982 8.726 -15.174 -5.213 1.00 0.00 C ATOM 969 CG ARG A 982 7.301 -15.705 -5.278 1.00 0.00 C ATOM 970 CD ARG A 982 6.924 -16.137 -6.684 1.00 0.00 C ATOM 971 NE ARG A 982 7.739 -17.250 -7.167 1.00 0.00 N ATOM 972 CZ ARG A 982 7.503 -17.896 -8.308 1.00 0.00 C ATOM 973 NH1 ARG A 982 6.480 -17.540 -9.077 1.00 0.00 N ATOM 974 NH2 ARG A 982 8.294 -18.891 -8.684 1.00 0.00 N ATOM 0 H ARG A 982 7.912 -15.695 -2.885 1.00 0.00 H new ATOM 0 HA ARG A 982 10.082 -14.110 -3.936 1.00 0.00 H new ATOM 0 HB2 ARG A 982 8.931 -14.603 -6.118 1.00 0.00 H new ATOM 0 HB3 ARG A 982 9.417 -16.017 -5.205 1.00 0.00 H new ATOM 0 HG2 ARG A 982 7.197 -16.550 -4.598 1.00 0.00 H new ATOM 0 HG3 ARG A 982 6.610 -14.934 -4.937 1.00 0.00 H new ATOM 0 HD2 ARG A 982 5.873 -16.426 -6.702 1.00 0.00 H new ATOM 0 HD3 ARG A 982 7.033 -15.290 -7.362 1.00 0.00 H new ATOM 0 HE ARG A 982 8.532 -17.549 -6.599 1.00 0.00 H new ATOM 0 HH11 ARG A 982 5.873 -16.770 -8.794 1.00 0.00 H new ATOM 0 HH12 ARG A 982 6.301 -18.036 -9.950 1.00 0.00 H new ATOM 0 HH21 ARG A 982 9.084 -19.163 -8.099 1.00 0.00 H new ATOM 0 HH22 ARG A 982 8.112 -19.385 -9.558 1.00 0.00 H new ATOM 988 N GLU A 983 6.967 -12.958 -4.051 1.00 0.00 N ATOM 989 CA GLU A 983 6.172 -11.761 -4.272 1.00 0.00 C ATOM 990 C GLU A 983 6.190 -10.820 -3.081 1.00 0.00 C ATOM 991 O GLU A 983 6.354 -9.613 -3.245 1.00 0.00 O ATOM 992 CB GLU A 983 4.729 -12.114 -4.594 1.00 0.00 C ATOM 993 CG GLU A 983 4.189 -11.312 -5.759 1.00 0.00 C ATOM 994 CD GLU A 983 4.149 -12.132 -7.034 1.00 0.00 C ATOM 995 OE1 GLU A 983 5.226 -12.527 -7.530 1.00 0.00 O ATOM 996 OE2 GLU A 983 3.040 -12.403 -7.533 1.00 0.00 O ATOM 0 H GLU A 983 6.423 -13.792 -3.828 1.00 0.00 H new ATOM 0 HA GLU A 983 6.629 -11.251 -5.120 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.660 -13.177 -4.824 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.109 -11.937 -3.715 1.00 0.00 H new ATOM 0 HG2 GLU A 983 3.186 -10.957 -5.523 1.00 0.00 H new ATOM 0 HG3 GLU A 983 4.811 -10.430 -5.913 1.00 0.00 H new ATOM 1003 N ILE A 984 6.000 -11.362 -1.885 1.00 0.00 N ATOM 1004 CA ILE A 984 5.891 -10.532 -0.693 1.00 0.00 C ATOM 1005 C ILE A 984 7.118 -9.636 -0.564 1.00 0.00 C ATOM 1006 O ILE A 984 7.022 -8.486 -0.151 1.00 0.00 O ATOM 1007 CB ILE A 984 5.705 -11.381 0.589 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.401 -10.479 1.789 1.00 0.00 C ATOM 1009 CG2 ILE A 984 6.937 -12.232 0.864 1.00 0.00 C ATOM 1010 CD1 ILE A 984 5.205 -11.237 3.085 1.00 0.00 C ATOM 0 H ILE A 984 5.919 -12.364 -1.715 1.00 0.00 H new ATOM 0 HA ILE A 984 5.002 -9.911 -0.803 1.00 0.00 H new ATOM 0 HB ILE A 984 4.859 -12.050 0.431 1.00 0.00 H new ATOM 0 HG12 ILE A 984 6.218 -9.768 1.914 1.00 0.00 H new ATOM 0 HG13 ILE A 984 4.503 -9.899 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 984 6.780 -12.818 1.770 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.111 -12.903 0.023 1.00 0.00 H new ATOM 0 HG23 ILE A 984 7.804 -11.585 0.997 1.00 0.00 H new ATOM 0 HD11 ILE A 984 4.994 -10.533 3.890 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.369 -11.929 2.979 1.00 0.00 H new ATOM 0 HD13 ILE A 984 6.111 -11.796 3.320 1.00 0.00 H new ATOM 1022 N GLU A 985 8.258 -10.163 -0.979 1.00 0.00 N ATOM 1023 CA GLU A 985 9.498 -9.416 -0.956 1.00 0.00 C ATOM 1024 C GLU A 985 9.547 -8.342 -2.038 1.00 0.00 C ATOM 1025 O GLU A 985 10.127 -7.279 -1.817 1.00 0.00 O ATOM 1026 CB GLU A 985 10.685 -10.361 -1.095 1.00 0.00 C ATOM 1027 CG GLU A 985 11.270 -10.772 0.240 1.00 0.00 C ATOM 1028 CD GLU A 985 11.976 -9.615 0.912 1.00 0.00 C ATOM 1029 OE1 GLU A 985 13.111 -9.292 0.504 1.00 0.00 O ATOM 1030 OE2 GLU A 985 11.395 -9.005 1.832 1.00 0.00 O ATOM 0 H GLU A 985 8.347 -11.114 -1.338 1.00 0.00 H new ATOM 0 HA GLU A 985 9.551 -8.907 0.006 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.372 -11.252 -1.639 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.459 -9.879 -1.692 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.476 -11.142 0.889 1.00 0.00 H new ATOM 0 HG3 GLU A 985 11.972 -11.593 0.094 1.00 0.00 H new ATOM 1037 N MET A 986 8.946 -8.606 -3.202 1.00 0.00 N ATOM 1038 CA MET A 986 9.020 -7.649 -4.305 1.00 0.00 C ATOM 1039 C MET A 986 8.280 -6.343 -3.984 1.00 0.00 C ATOM 1040 O MET A 986 8.882 -5.266 -3.986 1.00 0.00 O ATOM 1041 CB MET A 986 8.542 -8.245 -5.649 1.00 0.00 C ATOM 1042 CG MET A 986 7.045 -8.474 -5.780 1.00 0.00 C ATOM 1043 SD MET A 986 6.554 -8.900 -7.463 1.00 0.00 S ATOM 1044 CE MET A 986 7.019 -7.406 -8.338 1.00 0.00 C ATOM 0 H MET A 986 8.415 -9.454 -3.401 1.00 0.00 H new ATOM 0 HA MET A 986 10.077 -7.411 -4.423 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.860 -7.580 -6.452 1.00 0.00 H new ATOM 0 HB3 MET A 986 9.050 -9.197 -5.803 1.00 0.00 H new ATOM 0 HG2 MET A 986 6.743 -9.274 -5.104 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.515 -7.575 -5.467 1.00 0.00 H new ATOM 0 HE1 MET A 986 6.390 -7.291 -9.221 1.00 0.00 H new ATOM 0 HE2 MET A 986 6.886 -6.545 -7.683 1.00 0.00 H new ATOM 0 HE3 MET A 986 8.063 -7.473 -8.643 1.00 0.00 H new ATOM 1054 N ALA A 987 6.991 -6.430 -3.683 1.00 0.00 N ATOM 1055 CA ALA A 987 6.182 -5.237 -3.517 1.00 0.00 C ATOM 1056 C ALA A 987 6.362 -4.606 -2.146 1.00 0.00 C ATOM 1057 O ALA A 987 6.357 -3.392 -2.030 1.00 0.00 O ATOM 1058 CB ALA A 987 4.720 -5.530 -3.789 1.00 0.00 C ATOM 0 H ALA A 987 6.489 -7.308 -3.550 1.00 0.00 H new ATOM 0 HA ALA A 987 6.531 -4.511 -4.252 1.00 0.00 H new ATOM 0 HB1 ALA A 987 4.136 -4.619 -3.658 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.605 -5.890 -4.811 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.366 -6.291 -3.094 1.00 0.00 H new ATOM 1064 N GLN A 988 6.530 -5.420 -1.109 1.00 0.00 N ATOM 1065 CA GLN A 988 6.655 -4.882 0.244 1.00 0.00 C ATOM 1066 C GLN A 988 7.955 -4.090 0.395 1.00 0.00 C ATOM 1067 O GLN A 988 7.996 -3.070 1.083 1.00 0.00 O ATOM 1068 CB GLN A 988 6.580 -5.996 1.295 1.00 0.00 C ATOM 1069 CG GLN A 988 6.803 -5.514 2.724 1.00 0.00 C ATOM 1070 CD GLN A 988 5.730 -4.556 3.213 1.00 0.00 C ATOM 1071 OE1 GLN A 988 5.116 -3.832 2.436 1.00 0.00 O ATOM 1072 NE2 GLN A 988 5.508 -4.537 4.516 1.00 0.00 N ATOM 0 H GLN A 988 6.582 -6.437 -1.174 1.00 0.00 H new ATOM 0 HA GLN A 988 5.816 -4.206 0.410 1.00 0.00 H new ATOM 0 HB2 GLN A 988 5.603 -6.476 1.232 1.00 0.00 H new ATOM 0 HB3 GLN A 988 7.324 -6.756 1.058 1.00 0.00 H new ATOM 0 HG2 GLN A 988 6.839 -6.377 3.389 1.00 0.00 H new ATOM 0 HG3 GLN A 988 7.774 -5.023 2.786 1.00 0.00 H new ATOM 0 HE21 GLN A 988 6.038 -5.153 5.133 1.00 0.00 H new ATOM 0 HE22 GLN A 988 4.807 -3.906 4.905 1.00 0.00 H new ATOM 1081 N LYS A 989 9.015 -4.554 -0.256 1.00 0.00 N ATOM 1082 CA LYS A 989 10.272 -3.814 -0.273 1.00 0.00 C ATOM 1083 C LYS A 989 10.078 -2.519 -1.050 1.00 0.00 C ATOM 1084 O LYS A 989 10.686 -1.486 -0.749 1.00 0.00 O ATOM 1085 CB LYS A 989 11.378 -4.652 -0.916 1.00 0.00 C ATOM 1086 CG LYS A 989 12.747 -3.993 -0.880 1.00 0.00 C ATOM 1087 CD LYS A 989 13.804 -4.818 -1.606 1.00 0.00 C ATOM 1088 CE LYS A 989 14.106 -6.137 -0.899 1.00 0.00 C ATOM 1089 NZ LYS A 989 13.051 -7.164 -1.121 1.00 0.00 N ATOM 0 H LYS A 989 9.031 -5.432 -0.775 1.00 0.00 H new ATOM 0 HA LYS A 989 10.568 -3.586 0.751 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.435 -5.614 -0.407 1.00 0.00 H new ATOM 0 HB3 LYS A 989 11.110 -4.856 -1.953 1.00 0.00 H new ATOM 0 HG2 LYS A 989 12.684 -3.005 -1.335 1.00 0.00 H new ATOM 0 HG3 LYS A 989 13.051 -3.848 0.157 1.00 0.00 H new ATOM 0 HD2 LYS A 989 13.465 -5.023 -2.621 1.00 0.00 H new ATOM 0 HD3 LYS A 989 14.722 -4.235 -1.688 1.00 0.00 H new ATOM 0 HE2 LYS A 989 15.062 -6.523 -1.252 1.00 0.00 H new ATOM 0 HE3 LYS A 989 14.211 -5.955 0.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 12.679 -7.483 -0.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 12.279 -6.753 -1.