USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1027 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1006 GLN : amide:sc= -4.71! C(o=-7!,f=-8.2!) USER MOD Set 1.2: A1014 GLN : amide:sc= -2.26 K(o=-7,f=-5.7) USER MOD Set 2.1: A1002 MET CE :methyl -127:sc= -0.46 (180deg=-0.223) USER MOD Set 2.2: A1021 MET CE :methyl -103:sc= -1.33 (180deg=-2.46!) USER MOD Set 3.1: A 989 LYS NZ :NH3+ 177:sc= 0.543 (180deg=0) USER MOD Set 3.2: A 993 SER OG : rot 76:sc= 1.63 USER MOD Set 4.1: A 986 MET CE :methyl 148:sc= -1.74 (180deg=-4.16!) USER MOD Set 4.2: A1034 ASN : amide:sc= -1.46 K(o=-3.2,f=-1.7) USER MOD Set 5.1: A 928 ASN : amide:sc= -4.82! K(o=-4.3!,f=-9.8) USER MOD Set 5.2: A 968 THR OG1 : rot 170:sc= 0.482 USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= -1.01 X(o=-1,f=-0.95) USER MOD Single : A 924 LYS NZ :NH3+ 146:sc= -0.133 (180deg=-0.687) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot -91:sc= 1.18 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl -120:sc= -0.393 (180deg=-0.554) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 941 SER OG : rot 68:sc= 1.05 USER MOD Single : A 942 LYS NZ :NH3+ 158:sc= 0.448 (180deg=0.256) USER MOD Single : A 944 GLN : amide:sc= -1.42 X(o=-1.4,f=-1) USER MOD Single : A 951 TYR OH : rot 180:sc= 0 USER MOD Single : A 954 MET CE :methyl 152:sc= -9.94! (180deg=-14!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 79:sc= 1.22 USER MOD Single : A 972 SER OG : rot -24:sc= -1.73 USER MOD Single : A 979 SER OG : rot 5:sc= 1.25 USER MOD Single : A 980 THR OG1 : rot 82:sc= -0.98 USER MOD Single : A 981 HIS : no HD1:sc= -1.01 K(o=-1,f=-2.9!) USER MOD Single : A 988 GLN : amide:sc= -1.88! K(o=-1.9!,f=-0.49) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A1000 ASN : amide:sc= 1.14 K(o=1.1,f=-0.23) USER MOD Single : A1001 LYS NZ :NH3+ -163:sc= 1.25 (180deg=1.16) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1007 GLN : amide:sc= 0.0388 X(o=0.039,f=-0.36) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1015 GLN : amide:sc= -1.24! K(o=-1.2!,f=-0.016) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= -0.959 K(o=-0.96,f=0) USER MOD Single : A1023 THR OG1 : rot 77:sc= 0.576 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= -1.45! K(o=-1.4!,f=-0.057) USER MOD Single : A1045 LYS NZ :NH3+ -167:sc= 1.14 (180deg=0.991) USER MOD Single : A1046 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -2.35! K(o=-2.3!,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.234 -20.447 -2.118 1.00 0.00 N ATOM 2 CA ARG A 920 -8.181 -19.400 -1.112 1.00 0.00 C ATOM 3 C ARG A 920 -8.964 -18.174 -1.554 1.00 0.00 C ATOM 4 O ARG A 920 -8.741 -17.634 -2.639 1.00 0.00 O ATOM 5 CB ARG A 920 -6.739 -18.995 -0.826 1.00 0.00 C ATOM 6 CG ARG A 920 -6.596 -18.266 0.494 1.00 0.00 C ATOM 7 CD ARG A 920 -6.818 -19.215 1.656 1.00 0.00 C ATOM 8 NE ARG A 920 -7.068 -18.519 2.917 1.00 0.00 N ATOM 9 CZ ARG A 920 -7.192 -19.140 4.088 1.00 0.00 C ATOM 10 NH1 ARG A 920 -7.150 -20.463 4.138 1.00 0.00 N ATOM 11 NH2 ARG A 920 -7.387 -18.442 5.203 1.00 0.00 N ATOM 0 HA ARG A 920 -8.631 -19.801 -0.204 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.109 -19.885 -0.817 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -6.377 -18.357 -1.632 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -5.603 -17.822 0.565 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -7.315 -17.448 0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -7.664 -19.865 1.432 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -5.944 -19.856 1.767 1.00 0.00 H new ATOM 0 HE ARG A 920 -7.152 -17.503 2.899 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -7.023 -21.002 3.281 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -7.245 -20.943 5.033 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -7.442 -17.424 5.164 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -7.481 -18.924 6.097 1.00 0.00 H new ATOM 25 N SER A 921 -9.888 -17.744 -0.712 1.00 0.00 N ATOM 26 CA SER A 921 -10.579 -16.489 -0.925 1.00 0.00 C ATOM 27 C SER A 921 -9.737 -15.363 -0.343 1.00 0.00 C ATOM 28 O SER A 921 -9.916 -14.985 0.813 1.00 0.00 O ATOM 29 CB SER A 921 -11.969 -16.522 -0.289 1.00 0.00 C ATOM 30 OG SER A 921 -12.706 -15.350 -0.590 1.00 0.00 O ATOM 0 H SER A 921 -10.176 -18.248 0.127 1.00 0.00 H new ATOM 0 HA SER A 921 -10.716 -16.322 -1.993 1.00 0.00 H new ATOM 0 HB2 SER A 921 -12.513 -17.397 -0.646 1.00 0.00 H new ATOM 0 HB3 SER A 921 -11.873 -16.625 0.792 1.00 0.00 H new ATOM 0 HG SER A 921 -13.590 -15.403 -0.170 1.00 0.00 H new ATOM 36 N ASN A 922 -8.787 -14.908 -1.167 1.00 0.00 N ATOM 37 CA ASN A 922 -7.772 -13.898 -0.842 1.00 0.00 C ATOM 38 C ASN A 922 -8.024 -13.164 0.457 1.00 0.00 C ATOM 39 O ASN A 922 -8.595 -12.072 0.483 1.00 0.00 O ATOM 40 CB ASN A 922 -7.634 -12.915 -1.996 1.00 0.00 C ATOM 41 CG ASN A 922 -8.282 -13.444 -3.258 1.00 0.00 C ATOM 42 OD1 ASN A 922 -9.413 -13.088 -3.595 1.00 0.00 O ATOM 43 ND2 ASN A 922 -7.581 -14.338 -3.939 1.00 0.00 N ATOM 0 H ASN A 922 -8.700 -15.250 -2.124 1.00 0.00 H new ATOM 0 HA ASN A 922 -6.837 -14.438 -0.694 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -8.092 -11.964 -1.722 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -6.578 -12.718 -2.183 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -7.974 -14.762 -4.780 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -6.648 -14.603 -3.623 1.00 0.00 H new ATOM 50 N ASP A 923 -7.509 -13.794 1.506 1.00 0.00 N ATOM 51 CA ASP A 923 -7.673 -13.420 2.909 1.00 0.00 C ATOM 52 C ASP A 923 -7.437 -11.933 3.169 1.00 0.00 C ATOM 53 O ASP A 923 -7.294 -11.134 2.256 1.00 0.00 O ATOM 54 CB ASP A 923 -6.687 -14.253 3.730 1.00 0.00 C ATOM 55 CG ASP A 923 -7.186 -14.629 5.112 1.00 0.00 C ATOM 56 OD1 ASP A 923 -7.621 -13.742 5.864 1.00 0.00 O ATOM 57 OD2 ASP A 923 -7.100 -15.828 5.456 1.00 0.00 O ATOM 0 H ASP A 923 -6.932 -14.628 1.396 1.00 0.00 H new ATOM 0 HA ASP A 923 -8.706 -13.616 3.196 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -6.454 -15.165 3.180 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -5.756 -13.696 3.832 1.00 0.00 H new ATOM 62 N LYS A 924 -7.442 -11.584 4.439 1.00 0.00 N ATOM 63 CA LYS A 924 -7.186 -10.220 4.923 1.00 0.00 C ATOM 64 C LYS A 924 -6.103 -9.504 4.098 1.00 0.00 C ATOM 65 O LYS A 924 -6.085 -8.275 4.024 1.00 0.00 O ATOM 66 CB LYS A 924 -6.783 -10.292 6.400 1.00 0.00 C ATOM 67 CG LYS A 924 -6.887 -8.974 7.145 1.00 0.00 C ATOM 68 CD LYS A 924 -5.590 -8.185 7.110 1.00 0.00 C ATOM 69 CE LYS A 924 -5.692 -6.935 7.961 1.00 0.00 C ATOM 70 NZ LYS A 924 -6.119 -7.246 9.353 1.00 0.00 N ATOM 0 H LYS A 924 -7.627 -12.248 5.191 1.00 0.00 H new ATOM 0 HA LYS A 924 -8.098 -9.634 4.810 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.412 -11.028 6.900 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.757 -10.653 6.466 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -7.686 -8.375 6.708 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -7.164 -9.167 8.181 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -4.771 -8.808 7.469 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -5.354 -7.911 6.082 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -4.726 -6.430 7.982 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -6.404 -6.244 7.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -5.659 -6.586 10.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -7.152 -7.149 9.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -5.845 -8.221 9.591 1.00 0.00 H new ATOM 84 N VAL A 925 -5.227 -10.284 3.465 1.00 0.00 N ATOM 85 CA VAL A 925 -4.248 -9.763 2.536 1.00 0.00 C ATOM 86 C VAL A 925 -4.904 -8.971 1.398 1.00 0.00 C ATOM 87 O VAL A 925 -4.559 -7.817 1.195 1.00 0.00 O ATOM 88 CB VAL A 925 -3.395 -10.902 1.937 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.386 -11.409 2.958 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.277 -12.051 1.467 1.00 0.00 C ATOM 0 H VAL A 925 -5.183 -11.296 3.588 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.607 -9.088 3.103 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.858 -10.501 1.078 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -1.794 -12.211 2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.727 -10.593 3.255 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -2.913 -11.786 3.834 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.653 -12.841 1.049 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -4.843 -12.444 2.311 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -4.967 -11.691 0.704 1.00 0.00 H new ATOM 100 N TYR A 926 -5.895 -9.536 0.694 1.00 0.00 N ATOM 101 CA TYR A 926 -6.498 -8.806 -0.416 1.00 0.00 C ATOM 102 C TYR A 926 -7.283 -7.626 0.156 1.00 0.00 C ATOM 103 O TYR A 926 -7.404 -6.566 -0.459 1.00 0.00 O ATOM 104 CB TYR A 926 -7.431 -9.735 -1.199 1.00 0.00 C ATOM 105 CG TYR A 926 -8.557 -9.028 -1.920 1.00 0.00 C ATOM 106 CD1 TYR A 926 -8.297 -8.223 -3.009 1.00 0.00 C ATOM 107 CD2 TYR A 926 -9.876 -9.160 -1.499 1.00 0.00 C ATOM 108 CE1 TYR A 926 -9.307 -7.559 -3.670 1.00 0.00 C ATOM 109 CE2 TYR A 926 -10.901 -8.504 -2.155 1.00 0.00 C ATOM 110 CZ TYR A 926 -10.611 -7.702 -3.240 1.00 0.00 C ATOM 111 OH TYR A 926 -11.628 -7.042 -3.898 1.00 0.00 O ATOM 0 H TYR A 926 -6.281 -10.464 0.869 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.727 -8.442 -1.095 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.842 -10.291 -1.928 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.858 -10.465 -0.511 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -7.279 -8.111 -3.351 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -10.103 -9.784 -0.647 