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 13.457 -7.975 -1.630 1.00 0.00 H new ATOM 1103 N LEU A 990 9.191 -2.586 -2.032 1.00 0.00 N ATOM 1104 CA LEU A 990 8.856 -1.440 -2.849 1.00 0.00 C ATOM 1105 C LEU A 990 8.040 -0.445 -2.027 1.00 0.00 C ATOM 1106 O LEU A 990 8.270 0.763 -2.095 1.00 0.00 O ATOM 1107 CB LEU A 990 8.112 -1.932 -4.107 1.00 0.00 C ATOM 1108 CG LEU A 990 6.832 -1.195 -4.518 1.00 0.00 C ATOM 1109 CD1 LEU A 990 7.137 0.227 -4.965 1.00 0.00 C ATOM 1110 CD2 LEU A 990 6.140 -1.959 -5.629 1.00 0.00 C ATOM 0 H LEU A 990 8.687 -3.437 -2.281 1.00 0.00 H new ATOM 0 HA LEU A 990 9.753 -0.915 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.807 -1.888 -4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.860 -2.982 -3.957 1.00 0.00 H new ATOM 0 HG LEU A 990 6.172 -1.138 -3.653 1.00 0.00 H new ATOM 0 HD11 LEU A 990 6.211 0.725 -5.251 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.605 0.773 -4.146 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.814 0.203 -5.819 1.00 0.00 H new ATOM 0 HD21 LEU A 990 5.230 -1.434 -5.920 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.806 -2.034 -6.488 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.885 -2.959 -5.279 1.00 0.00 H new ATOM 1122 N LEU A 991 7.141 -0.970 -1.204 1.00 0.00 N ATOM 1123 CA LEU A 991 6.244 -0.144 -0.408 1.00 0.00 C ATOM 1124 C LEU A 991 6.975 0.506 0.747 1.00 0.00 C ATOM 1125 O LEU A 991 6.612 1.587 1.203 1.00 0.00 O ATOM 1126 CB LEU A 991 5.074 -0.970 0.107 1.00 0.00 C ATOM 1127 CG LEU A 991 4.212 -1.575 -0.988 1.00 0.00 C ATOM 1128 CD1 LEU A 991 2.976 -2.221 -0.390 1.00 0.00 C ATOM 1129 CD2 LEU A 991 3.827 -0.511 -2.001 1.00 0.00 C ATOM 0 H LEU A 991 7.014 -1.973 -1.070 1.00 0.00 H new ATOM 0 HA LEU A 991 5.860 0.647 -1.053 1.00 0.00 H new ATOM 0 HB2 LEU A 991 5.459 -1.772 0.737 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.449 -0.340 0.740 1.00 0.00 H new ATOM 0 HG LEU A 991 4.786 -2.347 -1.501 1.00 0.00 H new ATOM 0 HD11 LEU A 991 2.368 -2.650 -1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 991 3.275 -3.008 0.302 1.00 0.00 H new ATOM 0 HD13 LEU A 991 2.395 -1.469 0.145 1.00 0.00 H new ATOM 0 HD21 LEU A 991 3.209 -0.957 -2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 991 3.267 0.280 -1.503 1.00 0.00 H new ATOM 0 HD23 LEU A 991 4.728 -0.091 -2.448 1.00 0.00 H new ATOM 1141 N ASN A 992 8.012 -0.157 1.223 1.00 0.00 N ATOM 1142 CA ASN A 992 8.859 0.408 2.254 1.00 0.00 C ATOM 1143 C ASN A 992 9.484 1.692 1.720 1.00 0.00 C ATOM 1144 O ASN A 992 9.515 2.722 2.395 1.00 0.00 O ATOM 1145 CB ASN A 992 9.949 -0.608 2.633 1.00 0.00 C ATOM 1146 CG ASN A 992 10.726 -0.242 3.889 1.00 0.00 C ATOM 1147 OD1 ASN A 992 10.923 0.929 4.209 1.00 0.00 O ATOM 1148 ND2 ASN A 992 11.187 -1.259 4.607 1.00 0.00 N ATOM 0 H ASN A 992 8.288 -1.088 0.911 1.00 0.00 H new ATOM 0 HA ASN A 992 8.275 0.636 3.145 1.00 0.00 H new ATOM 0 HB2 ASN A 992 9.487 -1.585 2.776 1.00 0.00 H new ATOM 0 HB3 ASN A 992 10.647 -0.704 1.801 1.00 0.00 H new ATOM 0 HD21 ASN A 992 11.725 -1.082 5.456 1.00 0.00 H new ATOM 0 HD22 ASN A 992 11.004 -2.217 4.310 1.00 0.00 H new ATOM 1155 N SER A 993 9.941 1.620 0.478 1.00 0.00 N ATOM 1156 CA SER A 993 10.633 2.728 -0.160 1.00 0.00 C ATOM 1157 C SER A 993 9.674 3.832 -0.643 1.00 0.00 C ATOM 1158 O SER A 993 10.022 5.014 -0.592 1.00 0.00 O ATOM 1159 CB SER A 993 11.462 2.197 -1.329 1.00 0.00 C ATOM 1160 OG SER A 993 12.290 1.118 -0.921 1.00 0.00 O ATOM 0 H SER A 993 9.843 0.795 -0.113 1.00 0.00 H new ATOM 0 HA SER A 993 11.282 3.186 0.586 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.799 1.868 -2.129 1.00 0.00 H new ATOM 0 HB3 SER A 993 12.078 2.999 -1.735 1.00 0.00 H new ATOM 0 HG SER A 993 11.757 0.297 -0.871 1.00 0.00 H new ATOM 1166 N ASP A 994 8.469 3.472 -1.084 1.00 0.00 N ATOM 1167 CA ASP A 994 7.593 4.449 -1.740 1.00 0.00 C ATOM 1168 C ASP A 994 6.674 5.136 -0.729 1.00 0.00 C ATOM 1169 O ASP A 994 6.429 6.337 -0.831 1.00 0.00 O ATOM 1170 CB ASP A 994 6.786 3.813 -2.881 1.00 0.00 C ATOM 1171 CG ASP A 994 5.538 3.097 -2.417 1.00 0.00 C ATOM 1172 OD1 ASP A 994 5.618 2.346 -1.434 1.00 0.00 O ATOM 1173 OD2 ASP A 994 4.479 3.296 -3.035 1.00 0.00 O ATOM 0 H ASP A 994 8.081 2.532 -1.003 1.00 0.00 H new ATOM 0 HA ASP A 994 8.233 5.212 -2.182 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.505 4.590 -3.592 1.00 0.00 H new ATOM 0 HB3 ASP A 994 7.422 3.107 -3.414 1.00 0.00 H new ATOM 1178 N LEU A 995 6.181 4.391 0.261 1.00 0.00 N ATOM 1179 CA LEU A 995 5.478 5.002 1.379 1.00 0.00 C ATOM 1180 C LEU A 995 6.431 5.982 2.054 1.00 0.00 C ATOM 1181 O LEU A 995 6.034 7.070 2.482 1.00 0.00 O ATOM 1182 CB LEU A 995 4.958 3.924 2.363 1.00 0.00 C ATOM 1183 CG LEU A 995 4.209 4.422 3.613 1.00 0.00 C ATOM 1184 CD1 LEU A 995 5.174 4.834 4.716 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.284 5.575 3.257 1.00 0.00 C ATOM 0 H LEU A 995 6.256 3.375 0.308 1.00 0.00 H new ATOM 0 HA LEU A 995 4.598 5.540 1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 995 4.294 3.256 1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 995 5.809 3.328 2.693 1.00 0.00 H new ATOM 0 HG LEU A 995 3.608 3.594 3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 995 4.610 5.180 5.582 1.00 0.00 H new ATOM 0 HD12 LEU A 995 5.788 3.979 5.000 1.00 0.00 H new ATOM 0 HD13 LEU A 995 5.816 5.638 4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 995 2.763 5.914 4.153 1.00 0.00 H new ATOM 0 HD22 LEU A 995 3.869 6.397 2.845 1.00 0.00 H new ATOM 0 HD23 LEU A 995 2.555 5.242 2.518 1.00 0.00 H new ATOM 1197 N ALA A 996 7.702 5.592 2.105 1.00 0.00 N ATOM 1198 CA ALA A 996 8.736 6.456 2.640 1.00 0.00 C ATOM 1199 C ALA A 996 8.831 7.753 1.853 1.00 0.00 C ATOM 1200 O ALA A 996 8.806 8.842 2.436 1.00 0.00 O ATOM 1201 CB ALA A 996 10.083 5.753 2.659 1.00 0.00 C ATOM 0 H ALA A 996 8.035 4.684 1.781 1.00 0.00 H new ATOM 0 HA ALA A 996 8.459 6.697 3.666 1.00 0.00 H new ATOM 0 HB1 ALA A 996 10.839 6.425 3.065 1.00 0.00 H new ATOM 0 HB2 ALA A 996 10.019 4.861 3.282 1.00 0.00 H new ATOM 0 HB3 ALA A 996 10.359 5.468 1.644 1.00 0.00 H new ATOM 1207 N GLU A 997 8.950 7.665 0.532 1.00 0.00 N ATOM 1208 CA GLU A 997 9.070 8.884 -0.237 1.00 0.00 C ATOM 1209 C GLU A 997 7.810 9.711 -0.101 1.00 0.00 C ATOM 1210 O GLU A 997 7.877 10.921 -0.012 1.00 0.00 O ATOM 1211 CB GLU A 997 9.412 8.643 -1.712 1.00 0.00 C ATOM 1212 CG GLU A 997 8.254 8.170 -2.568 1.00 0.00 C ATOM 1213 CD GLU A 997 8.419 8.590 -4.013 1.00 0.00 C ATOM 1214 OE1 GLU A 997 9.144 7.904 -4.759 1.00 0.00 O ATOM 1215 OE2 GLU A 997 7.848 9.632 -4.396 1.00 0.00 O ATOM 0 H GLU A 997 8.965 6.798 -0.005 1.00 0.00 H new ATOM 0 HA GLU A 997 9.913 9.436 0.178 1.00 0.00 H new ATOM 0 HB2 GLU A 997 9.803 9.569 -2.135 1.00 0.00 H new ATOM 0 HB3 GLU A 997 10.212 7.904 -1.768 1.00 0.00 H new ATOM 0 HG2 GLU A 997 8.179 7.084 -2.511 1.00 0.00 H new ATOM 0 HG3 GLU A 997 7.322 8.575 -2.175 1.00 0.00 H new ATOM 1222 N LEU A 998 6.667 9.065 -0.011 1.00 0.00 N ATOM 1223 CA LEU A 998 5.420 9.803 0.012 1.00 0.00 C ATOM 1224 C LEU A 998 5.254 10.581 1.300 1.00 0.00 C ATOM 1225 O LEU A 998 4.841 11.741 1.273 1.00 0.00 O ATOM 1226 CB LEU A 998 4.225 8.892 -0.230 1.00 0.00 C ATOM 1227 CG LEU A 998 3.666 8.982 -1.643 1.00 0.00 C ATOM 1228 CD1 LEU A 998 3.268 10.416 -1.943 1.00 0.00 C ATOM 1229 CD2 LEU A 998 4.691 8.491 -2.653 1.00 0.00 C ATOM 0 H LEU A 998 6.574 8.051 0.046 1.00 0.00 H new ATOM 0 HA LEU A 998 5.462 10.522 -0.806 1.00 0.00 H new ATOM 0 HB2 LEU A 998 4.518 7.861 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.437 9.144 0.480 1.00 0.00 H new ATOM 0 HG LEU A 998 2.784 8.346 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 998 2.868 10.478 -2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 998 2.508 10.739 -1.232 1.00 0.00 H new ATOM 0 HD13 LEU A 998 4.142 11.062 -1.858 1.00 0.00 H new ATOM 0 HD21 LEU A 998 4.275 8.562 -3.658 1.00 0.00 H new ATOM 0 HD22 LEU A 998 5.589 9.105 -2.588 1.00 0.00 H new ATOM 0 HD23 LEU A 998 4.945 7.453 -2.438 1.00 0.00 H new ATOM 1241 N ILE A 999 5.594 9.966 2.422 1.00 0.00 N ATOM 1242 CA ILE A 999 5.487 10.648 3.710 1.00 0.00 C ATOM 1243 C ILE A 999 6.357 11.909 3.732 1.00 0.00 C ATOM 1244 O ILE A 999 6.063 12.868 4.440 1.00 0.00 O ATOM 1245 CB ILE A 999 5.840 9.718 4.905 1.00 0.00 C ATOM 1246 CG1 ILE A 999 5.425 10.368 6.226 1.00 0.00 C ATOM 1247 CG2 ILE A 999 7.324 9.388 4.931 1.00 0.00 C ATOM 1248 CD1 ILE A 999 5.588 9.464 7.432 1.00 0.00 C ATOM 0 H ILE A 999 5.942 9.009 2.472 1.00 0.00 H new ATOM 0 HA ILE A 999 4.443 10.939 3.828 1.00 0.00 H new ATOM 0 HB ILE A 999 5.288 8.787 4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 999 6.017 11.270 6.378 1.00 0.00 H new ATOM 0 HG13 ILE A 999 4.383 10.679 6.155 1.00 0.00 H new ATOM 0 HG21 ILE A 999 7.537 8.736 5.778 1.00 0.00 H new ATOM 0 HG22 ILE A 999 7.601 8.882 4.006 1.00 0.00 H new ATOM 0 HG23 ILE A 999 7.900 10.308 5.027 1.00 0.00 H new ATOM 0 HD11 ILE A 999 5.273 9.995 8.330 1.00 0.00 H new ATOM 0 HD12 ILE A 999 4.974 8.572 7.304 1.00 0.00 H new ATOM 0 HD13 ILE A 999 6.634 9.173 7.530 1.00 0.00 H new ATOM 1260 N ASN A1000 7.400 11.919 2.909 1.00 0.00 N ATOM 1261 CA ASN A1000 8.308 13.061 2.836 1.00 0.00 C ATOM 1262 C ASN A1000 8.048 13.887 1.578 1.00 0.00 C ATOM 1263 O ASN A1000 8.601 14.963 1.427 1.00 0.00 O ATOM 1264 CB ASN A1000 9.759 12.561 2.899 1.00 0.00 C ATOM 1265 CG ASN A1000 10.527 12.697 1.593 1.00 0.00 C ATOM 1266 OD1 ASN A1000 11.374 13.577 1.437 1.00 0.00 O ATOM 1267 ND2 ASN A1000 10.205 11.853 0.632 1.00 0.00 N ATOM 0 H ASN A1000 7.639 11.150 2.283 1.00 0.00 H new ATOM 0 HA ASN A1000 8.131 13.719 3.687 1.00 0.00 H new ATOM 0 HB2 ASN A1000 10.287 13.113 3.676 1.00 0.00 H new ATOM 0 HB3 ASN A1000 9.757 11.513 3.198 1.00 0.00 H new ATOM 0 HD21 ASN A1000 10.663 11.917 -0.277 1.00 0.00 H new ATOM 0 HD22 ASN A1000 9.498 11.137 0.798 1.00 0.00 H new ATOM 1274 N LYS A1001 7.193 13.387 0.693 1.00 0.00 N ATOM 1275 CA LYS A1001 6.772 14.146 -0.488 1.00 0.00 C ATOM 1276 C LYS A1001 5.641 15.071 -0.098 1.00 0.00 C ATOM 1277 O LYS A1001 5.563 16.209 -0.551 1.00 0.00 O ATOM 1278 CB LYS A1001 6.318 13.234 -1.641 1.00 0.00 C ATOM 1279 CG LYS A1001 7.454 12.516 -2.362 1.00 0.00 C ATOM 1280 CD LYS A1001 8.417 13.489 -3.025 1.00 0.00 C ATOM 1281 CE LYS A1001 9.628 12.767 -3.604 1.00 0.00 C ATOM 1282 NZ LYS A1001 9.259 11.819 -4.690 1.00 0.00 N ATOM 0 H LYS A1001 6.775 12.459 0.767 1.00 0.00 H new ATOM 0 HA LYS A1001 7.631 14.713 -0.845 1.00 0.00 H new ATOM 0 HB2 LYS A1001 5.626 12.490 -1.248 1.00 0.00 H new ATOM 0 HB3 LYS A1001 5.765 13.832 -2.365 1.00 0.00 H new ATOM 0 HG2 LYS A1001 7.999 11.895 -1.651 1.00 0.00 H new ATOM 0 HG3 LYS A1001 7.039 11.847 -3.116 1.00 0.00 H new ATOM 0 HD2 LYS A1001 7.901 14.030 -3.818 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.747 14.229 -2.296 1.00 0.00 H new ATOM 0 HE2 LYS A1001 10.334 13.501 -3.991 1.00 0.00 H new ATOM 0 HE3 LYS A1001 10.138 12.223 -2.809 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 10.122 11.455 -5.142 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 8.717 11.026 -4.290 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 8.679 12.312 -5.399 1.00 0.00 H new ATOM 1296 N MET A1002 4.778 14.571 0.776 1.00 0.00 N ATOM 1297 CA MET A1002 3.702 15.361 1.326 1.00 0.00 C ATOM 1298 C MET A1002 4.304 16.334 2.301 1.00 0.00 C ATOM 1299 O MET A1002 3.941 17.507 2.347 1.00 0.00 O ATOM 1300 CB MET A1002 2.719 14.457 2.046 1.00 0.00 C ATOM 1301 CG MET A1002 2.192 13.329 1.184 1.00 0.00 C ATOM 1302 SD MET A1002 1.111 13.902 -0.135 1.00 0.00 S ATOM 1303 CE MET A1002 0.449 12.351 -0.729 1.00 0.00 C ATOM 0 H MET A1002 4.809 13.611 1.118 1.00 0.00 H new ATOM 0 HA MET A1002 3.171 15.890 0.534 1.00 0.00 H new ATOM 0 HB2 MET A1002 3.204 14.035 2.926 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.880 15.055 2.400 1.00 0.00 H new ATOM 0 HG2 MET A1002 3.032 12.788 0.749 1.00 0.00 H new ATOM 0 HG3 MET A1002 1.648 12.623 1.811 1.00 0.00 H new ATOM 0 HE1 MET A1002 -0.562 12.507 -1.106 1.00 0.00 H new ATOM 0 HE2 MET A1002 1.081 11.969 -1.531 1.00 0.00 H new ATOM 0 HE3 MET A1002 0.424 11.630 0.088 1.00 0.00 H new ATOM 1313 N LYS A1003 5.248 15.816 3.076 1.00 0.00 N ATOM 1314 CA LYS A1003 6.041 16.635 3.958 1.00 0.00 C ATOM 1315 C LYS A1003 6.763 17.701 3.153 1.00 0.00 C ATOM 1316 O LYS A1003 6.734 18.854 3.521 1.00 0.00 O ATOM 1317 CB LYS A1003 7.052 15.783 4.728 1.00 0.00 C ATOM 1318 CG LYS A1003 7.919 16.591 5.677 1.00 0.00 C ATOM 1319 CD LYS A1003 8.915 15.722 6.429 1.00 0.00 C ATOM 1320 CE LYS A1003 9.993 15.180 5.506 1.00 0.00 C ATOM 1321 NZ LYS A1003 11.024 14.413 6.250 1.00 0.00 N ATOM 0 H LYS A1003 5.478 14.823 3.105 1.00 0.00 H new ATOM 0 HA LYS A1003 5.379 17.113 4.680 1.00 0.00 H new ATOM 0 HB2 LYS A1003 6.517 15.021 5.295 1.00 0.00 H new ATOM 0 HB3 LYS A1003 7.692 15.261 4.017 1.00 0.00 H new ATOM 0 HG2 LYS A1003 8.458 17.353 5.114 1.00 0.00 H new ATOM 0 HG3 LYS A1003 7.283 17.113 6.392 1.00 0.00 H new ATOM 0 HD2 LYS A1003 9.377 16.304 7.227 1.00 0.00 H new ATOM 0 HD3 LYS A1003 8.390 14.892 6.903 1.00 0.00 H new ATOM 0 HE2 LYS A1003 9.537 14.538 4.752 1.00 0.00 H new ATOM 0 HE3 LYS A1003 10.467 16.007 4.977 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 11.741 14.060 5.585 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 11.478 15.032 6.952 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 10.576 13.609 6.735 1.00 0.00 H new ATOM 1335 N LEU A1004 7.417 17.290 2.065 1.00 0.00 N ATOM 1336 CA LEU A1004 8.128 18.208 1.170 1.00 0.00 C ATOM 1337 C LEU A1004 7.216 19.277 0.586 1.00 0.00 C ATOM 1338 O LEU A1004 7.582 20.448 0.548 1.00 0.00 O ATOM 1339 CB LEU A1004 8.781 17.438 0.026 1.00 0.00 C ATOM 1340 CG LEU A1004 9.651 18.279 -0.909 1.00 0.00 C ATOM 1341 CD1 LEU A1004 10.851 18.844 -0.164 1.00 0.00 C ATOM 1342 CD2 LEU A1004 10.099 17.454 -2.105 1.00 0.00 C ATOM 0 H LEU A1004 7.469 16.312 1.779 1.00 0.00 H new ATOM 0 HA LEU A1004 8.887 18.703 1.775 1.00 0.00 H new ATOM 0 HB2 LEU A1004 9.393 16.641 0.448 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.998 16.960 -0.563 1.00 0.00 H new ATOM 0 HG LEU A1004 9.054 19.115 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU A1004 11.457 19.439 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.506 19.473 0.657 1.00 0.00 H new ATOM 0 HD13 LEU A1004 11.451 18.025 0.233 1.00 0.00 H new ATOM 0 HD21 LEU A1004 10.717 18.068 -2.760 1.00 0.00 H new ATOM 0 HD22 LEU A1004 10.677 16.597 -1.760 1.00 0.00 H new ATOM 0 HD23 LEU A1004 9.225 17.105 -2.654 1.00 0.00 H new ATOM 1354 N ALA A1005 6.044 18.886 0.111 1.00 0.00 N ATOM 1355 CA ALA A1005 5.131 19.849 -0.480 1.00 0.00 C ATOM 1356 C ALA A1005 4.683 20.858 0.559 1.00 0.00 C ATOM 1357 O ALA A1005 4.772 22.071 0.350 1.00 0.00 O ATOM 1358 CB ALA A1005 3.937 19.142 -1.106 1.00 0.00 C ATOM 0 H ALA A1005 5.707 17.923 0.123 1.00 0.00 H new ATOM 0 HA ALA A1005 5.655 20.385 -1.271 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.265 19.881 -1.543 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.284 18.462 -1.884 1.00 0.00 H new ATOM 0 HB3 ALA A1005 3.406 18.577 -0.340 1.00 0.00 H new ATOM 1364 N GLN A1006 4.253 20.337 1.696 1.00 0.00 N ATOM 1365 CA GLN A1006 3.862 21.147 2.833 1.00 0.00 C ATOM 1366 C GLN A1006 5.088 21.864 3.409 1.00 0.00 C ATOM 1367 O GLN A1006 4.970 22.846 4.149 1.00 0.00 O ATOM 1368 CB GLN A1006 3.178 20.231 3.867 1.00 0.00 C ATOM 1369 CG GLN A1006 4.082 19.702 4.972 1.00 0.00 C ATOM 1370 CD GLN A1006 4.094 20.596 6.197 1.00 0.00 C ATOM 1371 OE1 GLN A1006 3.116 21.283 6.488 1.00 0.00 O ATOM 1372 NE2 GLN A1006 5.195 20.592 6.925 1.00 0.00 N ATOM 0 H GLN A1006 4.166 19.333 1.855 1.00 0.00 H new ATOM 0 HA GLN A1006 3.155 21.921 2.536 1.00 0.00 H new ATOM 0 HB2 GLN A1006 2.356 20.780 4.326 1.00 0.00 H new ATOM 0 HB3 GLN A1006 2.740 19.382 3.342 1.00 0.00 H new ATOM 0 HG2 GLN A1006 3.752 18.704 5.259 1.00 0.00 H new ATOM 0 HG3 GLN A1006 5.098 19.604 4.589 1.00 0.00 H new ATOM 0 HE21 GLN A1006 5.985 20.008 6.651 1.00 0.00 H new ATOM 0 HE22 GLN A1006 5.255 21.172 7.762 1.00 0.00 H new ATOM 1381 N GLN A1007 6.265 21.357 3.042 1.00 0.00 N ATOM 1382 CA GLN A1007 7.538 21.912 3.481 1.00 0.00 C ATOM 1383 C GLN A1007 7.875 23.166 2.692 1.00 0.00 C ATOM 1384 O GLN A1007 8.485 24.098 3.215 1.00 0.00 O ATOM 1385 CB GLN A1007 8.656 20.875 3.313 1.00 0.00 C ATOM 1386 CG GLN A1007 9.837 21.092 4.234 1.00 0.00 C ATOM 1387 CD GLN A1007 9.443 21.017 5.693 1.00 0.00 C ATOM 1388 OE1 GLN A1007 8.444 20.199 5.998 1.00 0.00 O flip ATOM 1389 NE2 GLN A1007 10.031 21.685 6.540 1.00 0.00 N flip ATOM 0 H GLN A1007 6.359 20.547 2.430 1.00 0.00 H new ATOM 0 HA GLN A1007 7.451 22.175 4.535 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.246 19.881 3.492 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.005 20.895 2.280 1.00 0.00 H new ATOM 0 HG2 GLN A1007 10.601 20.342 4.026 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.282 22.066 4.029 1.00 0.00 H new ATOM 0 HE21 GLN A1007 10.794 22.302 6.263 1.00 0.00 H new ATOM 0 HE22 GLN A1007 9.756 21.622 7.520 1.00 0.00 H new ATOM 1398 N TYR A1008 7.473 23.172 1.436 1.00 0.00 N ATOM 1399 CA TYR A1008 7.725 24.292 0.552 1.00 0.00 C ATOM 1400 C TYR A1008 6.814 25.459 0.902 1.00 0.00 C ATOM 1401 O TYR A1008 7.249 26.402 1.562 1.00 0.00 O ATOM 1402 CB TYR A1008 7.517 23.847 -0.896 1.00 0.00 C ATOM 1403 CG TYR A1008 7.627 24.941 -1.928 1.00 0.00 C ATOM 1404 CD1 TYR A1008 8.679 25.845 -1.911 1.00 0.00 C ATOM 1405 CD2 TYR A1008 6.665 25.066 -2.920 1.00 0.00 C ATOM 1406 CE1 TYR A1008 8.772 26.845 -2.857 1.00 0.00 C ATOM 1407 CE2 TYR A1008 6.749 26.064 -3.868 1.00 0.00 C ATOM 1408 CZ TYR A1008 7.803 26.950 -3.832 1.00 0.00 C ATOM 1409 OH TYR A1008 7.883 27.952 -4.770 1.00 0.00 O ATOM 0 H TYR A1008 6.964 22.403 1.001 1.00 0.00 H new ATOM 0 HA TYR A1008 8.755 24.628 0.673 1.00 0.00 H new ATOM 0 HB2 TYR A1008 8.249 23.074 -1.130 1.00 0.00 H new ATOM 0 HB3 TYR A1008 6.532 23.388 -0.980 1.00 0.00 H new ATOM 0 HD1 TYR A1008 9.437 25.765 -1.146 1.00 0.00 H new ATOM 0 HD2 TYR A1008 5.838 24.372 -2.950 1.00 0.00 H new ATOM 0 HE1 TYR A1008 9.598 27.540 -2.834 1.00 0.00 H new ATOM 0 HE2 TYR A1008 5.993 26.150 -4.634 1.00 0.00 H new ATOM 0 HH TYR A1008 6.989 28.320 -4.933 1.00 0.00 H new ATOM 1419 N VAL A1009 5.546 25.348 0.490 1.00 0.00 N ATOM 1420 CA VAL A1009 4.529 26.391 0.677 1.00 0.00 C ATOM 1421 C VAL A1009 5.128 27.813 0.631 1.00 0.00 C ATOM 1422 O VAL A1009 5.350 28.461 1.656 1.00 0.00 O ATOM 1423 CB VAL A1009 3.679 26.149 1.962 1.00 0.00 