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -9.080 -6.931 -4.519 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -11.922 -8.618 -1.821 1.00 0.00 H new ATOM 0 HH TYR A 926 -12.484 -7.251 -3.470 1.00 0.00 H new ATOM 121 N GLU A 927 -7.768 -7.837 1.369 1.00 0.00 N ATOM 122 CA GLU A 927 -8.650 -6.910 2.054 1.00 0.00 C ATOM 123 C GLU A 927 -7.965 -5.603 2.452 1.00 0.00 C ATOM 124 O GLU A 927 -8.312 -4.538 1.949 1.00 0.00 O ATOM 125 CB GLU A 927 -9.223 -7.605 3.283 1.00 0.00 C ATOM 126 CG GLU A 927 -10.408 -8.495 2.970 1.00 0.00 C ATOM 127 CD GLU A 927 -11.593 -7.710 2.447 1.00 0.00 C ATOM 128 OE1 GLU A 927 -11.603 -7.355 1.252 1.00 0.00 O ATOM 129 OE2 GLU A 927 -12.529 -7.451 3.232 1.00 0.00 O ATOM 0 H GLU A 927 -7.555 -8.673 1.914 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.443 -6.631 1.360 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -8.441 -8.204 3.751 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.525 -6.851 4.010 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -10.114 -9.241 2.231 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -10.701 -9.036 3.870 1.00 0.00 H new ATOM 136 N ASN A 928 -7.000 -5.673 3.354 1.00 0.00 N ATOM 137 CA ASN A 928 -6.409 -4.455 3.905 1.00 0.00 C ATOM 138 C ASN A 928 -5.504 -3.764 2.890 1.00 0.00 C ATOM 139 O ASN A 928 -5.338 -2.553 2.934 1.00 0.00 O ATOM 140 CB ASN A 928 -5.636 -4.731 5.198 1.00 0.00 C ATOM 141 CG ASN A 928 -4.311 -5.413 4.959 1.00 0.00 C ATOM 142 OD1 ASN A 928 -4.156 -6.189 4.022 1.00 0.00 O ATOM 143 ND2 ASN A 928 -3.342 -5.128 5.808 1.00 0.00 N ATOM 0 H ASN A 928 -6.611 -6.543 3.718 1.00 0.00 H new ATOM 0 HA ASN A 928 -7.237 -3.786 4.141 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.465 -3.790 5.720 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -6.246 -5.353 5.853 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -2.424 -5.559 5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -3.511 -4.477 6.575 1.00 0.00 H new ATOM 150 N VAL A 929 -4.878 -4.538 2.011 1.00 0.00 N ATOM 151 CA VAL A 929 -4.043 -3.962 0.969 1.00 0.00 C ATOM 152 C VAL A 929 -4.867 -3.106 0.005 1.00 0.00 C ATOM 153 O VAL A 929 -4.417 -2.047 -0.436 1.00 0.00 O ATOM 154 CB VAL A 929 -3.255 -5.038 0.200 1.00 0.00 C ATOM 155 CG1 VAL A 929 -2.341 -4.384 -0.809 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.442 -5.890 1.159 1.00 0.00 C ATOM 0 H VAL A 929 -4.933 -5.556 2.000 1.00 0.00 H new ATOM 0 HA VAL A 929 -3.319 -3.317 1.467 1.00 0.00 H new ATOM 0 HB VAL A 929 -3.963 -5.681 -0.322 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.787 -5.152 -1.349 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.934 -3.801 -1.514 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -1.641 -3.726 -0.293 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.892 -6.645 0.598 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -1.739 -5.257 1.702 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -3.111 -6.380 1.867 1.00 0.00 H new ATOM 166 N THR A 930 -6.087 -3.530 -0.296 1.00 0.00 N ATOM 167 CA THR A 930 -6.983 -2.667 -1.051 1.00 0.00 C ATOM 168 C THR A 930 -7.462 -1.553 -0.133 1.00 0.00 C ATOM 169 O THR A 930 -7.774 -0.446 -0.573 1.00 0.00 O ATOM 170 CB THR A 930 -8.182 -3.423 -1.658 1.00 0.00 C ATOM 171 OG1 THR A 930 -8.756 -4.308 -0.695 1.00 0.00 O ATOM 172 CG2 THR A 930 -7.758 -4.210 -2.884 1.00 0.00 C ATOM 0 H THR A 930 -6.470 -4.439 -0.038 1.00 0.00 H new ATOM 0 HA THR A 930 -6.429 -2.260 -1.897 1.00 0.00 H new ATOM 0 HB THR A 930 -8.928 -2.685 -1.954 1.00 0.00 H new ATOM 0 HG1 THR A 930 -8.333 -5.189 -0.768 1.00 0.00 H new ATOM 0 HG21 THR A 930 -8.620 -4.735 -3.295 1.00 0.00 H new ATOM 0 HG22 THR A 930 -7.357 -3.528 -3.634 1.00 0.00 H new ATOM 0 HG23 THR A 930 -6.992 -4.933 -2.605 1.00 0.00 H new ATOM 180 N GLY A 931 -7.498 -1.873 1.157 1.00 0.00 N ATOM 181 CA GLY A 931 -7.705 -0.875 2.186 1.00 0.00 C ATOM 182 C GLY A 931 -6.646 0.217 2.161 1.00 0.00 C ATOM 183 O GLY A 931 -6.913 1.346 2.560 1.00 0.00 O ATOM 0 H GLY A 931 -7.385 -2.823 1.510 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.689 -0.425 2.058 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.700 -1.359 3.163 1.00 0.00 H new ATOM 187 N LEU A 932 -5.440 -0.113 1.694 1.00 0.00 N ATOM 188 CA LEU A 932 -4.398 0.888 1.530 1.00 0.00 C ATOM 189 C LEU A 932 -4.832 1.864 0.443 1.00 0.00 C ATOM 190 O LEU A 932 -4.719 3.079 0.602 1.00 0.00 O ATOM 191 CB LEU A 932 -3.058 0.224 1.172 1.00 0.00 C ATOM 192 CG LEU A 932 -1.790 1.025 1.523 1.00 0.00 C ATOM 193 CD1 LEU A 932 -0.549 0.183 1.291 1.00 0.00 C ATOM 194 CD2 LEU A 932 -1.698 2.318 0.719 1.00 0.00 C ATOM 0 H LEU A 932 -5.168 -1.059 1.426 1.00 0.00 H new ATOM 0 HA LEU A 932 -4.252 1.427 2.466 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.006 -0.740 1.679 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -3.051 0.022 0.101 1.00 0.00 H new ATOM 0 HG LEU A 932 -1.854 1.289 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.338 0.764 1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -0.591 -0.707 1.919 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.501 -0.114 0.243 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -0.790 2.854 0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -1.671 2.084 -0.345 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -2.567 2.941 0.932 1.00 0.00 H new ATOM 206 N VAL A 933 -5.353 1.326 -0.657 1.00 0.00 N ATOM 207 CA VAL A 933 -5.958 2.159 -1.693 1.00 0.00 C ATOM 208 C VAL A 933 -7.104 3.003 -1.108 1.00 0.00 C ATOM 209 O VAL A 933 -7.284 4.161 -1.470 1.00 0.00 O ATOM 210 CB VAL A 933 -6.479 1.310 -2.877 1.00 0.00 C ATOM 211 CG1 VAL A 933 -7.115 2.188 -3.948 1.00 0.00 C ATOM 212 CG2 VAL A 933 -5.350 0.480 -3.471 1.00 0.00 C ATOM 0 H VAL A 933 -5.369 0.325 -0.853 1.00 0.00 H new ATOM 0 HA VAL A 933 -5.181 2.824 -2.071 1.00 0.00 H new ATOM 0 HB VAL A 933 -7.247 0.637 -2.496 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -7.471 1.563 -4.767 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -7.954 2.736 -3.518 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -6.376 2.894 -4.326 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.732 -0.112 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.561 1.142 -3.829 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -4.947 -0.185 -2.707 1.00 0.00 H new ATOM 222 N LYS A 934 -7.870 2.420 -0.195 1.00 0.00 N ATOM 223 CA LYS A 934 -8.933 3.150 0.500 1.00 0.00 C ATOM 224 C LYS A 934 -8.341 4.290 1.326 1.00 0.00 C ATOM 225 O LYS A 934 -8.931 5.362 1.443 1.00 0.00 O ATOM 226 CB LYS A 934 -9.730 2.227 1.436 1.00 0.00 C ATOM 227 CG LYS A 934 -10.181 0.902 0.830 1.00 0.00 C ATOM 228 CD LYS A 934 -11.233 1.059 -0.259 1.00 0.00 C ATOM 229 CE LYS A 934 -10.619 1.392 -1.609 1.00 0.00 C ATOM 230 NZ LYS A 934 -11.600 1.221 -2.709 1.00 0.00 N ATOM 0 H LYS A 934 -7.778 1.443 0.085 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.604 3.547 -0.262 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -9.120 2.015 2.314 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -10.612 2.766 1.783 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.314 0.388 0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -10.580 0.267 1.621 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -11.808 0.137 -0.341 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -11.932 1.846 0.024 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -10.255 2.419 -1.601 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.756 0.750 -1.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -11.149 1.456 -3.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.928 0.234 -2.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -12.411 1.852 -2.552 1.00 0.00 H new ATOM 244 N ALA A 935 -7.171 4.045 1.895 1.00 0.00 N ATOM 245 CA ALA A 935 -6.497 5.030 2.728 1.00 0.00 C ATOM 246 C ALA A 935 -5.874 6.141 1.892 1.00 0.00 C ATOM 247 O ALA A 935 -5.676 7.251 2.375 1.00 0.00 O ATOM 248 CB ALA A 935 -5.454 4.363 3.601 1.00 0.00 C ATOM 0 H ALA A 935 -6.665 3.165 1.794 1.00 0.00 H new ATOM 0 HA ALA A 935 -7.247 5.489 3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -4.960 5.115 4.217 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -5.935 3.626 4.244 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.715 3.868 2.971 1.00 0.00 H new ATOM 254 N VAL A 936 -5.544 5.858 0.641 1.00 0.00 N ATOM 255 CA VAL A 936 -5.096 6.923 -0.236 1.00 0.00 C ATOM 256 C VAL A 936 -6.307 7.668 -0.796 1.00 0.00 C ATOM 257 O VAL A 936 -6.205 8.802 -1.273 1.00 0.00 O ATOM 258 CB VAL A 936 -4.131 6.430 -1.345 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.807 5.467 -2.301 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.528 7.603 -2.107 1.00 0.00 C ATOM 0 H VAL A 936 -5.576 4.929 0.222 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.503 7.622 0.354 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.326 5.888 -0.848 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -4.094 5.148 -3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -5.163 4.597 -1.750 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.651 5.963 -2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.855 7.228 -2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -4.325 8.184 -2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.971 8.237 -1.417 1.00 0.00 H new ATOM 270 N ILE A 937 -7.473 7.043 -0.684 1.00 0.00 N ATOM 271 CA ILE A 937 -8.721 7.753 -0.893 1.00 0.00 C ATOM 272 C ILE A 937 -8.917 8.737 0.263 1.00 0.00 C ATOM 273 O ILE A 937 -9.396 9.858 0.073 1.00 0.00 O ATOM 274 CB ILE A 937 -9.936 6.800 -0.993 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.775 5.838 -2.176 