C ATOM 1424 CG1 VAL A1009 4.534 26.112 3.221 1.00 0.00 C ATOM 1425 CG2 VAL A1009 2.576 27.188 2.091 1.00 0.00 C ATOM 0 H VAL A1009 5.192 24.520 0.011 1.00 0.00 H new ATOM 0 HA VAL A1009 3.848 26.320 -0.171 1.00 0.00 H new ATOM 0 HB VAL A1009 3.219 25.167 1.856 1.00 0.00 H new ATOM 0 HG11 VAL A1009 3.897 25.941 4.089 1.00 0.00 H new ATOM 0 HG12 VAL A1009 5.263 25.306 3.142 1.00 0.00 H new ATOM 0 HG13 VAL A1009 5.055 27.063 3.335 1.00 0.00 H new ATOM 0 HG21 VAL A1009 1.999 26.996 2.995 1.00 0.00 H new ATOM 0 HG22 VAL A1009 3.018 28.183 2.147 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.919 27.131 1.223 1.00 0.00 H new ATOM 1435 N MET A1010 5.421 28.277 -0.584 1.00 0.00 N ATOM 1436 CA MET A1010 6.030 29.604 -0.772 1.00 0.00 C ATOM 1437 C MET A1010 5.431 30.340 -1.976 1.00 0.00 C ATOM 1438 O MET A1010 4.324 30.868 -1.900 1.00 0.00 O ATOM 1439 CB MET A1010 7.551 29.498 -0.939 1.00 0.00 C ATOM 1440 CG MET A1010 8.287 29.035 0.308 1.00 0.00 C ATOM 1441 SD MET A1010 10.063 28.874 0.044 1.00 0.00 S ATOM 1442 CE MET A1010 10.589 28.330 1.667 1.00 0.00 C ATOM 0 H MET A1010 5.250 27.763 -1.448 1.00 0.00 H new ATOM 0 HA MET A1010 5.810 30.179 0.127 1.00 0.00 H new ATOM 0 HB2 MET A1010 7.768 28.806 -1.753 1.00 0.00 H new ATOM 0 HB3 MET A1010 7.941 30.472 -1.236 1.00 0.00 H new ATOM 0 HG2 MET A1010 8.106 29.743 1.116 1.00 0.00 H new ATOM 0 HG3 MET A1010 7.882 28.075 0.629 1.00 0.00 H new ATOM 0 HE1 MET A1010 11.669 28.184 1.670 1.00 0.00 H new ATOM 0 HE2 MET A1010 10.323 29.084 2.408 1.00 0.00 H new ATOM 0 HE3 MET A1010 10.096 27.390 1.913 1.00 0.00 H new ATOM 1452 N THR A1011 6.169 30.381 -3.080 1.00 0.00 N ATOM 1453 CA THR A1011 5.679 30.974 -4.321 1.00 0.00 C ATOM 1454 C THR A1011 4.860 29.932 -5.074 1.00 0.00 C ATOM 1455 O THR A1011 5.327 28.799 -5.232 1.00 0.00 O ATOM 1456 CB THR A1011 6.852 31.455 -5.193 1.00 0.00 C ATOM 1457 OG1 THR A1011 7.765 32.213 -4.387 1.00 0.00 O ATOM 1458 CG2 THR A1011 6.363 32.315 -6.347 1.00 0.00 C ATOM 0 H THR A1011 7.116 30.008 -3.141 1.00 0.00 H new ATOM 0 HA THR A1011 5.056 31.837 -4.087 1.00 0.00 H new ATOM 0 HB THR A1011 7.353 30.580 -5.607 1.00 0.00 H new ATOM 0 HG1 THR A1011 8.514 32.519 -4.940 1.00 0.00 H new ATOM 0 HG21 THR A1011 7.214 32.640 -6.945 1.00 0.00 H new ATOM 0 HG22 THR A1011 5.682 31.735 -6.970 1.00 0.00 H new ATOM 0 HG23 THR A1011 5.841 33.188 -5.955 1.00 0.00 H new ATOM 1466 N SER A1012 3.658 30.311 -5.545 1.00 0.00 N ATOM 1467 CA SER A1012 2.640 29.329 -5.938 1.00 0.00 C ATOM 1468 C SER A1012 2.648 28.242 -4.876 1.00 0.00 C ATOM 1469 O SER A1012 2.861 27.059 -5.156 1.00 0.00 O ATOM 1470 CB SER A1012 2.891 28.770 -7.354 1.00 0.00 C ATOM 1471 OG SER A1012 4.218 28.301 -7.521 1.00 0.00 O ATOM 0 H SER A1012 3.372 31.283 -5.661 1.00 0.00 H new ATOM 0 HA SER A1012 1.656 29.796 -5.994 1.00 0.00 H new ATOM 0 HB2 SER A1012 2.193 27.956 -7.549 1.00 0.00 H new ATOM 0 HB3 SER A1012 2.688 29.548 -8.090 1.00 0.00 H new ATOM 0 HG SER A1012 4.624 28.149 -6.642 1.00 0.00 H new ATOM 1477 N LEU A1013 2.372 28.694 -3.652 1.00 0.00 N ATOM 1478 CA LEU A1013 2.909 28.085 -2.442 1.00 0.00 C ATOM 1479 C LEU A1013 2.848 26.569 -2.415 1.00 0.00 C ATOM 1480 O LEU A1013 3.880 25.922 -2.271 1.00 0.00 O ATOM 1481 CB LEU A1013 2.204 28.676 -1.210 1.00 0.00 C ATOM 1482 CG LEU A1013 0.676 28.770 -1.286 1.00 0.00 C ATOM 1483 CD1 LEU A1013 0.019 27.666 -0.470 1.00 0.00 C ATOM 1484 CD2 LEU A1013 0.206 30.135 -0.810 1.00 0.00 C ATOM 0 H LEU A1013 1.767 29.496 -3.475 1.00 0.00 H new ATOM 0 HA LEU A1013 3.972 28.326 -2.428 1.00 0.00 H new ATOM 0 HB2 LEU A1013 2.467 28.072 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A1013 2.601 29.676 -1.035 1.00 0.00 H new ATOM 0 HG LEU A1013 0.380 28.641 -2.327 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -1.065 27.757 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU A1013 0.328 26.695 -0.856 1.00 0.00 H new ATOM 0 HD13 LEU A1013 0.322 27.755 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -0.881 30.187 -0.870 1.00 0.00 H new ATOM 0 HD22 LEU A1013 0.520 30.288 0.222 1.00 0.00 H new ATOM 0 HD23 LEU A1013 0.641 30.910 -1.441 1.00 0.00 H new ATOM 1496 N GLN A1014 1.681 25.994 -2.541 1.00 0.00 N ATOM 1497 CA GLN A1014 1.580 24.555 -2.487 1.00 0.00 C ATOM 1498 C GLN A1014 1.757 23.887 -3.848 1.00 0.00 C ATOM 1499 O GLN A1014 2.453 22.884 -3.978 1.00 0.00 O ATOM 1500 CB GLN A1014 0.261 24.123 -1.859 1.00 0.00 C ATOM 1501 CG GLN A1014 0.428 23.536 -0.469 1.00 0.00 C ATOM 1502 CD GLN A1014 1.414 22.394 -0.430 1.00 0.00 C ATOM 1503 OE1 GLN A1014 2.013 22.132 0.602 1.00 0.00 O ATOM 1504 NE2 GLN A1014 1.598 21.714 -1.554 1.00 0.00 N ATOM 0 H GLN A1014 0.799 26.488 -2.680 1.00 0.00 H new ATOM 0 HA GLN A1014 2.406 24.220 -1.859 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -0.408 24.982 -1.806 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -0.217 23.385 -2.503 1.00 0.00 H new ATOM 0 HG2 GLN A1014 0.759 24.319 0.213 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -0.540 23.187 -0.109 1.00 0.00 H new ATOM 0 HE21 GLN A1014 1.077 21.966 -2.394 1.00 0.00 H new ATOM 0 HE22 GLN A1014 2.261 20.939 -1.579 1.00 0.00 H new ATOM 1513 N GLN A1015 1.134 24.471 -4.853 1.00 0.00 N ATOM 1514 CA GLN A1015 0.775 23.749 -6.072 1.00 0.00 C ATOM 1515 C GLN A1015 1.962 23.147 -6.822 1.00 0.00 C ATOM 1516 O GLN A1015 1.898 21.989 -7.223 1.00 0.00 O ATOM 1517 CB GLN A1015 -0.033 24.644 -6.993 1.00 0.00 C ATOM 1518 CG GLN A1015 -1.364 25.063 -6.393 1.00 0.00 C ATOM 1519 CD GLN A1015 -2.244 25.785 -7.386 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -3.030 25.162 -8.096 1.00 0.00 O ATOM 1521 NE2 GLN A1015 -2.118 27.100 -7.440 1.00 0.00 N ATOM 0 H GLN A1015 0.861 25.454 -4.854 1.00 0.00 H new ATOM 0 HA GLN A1015 0.172 22.901 -5.747 1.00 0.00 H new ATOM 0 HB2 GLN A1015 0.550 25.534 -7.229 1.00 0.00 H new ATOM 0 HB3 GLN A1015 -0.212 24.122 -7.933 1.00 0.00 H new ATOM 0 HG2 GLN A1015 -1.886 24.180 -6.024 1.00 0.00 H new ATOM 0 HG3 GLN A1015 -1.184 25.710 -5.534 1.00 0.00 H new ATOM 0 HE21 GLN A1015 -1.452 27.574 -6.830 1.00 0.00 H new ATOM 0 HE22 GLN A1015 -2.687 27.641 -8.091 1.00 0.00 H new ATOM 1530 N GLU A1016 3.013 23.925 -7.048 1.00 0.00 N ATOM 1531 CA GLU A1016 4.199 23.406 -7.741 1.00 0.00 C ATOM 1532 C GLU A1016 4.687 22.099 -7.107 1.00 0.00 C ATOM 1533 O GLU A1016 4.845 21.075 -7.789 1.00 0.00 O ATOM 1534 CB GLU A1016 5.327 24.436 -7.748 1.00 0.00 C ATOM 1535 CG GLU A1016 6.571 23.954 -8.478 1.00 0.00 C ATOM 1536 CD GLU A1016 6.275 23.474 -9.888 1.00 0.00 C ATOM 1537 OE1 GLU A1016 5.575 24.193 -10.634 1.00 0.00 O ATOM 1538 OE2 GLU A1016 6.726 22.367 -10.250 1.00 0.00 O ATOM 0 H GLU A1016 3.075 24.904 -6.769 1.00 0.00 H new ATOM 0 HA GLU A1016 3.908 23.202 -8.771 1.00 0.00 H new ATOM 0 HB2 GLU A1016 4.970 25.353 -8.217 1.00 0.00 H new ATOM 0 HB3 GLU A1016 5.590 24.685 -6.720 1.00 0.00 H new ATOM 0 HG2 GLU A1016 7.299 24.764 -8.520 1.00 0.00 H new ATOM 0 HG3 GLU A1016 7.028 23.143 -7.911 1.00 0.00 H new ATOM 1545 N TYR A1017 4.885 22.117 -5.800 1.00 0.00 N ATOM 1546 CA TYR A1017 5.303 20.918 -5.093 1.00 0.00 C ATOM 1547 C TYR A1017 4.160 19.914 -5.005 1.00 0.00 C ATOM 1548 O TYR A1017 4.392 18.719 -4.884 1.00 0.00 O ATOM 1549 CB TYR A1017 5.823 21.250 -3.699 1.00 0.00 C ATOM 1550 CG TYR A1017 7.317 21.496 -3.644 1.00 0.00 C ATOM 1551 CD1 TYR A1017 7.991 22.030 -4.735 1.00 0.00 C ATOM 1552 CD2 TYR A1017 8.058 21.183 -2.504 1.00 0.00 C ATOM 1553 CE1 TYR A1017 9.354 22.250 -4.695 1.00 0.00 C ATOM 1554 CE2 TYR A1017 9.421 21.405 -2.459 1.00 0.00 C ATOM 1555 CZ TYR A1017 10.064 21.933 -3.557 1.00 0.00 C ATOM 1556 OH TYR A1017 11.420 22.147 -3.518 1.00 0.00 O ATOM 0 H TYR A1017 4.764 22.941 -5.211 1.00 0.00 H new ATOM 0 HA TYR A1017 6.118 20.469 -5.661 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.305 22.135 -3.330 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.574 20.431 -3.024 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.440 22.277 -5.630 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.559 20.761 -1.644 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.861 22.669 -5.552 1.00 0.00 H new ATOM 0 HE2 TYR A1017 9.980 21.166 -1.567 1.00 0.00 H new ATOM 0 HH TYR A1017 11.770 21.872 -2.645 1.00 0.00 H new ATOM 1566 N LYS A1018 2.927 20.406 -5.079 1.00 0.00 N ATOM 1567 CA LYS A1018 1.752 19.541 -5.049 1.00 0.00 C ATOM 1568 C LYS A1018 1.679 18.693 -6.317 1.00 0.00 C ATOM 1569 O LYS A1018 1.169 17.578 -6.295 1.00 0.00 O ATOM 1570 CB LYS A1018 0.470 20.365 -4.912 1.00 0.00 C ATOM 1571 CG LYS A1018 -0.787 19.517 -4.810 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.928 20.117 -5.611 1.00 0.00 C ATOM 1573 CE LYS A1018 -3.142 19.202 -5.601 1.00 0.00 C ATOM 1574 NZ LYS A1018 -4.190 19.650 -6.554 1.00 0.00 N ATOM 0 H LYS A1018 2.715 21.400 -5.160 1.00 0.00 H new ATOM 0 HA LYS A1018 1.844 18.886 -4.183 1.00 0.00 H new ATOM 0 HB2 LYS A1018 0.546 20.996 -4.027 1.00 0.00 H new ATOM 0 HB3 LYS A1018 0.381 21.030 -5.771 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -0.578 18.510 -5.170 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -1.083 19.427 -3.765 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -2.197 21.088 -5.196 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -1.605 20.288 -6.638 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -2.833 18.188 -5.854 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -3.560 19.166 -4.595 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -4.998 18.997 -6.513 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -4.505 20.608 -6.298 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -3.801 19.660 -7.518 1.00 0.00 H new ATOM 1588 N LYS A1019 2.173 19.233 -7.426 1.00 0.00 N ATOM 1589 CA LYS A1019 2.249 18.471 -8.670 1.00 0.00 C ATOM 1590 C LYS A1019 3.151 17.267 -8.457 1.00 0.00 C ATOM 1591 O LYS A1019 2.752 16.118 -8.667 1.00 0.00 O ATOM 1592 CB LYS A1019 2.829 19.331 -9.798 1.00 0.00 C ATOM 1593 CG LYS A1019 2.115 20.655 -10.009 1.00 0.00 C ATOM 1594 CD LYS A1019 2.915 21.560 -10.931 1.00 0.00 C ATOM 1595 CE LYS A1019 2.313 22.952 -11.017 1.00 0.00 C ATOM 1596 NZ LYS A1019 3.148 23.865 -11.845 1.00 0.00 N ATOM 0 H LYS A1019 2.525 20.188 -7.491 1.00 0.00 H new ATOM 0 HA LYS A1019 1.244 18.154 -8.949 1.00 0.00 H new ATOM 0 HB2 LYS A1019 3.879 19.529 -9.584 1.00 0.00 H new ATOM 0 HB3 LYS A1019 2.795 18.762 -10.727 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.127 20.477 -10.435 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.964 21.149 -9.049 1.00 0.00 H new ATOM 0 HD2 LYS A1019 3.941 21.630 -10.571 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.956 21.119 -11.927 1.00 0.00 H new ATOM 0 HE2 LYS A1019 1.311 22.889 -11.443 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.208 23.365 -10.014 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 2.812 24.842 -11.730 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.140 23.802 -11.539 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 3.076 23.590 -12.845 1.00 0.00 H new ATOM 1610 N GLN A1020 4.380 17.565 -8.057 1.00 0.00 N ATOM 1611 CA GLN A1020 5.346 16.549 -7.645 1.00 0.00 C ATOM 1612 C GLN A1020 4.735 15.598 -6.608 1.00 0.00 C ATOM 1613 O GLN A1020 4.869 14.379 -6.712 1.00 0.00 O ATOM 1614 CB GLN A1020 6.588 17.243 -7.082 1.00 0.00 C ATOM 1615 CG GLN A1020 7.127 18.330 -8.003 1.00 0.00 C ATOM 1616 CD GLN A1020 8.242 19.151 -7.382 1.00 0.00 C ATOM 1617 OE1 GLN A1020 9.022 18.654 -6.571 1.00 0.00 O ATOM 1618 NE2 GLN A1020 8.316 20.423 -7.756 1.00 0.00 N ATOM 0 H GLN A1020 4.738 18.519 -8.008 1.00 0.00 H new ATOM 0 HA GLN A1020 5.627 15.949 -8.510 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.346 17.681 -6.114 1.00 0.00 H new ATOM 0 HB3 GLN A1020 7.367 16.500 -6.910 1.00 0.00 H new ATOM 0 HG2 GLN A1020 7.493 17.869 -8.920 1.00 0.00 H new ATOM 0 HG3 GLN A1020 6.310 18.995 -8.284 1.00 0.00 H new ATOM 0 HE21 GLN A1020 7.649 20.796 -8.432 1.00 0.00 H new ATOM 0 HE22 GLN A1020 9.040 21.027 -7.368 1.00 0.00 H new ATOM 1627 N MET A1021 4.052 16.179 -5.627 1.00 0.00 N ATOM 1628 CA MET A1021 3.348 15.435 -4.581 1.00 0.00 C ATOM 1629 C MET A1021 2.330 14.449 -5.164 1.00 0.00 C ATOM 1630 O MET A1021 2.366 13.257 -4.860 1.00 0.00 O ATOM 1631 CB MET A1021 2.649 16.441 -3.654 1.00 0.00 C ATOM 1632 CG MET A1021 1.461 15.893 -2.880 1.00 0.00 C ATOM 1633 SD MET A1021 0.525 17.201 -2.062 1.00 0.00 S ATOM 1634 CE MET A1021 -0.874 16.276 -1.435 1.00 0.00 C ATOM 0 H MET A1021 3.969 17.191 -5.532 1.00 0.00 H new ATOM 0 HA MET A1021 4.074 14.844 -4.022 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.381 16.823 -2.942 1.00 0.00 H new ATOM 0 HB3 MET A1021 2.313 17.288 -4.252 1.00 0.00 H new ATOM 0 HG2 MET A1021 0.805 15.349 -3.560 1.00 0.00 H new ATOM 0 HG3 MET A1021 1.812 15.178 -2.135 1.00 0.00 H new ATOM 0 HE1 MET A1021 -1.796 16.807 -1.670 1.00 0.00 H new ATOM 0 HE2 MET A1021 -0.895 15.290 -1.898 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.783 16.167 -0.354 1.00 0.00 H new ATOM 1644 N LEU A1022 1.436 14.956 -6.004 1.00 0.00 N ATOM 1645 CA LEU A1022 0.349 14.155 -6.563 1.00 0.00 C ATOM 1646 C LEU A1022 0.902 13.036 -7.442 1.00 0.00 C ATOM 1647 O LEU A1022 0.476 11.886 -7.339 1.00 0.00 O ATOM 1648 CB LEU A1022 -0.596 15.059 -7.373 1.00 0.00 C ATOM 1649 CG LEU A1022 -2.046 14.568 -7.514 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -2.918 15.676 -8.078 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -2.135 13.339 -8.407 1.00 0.00 C ATOM 0 H LEU A1022 1.442 15.927 -6.317 1.00 0.00 H new ATOM 0 HA LEU A1022 -0.209 13.698 -5.746 1.00 0.00 H new ATOM 0 HB2 LEU A1022 -0.611 16.044 -6.907 1.00 0.00 H new ATOM 0 HB3 LEU A1022 -0.178 15.185 -8.372 1.00 0.00 H new ATOM 0 HG LEU A1022 -2.402 14.291 -6.521 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -3.943 15.319 -8.174 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -2.894 16.535 -7.407 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -2.543 15.971 -9.058 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -3.174 13.020 -8.484 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -1.756 13.582 -9.399 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -1.539 12.534 -7.978 1.00 0.00 H new ATOM 1663 N THR A1023 1.863 13.380 -8.289 1.00 0.00 N ATOM 1664 CA THR A1023 2.471 12.414 -9.195 1.00 0.00 C ATOM 1665 C THR A1023 3.151 11.289 -8.407 1.00 0.00 C ATOM 1666 O THR A1023 3.164 10.128 -8.827 1.00 0.00 O ATOM 1667 CB THR A1023 3.501 13.106 -10.112 1.00 0.00 C ATOM 1668 OG1 THR A1023 2.920 14.288 -10.687 1.00 0.00 O ATOM 1669 CG2 THR A1023 3.963 12.176 -11.225 1.00 0.00 C ATOM 0 H THR A1023 2.240 14.325 -8.368 1.00 0.00 H new ATOM 0 HA THR A1023 1.681 11.985 -9.811 1.00 0.00 H new ATOM 0 HB THR A1023 4.367 13.373 -9.507 1.00 0.00 H new ATOM 0 HG1 THR A1023 2.938 15.015 -10.030 1.00 0.00 H new ATOM 0 HG21 THR A1023 4.688 12.693 -11.854 1.00 0.00 H new ATOM 0 HG22 THR A1023 4.426 11.290 -10.790 1.00 0.00 H new ATOM 0 HG23 THR A1023 3.106 11.878 -11.829 1.00 0.00 H new ATOM 1677 N ALA A1024 3.670 11.640 -7.238 1.00 0.00 N ATOM 1678 CA ALA A1024 4.348 10.680 -6.383 1.00 0.00 C ATOM 1679 C ALA A1024 3.325 9.828 -5.644 1.00 0.00 C ATOM 1680 O ALA A1024 3.457 8.608 -5.558 1.00 0.00 O ATOM 1681 CB ALA A1024 5.258 11.394 -5.397 1.00 0.00 C ATOM 0 H ALA A1024 3.633 12.587 -6.861 1.00 0.00 H new ATOM 0 HA ALA A1024 4.963 10.030 -7.005 1.00 0.00 H new ATOM 0 HB1 ALA A1024 5.757 10.660 -4.765 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.005 11.971 -5.943 1.00 0.00 H new ATOM 0 HB3 ALA A1024 4.665 12.065 -4.775 1.00 0.00 H new ATOM 1687 N ALA A1025 2.287 10.484 -5.135 1.00 0.00 N ATOM 1688 CA ALA A1025 1.213 9.802 -4.421 1.00 0.00 C ATOM 1689 C ALA A1025 0.545 8.767 -5.307 1.00 0.00 C ATOM 1690 O ALA A1025 0.061 7.741 -4.829 1.00 0.00 O ATOM 1691 CB ALA A1025 0.183 10.804 -3.924 1.00 0.00 C ATOM 0 H ALA A1025 2.167 11.494 -5.205 1.00 0.00 H new ATOM 0 HA ALA A1025 1.651 9.291 -3.563 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.611 10.277 -3.394 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.662 11.513 -3.249 1.00 0.00 H new ATOM 0 HB3 ALA A1025 -0.242 11.341 -4.772 1.00 0.00 H new ATOM 1697 N HIS A1026 0.515 9.044 -6.601 1.00 0.00 N ATOM 1698 CA HIS A1026 -0.072 8.119 -7.551 1.00 0.00 C ATOM 1699 C HIS A1026 0.796 6.879 -7.690 1.00 0.00 C ATOM 1700 O HIS A1026 0.279 5.770 -7.803 1.00 0.00 O ATOM 1701 CB HIS A1026 -0.274 8.797 -8.911 1.00 0.00 C ATOM 1702 CG HIS A1026 -0.895 7.912 -9.952 1.00 0.00 C ATOM 1703 ND1 HIS A1026 -0.203 7.438 -11.046 1.00 0.00 N ATOM 1704 CD2 HIS A1026 -2.156 7.432 -10.072 1.00 0.00 C ATOM 1705 CE1 HIS A1026 -1.012 6.709 -11.793 1.00 0.00 C ATOM 1706 NE2 HIS A1026 -2.202 6.688 -11.224 1.00 0.00 N ATOM 0 H HIS A1026 0.889 9.898 -7.014 1.00 0.00 H new ATOM 0 HA HIS A1026 -1.049 7.813 -7.177 1.00 0.00 H new ATOM 0 HB2 HIS A1026 -0.903 9.677 -8.776 1.00 0.00 H new ATOM 0 HB3 HIS A1026 0.691 9.148 -9.277 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -2.974 7.603 -9.388 1.00 0.00 H new ATOM 0 HE1 HIS A1026 -0.744 6.213 -12.715 1.00 0.00 H new ATOM 0 HE2 HIS A1026 -3.022 6.199 -11.582 1.00 0.00 H new ATOM 1715 N ALA A1027 2.109 7.068 -7.673 1.00 0.00 N ATOM 1716 CA ALA A1027 3.033 5.943 -7.684 1.00 0.00 C ATOM 1717 C ALA A1027 2.792 5.066 -6.460 1.00 0.00 C ATOM 1718 O ALA A1027 2.702 3.848 -6.574 1.00 0.00 O ATOM 1719 CB ALA A1027 4.475 6.432 -7.719 1.00 0.00 C ATOM 0 H ALA A1027 2.556 7.985 -7.652 1.00 0.00 H new ATOM 0 HA ALA A1027 2.857 5.351 -8.582 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.149 