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.229 7.595 -1.133 1.00 0.00 C ATOM 277 CD1 ILE A 937 -9.648 6.529 -3.519 1.00 0.00 C ATOM 0 H ILE A 937 -7.577 6.055 -0.452 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.660 8.280 -1.845 1.00 0.00 H new ATOM 0 HB ILE A 937 -9.984 6.214 -0.075 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -8.892 5.221 -2.012 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -10.633 5.166 -2.204 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -12.073 6.908 -1.202 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.356 8.239 -0.263 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.184 8.207 -2.034 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -9.538 5.781 -4.304 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -10.541 7.124 -3.708 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -8.773 7.179 -3.512 1.00 0.00 H new ATOM 289 N GLU A 938 -8.521 8.302 1.466 1.00 0.00 N ATOM 290 CA GLU A 938 -8.467 9.179 2.636 1.00 0.00 C ATOM 291 C GLU A 938 -7.638 10.415 2.342 1.00 0.00 C ATOM 292 O GLU A 938 -7.978 11.506 2.778 1.00 0.00 O ATOM 293 CB GLU A 938 -7.866 8.466 3.850 1.00 0.00 C ATOM 294 CG GLU A 938 -8.712 7.319 4.373 1.00 0.00 C ATOM 295 CD GLU A 938 -10.113 7.761 4.736 1.00 0.00 C ATOM 296 OE1 GLU A 938 -10.275 8.451 5.761 1.00 0.00 O ATOM 297 OE2 GLU A 938 -11.057 7.438 3.990 1.00 0.00 O ATOM 0 H GLU A 938 -8.232 7.342 1.652 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.494 9.464 2.864 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.880 8.085 3.584 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.722 9.192 4.650 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.765 6.535 3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.231 6.885 5.250 1.00 0.00 H new ATOM 304 N MET A 939 -6.564 10.241 1.580 1.00 0.00 N ATOM 305 CA MET A 939 -5.691 11.356 1.234 1.00 0.00 C ATOM 306 C MET A 939 -6.491 12.428 0.500 1.00 0.00 C ATOM 307 O MET A 939 -6.408 13.610 0.820 1.00 0.00 O ATOM 308 CB MET A 939 -4.525 10.885 0.362 1.00 0.00 C ATOM 309 CG MET A 939 -3.527 11.985 0.034 1.00 0.00 C ATOM 310 SD MET A 939 -2.253 11.456 -1.128 1.00 0.00 S ATOM 311 CE MET A 939 -3.227 11.219 -2.612 1.00 0.00 C ATOM 0 H MET A 939 -6.278 9.342 1.192 1.00 0.00 H new ATOM 0 HA MET A 939 -5.283 11.774 2.154 1.00 0.00 H new ATOM 0 HB2 MET A 939 -4.005 10.074 0.872 1.00 0.00 H new ATOM 0 HB3 MET A 939 -4.920 10.475 -0.568 1.00 0.00 H new ATOM 0 HG2 MET A 939 -4.060 12.839 -0.384 1.00 0.00 H new ATOM 0 HG3 MET A 939 -3.053 12.324 0.955 1.00 0.00 H new ATOM 0 HE1 MET A 939 -3.145 10.183 -2.940 1.00 0.00 H new ATOM 0 HE2 MET A 939 -4.271 11.452 -2.403 1.00 0.00 H new ATOM 0 HE3 MET A 939 -2.859 11.878 -3.398 1.00 0.00 H new ATOM 321 N SER A 940 -7.300 11.995 -0.457 1.00 0.00 N ATOM 322 CA SER A 940 -8.142 12.912 -1.214 1.00 0.00 C ATOM 323 C SER A 940 -9.295 13.443 -0.355 1.00 0.00 C ATOM 324 O SER A 940 -9.757 14.568 -0.548 1.00 0.00 O ATOM 325 CB SER A 940 -8.684 12.211 -2.460 1.00 0.00 C ATOM 326 OG SER A 940 -7.625 11.696 -3.253 1.00 0.00 O ATOM 0 H SER A 940 -7.391 11.016 -0.728 1.00 0.00 H new ATOM 0 HA SER A 940 -7.534 13.764 -1.519 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.350 11.400 -2.165 1.00 0.00 H new ATOM 0 HB3 SER A 940 -9.276 12.912 -3.048 1.00 0.00 H new ATOM 0 HG SER A 940 -7.995 11.250 -4.044 1.00 0.00 H new ATOM 332 N SER A 941 -9.733 12.660 0.620 1.00 0.00 N ATOM 333 CA SER A 941 -10.872 13.056 1.431 1.00 0.00 C ATOM 334 C SER A 941 -10.407 14.093 2.435 1.00 0.00 C ATOM 335 O SER A 941 -11.060 15.111 2.677 1.00 0.00 O ATOM 336 CB SER A 941 -11.470 11.839 2.141 1.00 0.00 C ATOM 337 OG SER A 941 -11.787 10.811 1.210 1.00 0.00 O ATOM 0 H SER A 941 -9.323 11.759 0.866 1.00 0.00 H new ATOM 0 HA SER A 941 -11.651 13.483 0.799 1.00 0.00 H new ATOM 0 HB2 SER A 941 -10.763 11.461 2.879 1.00 0.00 H new ATOM 0 HB3 SER A 941 -12.369 12.134 2.682 1.00 0.00 H new ATOM 0 HG SER A 941 -10.960 10.449 0.828 1.00 0.00 H new ATOM 343 N LYS A 942 -9.233 13.820 2.968 1.00 0.00 N ATOM 344 CA LYS A 942 -8.576 14.664 3.937 1.00 0.00 C ATOM 345 C LYS A 942 -8.324 16.059 3.396 1.00 0.00 C ATOM 346 O LYS A 942 -8.516 17.043 4.102 1.00 0.00 O ATOM 347 CB LYS A 942 -7.258 14.017 4.334 1.00 0.00 C ATOM 348 CG LYS A 942 -7.315 13.291 5.655 1.00 0.00 C ATOM 349 CD LYS A 942 -7.265 14.291 6.779 1.00 0.00 C ATOM 350 CE LYS A 942 -7.871 13.739 8.062 1.00 0.00 C ATOM 351 NZ LYS A 942 -7.113 12.572 8.590 1.00 0.00 N ATOM 0 H LYS A 942 -8.699 12.984 2.731 1.00 0.00 H new ATOM 0 HA LYS A 942 -9.229 14.767 4.804 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -6.959 13.315 3.556 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -6.486 14.785 4.384 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -8.229 12.701 5.719 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.480 12.595 5.736 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -6.230 14.579 6.962 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.800 15.194 6.485 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -7.895 14.525 8.817 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -8.904 13.444 7.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -7.307 12.463 9.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -7.407 11.711 8.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -6.095 12.726 8.446 1.00 0.00 H new ATOM 365 N ILE A 943 -7.892 16.150 2.149 1.00 0.00 N ATOM 366 CA ILE A 943 -7.548 17.440 1.583 1.00 0.00 C ATOM 367 C ILE A 943 -8.799 18.278 1.326 1.00 0.00 C ATOM 368 O ILE A 943 -8.735 19.510 1.291 1.00 0.00 O ATOM 369 CB ILE A 943 -6.721 17.305 0.276 1.00 0.00 C ATOM 370 CG1 ILE A 943 -6.215 18.675 -0.189 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.538 16.645 -0.823 1.00 0.00 C ATOM 372 CD1 ILE A 943 -5.346 18.618 -1.427 1.00 0.00 C ATOM 0 H ILE A 943 -7.773 15.357 1.518 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.926 17.949 2.320 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.861 16.670 0.490 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -7.071 19.320 -0.387 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -5.649 19.136 0.620 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.934 16.563 -1.727 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.845 15.650 -0.501 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -8.422 17.248 -1.031 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -5.027 19.625 -1.694 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -4.470 18.000 -1.229 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -5.915 18.187 -2.251 1.00 0.00 H new ATOM 384 N GLN A 944 -9.935 17.608 1.154 1.00 0.00 N ATOM 385 CA GLN A 944 -11.195 18.303 0.910 1.00 0.00 C ATOM 386 C GLN A 944 -11.514 19.324 2.014 1.00 0.00 C ATOM 387 O GLN A 944 -11.575 20.520 1.731 1.00 0.00 O ATOM 388 CB GLN A 944 -12.343 17.306 0.740 1.00 0.00 C ATOM 389 CG GLN A 944 -12.171 16.390 -0.457 1.00 0.00 C ATOM 390 CD GLN A 944 -13.226 15.307 -0.521 1.00 0.00 C ATOM 391 OE1 GLN A 944 -14.357 15.497 -0.081 1.00 0.00 O ATOM 392 NE2 GLN A 944 -12.861 14.160 -1.072 1.00 0.00 N ATOM 0 H GLN A 944 -10.009 16.591 1.179 1.00 0.00 H new ATOM 0 HA GLN A 944 -11.081 18.860 -0.020 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -12.426 16.701 1.643 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -13.279 17.855 0.637 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -12.209 16.983 -1.371 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -11.184 15.928 -0.417 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -11.911 14.043 -1.425 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -13.529 13.393 -1.143 1.00 0.00 H new ATOM 401 N PRO A 945 -11.708 18.906 3.289 1.00 0.00 N ATOM 402 CA PRO A 945 -12.094 19.829 4.348 1.00 0.00 C ATOM 403 C PRO A 945 -10.936 20.271 5.252 1.00 0.00 C ATOM 404 O PRO A 945 -11.169 20.871 6.303 1.00 0.00 O ATOM 405 CB PRO A 945 -13.083 18.980 5.142 1.00 0.00 C ATOM 406 CG PRO A 945 -12.590 17.570 4.995 1.00 0.00 C ATOM 407 CD PRO A 945 -11.633 17.546 3.820 1.00 0.00 C ATOM 0 HA PRO A 945 -12.481 20.767 3.950 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -13.110 19.281 6.189 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -14.096 19.087 4.753 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -12.089 17.242 5.905 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -13.423 16.888 4.826 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -10.620 17.293 4.133 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -11.931 16.808 3.075 1.00 0.00 H new ATOM 415 N ALA A 946 -9.699 19.995 4.858 1.00 0.00 N ATOM 416 CA ALA A 946 -8.562 20.286 5.723 1.00 0.00 C ATOM 417 C ALA A 946 -7.444 21.033 4.987 1.00 0.00 C ATOM 418 O ALA A 946 -7.326 20.947 3.764 1.00 0.00 O ATOM 419 CB ALA A 946 -8.043 18.997 6.332 1.00 0.00 C ATOM 0 H ALA A 946 -9.459 19.576 3.959 1.00 0.00 H new ATOM 0 HA ALA A 946 -8.906 20.949 6.516 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -7.193 19.216 6.978 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -8.833 18.528 6.918 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -7.729 18.320 5.538 1.00 0.00 H new ATOM 425 N PRO A 947 -6.617 21.786 5.741 1.00 0.00 N ATOM 426 CA PRO A 947 -5.534 22.608 5.194 1.00 0.00 C ATOM 427 C PRO A 947 -4.180 21.866 5.163 1.00 0.00 C ATOM 428 O PRO A 947 -4.140 20.653 5.372 1.00 0.00 O ATOM 429 CB PRO A 947 -5.517 23.758 6.201 1.00 0.00 C ATOM 430 CG PRO A 947 -5.825 23.117 7.511 1.00 0.00 C ATOM 431 CD PRO A 947 -6.680 21.910 7.212 1.00 0.00 C ATOM 0 HA PRO A 947 -5.687 22.904 4.156 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -4.546 24.253 6.221 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -6.257 24.517 5.948 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -4.909 22.825 8.024 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -6.350 23.811 8.167 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -6.297 21.017 7.705 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.704 22.050 7.558 1.00 0.00 H new ATOM 439 N PRO A 948 -3.050 22.575 4.887 1.00 0.00 N ATOM 440 CA PRO A 948 -1.692 21.981 4.906 1.00 0.00 C ATOM 441 C PRO A 948 -1.393 21.181 6.173 1.00 0.00 C ATOM 442 O PRO A 948 -0.674 20.161 6.129 1.00 0.00 O ATOM 443 CB PRO A 948 -0.785 23.203 4.850 1.00 0.00 C ATOM 444 CG PRO A 948 -1.565 24.212 4.085 1.00 0.00 C ATOM 445 CD PRO A 948 -3.004 23.995 4.464 1.00 0.00 C ATOM 0 HA PRO A 948 -1.561 21.270 4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -0.543 23.563 5.850 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.159 22.974 4.356 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -1.244 25.224 4.333 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -1.420 24.086 3.012 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -3.310 24.662 5.270 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.672 24.183 3.623 1.00 0.00 H new ATOM 453 N GLU A 949 -1.975 21.631 7.289 1.00 0.00 N ATOM 454 CA GLU A 949 -1.866 20.935 8.570 1.00 0.00 C ATOM 455 C GLU A 949 -2.289 19.485 8.436 1.00 0.00 C ATOM 456 O GLU A 949 -1.908 18.644 9.243 1.00 0.00 O ATOM 457 CB GLU A 949 -2.749 21.607 9.621 1.00 0.00 C ATOM 458 CG GLU A 949 -2.217 22.934 10.119 1.00 0.00 C ATOM 459 CD GLU A 949 -0.895 22.788 10.837 1.00 0.00 C ATOM 460 OE1 GLU A 949 -0.778 21.890 11.696 1.00 0.00 O ATOM 461 OE2 GLU A 949 0.036 23.566 10.543 1.00 0.00 O ATOM 0 H GLU A 949 -2.532 22.485 7.328 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.822 20.980 8.880 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -3.743 21.761 9.200 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -2.863 20.932 10.469 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -2.097 23.614 9.276 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -2.946 23.386 10.792 1.00 0.00 H new ATOM 468 N GLU A 950 -3.056 19.202 7.399 1.00 0.00 N ATOM 469 CA GLU A 950 -3.560 17.865 7.162 1.00 0.00 C ATOM 470 C GLU A 950 -3.054 17.333 5.839 1.00 0.00 C ATOM 471 O GLU A 950 -3.270 16.174 5.513 1.00 0.00 O ATOM 472 CB GLU A 950 -5.080 17.835 7.161 1.00 0.00 C ATOM 473 CG GLU A 950 -5.690 17.077 8.328 1.00 0.00 C ATOM 474 CD GLU A 950 -5.244 17.590 9.679 1.00 0.00 C ATOM 475 OE1 GLU A 950 -5.717 18.668 10.100 1.00 0.00 O ATOM 476 OE2 GLU A 950 -4.439 16.900 10.337 1.00 0.00 O ATOM 0 H GLU A 950 -3.345 19.889 6.702 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.198 17.235 7.974 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -5.452 18.859 7.174 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.422 17.383 6.230 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -6.776 17.141 8.264 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -5.427 16.023 8.244 1.00 0.00 H new ATOM 483 N TYR A 951 -2.385 18.184 5.077 1.00 0.00 N ATOM 484 CA TYR A 951 -1.763 17.760 3.836 1.00 0.00 C ATOM 485 C TYR A 951 -0.811 16.609 4.101 1.00 0.00 C ATOM 486 O TYR A 951 -0.846 15.586 3.421 1.00 0.00 O ATOM 487 CB TYR A 951 -1.002 18.905 3.193 1.00 0.00 C ATOM 488 CG TYR A 951 -1.775 19.722 2.186 1.00 0.00 C ATOM 489 CD1 TYR A 951 -3.059 20.174 2.438 1.00 0.00 C ATOM 490 CD2 TYR A 951 -1.183 20.070 0.985 1.00 0.00 C ATOM 491 CE1 TYR A 951 -3.731 20.952 1.515 1.00 0.00 C ATOM 492 CE2 TYR A 951 -1.838 20.839 0.057 1.00 0.00 C ATOM 493 CZ TYR A 951 -3.117 21.284 0.324 1.00 0.00 C ATOM 494 OH TYR A 951 -3.782 22.064 -0.597 1.00 0.00 O ATOM 0 H TYR A 951 -2.260 19.172 5.297 1.00 0.00 H new ATOM 0 HA TYR A 951 -2.550 17.437 3.155 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -0.651 19.571 3.981 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.118 18.499 2.702 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -3.542 19.915 3.369 1.00 0.00 H new ATOM 0 HD2 TYR A 951 -0.181 19.728 0.773 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -4.732 21.299 1.724 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.357 21.094 -0.875 1.00 0.00 H new ATOM 0 HH TYR A 951 -3.209 22.206 -1.380 1.00 0.00 H new ATOM 504 N VAL A 952 0.043 16.759 5.098 1.00 0.00 N ATOM 505 CA VAL A 952 0.933 15.657 5.441 1.00 0.00 C ATOM 506 C VAL A 952 0.189 14.539 6.215 1.00 0.00 C ATOM 507 O VAL A 952 0.366 13.368 5.893 1.00 0.00 O ATOM 508 CB VAL A 952 2.252 16.114 6.142 1.00 0.00 C ATOM 509 CG1 VAL A 952 2.044 17.340 7.020 1.00 0.00 C ATOM 510 CG2 VAL A 952 2.866 14.976 6.949 1.00 0.00 C ATOM 0 H VAL A 952 0.141 17.599 5.668 1.00 0.00 H new ATOM 0 HA VAL A 952 1.259 15.223 4.496 1.00 0.00 H new ATOM 0 HB VAL A 952 2.947 16.395 5.351 1.00 0.00 H new ATOM 0 HG11 VAL A 952 2.989 17.619 7.485 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.682 18.167 6.410 1.00 0.00 H new ATOM 0 HG13 VAL A 952 1.311 17.113 7.795 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.783 15.322 7.426 1.00 0.00 H new ATOM 0 HG22 VAL A 952 2.160 14.649 7.713 1.00 0.00 H new ATOM 0 HG23 VAL A 952 3.095 14.142 6.286 1.00 0.00 H new ATOM 520 N PRO A 953 -0.663 14.853 7.225 1.00 0.00 N ATOM 521 CA PRO A 953 -1.524 13.844 7.886 1.00 0.00 C ATOM 522 C PRO A 953 -2.435 13.038 6.949 1.00 0.00 C ATOM 523 O PRO A 953 -2.795 11.910 7.273 1.00 0.00 O ATOM 524 CB PRO A 953 -2.367 14.677 8.836 1.00 0.00 C ATOM 525 CG PRO A 953 -1.481 15.810 9.176 1.00 0.00 C ATOM 526 CD PRO A 953 -0.793 16.160 7.889 1.00 0.00 C ATOM 0 HA PRO A 953 -0.907 13.078 8.355 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.289 15.016 8.363 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -2.653 14.110 9.722 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.051 16.655 9.562 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -0.761 15.532 9.946 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.380 16.860 7.294 1.00 0.00 H new ATOM 0 HD3 PRO A 953 0.178 16.624 8.062 1.00 0.00 H new ATOM 534 N MET A 954 -2.836 13.597 5.811 1.00 0.00 N ATOM 535 CA MET A 954 -3.629 12.827 4.853 1.00 0.00 C ATOM 536 C MET A 954 -2.748 11.754 4.241 1.00 0.00 C ATOM 537 O MET A 954 -3.138 10.596 4.083 1.00 0.00 O ATOM 538 CB MET A 954 -4.235 13.719 3.757 1.00 0.00 C ATOM 539 CG MET A 954 -3.247 14.244 2.733 1.00 0.00 C ATOM 540 SD MET A 954 -3.990 15.397 1.564 1.00 0.00 S ATOM 541 CE MET A 954 -4.587 16.653 2.688 1.00 0.00 C ATOM 0 H MET A 954 -2.632 14.557 5.532 1.00 0.00 H new ATOM 0 HA MET A 954 -4.465 12.369 5.382 1.00 0.00 H new ATOM 0 HB2 MET A 954 -5.008 13.153 3.236 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.727 14.568 4.232 1.00 0.00 H new ATOM 0 HG2 MET A 954 -2.425 14.739 3.250 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.820 13.404 2.185 1.00 0.00 H new ATOM 0 HE1 MET A 954 -4.613 17.616 2.177 1.00 0.00 H new ATOM 0 HE2 MET A 954 -5.591 16.393 3.024 1.00 0.00 H new ATOM 0 HE3 MET A 954 -3.922 16.717 3.549 1.00 0.00 H new ATOM 551 N VAL A 955 -1.554 12.163 3.877 1.00 0.00 N ATOM 552 CA VAL A 955 -0.521 11.231 3.487 1.00 0.00 C ATOM 553 C VAL A 955 -0.199 10.265 4.627 1.00 0.00 C ATOM 554 O VAL A 955 0.217 9.133 4.400 1.00 0.00 O ATOM 555 CB VAL A 955 0.740 11.968 3.028 1.00 0.00 C ATOM 556 CG1 VAL A 955 1.799 10.980 2.603 1.00 0.00 C ATOM 557 CG2 VAL A 955 0.395 12.909 1.889 1.00 0.00 C ATOM 0 H VAL A 955 -1.273 13.143 3.843 1.00 0.00 H new ATOM 0 HA VAL A 955 -0.897 10.650 2.645 1.00 0.00 H new ATOM 0 HB VAL A 955 1.136 12.553 3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 955 2.690 11.518 2.279 1.00 0.00 H new ATOM 0 HG12 VAL A 955 2.051 10.333 3.443 1.00 0.00 H new ATOM 0 HG13 VAL A 955 1.422 10.374 1.779 1.00 0.00 H new ATOM 0 HG21 VAL A 955 1.294 13.432 1.564 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.013 12.337 1.056 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -0.345 13.635 2.228 1.00 0.00 H new ATOM 567 N LYS A 956 -0.408 10.706 5.855 1.00 0.00 N ATOM 568 CA LYS A 956 -0.200 9.837 7.004 1.00 0.00 C ATOM 569 C LYS A 956 -1.229 8.711 6.978 1.00 0.00 C ATOM 570 O LYS A 956 -0.955 7.595 7.414 1.00 0.00 O ATOM 571 CB LYS A 956 -0.323 10.625 8.304 1.00 0.00 C ATOM 572 CG LYS A 956 0.024 9.823 9.546 1.00 0.00 C ATOM 573 CD LYS A 956 -0.625 10.411 10.786 1.00 0.00 C ATOM 574 CE LYS A 956 -2.140 10.310 10.705 1.00 0.00 C ATOM 575 NZ LYS A 956 -2.806 10.768 11.952 1.00 0.00 N ATOM 0 H LYS A 956 -0.718 11.650 6.083 1.00 0.00 H new ATOM 0 HA LYS A 956 0.804 9.417 6.953 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.330 11.496 8.252 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.344 10.996 8.397 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -0.303 8.791 9.417 1.00 0.00 H new ATOM 0 HG3 LYS A 956 1.106 9.801 9.676 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -0.268 9.886 11.672 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -0.331 11.455 10.895 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -2.497 10.907 9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.422 9.277 10.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -3.837 10.680 11.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -2.488 10.183 12.