5.576 -7.727 1.00 0.00 H new ATOM 0 HB2 ALA A1027 4.635 7.028 -8.617 1.00 0.00 H new ATOM 0 HB3 ALA A1027 4.674 7.042 -6.838 1.00 0.00 H new ATOM 1725 N LEU A1028 2.625 5.713 -5.309 1.00 0.00 N ATOM 1726 CA LEU A1028 2.376 5.013 -4.052 1.00 0.00 C ATOM 1727 C LEU A1028 1.077 4.226 -4.131 1.00 0.00 C ATOM 1728 O LEU A1028 1.038 3.024 -3.887 1.00 0.00 O ATOM 1729 CB LEU A1028 2.291 6.003 -2.883 1.00 0.00 C ATOM 1730 CG LEU A1028 1.873 5.381 -1.543 1.00 0.00 C ATOM 1731 CD1 LEU A1028 2.784 5.840 -0.428 1.00 0.00 C ATOM 1732 CD2 LEU A1028 0.429 5.737 -1.216 1.00 0.00 C ATOM 0 H LEU A1028 2.658 6.729 -5.221 1.00 0.00 H new ATOM 0 HA LEU A1028 3.208 4.329 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.263 6.481 -2.758 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.580 6.788 -3.141 1.00 0.00 H new ATOM 0 HG LEU A1028 1.957 4.298 -1.635 1.00 0.00 H new ATOM 0 HD11 LEU A1028 2.467 5.386 0.511 1.00 0.00 H new ATOM 0 HD12 LEU A1028 3.809 5.540 -0.649 1.00 0.00 H new ATOM 0 HD13 LEU A1028 2.734 6.925 -0.341 1.00 0.00 H new ATOM 0 HD21 LEU A1028 0.150 5.288 -0.263 1.00 0.00 H new ATOM 0 HD22 LEU A1028 0.327 6.820 -1.150 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -0.226 5.358 -2.001 1.00 0.00 H new ATOM 1744 N ALA A1029 0.010 4.931 -4.471 1.00 0.00 N ATOM 1745 CA ALA A1029 -1.321 4.342 -4.527 1.00 0.00 C ATOM 1746 C ALA A1029 -1.373 3.138 -5.463 1.00 0.00 C ATOM 1747 O ALA A1029 -2.075 2.160 -5.194 1.00 0.00 O ATOM 1748 CB ALA A1029 -2.339 5.383 -4.961 1.00 0.00 C ATOM 0 H ALA A1029 0.040 5.921 -4.715 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.565 3.992 -3.524 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -3.330 4.930 -4.999 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -2.344 6.207 -4.247 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -2.075 5.760 -5.949 1.00 0.00 H new ATOM 1754 N VAL A1030 -0.640 3.208 -6.563 1.00 0.00 N ATOM 1755 CA VAL A1030 -0.590 2.106 -7.508 1.00 0.00 C ATOM 1756 C VAL A1030 0.274 0.972 -6.965 1.00 0.00 C ATOM 1757 O VAL A1030 -0.065 -0.200 -7.106 1.00 0.00 O ATOM 1758 CB VAL A1030 -0.065 2.566 -8.889 1.00 0.00 C ATOM 1759 CG1 VAL A1030 0.133 1.385 -9.826 1.00 0.00 C ATOM 1760 CG2 VAL A1030 -1.024 3.569 -9.514 1.00 0.00 C ATOM 0 H VAL A1030 -0.073 4.015 -6.822 1.00 0.00 H new ATOM 0 HA VAL A1030 -1.608 1.741 -7.641 1.00 0.00 H new ATOM 0 HB VAL A1030 0.902 3.044 -8.734 1.00 0.00 H new ATOM 0 HG11 VAL A1030 0.502 1.741 -10.788 1.00 0.00 H new ATOM 0 HG12 VAL A1030 0.856 0.694 -9.393 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -0.818 0.872 -9.970 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -0.640 3.883 -10.485 1.00 0.00 H new ATOM 0 HG22 VAL A1030 -2.002 3.106 -9.643 1.00 0.00 H new ATOM 0 HG23 VAL A1030 -1.117 4.438 -8.863 1.00 0.00 H new ATOM 1770 N ASP A1031 1.394 1.322 -6.364 1.00 0.00 N ATOM 1771 CA ASP A1031 2.272 0.324 -5.770 1.00 0.00 C ATOM 1772 C ASP A1031 1.637 -0.368 -4.558 1.00 0.00 C ATOM 1773 O ASP A1031 1.914 -1.546 -4.311 1.00 0.00 O ATOM 1774 CB ASP A1031 3.639 0.924 -5.462 1.00 0.00 C ATOM 1775 CG ASP A1031 4.446 1.105 -6.740 1.00 0.00 C ATOM 1776 OD1 ASP A1031 4.541 0.135 -7.524 1.00 0.00 O ATOM 1777 OD2 ASP A1031 4.979 2.208 -6.984 1.00 0.00 O ATOM 0 H ASP A1031 1.720 2.284 -6.272 1.00 0.00 H new ATOM 0 HA ASP A1031 2.424 -0.466 -6.506 1.00 0.00 H new ATOM 0 HB2 ASP A1031 3.516 1.886 -4.964 1.00 0.00 H new ATOM 0 HB3 ASP A1031 4.180 0.275 -4.773 1.00 0.00 H new ATOM 1782 N ALA A1032 0.763 0.333 -3.826 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.130 -0.325 -2.873 1.00 0.00 C ATOM 1784 C ALA A1032 -0.868 -1.453 -3.587 1.00 0.00 C ATOM 1785 O ALA A1032 -0.863 -2.600 -3.151 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.130 0.680 -2.327 1.00 0.00 C ATOM 0 H ALA A1032 0.657 1.346 -3.876 1.00 0.00 H new ATOM 0 HA ALA A1032 0.450 -0.731 -2.044 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -1.793 0.185 -1.618 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.597 1.487 -1.824 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.718 1.090 -3.148 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.457 -1.106 -4.721 1.00 0.00 N ATOM 1793 CA LYS A1033 -2.200 -2.061 -5.536 1.00 0.00 C ATOM 1794 C LYS A1033 -1.308 -3.175 -6.099 1.00 0.00 C ATOM 1795 O LYS A1033 -1.815 -4.220 -6.513 1.00 0.00 O ATOM 1796 CB LYS A1033 -2.941 -1.347 -6.672 1.00 0.00 C ATOM 1797 CG LYS A1033 -4.041 -0.417 -6.182 1.00 0.00 C ATOM 1798 CD LYS A1033 -4.896 0.117 -7.323 1.00 0.00 C ATOM 1799 CE LYS A1033 -4.125 1.073 -8.219 1.00 0.00 C ATOM 1800 NZ LYS A1033 -4.984 1.624 -9.299 1.00 0.00 N ATOM 0 H LYS A1033 -1.435 -0.160 -5.103 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.928 -2.534 -4.877 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -2.224 -0.773 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -3.375 -2.092 -7.338 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -4.676 -0.950 -5.474 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -3.594 0.419 -5.644 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -5.267 -0.717 -7.918 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -5.767 0.628 -6.914 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -3.724 1.890 -7.620 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -3.274 0.553 -8.660 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 -4.425 2.272 -9.890 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -5.347 0.845 -9.885 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -5.782 2.141 -8.878 1.00 0.00 H new ATOM 1814 N ASN A1034 0.013 -2.984 -6.110 1.00 0.00 N ATOM 1815 CA ASN A1034 0.899 -4.021 -6.631 1.00 0.00 C ATOM 1816 C ASN A1034 1.020 -5.155 -5.626 1.00 0.00 C ATOM 1817 O ASN A1034 1.027 -6.327 -5.991 1.00 0.00 O ATOM 1818 CB ASN A1034 2.287 -3.465 -6.963 1.00 0.00 C ATOM 1819 CG ASN A1034 3.170 -4.499 -7.644 1.00 0.00 C ATOM 1820 OD1 ASN A1034 2.688 -5.378 -8.358 1.00 0.00 O ATOM 1821 ND2 ASN A1034 4.468 -4.405 -7.425 1.00 0.00 N ATOM 0 H ASN A1034 0.481 -2.143 -5.773 1.00 0.00 H new ATOM 0 HA ASN A1034 0.462 -4.399 -7.555 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.183 -2.595 -7.611 1.00 0.00 H new ATOM 0 HB3 ASN A1034 2.769 -3.124 -6.047 1.00 0.00 H new ATOM 0 HD21 ASN A1034 5.107 -5.074 -7.854 1.00 0.00 H new ATOM 0 HD22 ASN A1034 4.832 -3.663 -6.827 1.00 0.00 H new ATOM 1828 N LEU A1035 1.047 -4.797 -4.347 1.00 0.00 N ATOM 1829 CA LEU A1035 1.170 -5.784 -3.283 1.00 0.00 C ATOM 1830 C LEU A1035 -0.168 -6.500 -3.108 1.00 0.00 C ATOM 1831 O LEU A1035 -0.239 -7.598 -2.572 1.00 0.00 O ATOM 1832 CB LEU A1035 1.609 -5.113 -1.978 1.00 0.00 C ATOM 1833 CG LEU A1035 1.896 -6.063 -0.817 1.00 0.00 C ATOM 1834 CD1 LEU A1035 3.154 -6.873 -1.070 1.00 0.00 C ATOM 1835 CD2 LEU A1035 2.028 -5.289 0.470 1.00 0.00 C ATOM 0 H LEU A1035 0.985 -3.832 -4.023 1.00 0.00 H new ATOM 0 HA LEU A1035 1.932 -6.516 -3.550 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.506 -4.526 -2.175 1.00 0.00 H new ATOM 0 HB3 LEU A1035 0.832 -4.414 -1.669 1.00 0.00 H new ATOM 0 HG LEU A1035 1.058 -6.755 -0.733 1.00 0.00 H new ATOM 0 HD11 LEU A1035 3.333 -7.540 -0.227 1.00 0.00 H new ATOM 0 HD12 LEU A1035 3.031 -7.462 -1.979 1.00 0.00 H new ATOM 0 HD13 LEU A1035 4.003 -6.200 -1.186 1.00 0.00 H new ATOM 0 HD21 LEU A1035 2.232 -5.978 1.290 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.847 -4.575 0.383 1.00 0.00 H new ATOM 0 HD23 LEU A1035 1.100 -4.753 0.669 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.217 -5.850 -3.588 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.559 -6.409 -3.626 1.00 0.00 C ATOM 1849 C LEU A1036 -2.541 -7.698 -4.418 1.00 0.00 C ATOM 1850 O LEU A1036 -2.978 -8.738 -3.951 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.500 -5.397 -4.289 1.00 0.00 C ATOM 1852 CG LEU A1036 -4.965 -5.805 -4.382 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -5.580 -5.843 -3.004 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -5.729 -4.847 -5.282 1.00 0.00 C ATOM 0 H LEU A1036 -1.159 -4.905 -3.968 1.00 0.00 H new ATOM 0 HA LEU A1036 -2.908 -6.619 -2.615 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -3.439 -4.459 -3.737 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -3.135 -5.198 -5.296 1.00 0.00 H new ATOM 0 HG LEU A1036 -5.024 -6.802 -4.818 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -6.627 -6.136 -3.081 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -5.046 -6.565 -2.387 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -5.512 -4.855 -2.548 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -6.773 -5.154 -5.337 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -5.668 -3.838 -4.874 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -5.294 -4.861 -6.281 1.00 0.00 H new ATOM 1866 N ASP A1037 -1.972 -7.601 -5.601 1.00 0.00 N ATOM 1867 CA ASP A1037 -1.830 -8.743 -6.493 1.00 0.00 C ATOM 1868 C ASP A1037 -0.778 -9.696 -5.944 1.00 0.00 C ATOM 1869 O ASP A1037 -0.858 -10.902 -6.134 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.449 -8.294 -7.908 1.00 0.00 C ATOM 1871 CG ASP A1037 -2.635 -7.771 -8.700 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -3.347 -6.879 -8.200 1.00 0.00 O ATOM 1873 OD2 ASP A1037 -2.858 -8.243 -9.834 1.00 0.00 O ATOM 0 H ASP A1037 -1.594 -6.731 -5.975 1.00 0.00 H new ATOM 0 HA ASP A1037 -2.790 -9.257 -6.550 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.689 -7.515 -7.845 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.003 -9.133 -8.442 1.00 0.00 H new ATOM 1878 N VAL A1038 0.204 -9.127 -5.262 1.00 0.00 N ATOM 1879 CA VAL A1038 1.268 -9.889 -4.611 1.00 0.00 C ATOM 1880 C VAL A1038 0.720 -10.847 -3.547 1.00 0.00 C ATOM 1881 O VAL A1038 0.874 -12.058 -3.648 1.00 0.00 O ATOM 1882 CB VAL A1038 2.288 -8.927 -3.963 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.147 -9.644 -2.936 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.157 -8.288 -5.032 1.00 0.00 C ATOM 0 H VAL A1038 0.289 -8.118 -5.142 1.00 0.00 H new ATOM 0 HA VAL A1038 1.757 -10.487 -5.380 1.00 0.00 H new ATOM 0 HB VAL A1038 1.734 -8.145 -3.444 1.00 0.00 H new ATOM 0 HG11 VAL A1038 3.855 -8.940 -2.498 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.511 -10.054 -2.152 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.693 -10.454 -3.420 1.00 0.00 H new ATOM 0 HG21 VAL A1038 3.872 -7.612 -4.563 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.695 -9.065 -5.576 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.529 -7.728 -5.725 1.00 0.00 H new ATOM 1894 N ILE A1039 0.097 -10.286 -2.526 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.431 -11.052 -1.414 1.00 0.00 C ATOM 1896 C ILE A1039 -1.744 -11.735 -1.784 1.00 0.00 C ATOM 1897 O ILE A1039 -2.120 -12.728 -1.168 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.648 -10.194 -0.155 1.00 0.00 C ATOM 1899 CG1 ILE A1039 0.348 -9.049 -0.079 1.00 0.00 C ATOM 1900 CG2 ILE A1039 -0.476 -11.054 1.075 1.00 0.00 C ATOM 1901 CD1 ILE A1039 0.141 -8.182 1.137 1.00 0.00 C ATOM 0 H ILE A1039 -0.057 -9.281 -2.446 1.00 0.00 H new ATOM 0 HA ILE A1039 0.323 -11.806 -1.188 1.00 0.00 H new ATOM 0 HB ILE A1039 -1.655 -9.781 -0.206 1.00 0.00 H new ATOM 0 HG12 ILE A1039 1.360 -9.453 -0.065 1.00 0.00 H new ATOM 0 HG13 ILE A1039 0.262 -8.437 -0.977 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -0.629 -10.447 1.967 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -1.205 -11.864 1.057 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.531 -11.472 1.089 1.00 0.00 H new ATOM 0 HD11 ILE A1039 0.879 -7.380 1.142 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.861 -7.753 1.112 1.00 0.00 H new ATOM 0 HD13 ILE A1039 0.255 -8.785 2.038 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.469 -11.200 -2.758 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.554 -11.978 -3.346 1.00 0.00 C ATOM 1915 C ASP A1040 -2.972 -13.225 -3.982 1.00 0.00 C ATOM 1916 O ASP A1040 -3.548 -14.301 -3.914 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.359 -11.204 -4.386 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.353 -12.099 -5.099 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -6.202 -12.709 -4.419 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -5.266 -12.221 -6.338 1.00 0.00 O ATOM 0 H ASP A1040 -2.335 -10.267 -3.147 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.246 -12.229 -2.542 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -4.889 -10.384 -3.901 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.681 -10.759 -5.114 1.00 0.00 H new ATOM 1925 N GLN A1041 -1.811 -13.089 -4.590 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.101 -14.260 -5.052 1.00 0.00 C ATOM 1927 C GLN A1041 -0.563 -15.036 -3.877 1.00 0.00 C ATOM 1928 O GLN A1041 -0.466 -16.243 -3.961 1.00 0.00 O ATOM 1929 CB GLN A1041 0.030 -13.934 -6.015 1.00 0.00 C ATOM 1930 CG GLN A1041 -0.456 -13.597 -7.413 1.00 0.00 C ATOM 1931 CD GLN A1041 -1.260 -14.722 -8.035 1.00 0.00 C ATOM 1932 OE1 GLN A1041 -2.474 -14.804 -7.854 1.00 0.00 O ATOM 1933 NE2 GLN A1041 -0.595 -15.590 -8.778 1.00 0.00 N ATOM 0 H GLN A1041 -1.348 -12.198 -4.772 1.00 0.00 H new ATOM 0 HA GLN A1041 -1.822 -14.863 -5.603 1.00 0.00 H new ATOM 0 HB2 GLN A1041 0.602 -13.093 -5.623 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.710 -14.784 -6.068 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -1.068 -12.696 -7.374 1.00 0.00 H new ATOM 0 HG3 GLN A1041 0.401 -13.373 -8.048 1.00 0.00 H new ATOM 0 HE21 GLN A1041 0.412 -15.488 -8.904 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -1.089 -16.362 -9.225 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.198 -14.345 -2.793 1.00 0.00 N ATOM 1943 CA ALA A1042 0.158 -15.014 -1.548 1.00 0.00 C ATOM 1944 C ALA A1042 -0.974 -15.940 -1.108 1.00 0.00 C ATOM 1945 O ALA A1042 -0.750 -17.078 -0.715 1.00 0.00 O ATOM 1946 CB ALA A1042 0.466 -14.018 -0.446 1.00 0.00 C ATOM 0 H ALA A1042 -0.143 -13.327 -2.757 1.00 0.00 H new ATOM 0 HA ALA A1042 1.058 -15.600 -1.733 1.00 0.00 H new ATOM 0 HB1 ALA A1042 0.727 -14.554 0.466 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.302 -13.388 -0.748 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.410 -13.395 -0.263 1.00 0.00 H new ATOM 1952 N ARG A1043 -2.188 -15.418 -1.181 1.00 0.00 N ATOM 1953 CA ARG A1043 -3.400 -16.211 -0.988 1.00 0.00 C ATOM 1954 C ARG A1043 -3.332 -17.527 -1.777 1.00 0.00 C ATOM 1955 O ARG A1043 -3.554 -18.604 -1.225 1.00 0.00 O ATOM 1956 CB ARG A1043 -4.625 -15.353 -1.384 1.00 0.00 C ATOM 1957 CG ARG A1043 -5.791 -16.095 -2.034 1.00 0.00 C ATOM 1958 CD ARG A1043 -5.728 -16.034 -3.554 1.00 0.00 C ATOM 1959 NE ARG A1043 -6.917 -16.589 -4.197 1.00 0.00 N ATOM 1960 CZ ARG A1043 -7.223 -16.381 -5.478 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -6.465 -15.583 -6.217 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -8.308 -16.931 -6.007 1.00 0.00 N ATOM 0 H ARG A1043 -2.365 -14.433 -1.376 1.00 0.00 H new ATOM 0 HA ARG A1043 -3.495 -16.491 0.061 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -4.995 -14.852 -0.489 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.290 -14.575 -2.070 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.783 -17.136 -1.712 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -6.732 -15.663 -1.692 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -5.604 -14.997 -3.866 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -4.848 -16.578 -3.898 1.00 0.00 H new ATOM 0 HE ARG A1043 -7.545 -17.165 -3.637 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -5.649 -15.129 -5.805 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -6.697 -15.423 -7.197 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -8.914 -17.517 -5.433 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -8.536 -16.768 -6.988 1.00 0.00 H new ATOM 1976 N LEU A1044 -3.002 -17.441 -3.054 1.00 0.00 N ATOM 1977 CA LEU A1044 -2.880 -18.632 -3.888 1.00 0.00 C ATOM 1978 C LEU A1044 -1.543 -19.335 -3.664 1.00 0.00 C ATOM 1979 O LEU A1044 -1.401 -20.503 -3.981 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.047 -18.265 -5.354 1.00 0.00 C ATOM 1981 CG LEU A1044 -4.099 -19.067 -6.123 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -4.236 -18.535 -7.538 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -3.750 -20.547 -6.147 1.00 0.00 C ATOM 0 H LEU A1044 -2.813 -16.563 -3.538 1.00 0.00 H new ATOM 0 HA LEU A1044 -3.671 -19.325 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -3.305 -17.208 -5.418 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.086 -18.390 -5.853 1.00 0.00 H new ATOM 0 HG LEU A1044 -5.053 -18.953 -5.609 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -4.988 -19.115 -8.074 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -4.540 -17.489 -7.506 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -3.279 -18.619 -8.053 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -4.515 -21.092 -6.700 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -2.784 -20.685 -6.632 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -3.701 -20.926 -5.126 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.562 -18.612 -3.140 1.00 0.00 N ATOM 1996 CA LYS A1045 0.724 -19.197 -2.780 1.00 0.00 C ATOM 1997 C LYS A1045 0.523 -20.182 -1.658 1.00 0.00 C ATOM 1998 O LYS A1045 1.124 -21.252 -1.632 1.00 0.00 O ATOM 1999 CB LYS A1045 1.715 -18.124 -2.324 1.00 0.00 C ATOM 2000 CG LYS A1045 2.190 -17.199 -3.425 1.00 0.00 C ATOM 2001 CD LYS A1045 2.829 -17.961 -4.577 1.00 0.00 C ATOM 2002 CE