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.560 11.762 12.132 1.00 0.00 H new ATOM 589 N GLU A 957 -2.417 9.035 6.474 1.00 0.00 N ATOM 590 CA GLU A 957 -3.480 8.051 6.293 1.00 0.00 C ATOM 591 C GLU A 957 -2.993 6.886 5.427 1.00 0.00 C ATOM 592 O GLU A 957 -3.215 5.725 5.768 1.00 0.00 O ATOM 593 CB GLU A 957 -4.731 8.703 5.678 1.00 0.00 C ATOM 594 CG GLU A 957 -5.232 9.917 6.452 1.00 0.00 C ATOM 595 CD GLU A 957 -5.731 9.583 7.846 1.00 0.00 C ATOM 596 OE1 GLU A 957 -4.913 9.203 8.709 1.00 0.00 O ATOM 597 OE2 GLU A 957 -6.946 9.727 8.092 1.00 0.00 O ATOM 0 H GLU A 957 -2.669 9.979 6.182 1.00 0.00 H new ATOM 0 HA GLU A 957 -3.752 7.659 7.273 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.508 9.003 4.654 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.528 7.962 5.626 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.426 10.647 6.528 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -6.038 10.389 5.890 1.00 0.00 H new ATOM 604 N VAL A 958 -2.309 7.184 4.317 1.00 0.00 N ATOM 605 CA VAL A 958 -1.724 6.120 3.495 1.00 0.00 C ATOM 606 C VAL A 958 -0.535 5.458 4.205 1.00 0.00 C ATOM 607 O VAL A 958 -0.212 4.298 3.940 1.00 0.00 O ATOM 608 CB VAL A 958 -1.288 6.614 2.089 1.00 0.00 C ATOM 609 CG1 VAL A 958 -2.348 7.514 1.492 1.00 0.00 C ATOM 610 CG2 VAL A 958 0.055 7.325 2.117 1.00 0.00 C ATOM 0 H VAL A 958 -2.149 8.131 3.973 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.514 5.383 3.353 1.00 0.00 H new ATOM 0 HB VAL A 958 -1.172 5.731 1.461 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -2.026 7.851 0.507 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.283 6.962 1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.499 8.378 2.140 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.315 7.651 1.110 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -0.006 8.192 2.775 1.00 0.00 H new ATOM 0 HG23 VAL A 958 0.820 6.643 2.486 1.00 0.00 H new ATOM 620 N GLY A 959 0.109 6.184 5.115 1.00 0.00 N ATOM 621 CA GLY A 959 1.215 5.610 5.864 1.00 0.00 C ATOM 622 C GLY A 959 0.736 4.617 6.904 1.00 0.00 C ATOM 623 O GLY A 959 1.306 3.534 7.055 1.00 0.00 O ATOM 0 H GLY A 959 -0.113 7.152 5.346 1.00 0.00 H new ATOM 0 HA2 GLY A 959 1.901 5.114 5.177 1.00 0.00 H new ATOM 0 HA3 GLY A 959 1.775 6.407 6.353 1.00 0.00 H new ATOM 627 N LEU A 960 -0.323 4.987 7.616 1.00 0.00 N ATOM 628 CA LEU A 960 -1.010 4.066 8.514 1.00 0.00 C ATOM 629 C LEU A 960 -1.599 2.910 7.719 1.00 0.00 C ATOM 630 O LEU A 960 -1.812 1.819 8.247 1.00 0.00 O ATOM 631 CB LEU A 960 -2.109 4.790 9.298 1.00 0.00 C ATOM 632 CG LEU A 960 -1.621 5.904 10.228 1.00 0.00 C ATOM 633 CD1 LEU A 960 -2.795 6.573 10.925 1.00 0.00 C ATOM 634 CD2 LEU A 960 -0.639 5.354 11.249 1.00 0.00 C ATOM 0 H LEU A 960 -0.726 5.924 7.588 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.287 3.673 9.229 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -2.819 5.216 8.589 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -2.653 4.056 9.892 1.00 0.00 H new ATOM 0 HG LEU A 960 -1.108 6.653 9.625 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -2.427 7.362 11.581 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -3.463 7.004 10.179 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -3.337 5.834 11.515 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -0.303 6.160 11.901 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -1.128 4.584 11.846 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.219 4.923 10.733 1.00 0.00 H new ATOM 646 N ALA A 961 -1.855 3.164 6.447 1.00 0.00 N ATOM 647 CA ALA A 961 -2.282 2.118 5.538 1.00 0.00 C ATOM 648 C ALA A 961 -1.170 1.097 5.347 1.00 0.00 C ATOM 649 O ALA A 961 -1.409 -0.096 5.470 1.00 0.00 O ATOM 650 CB ALA A 961 -2.717 2.695 4.210 1.00 0.00 C ATOM 0 H ALA A 961 -1.774 4.087 6.021 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.143 1.614 5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.032 1.888 3.548 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.549 3.381 4.367 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -1.884 3.232 3.756 1.00 0.00 H new ATOM 656 N LEU A 962 0.045 1.563 5.046 1.00 0.00 N ATOM 657 CA LEU A 962 1.208 0.683 4.991 1.00 0.00 C ATOM 658 C LEU A 962 1.454 -0.003 6.341 1.00 0.00 C ATOM 659 O LEU A 962 1.805 -1.178 6.384 1.00 0.00 O ATOM 660 CB LEU A 962 2.441 1.471 4.540 1.00 0.00 C ATOM 661 CG LEU A 962 3.795 0.806 4.808 1.00 0.00 C ATOM 662 CD1 LEU A 962 3.971 -0.434 3.948 1.00 0.00 C ATOM 663 CD2 LEU A 962 4.929 1.793 4.564 1.00 0.00 C ATOM 0 H LEU A 962 0.245 2.541 4.838 1.00 0.00 H new ATOM 0 HA LEU A 962 1.010 -0.102 4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 962 2.356 1.660 3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.430 2.441 5.037 1.00 0.00 H new ATOM 0 HG LEU A 962 3.822 0.498 5.853 1.00 0.00 H new ATOM 0 HD11 LEU A 962 4.940 -0.887 4.157 1.00 0.00 H new ATOM 0 HD12 LEU A 962 3.180 -1.149 4.174 1.00 0.00 H new ATOM 0 HD13 LEU A 962 3.920 -0.157 2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 962 5.884 1.305 4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.899 2.133 3.529 1.00 0.00 H new ATOM 0 HD23 LEU A 962 4.816 2.649 5.230 1.00 0.00 H new ATOM 675 N ARG A 963 1.296 0.728 7.441 1.00 0.00 N ATOM 676 CA ARG A 963 1.346 0.119 8.775 1.00 0.00 C ATOM 677 C ARG A 963 0.340 -1.037 8.895 1.00 0.00 C ATOM 678 O ARG A 963 0.703 -2.161 9.253 1.00 0.00 O ATOM 679 CB ARG A 963 1.071 1.173 9.857 1.00 0.00 C ATOM 680 CG ARG A 963 1.036 0.602 11.266 1.00 0.00 C ATOM 681 CD ARG A 963 2.393 0.073 11.699 1.00 0.00 C ATOM 682 NE ARG A 963 3.340 1.145 12.003 1.00 0.00 N ATOM 683 CZ ARG A 963 4.663 1.015 11.926 1.00 0.00 C ATOM 684 NH1 ARG A 963 5.194 -0.122 11.491 1.00 0.00 N ATOM 685 NH2 ARG A 963 5.454 2.018 12.286 1.00 0.00 N ATOM 0 H ARG A 963 1.133 1.735 7.440 1.00 0.00 H new ATOM 0 HA ARG A 963 2.348 -0.285 8.921 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.839 1.944 9.805 1.00 0.00 H new ATOM 0 HB3 ARG A 963 0.118 1.658 9.646 1.00 0.00 H new ATOM 0 HG2 ARG A 963 0.709 1.374 11.962 1.00 0.00 H new ATOM 0 HG3 ARG A 963 0.301 -0.202 11.313 1.00 0.00 H new ATOM 0 HD2 ARG A 963 2.269 -0.559 12.579 1.00 0.00 H new ATOM 0 HD3 ARG A 963 2.803 -0.557 10.909 1.00 0.00 H new ATOM 0 HE ARG A 963 2.964 2.048 12.292 1.00 0.00 H new ATOM 0 HH11 ARG A 963 4.588 -0.895 11.216 1.00 0.00 H new ATOM 0 HH12 ARG A 963 6.207 -0.222 11.432 1.00 0.00 H new ATOM 0 HH21 ARG A 963 5.049 2.891 12.623 1.00 0.00 H new ATOM 0 HH22 ARG A 963 6.467 1.915 12.226 1.00 0.00 H new ATOM 699 N THR A 964 -0.922 -0.743 8.618 1.00 0.00 N ATOM 700 CA THR A 964 -1.965 -1.771 8.583 1.00 0.00 C ATOM 701 C THR A 964 -1.583 -2.889 7.602 1.00 0.00 C ATOM 702 O THR A 964 -1.736 -4.082 7.885 1.00 0.00 O ATOM 703 CB THR A 964 -3.319 -1.152 8.177 1.00 0.00 C ATOM 704 OG1 THR A 964 -3.630 -0.061 9.054 1.00 0.00 O ATOM 705 CG2 THR A 964 -4.438 -2.182 8.229 1.00 0.00 C ATOM 0 H THR A 964 -1.254 0.199 8.413 1.00 0.00 H new ATOM 0 HA THR A 964 -2.060 -2.197 9.582 1.00 0.00 H new ATOM 0 HB THR A 964 -3.235 -0.794 7.151 1.00 0.00 H new ATOM 0 HG1 THR A 964 -3.124 0.733 8.781 1.00 0.00 H new ATOM 0 HG21 THR A 964 -5.378 -1.713 7.937 1.00 0.00 H new ATOM 0 HG22 THR A 964 -4.212 -2.999 7.544 1.00 0.00 H new ATOM 0 HG23 THR A 964 -4.526 -2.572 9.243 1.00 0.00 H new ATOM 713 N LEU A 965 -1.062 -2.476 6.459 1.00 0.00 N ATOM 714 CA LEU A 965 -0.562 -3.377 5.429 1.00 0.00 C ATOM 715 C LEU A 965 0.475 -4.338 6.005 1.00 0.00 C ATOM 716 O LEU A 965 0.493 -5.524 5.674 1.00 0.00 O ATOM 717 CB LEU A 965 0.085 -2.531 4.334 1.00 0.00 C ATOM 718 CG LEU A 965 0.440 -3.252 3.048 1.00 0.00 C ATOM 719 CD1 LEU A 965 -0.775 -3.319 2.155 1.00 0.00 C ATOM 720 CD2 LEU A 965 1.583 -2.542 2.349 1.00 0.00 C ATOM 0 H LEU A 965 -0.972 -1.490 6.215 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.387 -3.967 5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -0.591 -1.711 4.091 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.994 -2.085 4.738 1.00 0.00 H new ATOM 0 HG LEU A 965 0.762 -4.267 3.279 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.519 -3.837 1.231 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -1.572 -3.859 2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -1.112 -2.309 1.923 1.00 0.00 H new ATOM 0 HD21 LEU A 965 1.829 -3.069 1.427 1.00 0.00 H new ATOM 0 HD22 LEU A 965 1.287 -1.519 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 965 2.456 -2.527 3.002 1.00 0.00 H new ATOM 732 N LEU A 966 1.321 -3.804 6.875 1.00 0.00 N ATOM 733 CA LEU A 966 2.398 -4.566 7.506 1.00 0.00 C ATOM 734 C LEU A 966 1.834 -5.742 8.306 1.00 0.00 C ATOM 735 O LEU A 966 2.454 -6.803 8.383 1.00 0.00 O ATOM 736 CB LEU A 966 3.235 -3.630 8.395 1.00 0.00 C ATOM 737 CG LEU A 966 4.534 -4.209 8.971 1.00 0.00 C ATOM 738 CD1 LEU A 966 5.519 -3.085 9.250 1.00 0.00 C ATOM 739 CD2 LEU A 966 4.267 -4.985 10.255 1.00 0.00 C ATOM 0 H LEU A 966 1.282 -2.827 7.166 1.00 0.00 H new ATOM 0 HA LEU A 966 3.045 -4.982 6.734 1.00 0.00 H new ATOM 0 HB2 LEU A 966 3.486 -2.743 7.814 1.00 0.00 H new ATOM 0 HB3 LEU A 966 2.611 -3.301 9.226 1.00 0.00 H new ATOM 0 HG LEU A 966 4.956 -4.895 8.236 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.440 -3.501 9.659 1.00 0.00 H new ATOM 0 HD12 LEU A 966 5.740 -2.556 8.323 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.084 -2.390 9.969 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.205 -5.384 10.641 1.00 0.00 H new ATOM 0 HD22 LEU A 966 3.823 -4.320 10.996 1.00 0.00 H new ATOM 0 HD23 LEU A 966 3.581 -5.807 10.048 1.00 0.00 H new ATOM 751 N ALA A 967 0.653 -5.555 8.886 1.00 0.00 N ATOM 752 CA ALA A 967 -0.026 -6.639 9.589 1.00 0.00 C ATOM 753 C ALA A 967 -0.353 -7.774 8.621 1.00 0.00 C ATOM 754 O ALA A 967 -0.242 -8.951 8.961 1.00 0.00 O ATOM 755 CB ALA A 967 -1.287 -6.129 10.270 1.00 0.00 C ATOM 0 H ALA A 967 0.148 -4.669 8.884 1.00 0.00 H new ATOM 0 HA ALA A 967 0.641 -7.025 10.360 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.779 -6.952 10.789 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -1.024 -5.353 10.989 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.963 -5.716 9.521 1.00 0.00 H new ATOM 761 N THR A 968 -0.728 -7.410 7.402 1.00 0.00 N ATOM 762 CA THR A 968 -0.972 -8.398 6.355 1.00 0.00 C ATOM 763 C THR A 968 0.331 -9.032 5.896 1.00 0.00 C ATOM 764 O THR A 968 0.369 -10.210 5.551 1.00 0.00 O ATOM 765 CB THR A 968 -1.729 -7.787 5.160 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.096 -8.174 5.234 1.00 0.00 O ATOM 767 CG2 THR A 968 -1.154 -8.204 3.813 1.00 0.00 C ATOM 0 H THR A 968 -0.870 -6.442 7.113 1.00 0.00 H new ATOM 0 HA THR A 968 -1.604 -9.176 6.782 1.00 0.00 H new ATOM 0 HB THR A 968 -1.623 -6.704 5.226 1.00 0.00 H new ATOM 0 HG1 THR A 968 -3.615 -7.669 4.574 1.00 0.00 H new ATOM 0 HG21 THR A 968 -1.731 -7.741 3.012 1.00 0.00 H new ATOM 0 HG22 THR A 968 -0.115 -7.881 3.745 1.00 0.00 H new ATOM 0 HG23 THR A 968 -1.204 -9.289 3.716 1.00 0.00 H new ATOM 775 N VAL A 969 1.392 -8.243 5.901 1.00 0.00 N ATOM 776 CA VAL A 969 2.728 -8.749 5.611 1.00 0.00 C ATOM 777 C VAL A 969 3.076 -9.902 6.556 1.00 0.00 C ATOM 778 O VAL A 969 3.820 -10.804 6.194 1.00 0.00 O ATOM 779 CB VAL A 969 3.798 -7.635 5.711 1.00 0.00 C ATOM 780 CG1 VAL A 969 5.195 -8.183 5.444 1.00 0.00 C ATOM 781 CG2 VAL A 969 3.483 -6.505 4.742 1.00 0.00 C ATOM 0 H VAL A 969 1.356 -7.244 6.104 1.00 0.00 H new ATOM 0 HA VAL A 969 2.726 -9.115 4.584 1.00 0.00 H new ATOM 0 HB VAL A 969 3.777 -7.244 6.728 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.923 -7.376 5.522 1.00 0.00 H new ATOM 0 HG12 VAL A 969 5.429 -8.955 6.177 1.00 0.00 H new ATOM 0 HG13 VAL A 969 5.233 -8.611 4.442 1.00 0.00 H new ATOM 0 HG21 VAL A 969 4.246 -5.731 4.826 1.00 0.00 H new ATOM 0 HG22 VAL A 969 3.470 -6.892 3.723 1.00 0.00 H new ATOM 0 HG23 VAL A 969 2.508 -6.081 4.982 1.00 0.00 H new ATOM 791 N ASP A 970 2.524 -9.861 7.766 1.00 0.00 N ATOM 792 CA ASP A 970 2.735 -10.924 8.752 1.00 0.00 C ATOM 793 C ASP A 970 1.833 -12.120 8.506 1.00 0.00 C ATOM 794 O ASP A 970 2.200 -13.234 8.824 1.00 0.00 O ATOM 795 CB ASP A 970 2.532 -10.381 10.169 1.00 0.00 C ATOM 796 CG ASP A 970 2.777 -11.426 11.241 1.00 0.00 C ATOM 797 OD1 ASP A 970 3.951 -11.628 11.615 1.00 0.00 O ATOM 798 OD2 ASP A 970 1.794 -12.036 11.719 1.00 0.00 O ATOM 0 H ASP A 970 1.925 -9.102 8.090 1.00 0.00 H new ATOM 0 HA ASP A 970 3.763 -11.269 8.645 1.00 0.00 H new ATOM 0 HB2 ASP A 970 3.204 -9.538 10.330 1.00 0.00 H new ATOM 0 HB3 ASP A 970 1.515 -10.001 10.265 1.00 0.00 H new ATOM 803 N GLU A 971 0.667 -11.894 7.941 1.00 0.00 N ATOM 804 CA GLU A 971 -0.176 -13.002 7.496 1.00 0.00 C ATOM 805 C GLU A 971 0.497 -13.660 6.296 1.00 0.00 C ATOM 806 O GLU A 971 0.571 -14.893 6.150 1.00 0.00 O ATOM 807 CB GLU A 971 -1.558 -12.490 7.099 1.00 0.00 C ATOM 808 CG GLU A 971 -2.199 -11.612 8.154 1.00 0.00 C ATOM 809 CD GLU A 971 -2.492 -12.357 9.440 1.00 0.00 C ATOM 810 OE1 GLU A 971 -3.181 -13.399 9.392 1.00 0.00 O ATOM 811 OE2 GLU A 971 -2.043 -11.898 10.510 1.00 0.00 O ATOM 0 H GLU A 971 0.277 -10.966 7.776 1.00 0.00 H new ATOM 0 HA GLU A 971 -0.299 -13.723 8.304 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.476 -11.927 6.169 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -2.209 -13.341 6.900 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.540 -10.771 8.369 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -3.127 -11.198 7.760 1.00 0.00 H new ATOM 818 N SER A 972 0.989 -12.798 5.441 1.00 0.00 N ATOM 819 CA SER A 972 1.763 -13.185 4.300 1.00 0.00 C ATOM 820 C SER A 972 3.121 -13.766 4.708 1.00 0.00 C ATOM 821 O SER A 972 3.758 -14.461 3.928 1.00 0.00 O ATOM 822 CB SER A 972 1.902 -12.014 3.341 1.00 0.00 C ATOM 823 OG SER A 972 2.592 -12.396 2.164 1.00 0.00 O ATOM 0 H SER A 972 0.857 -11.790 5.525 1.00 0.00 H new ATOM 0 HA SER A 972 1.235 -13.984 3.778 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.914 -11.635 3.080 1.00 0.00 H new ATOM 0 HB3 SER A 972 2.436 -11.200 3.831 1.00 0.00 H new ATOM 0 HG SER A 972 3.160 -13.172 2.355 1.00 0.00 H new ATOM 829 N LEU A 973 3.594 -13.430 5.896 1.00 0.00 N ATOM 830 CA LEU A 973 4.871 -13.952 6.370 1.00 0.00 C ATOM 831 C LEU A 973 4.860 -15.485 6.409 1.00 0.00 C ATOM 832 O LEU A 973 5.740 -16.085 5.829 1.00 0.00 O ATOM 833 CB LEU A 973 5.240 -13.345 7.736 1.00 0.00 C ATOM 834 CG LEU A 973 6.702 -13.502 8.179 1.00 0.00 C ATOM 835 CD1 LEU A 973 7.021 -12.508 9.283 1.00 0.00 C ATOM 836 CD2 LEU A 973 6.988 -14.916 8.666 1.00 0.00 C ATOM 0 H LEU A 973 3.120 -12.804 6.547 1.00 0.00 H new ATOM 0 HA LEU A 973 5.645 -13.654 5.663 1.00 0.00 H new ATOM 0 HB2 LEU A 973 5.002 -12.282 7.713 1.00 0.00 H new ATOM 0 HB3 LEU A 973 4.602 -13.798 8.495 1.00 0.00 H new ATOM 0 HG LEU A 973 7.335 -13.305 7.314 1.00 0.00 H new ATOM 0 HD11 LEU A 973 8.060 -12.627 9.591 1.00 0.00 H new ATOM 0 HD12 LEU A 973 6.865 -11.494 8.916 1.00 0.00 H new ATOM 0 HD13 LEU A 973 6.367 -12.689 10.136 1.00 0.00 H new ATOM 0 HD21 LEU A 973 8.032 -14.991 8.972 1.00 0.00 H new ATOM 0 HD22 LEU A 973 6.344 -15.146 9.515 1.00 0.00 H new ATOM 0 HD23 LEU A 973 6.794 -15.624 7.861 1.00 0.00 H new ATOM 848 N PRO A 974 3.894 -16.167 7.067 1.00 0.00 N ATOM 849 CA PRO A 974 3.805 -17.629 6.977 1.00 0.00 C ATOM 850 C PRO A 974 3.604 -18.099 5.542 1.00 0.00 C ATOM 851 O PRO A 974 4.138 -19.141 5.129 1.00 0.00 O ATOM 852 CB PRO A 974 2.586 -17.983 7.831 1.00 0.00 C ATOM 853 CG PRO A 974 2.429 -16.829 8.749 1.00 0.00 C ATOM 854 CD PRO A 974 2.877 -15.631 7.966 1.00 0.00 C ATOM 0 HA PRO A 974 4.722 -18.111 7.317 1.00 0.00 H new ATOM 0 HB2 PRO A 974 1.698 -18.124 7.216 1.00 0.00 H new ATOM 0 HB3 PRO A 974 2.743 -18.910 8.382 1.00 0.00 H new ATOM 0 HG2 PRO A 974 1.393 -16.722 9.072 1.00 0.00 H new ATOM 0 HG3 PRO A 974 3.031 -16.958 9.648 1.00 0.00 H new ATOM 0 HD2 PRO A 974 2.051 -15.181 7.414 1.00 0.00 H new ATOM 0 HD3 PRO A 974 3.285 -14.857 8.616 1.00 0.00 H new ATOM 862 N VAL A 975 2.866 -17.324 4.748 1.00 0.00 N ATOM 863 CA VAL A 975 2.622 -17.748 3.379 1.00 0.00 C ATOM 864 C VAL A 975 3.848 -17.500 2.492 1.00 0.00 C ATOM 865 O VAL A 975 3.912 -18.000 1.367 1.00 0.00 O ATOM 866 CB VAL A 975 1.355 -17.105 2.763 1.00 0.00 C ATOM 867 CG1 VAL A 975 0.132 -17.392 3.617 1.00 0.00 C ATOM 868 CG2 VAL A 975 1.517 -15.628 2.550 1.00 0.00 C ATOM 0 H VAL A 975 2.444 -16.436 5.018 1.00 0.00 H new ATOM 0 HA VAL A 975 2.438 -18.821 3.422 1.00 0.00 H new ATOM 0 HB VAL A 975 1.210 -17.560 1.783 1.00 0.00 H new ATOM 0 HG11 VAL A 975 -0.745 -16.930 3.164 1.00 0.00 H new ATOM 0 HG12 VAL A 975 -0.020 -18.469 3.685 1.00 0.00 H new ATOM 0 HG13 VAL A 975 0.282 -16.983 4.616 1.00 0.00 H new ATOM 0 HG21 VAL A 975 0.604 -15.221 2.116 1.00 0.00 H new ATOM 0 HG22 VAL A 975 1.713 -15.142 3.506 1.00 0.00 H new ATOM 0 HG23 VAL A 975 2.352 -15.447 1.873 1.00 0.00 H new ATOM 878 N LEU A 976 4.847 -16.770 3.004 1.00 0.00 N ATOM 879 CA LEU A 976 6.016 -16.445 2.193 1.00 0.00 C ATOM 880 C LEU A 976 7.053 -17.579 2.144 1.00 0.00 C ATOM 881 O LEU A 976 7.598 -17.825 1.069 1.00 0.00 O ATOM 882 CB LEU A 976 6.642 -15.069 2.548 1.00 0.00 C ATOM 883 CG LEU A 976 7.412 -14.926 3.864 1.00 0.00 C ATOM 884 CD1 LEU A 976 8.816 -15.487 3.746 1.00 0.00 C ATOM 885 CD2 LEU A 976 7.471 -13.464 4.272 1.00 0.00 C ATOM 0 H LEU A 976 4.867 -16.402 3.955 1.00 0.00 H new ATOM 0 HA LEU A 976 5.641 -16.345 1.174 1.00 0.00 H new ATOM 0 HB2 LEU A 976 7.319 -14.796 1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 976 5.838 -14.333 2.554 1.00 0.00 H new ATOM 0 HG LEU A 976 6.884 -15.497 4.628 1.00 0.00 H new ATOM 0 HD11 LEU A 976 9.336 -15.370 4.697 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.765 -16.545 3.488 1.00 0.00 H new ATOM 0 HD13 LEU A 976 9.358 -14.950 2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 976 8.020 -13.370 5.209 1.00 0.00 H new ATOM 0 HD22 LEU A 976 7.977 -12.890 3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 976 6.459 -13.082 4.405 1.00 0.00 H new ATOM 897 N PRO A 977 7.358 -18.316 3.246 1.00 0.00 N ATOM 898 CA PRO A 977 8.215 -19.488 3.131 1.00 0.00 C ATOM 899 C PRO A 977 7.479 -20.587 2.394 1.00 0.00 C ATOM 900 O PRO A 977 8.093 -21.431 1.741 1.00 0.00 O ATOM 901 CB PRO A 977 8.509 -19.894 4.574 1.00 0.00 C ATOM 902 CG PRO A 977 7.373 -19.348 5.352 1.00 0.00 C ATOM 903 CD PRO A 977 6.944 -18.100 4.635 1.00 0.00 C ATOM 0 HA PRO A 977 9.131 -19.294 2.573 1.00 0.00 H new ATOM 0 HB2 PRO A 977 8.576 -20.977 4.676 1.00 0.00 H new ATOM 0 HB3 PRO A 977 9.459 -19.483 4.916 1.00 0.00 H new ATOM 0 HG2 PRO A 977 6.556 -20.067 5.407 1.00 0.00 H new ATOM 0 HG3 PRO A 977 7.672 -19.126 6.377 1.00 0.00 H new ATOM 0 HD2 PRO A 977 5.867 -17.949 4.710 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.420 -17.215 5.058 1.00 0.00 H new ATOM 911 N ALA A 978 6.149 -20.553 2.499 1.00 0.00 N ATOM 912 CA ALA A 978 5.304 -21.438 1.718 1.00 0.00 C ATOM 913 C ALA A 978 5.561 -21.245 0.224 1.00 0.00 C ATOM 914 O ALA A 978 5.938 -22.190 -0.466 1.00 0.00 O ATOM 915 CB ALA A 978 3.839 -21.192 2.045 1.00 0.00 C ATOM 0 H ALA A 978 5.641 -19.921 3.118 1.00 0.00 H new ATOM 0 HA ALA A 978 5.548 -22.468 1.976 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.216 -21.862 1.452 1.00 0.00 H new ATOM 0 HB2 ALA A 978 3.666 -21.379 3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 978 3.583 -20.158 1.812 1.00 0.00 H new ATOM 921 N SER A 979 5.373 -20.017 -0.266 1.00 0.00 N ATOM 922 CA SER A 979 5.557 -19.721 -1.694 1.00 0.00 C ATOM 923 C SER A 979 5.581 -18.214 -1.994 1.00 0.00 C ATOM 924 O SER A 979 5.846 -17.809 -3.128 1.00 0.00 O ATOM 925 CB SER A 979 4.430 -20.370 -2.506 1.00 0.00 C ATOM 926 OG SER A 979 4.625 -21.769 -2.642 1.00 0.00 O ATOM 0 H SER A 979 5.095 -19.214 0.299 1.00 0.00 H new ATOM 0 HA SER A 979 6.527 -20.130 -1.977 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.474 -20.181 -2.019 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.381 -19.911 -3.493 1.00 0.00 H new ATOM 0 HG SER A 979 5.411 -22.042 -2.124 1.00 0.00 H new ATOM 932 N THR A 980 5.305 -17.393 -0.988 1.00 0.00 N ATOM 933 CA THR A 980 5.079 -15.961 -1.200 1.00 0.00 C ATOM 934 C THR A 980 6.340 -15.084 -1.165 1.00 0.00 C ATOM 935 O THR A 980 6.331 -14.007 -1.752 1.00 0.00 O ATOM 936 CB THR A 980 4.087 -15.418 -0.164 1.00 0.00 C ATOM 937 OG1 THR A 980 2.861 -16.142 -0.260 1.00 0.00 O ATOM 938 CG2 THR A 980 3.829 -13.933 -0.360 1.00 0.00 C ATOM 0 H THR A 980 5.231 -17.691 -0.015 1.00 0.00 H new ATOM 0 HA THR A 980 4.684 -15.898 -2.214 1.00 0.00 H new ATOM 0 HB THR A 980 4.521 -15.549 0.827 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.938 -16.984 0.236 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.121 -13.584 0.392 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.766 -13.385 -0.259 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.415 -13.764 -1.354 1.00 0.00 H new ATOM 946 N HIS A 981 7.418 -15.526 -0.513 1.00 0.00 N ATOM 947 CA HIS A 981 8.602 -14.666 -0.315 1.00 0.00 C ATOM 948 C HIS A 981 9.063 -14.036 -1.633 1.00 0.00 C ATOM 949 O HIS A 981 9.529 -12.897 -1.653 1.00 0.00 O ATOM 950 CB HIS A 981 9.753 -15.473 0.316 1.00 0.00 C ATOM 951 CG HIS A 981 11.007 -14.679 0.579 1.00 0.00 C ATOM 952 ND1 HIS A 981 11.386 -14.252 1.835 1.00 0.00 N ATOM 953 CD2 HIS A 981 11.972 -14.243 -0.265 1.00 0.00 C ATOM 954 CE1 HIS A 981 12.521 -13.587 1.747 1.00 0.00 C ATOM 955 NE2 HIS A 981 12.900 -13.566 0.485 1.00 0.00 N ATOM 0 H HIS A 981 7.502 -16.461 -0.115 1.00 0.00 H new ATOM 0 HA HIS A 981 8.317 -13.861 0.363 1.00 0.00 H new ATOM 0 HB2 HIS A 981 9.406 -15.901 1.257 1.00 0.00 H new ATOM 0 HB3 HIS A 981 9.998 -16.307 -0.342 1.00 0.00 H new ATOM 0 HD2 HIS A 981 12.005 -14.400 -1.333 1.00 0.00 H new ATOM 0 HE1 HIS A 981 13.052 -13.135 2.572 1.00 0.00 H new ATOM 0 HE2 HIS A 981 13.744 -13.120 0.125 1.00 0.00 H new ATOM 964 N ARG A 982 8.925 -14.772 -2.716 1.00 0.00 N ATOM 965 CA ARG A 982 9.224 -14.234 -4.038 1.00 0.00 C ATOM 966 C ARG A 982 8.347 -13.010 -4.368 1.00 0.00 C ATOM 967 O ARG A 982 8.869 -11.934 -4.684 1.00 0.00 O ATOM 968 CB ARG A 982 9.040 -15.325 -5.089 1.00 0.00 C ATOM 969 CG ARG A 982 10.023 -16.472 -4.929 1.00 0.00 C ATOM 970 CD ARG A 982 9.614 -17.685 -5.741 1.00 0.00 C ATOM 971 NE ARG A 982 8.326 -18.222 -5.306 1.00 0.00 N ATOM 972 CZ ARG A 982 7.745 -19.292 -5.846 1.00 0.00 C ATOM 973 NH1 ARG A 982 8.375 -19.989 -6.784 1.00 0.00 N ATOM 974 NH2 ARG A 982 6.544 -19.677 -5.426 1.00 0.00 N ATOM 0 H ARG A 982 8.609 -15.742 -2.713 1.00 0.00 H new ATOM 0 HA ARG A 982 10.261 -13.898 -4.042 1.00 0.00 H new ATOM 0 HB2 ARG A 982 8.023 -15.713 -5.028 1.00 0.00 H new ATOM 0 HB3 ARG A 982 9.156 -14.890 -6.082 1.00 0.00 H new ATOM 0 HG2 ARG A 982 11.016 -16.145 -5.239 1.00 0.00 H new ATOM 0 HG3 ARG A 982 10.092 -16.746 -3.876 1.00 0.00 H new ATOM 0 HD2 ARG A 982 9.557 -17.414 -6.795 1.00 0.00 H new ATOM 0 HD3 ARG A 982 10.378 -18.457 -5.651 1.00 0.00 H new ATOM 0 HE ARG A 982 7.843 -17.749 -4.543 1.00 0.00 H new ATOM 0 HH11 ARG A 982 9.305 -19.705 -7.092 1.00 0.00 H new ATOM 0 HH12 ARG A 982 7.929 -20.808 -7.197 1.00 0.00 H new ATOM 0 HH21 ARG A 982 6.069 -19.153 -4.691 1.00 0.00 H new ATOM 0 HH22 ARG A 982 6.098 -20.496 -5.839 1.00 0.00 H new ATOM 988 N GLU A 983 7.025 -13.147 -4.244 1.00 0.00 N ATOM 989 CA GLU A 983 6.127 -12.041 -4.568 1.00 0.00 C ATOM 990 C GLU A 983 6.146 -10.967 -3.502 1.00 0.00 C ATOM 991 O GLU A 983 6.234 -9.782 -3.815 1.00 0.00 O ATOM 992 CB GLU A 983 4.681 -12.488 -4.721 1.00 0.00 C ATOM 993 CG GLU A 983 3.990 -11.808 -5.882 1.00 0.00 C ATOM 994 CD GLU A 983 4.135 -12.622 -7.154 1.00 0.00 C ATOM 995 OE1 GLU A 983 3.309 -13.533 -7.383 1.00 0.00 O ATOM 996 OE2 GLU A 983 5.096 -12.387 -7.911 1.00 0.00 O ATOM 0 H GLU A 983 6.560 -13.998 -3.927 1.00 0.00 H new ATOM 0 HA GLU A 983 6.498 -11.650 -5.515 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.650 -13.568 -4.865 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.137 -12.273 -3.801 1.00 0.00 H new ATOM 0 HG2 GLU A 983 2.933 -11.672 -5.652 1.00 0.00 H new ATOM 0 HG3 GLU A 983 4.414 -10.815 -6.031 1.00 0.00 H new ATOM 1003 N ILE A 984 6.028 -11.377 -2.244 1.00 0.00 N ATOM 1004 CA ILE A 984 5.888 -10.427 -1.151 1.00 0.00 C ATOM 1005 C ILE A 984 7.034 -9.434 -1.177 1.00 0.00 C ATOM 1006 O ILE A 984 6.826 -8.244 -0.992 1.00 0.00 O ATOM 1007 CB ILE A 984 5.787 -11.123 0.232 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.564 -10.101 1.351 1.00 0.00 C ATOM 1009 CG2 ILE A 984 7.027 -11.944 0.528 1.00 0.00 C ATOM 1010 CD1 ILE A 984 4.217 -9.417 1.295 1.00 0.00 C ATOM 0 H ILE A 984 6.027 -12.356 -1.958 1.00 0.00 H new ATOM 0 HA ILE A 984 4.949 -9.894 -1.298 1.00 0.00 H new ATOM 0 HB ILE A 984 4.928 -11.792 0.192 1.00 0.00 H new ATOM 0 HG12 ILE A 984 5.666 -10.602 2.313 1.00 0.00 H new ATOM 0 HG13 ILE A 984 6.347 -9.345 1.301 1.00 0.00 H new ATOM 0 HG21 ILE A 984 6.925 -12.419 1.504 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.147 -12.711 -0.238 1.00 0.00 H new ATOM 0 HG23 ILE A 984 7.902 -11.294 0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 984 4.134 -8.708 2.119 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.118 -8.886 0.348 1.00 0.00 H new ATOM 0 HD13 ILE A 984 3.426 -10.163 1.377 1.00 0.00 H new ATOM 1022 N GLU A 985 8.225 -9.917 -1.492 1.00 0.00 N ATOM 1023 CA GLU A 985 9.395 -9.058 -1.545 1.00 0.00 C ATOM 1024 C GLU A 985 9.377 -8.147 -2.770 1.00 0.00 C ATOM 1025 O GLU A 985 9.944 -7.054 -2.726 1.00 0.00 O ATOM 1026 CB GLU A 985 10.686 -9.877 -1.489 1.00 0.00 C ATOM 1027 CG GLU A 985 10.941 -10.493 -0.121 1.00 0.00 C ATOM 1028 CD GLU A 985 11.090 -9.452 0.974 1.00 0.00 C ATOM 1029 OE1 GLU A 985 10.087 -8.786 1.312 1.00 0.00 O ATOM 1030 OE2 GLU A 985 12.206 -9.309 1.517 1.00 0.00 O ATOM 0 H GLU A 985 8.406 -10.896 -1.714 1.00 0.00 H new ATOM 0 HA GLU A 985 9.363 -8.417 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.639 -10.670 -2.235 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.527 -9.237 -1.756 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.118 -11.163 0.130 1.00 0.00 H new ATOM 0 HG3 GLU A 985 11.845 -11.101 -0.164 1.00 0.00 H new ATOM 1037 N MET A 986 8.724 -8.567 -3.865 1.00 0.00 N ATOM 1038 CA MET A 986 8.666 -7.707 -5.044 1.00 0.00 C ATOM 1039 C MET A 986 7.906 -6.420 -4.720 1.00 0.00 C ATOM 1040 O MET A 986 8.401 -5.317 -4.960 1.00 0.00 O ATOM 1041 CB MET A 986 8.074 -8.409 -6.285 1.00 0.00 C ATOM 1042 CG MET A 986 6.556 -8.454 -6.373 1.00 0.00 C ATOM 1043 SD MET A 986 6.000 -8.907 -8.032 1.00 0.00 S ATOM 1044 CE MET A 986 4.223 -8.762 -7.889 1.00 0.00 C ATOM 0 H MET A 986 8.247 -9.464 -3.954 1.00 0.00 H new ATOM 0 HA MET A 986 9.694 -7.460 -5.307 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.454 -7.908 -7.175 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.449 -9.432 -6.311 1.00 0.00 H new ATOM 0 HG2 MET A 986 6.170 -9.173 -5.650 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.146 -7.480 -6.104 1.00 0.00 H new ATOM 0 HE1 MET A 986 3.805 -8.450 -8.846 1.00 0.00 H new ATOM 0 HE2 MET A 986 3.801 -9.726 -7.606 1.00 0.00 H new ATOM 0 HE3 MET A 986 3.978 -8.022 -7.127 1.00 0.00 H new ATOM 1054 N ALA A 987 6.722 -6.566 -4.140 1.00 0.00 N ATOM 1055 CA ALA A 987 5.888 -5.433 -3.808 1.00 0.00 C ATOM 1056 C ALA A 987 6.330 -4.769 -2.520 1.00 0.00 C ATOM 1057 O ALA A 987 6.367 -3.560 -2.446 1.00 0.00 O ATOM 1058 CB ALA A 987 4.440 -5.850 -3.705 1.00 0.00 C ATOM 0 H ALA A 987 6.320 -7.470 -3.890 1.00 0.00 H new ATOM 0 HA ALA A 987 5.993 -4.706 -4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.829 -4.983 -3.454 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.111 -6.262 -4.659 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.334 -6.606 -2.927 1.00 0.00 H new ATOM 1064 N GLN A 988 6.663 -5.563 -1.503 1.00 0.00 N ATOM 1065 CA GLN A 988 6.960 -5.010 -0.184 1.00 0.00 C ATOM 1066 C GLN A 988 8.167 -4.073 -0.241 1.00 0.00 C ATOM 1067 O GLN A 988 8.153 -3.006 0.362 1.00 0.00 O ATOM 1068 CB GLN A 988 7.188 -6.129 0.847 1.00 0.00 C ATOM 1069 CG GLN A 988 7.287 -5.652 2.294 1.00 0.00 C ATOM 1070 CD GLN A 988 8.692 -5.232 2.697 1.00 0.00 C ATOM 1071 OE1 GLN A 988 8.866 -4.333 3.519 1.00 0.00 O ATOM 1072 NE2 GLN A 988 9.700 -5.900 2.155 1.00 0.00 N ATOM 0 H GLN A 988 6.733 -6.579 -1.566 1.00 0.00 H new ATOM 0 HA GLN A 988 6.095 -4.429 0.134 1.00 0.00 H new ATOM 0 HB2 GLN A 988 6.371 -6.847 0.770 1.00 0.00 H new ATOM 0 HB3 GLN A 988 8.105 -6.660 0.590 1.00 0.00 H new ATOM 0 HG2 GLN A 988 6.609 -4.811 2.439 1.00 0.00 H new ATOM 0 HG3 GLN A 988 6.951 -6.450 2.956 1.00 0.00 H new ATOM 0 HE21 GLN A 988 9.516 -6.639 1.477 1.00 0.00 H new ATOM 0 HE22 GLN A 988 10.660 -5.675 2.416 1.00 0.00 H new ATOM 1081 N LYS A 989 9.208 -4.462 -0.973 1.00 0.00 N ATOM 1082 CA LYS A 989 10.357 -3.579 -1.152 1.00 0.00 C ATOM 1083 C LYS A 989 9.912 -2.355 -1.946 1.00 0.00 C ATOM 1084 O LYS A 989 10.278 -1.220 -1.632 1.00 0.00 O ATOM 1085 CB LYS A 989 11.503 -4.314 -1.870 1.00 0.00 C ATOM 1086 CG LYS A 989 12.866 -3.632 -1.756 1.00 0.00 C ATOM 1087 CD LYS A 989 12.940 -2.346 -2.568 1.00 0.00 C ATOM 1088 CE LYS A 989 14.261 -1.620 -2.362 1.00 0.00 C ATOM 1089 NZ LYS A 989 14.283 -0.306 -3.055 1.00 0.00 N ATOM 0 H LYS A 989 9.280 -5.364 -1.443 1.00 0.00 H new ATOM 0 HA LYS A 989 10.733 -3.264 -0.179 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.581 -5.323 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 989 11.248 -4.414 -2.925 1.00 0.00 H new ATOM 0 HG2 LYS A 989 13.072 -3.410 -0.709 1.00 0.00 H new ATOM 0 HG3 LYS A 989 13.642 -4.318 -2.095 1.00 0.00 H new ATOM 0 HD2 LYS A 989 12.814 -2.577 -3.626 1.00 0.00 H new ATOM 0 HD3 LYS A 989 12.117 -1.690 -2.285 1.00 0.00 H new ATOM 0 HE2 LYS A 989 14.431 -1.471 -1.296 1.00 0.00 H new ATOM 0 HE3 LYS A 989 15.078 -2.240 -2.