LYS A1045 3.033 -17.072 -5.793 1.00 0.00 C ATOM 2003 NZ LYS A1045 1.756 -16.791 -6.506 1.00 0.00 N ATOM 0 H LYS A1045 -0.633 -17.612 -2.953 1.00 0.00 H new ATOM 0 HA LYS A1045 1.131 -19.694 -3.661 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.249 -17.526 -1.541 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.581 -18.613 -1.879 1.00 0.00 H new ATOM 0 HG2 LYS A1045 1.347 -16.618 -3.799 1.00 0.00 H new ATOM 0 HG3 LYS A1045 2.910 -16.490 -3.017 1.00 0.00 H new ATOM 0 HD2 LYS A1045 3.789 -18.367 -4.257 1.00 0.00 H new ATOM 0 HD3 LYS A1045 2.199 -18.808 -4.847 1.00 0.00 H new ATOM 0 HE2 LYS A1045 3.487 -16.132 -5.481 1.00 0.00 H new ATOM 0 HE3 LYS A1045 3.732 -17.552 -6.478 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 1.857 -15.924 -7.071 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 1.526 -17.588 -7.133 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 0.992 -16.665 -5.812 1.00 0.00 H new ATOM 2017 N MET A1046 -0.331 -19.800 -0.729 1.00 0.00 N ATOM 2018 CA MET A1046 -0.665 -20.662 0.383 1.00 0.00 C ATOM 2019 C MET A1046 -1.289 -21.948 -0.143 1.00 0.00 C ATOM 2020 O MET A1046 -0.939 -23.050 0.290 1.00 0.00 O ATOM 2021 CB MET A1046 -1.611 -19.936 1.336 1.00 0.00 C ATOM 2022 CG MET A1046 -1.897 -20.707 2.608 1.00 0.00 C ATOM 2023 SD MET A1046 -3.181 -21.960 2.399 1.00 0.00 S ATOM 2024 CE MET A1046 -3.232 -22.670 4.038 1.00 0.00 C ATOM 0 H MET A1046 -0.806 -18.897 -0.724 1.00 0.00 H new ATOM 0 HA MET A1046 0.238 -20.919 0.937 1.00 0.00 H new ATOM 0 HB2 MET A1046 -1.180 -18.969 1.596 1.00 0.00 H new ATOM 0 HB3 MET A1046 -2.551 -19.738 0.821 1.00 0.00 H new ATOM 0 HG2 MET A1046 -0.980 -21.188 2.949 1.00 0.00 H new ATOM 0 HG3 MET A1046 -2.201 -20.010 3.389 1.00 0.00 H new ATOM 0 HE1 MET A1046 -3.981 -23.462 4.068 1.00 0.00 H new ATOM 0 HE2 MET A1046 -2.255 -23.085 4.285 1.00 0.00 H new ATOM 0 HE3 MET A1046 -3.492 -21.897 4.761 1.00 0.00 H new ATOM 2034 N ILE A1047 -2.197 -21.795 -1.097 1.00 0.00 N ATOM 2035 CA ILE A1047 -2.790 -22.935 -1.780 1.00 0.00 C ATOM 2036 C ILE A1047 -1.730 -23.690 -2.575 1.00 0.00 C ATOM 2037 O ILE A1047 -1.625 -24.906 -2.472 1.00 0.00 O ATOM 2038 CB ILE A1047 -3.934 -22.500 -2.722 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -5.058 -21.849 -1.915 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -4.467 -23.687 -3.515 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.620 -22.736 -0.821 1.00 0.00 C ATOM 0 H ILE A1047 -2.540 -20.889 -1.416 1.00 0.00 H new ATOM 0 HA ILE A1047 -3.207 -23.592 -1.017 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.539 -21.772 -3.430 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -4.684 -20.928 -1.467 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -5.864 -21.569 -2.593 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -5.272 -23.355 -4.171 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -3.663 -24.114 -4.115 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -4.848 -24.442 -2.828 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -6.412 -22.205 -0.293 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -6.025 -23.646 -1.263 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -4.827 -22.995 -0.119 1.00 0.00 H new ATOM 2053 N SER A1048 -0.939 -22.949 -3.345 1.00 0.00 N ATOM 2054 CA SER A1048 0.130 -23.518 -4.166 1.00 0.00 C ATOM 2055 C SER A1048 1.040 -24.452 -3.362 1.00 0.00 C ATOM 2056 O SER A1048 1.530 -25.450 -3.889 1.00 0.00 O ATOM 2057 CB SER A1048 0.962 -22.390 -4.785 1.00 0.00 C ATOM 2058 OG SER A1048 1.853 -22.879 -5.776 1.00 0.00 O ATOM 0 H SER A1048 -1.020 -21.935 -3.419 1.00 0.00 H new ATOM 0 HA SER A1048 -0.338 -24.112 -4.951 1.00 0.00 H new ATOM 0 HB2 SER A1048 0.297 -21.648 -5.227 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.529 -21.885 -4.003 1.00 0.00 H new ATOM 0 HG SER A1048 2.367 -22.133 -6.151 1.00 0.00 H new ATOM 2064 N GLN A1049 1.269 -24.121 -2.099 1.00 0.00 N ATOM 2065 CA GLN A1049 2.123 -24.929 -1.240 1.00 0.00 C ATOM 2066 C GLN A1049 1.359 -26.149 -0.730 1.00 0.00 C ATOM 2067 O GLN A1049 1.839 -27.278 -0.838 1.00 0.00 O ATOM 2068 CB GLN A1049 2.642 -24.077 -0.073 1.00 0.00 C ATOM 2069 CG GLN A1049 3.814 -24.681 0.696 1.00 0.00 C ATOM 2070 CD GLN A1049 3.393 -25.651 1.786 1.00 0.00 C ATOM 2071 OE1 GLN A1049 3.108 -25.247 2.911 1.00 0.00 O ATOM 2072 NE2 GLN A1049 3.397 -26.936 1.478 1.00 0.00 N ATOM 0 H GLN A1049 0.874 -23.297 -1.646 1.00 0.00 H new ATOM 0 HA GLN A1049 2.978 -25.284 -1.816 1.00 0.00 H new ATOM 0 HB2 GLN A1049 2.944 -23.104 -0.460 1.00 0.00 H new ATOM 0 HB3 GLN A1049 1.821 -23.903 0.623 1.00 0.00 H new ATOM 0 HG2 GLN A1049 4.469 -25.198 -0.005 1.00 0.00 H new ATOM 0 HG3 GLN A1049 4.397 -23.876 1.143 1.00 0.00 H new ATOM 0 HE21 GLN A1049 3.639 -27.233 0.533 1.00 0.00 H new ATOM 0 HE22 GLN A1049 3.158 -27.631 2.185 1.00 0.00 H new ATOM 2081 N SER A1050 0.168 -25.916 -0.193 1.00 0.00 N ATOM 2082 CA SER A1050 -0.642 -26.986 0.382 1.00 0.00 C ATOM 2083 C SER A1050 -1.072 -27.991 -0.692 1.00 0.00 C ATOM 2084 O SER A1050 -0.947 -29.204 -0.509 1.00 0.00 O ATOM 2085 CB SER A1050 -1.872 -26.390 1.069 1.00 0.00 C ATOM 2086 OG SER A1050 -1.498 -25.402 2.020 1.00 0.00 O ATOM 0 H SER A1050 -0.261 -24.992 -0.143 1.00 0.00 H new ATOM 0 HA SER A1050 -0.038 -27.518 1.118 1.00 0.00 H new ATOM 0 HB2 SER A1050 -2.532 -25.949 0.322 1.00 0.00 H new ATOM 0 HB3 SER A1050 -2.435 -27.181 1.564 1.00 0.00 H new ATOM 0 HG SER A1050 -1.285 -24.566 1.556 1.00 0.00 H new ATOM 2092 N ARG A1051 -1.561 -27.470 -1.807 1.00 0.00 N ATOM 2093 CA ARG A1051 -2.015 -28.281 -2.927 1.00 0.00 C ATOM 2094 C ARG A1051 -2.353 -27.349 -4.086 1.00 0.00 C ATOM 2095 O ARG A1051 -3.427 -26.748 -4.106 1.00 0.00 O ATOM 2096 CB ARG A1051 -3.250 -29.108 -2.522 1.00 0.00 C ATOM 2097 CG ARG A1051 -3.558 -30.307 -3.421 1.00 0.00 C ATOM 2098 CD ARG A1051 -3.983 -29.901 -4.828 1.00 0.00 C ATOM 2099 NE ARG A1051 -5.022 -28.871 -4.817 1.00 0.00 N ATOM 2100 CZ ARG A1051 -6.210 -28.993 -5.407 1.00 0.00 C ATOM 2101 NH1 ARG A1051 -6.517 -30.101 -6.074 1.00 0.00 N ATOM 2102 NH2 ARG A1051 -7.086 -27.997 -5.335 1.00 0.00 N ATOM 0 H ARG A1051 -1.655 -26.466 -1.961 1.00 0.00 H new ATOM 0 HA ARG A1051 -1.231 -28.977 -3.227 1.00 0.00 H new ATOM 0 HB2 ARG A1051 -3.108 -29.466 -1.502 1.00 0.00 H new ATOM 0 HB3 ARG A1051 -4.119 -28.450 -2.511 1.00 0.00 H new ATOM 0 HG2 ARG A1051 -2.676 -30.944 -3.483 1.00 0.00 H new ATOM 0 HG3 ARG A1051 -4.349 -30.902 -2.966 1.00 0.00 H new ATOM 0 HD2 ARG A1051 -3.115 -29.533 -5.376 1.00 0.00 H new ATOM 0 HD3 ARG A1051 -4.349 -30.778 -5.362 1.00 0.00 H new ATOM 0 HE ARG A1051 -4.823 -28.000 -4.324 1.00 0.00 H new ATOM 0 HH11 ARG A1051 -5.842 -30.863 -6.136 1.00 0.00 H new ATOM 0 HH12 ARG A1051 -7.428 -30.189 -6.524 1.00 0.00 H new ATOM 0 HH21 ARG A1051 -6.848 -27.144 -4.830 1.00 0.00 H new ATOM 0 HH22 ARG A1051 -7.997 -28.086 -5.785 1.00 0.00 H new ATOM 2116 N PRO A1052 -1.428 -27.186 -5.042 1.00 0.00 N ATOM 2117 CA PRO A1052 -1.624 -26.273 -6.169 1.00 0.00 C ATOM 2118 C PRO A1052 -2.730 -26.742 -7.111 1.00 0.00 C ATOM 2119 O PRO A1052 -3.812 -26.158 -7.152 1.00 0.00 O ATOM 2120 CB PRO A1052 -0.264 -26.272 -6.877 1.00 0.00 C ATOM 2121 CG PRO A1052 0.387 -27.550 -6.471 1.00 0.00 C ATOM 2122 CD PRO A1052 -0.120 -27.863 -5.090 1.00 0.00 C ATOM 0 HA PRO A1052 -1.940 -25.283 -5.840 1.00 0.00 H new ATOM 0 HB2 PRO A1052 -0.383 -26.217 -7.959 1.00 0.00 H new ATOM 0 HB3 PRO A1052 0.335 -25.412 -6.578 1.00 0.00 H new ATOM 0 HG2 PRO A1052 0.138 -28.351 -7.167 1.00 0.00 H new ATOM 0 HG3 PRO A1052 1.473 -27.451 -6.473 1.00 0.00 H new ATOM 0 HD2 PRO A1052 -0.218 -28.937 -4.932 1.00 0.00 H new ATOM 0 HD3 PRO A1052 0.555 -27.488 -4.320 1.00 0.00 H new ATOM 2130 N HIS A1053 -2.454 -27.798 -7.861 1.00 0.00 N ATOM 2131 CA HIS A1053 -3.425 -28.363 -8.788 1.00 0.00 C ATOM 2132 C HIS A1053 -3.271 -29.875 -8.816 1.00 0.00 C ATOM 2133 O HIS A1053 -4.044 -30.569 -8.129 1.00 0.00 O ATOM 2134 CB HIS A1053 -3.244 -27.790 -10.204 1.00 0.00 C ATOM 2135 CG HIS A1053 -3.509 -26.318 -10.311 1.00 0.00 C ATOM 2136 ND1 HIS A1053 -2.539 -25.401 -10.655 1.00 0.00 N ATOM 2137 CD2 HIS A1053 -4.645 -25.604 -10.120 1.00 0.00 C ATOM 2138 CE1 HIS A1053 -3.065 -24.189 -10.669 1.00 0.00 C ATOM 2139 NE2 HIS A1053 -4.339 -24.286 -10.350 1.00 0.00 N ATOM 2140 OXT HIS A1053 -2.340 -30.360 -9.489 1.00 0.00 O ATOM 0 H HIS A1053 -1.558 -28.285 -7.846 1.00 0.00 H new ATOM 0 HA HIS A1053 -4.426 -28.098 -8.446 1.00 0.00 H new ATOM 0 HB2 HIS A1053 -2.225 -27.989 -10.537 1.00 0.00 H new ATOM 0 HB3 HIS A1053 -3.911 -28.318 -10.885 1.00 0.00 H new ATOM 0 HD2 HIS A1053 -5.610 -25.998 -9.839 1.00 0.00 H new ATOM 0 HE1 HIS A1053 -2.540 -23.275 -10.902 1.00 0.00 H new ATOM 0 HE2 HIS A1053 -4.994 -23.506 -10.284 1.00 0.00 H new TER 2149 HIS A1053