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 15.179 0.180 -2.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 14.197 -0.453 -4.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 13.489 0.276 -2.721 1.00 0.00 H new ATOM 1103 N LEU A 990 9.092 -2.608 -2.958 1.00 0.00 N ATOM 1104 CA LEU A 990 8.534 -1.557 -3.792 1.00 0.00 C ATOM 1105 C LEU A 990 7.723 -0.555 -2.954 1.00 0.00 C ATOM 1106 O LEU A 990 7.970 0.647 -3.017 1.00 0.00 O ATOM 1107 CB LEU A 990 7.692 -2.219 -4.901 1.00 0.00 C ATOM 1108 CG LEU A 990 6.453 -1.466 -5.394 1.00 0.00 C ATOM 1109 CD1 LEU A 990 6.825 -0.124 -6.015 1.00 0.00 C ATOM 1110 CD2 LEU A 990 5.696 -2.312 -6.404 1.00 0.00 C ATOM 0 H LEU A 990 8.796 -3.548 -3.222 1.00 0.00 H new ATOM 0 HA LEU A 990 9.332 -0.977 -4.255 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.342 -2.393 -5.758 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.370 -3.196 -4.541 1.00 0.00 H new ATOM 0 HG LEU A 990 5.815 -1.272 -4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 990 5.922 0.383 -6.354 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.330 0.493 -5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.489 -0.287 -6.864 1.00 0.00 H new ATOM 0 HD21 LEU A 990 4.817 -1.768 -6.748 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.343 -2.531 -7.253 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.384 -3.246 -5.936 1.00 0.00 H new ATOM 1122 N LEU A 991 6.807 -1.053 -2.129 1.00 0.00 N ATOM 1123 CA LEU A 991 5.915 -0.185 -1.367 1.00 0.00 C ATOM 1124 C LEU A 991 6.640 0.478 -0.212 1.00 0.00 C ATOM 1125 O LEU A 991 6.295 1.584 0.194 1.00 0.00 O ATOM 1126 CB LEU A 991 4.663 -0.940 -0.891 1.00 0.00 C ATOM 1127 CG LEU A 991 4.876 -2.304 -0.241 1.00 0.00 C ATOM 1128 CD1 LEU A 991 5.289 -2.168 1.215 1.00 0.00 C ATOM 1129 CD2 LEU A 991 3.612 -3.125 -0.364 1.00 0.00 C ATOM 0 H LEU A 991 6.663 -2.050 -1.971 1.00 0.00 H new ATOM 0 HA LEU A 991 5.579 0.606 -2.037 1.00 0.00 H new ATOM 0 HB2 LEU A 991 4.136 -0.305 -0.179 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.003 -1.074 -1.748 1.00 0.00 H new ATOM 0 HG LEU A 991 5.688 -2.812 -0.761 1.00 0.00 H new ATOM 0 HD11 LEU A 991 5.432 -3.159 1.647 1.00 0.00 H new ATOM 0 HD12 LEU A 991 6.221 -1.607 1.278 1.00 0.00 H new ATOM 0 HD13 LEU A 991 4.510 -1.641 1.766 1.00 0.00 H new ATOM 0 HD21 LEU A 991 3.764 -4.099 0.100 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.793 -2.609 0.136 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.367 -3.260 -1.417 1.00 0.00 H new ATOM 1141 N ASN A 992 7.655 -0.193 0.311 1.00 0.00 N ATOM 1142 CA ASN A 992 8.492 0.399 1.340 1.00 0.00 C ATOM 1143 C ASN A 992 9.107 1.686 0.812 1.00 0.00 C ATOM 1144 O ASN A 992 9.099 2.714 1.482 1.00 0.00 O ATOM 1145 CB ASN A 992 9.599 -0.575 1.764 1.00 0.00 C ATOM 1146 CG ASN A 992 10.546 0.018 2.795 1.00 0.00 C ATOM 1147 OD1 ASN A 992 11.555 0.632 2.448 1.00 0.00 O ATOM 1148 ND2 ASN A 992 10.243 -0.180 4.067 1.00 0.00 N ATOM 0 H ASN A 992 7.917 -1.141 0.041 1.00 0.00 H new ATOM 0 HA ASN A 992 7.877 0.619 2.212 1.00 0.00 H new ATOM 0 HB2 ASN A 992 9.145 -1.478 2.172 1.00 0.00 H new ATOM 0 HB3 ASN A 992 10.169 -0.875 0.884 1.00 0.00 H new ATOM 0 HD21 ASN A 992 10.855 0.181 4.799 1.00 0.00 H new ATOM 0 HD22 ASN A 992 9.398 -0.694 4.316 1.00 0.00 H new ATOM 1155 N SER A 993 9.575 1.627 -0.426 1.00 0.00 N ATOM 1156 CA SER A 993 10.300 2.729 -1.032 1.00 0.00 C ATOM 1157 C SER A 993 9.368 3.867 -1.465 1.00 0.00 C ATOM 1158 O SER A 993 9.773 5.031 -1.473 1.00 0.00 O ATOM 1159 CB SER A 993 11.095 2.207 -2.233 1.00 0.00 C ATOM 1160 OG SER A 993 11.867 1.065 -1.873 1.00 0.00 O ATOM 0 H SER A 993 9.463 0.816 -1.035 1.00 0.00 H new ATOM 0 HA SER A 993 10.978 3.141 -0.284 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.412 1.949 -3.042 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.752 2.992 -2.608 1.00 0.00 H new ATOM 0 HG SER A 993 11.280 0.284 -1.796 1.00 0.00 H new ATOM 1166 N ASP A 994 8.115 3.541 -1.772 1.00 0.00 N ATOM 1167 CA ASP A 994 7.212 4.515 -2.386 1.00 0.00 C ATOM 1168 C ASP A 994 6.198 5.069 -1.390 1.00 0.00 C ATOM 1169 O ASP A 994 5.976 6.281 -1.351 1.00 0.00 O ATOM 1170 CB ASP A 994 6.507 3.925 -3.608 1.00 0.00 C ATOM 1171 CG ASP A 994 7.405 3.894 -4.828 1.00 0.00 C ATOM 1172 OD1 ASP A 994 7.431 4.890 -5.582 1.00 0.00 O ATOM 1173 OD2 ASP A 994 8.104 2.881 -5.042 1.00 0.00 O ATOM 0 H ASP A 994 7.704 2.622 -1.609 1.00 0.00 H new ATOM 0 HA ASP A 994 7.829 5.350 -2.718 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.173 2.913 -3.379 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.616 4.512 -3.830 1.00 0.00 H new ATOM 1178 N LEU A 995 5.591 4.199 -0.578 1.00 0.00 N ATOM 1179 CA LEU A 995 4.720 4.655 0.502 1.00 0.00 C ATOM 1180 C LEU A 995 5.521 5.616 1.380 1.00 0.00 C ATOM 1181 O LEU A 995 5.083 6.730 1.681 1.00 0.00 O ATOM 1182 CB LEU A 995 4.203 3.470 1.354 1.00 0.00 C ATOM 1183 CG LEU A 995 2.778 3.593 1.897 1.00 0.00 C ATOM 1184 CD1 LEU A 995 2.573 4.922 2.599 1.00 0.00 C ATOM 1185 CD2 LEU A 995 1.762 3.398 0.784 1.00 0.00 C ATOM 0 H LEU A 995 5.687 3.186 -0.648 1.00 0.00 H new ATOM 0 HA LEU A 995 3.849 5.152 0.075 1.00 0.00 H new ATOM 0 HB2 LEU A 995 4.262 2.564 0.750 1.00 0.00 H new ATOM 0 HB3 LEU A 995 4.880 3.335 2.198 1.00 0.00 H new ATOM 0 HG LEU A 995 2.627 2.805 2.635 1.00 0.00 H new ATOM 0 HD11 LEU A 995 1.551 4.981 2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 995 3.271 5.005 3.432 1.00 0.00 H new ATOM 0 HD13 LEU A 995 2.749 5.736 1.896 1.00 0.00 H new ATOM 0 HD21 LEU A 995 0.755 3.489 1.191 1.00 0.00 H new ATOM 0 HD22 LEU A 995 1.913 4.157 0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 995 1.888 2.408 0.346 1.00 0.00 H new ATOM 1197 N ALA A 996 6.711 5.165 1.773 1.00 0.00 N ATOM 1198 CA ALA A 996 7.616 5.993 2.555 1.00 0.00 C ATOM 1199 C ALA A 996 7.951 7.296 1.841 1.00 0.00 C ATOM 1200 O ALA A 996 7.930 8.358 2.453 1.00 0.00 O ATOM 1201 CB ALA A 996 8.889 5.245 2.907 1.00 0.00 C ATOM 0 H ALA A 996 7.067 4.233 1.561 1.00 0.00 H new ATOM 0 HA ALA A 996 7.095 6.240 3.480 1.00 0.00 H new ATOM 0 HB1 ALA A 996 9.542 5.893 3.491 1.00 0.00 H new ATOM 0 HB2 ALA A 996 8.641 4.359 3.491 1.00 0.00 H new ATOM 0 HB3 ALA A 996 9.400 4.945 1.992 1.00 0.00 H new ATOM 1207 N GLU A 997 8.267 7.238 0.558 1.00 0.00 N ATOM 1208 CA GLU A 997 8.612 8.454 -0.161 1.00 0.00 C ATOM 1209 C GLU A 997 7.452 9.438 -0.179 1.00 0.00 C ATOM 1210 O GLU A 997 7.663 10.641 -0.082 1.00 0.00 O ATOM 1211 CB GLU A 997 9.070 8.140 -1.586 1.00 0.00 C ATOM 1212 CG GLU A 997 9.159 9.367 -2.479 1.00 0.00 C ATOM 1213 CD GLU A 997 9.762 9.076 -3.838 1.00 0.00 C ATOM 1214 OE1 GLU A 997 9.507 7.994 -4.396 1.00 0.00 O ATOM 1215 OE2 GLU A 997 10.491 9.944 -4.361 1.00 0.00 O ATOM 0 H GLU A 997 8.292 6.383 0.003 1.00 0.00 H new ATOM 0 HA GLU A 997 9.441 8.921 0.371 1.00 0.00 H new ATOM 0 HB2 GLU A 997 10.046 7.657 -1.547 1.00 0.00 H new ATOM 0 HB3 GLU A 997 8.379 7.425 -2.032 1.00 0.00 H new ATOM 0 HG2 GLU A 997 8.161 9.783 -2.614 1.00 0.00 H new ATOM 0 HG3 GLU A 997 9.757 10.129 -1.979 1.00 0.00 H new ATOM 1222 N LEU A 998 6.236 8.929 -0.260 1.00 0.00 N ATOM 1223 CA LEU A 998 5.073 9.788 -0.411 1.00 0.00 C ATOM 1224 C LEU A 998 4.773 10.534 0.890 1.00 0.00 C ATOM 1225 O LEU A 998 4.380 11.704 0.861 1.00 0.00 O ATOM 1226 CB LEU A 998 3.872 8.963 -0.879 1.00 0.00 C ATOM 1227 CG LEU A 998 2.763 9.730 -1.618 1.00 0.00 C ATOM 1228 CD1 LEU A 998 1.798 10.389 -0.650 1.00 0.00 C ATOM 1229 CD2 LEU A 998 3.365 10.772 -2.542 1.00 0.00 C ATOM 0 H LEU A 998 6.027 7.931 -0.224 1.00 0.00 H new ATOM 0 HA LEU A 998 5.285 10.540 -1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 998 4.236 8.172 -1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.430 8.478 -0.008 1.00 0.00 H new ATOM 0 HG LEU A 998 2.203 9.007 -2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 998 1.029 10.921 -1.209 1.00 0.00 H new ATOM 0 HD12 LEU A 998 1.331 9.627 -0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 998 2.340 11.093 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 998 2.567 11.306 -3.057 1.00 0.00 H new ATOM 0 HD22 LEU A 998 3.956 11.478 -1.958 1.00 0.00 H new ATOM 0 HD23 LEU A 998 4.006 10.282 -3.275 1.00 0.00 H new ATOM 1241 N ILE A 999 4.985 9.882 2.033 1.00 0.00 N ATOM 1242 CA ILE A 999 4.779 10.549 3.326 1.00 0.00 C ATOM 1243 C ILE A 999 5.786 11.684 3.508 1.00 0.00 C ATOM 1244 O ILE A 999 5.513 12.674 4.177 1.00 0.00 O ATOM 1245 CB ILE A 999 4.845 9.580 4.535 1.00 0.00 C ATOM 1246 CG1 ILE A 999 6.253 9.014 4.725 1.00 0.00 C ATOM 1247 CG2 ILE A 999 3.836 8.453 4.363 1.00 0.00 C ATOM 1248 CD1 ILE A 999 6.388 8.098 5.925 1.00 0.00 C ATOM 0 H ILE A 999 5.293 8.912 2.095 1.00 0.00 H new ATOM 0 HA ILE A 999 3.767 10.953 3.303 1.00 0.00 H new ATOM 0 HB ILE A 999 4.594 10.147 5.432 1.00 0.00 H new ATOM 0 HG12 ILE A 999 6.538 8.465 3.827 1.00 0.00 H new ATOM 0 HG13 ILE A 999 6.956 9.841 4.830 1.00 0.00 H new ATOM 0 HG21 ILE A 999 3.893 7.780 5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 999 2.832 8.871 4.296 1.00 0.00 H new ATOM 0 HG23 ILE A 999 4.060 7.900 3.451 1.00 0.00 H new ATOM 0 HD11 ILE A 999 7.414 7.737 5.993 1.00 0.00 H new ATOM 0 HD12 ILE A 999 6.136 8.647 6.832 1.00 0.00 H new ATOM 0 HD13 ILE A 999 5.712 7.251 5.814 1.00 0.00 H new ATOM 1260 N ASN A1000 6.927 11.537 2.857 1.00 0.00 N ATOM 1261 CA ASN A1000 7.962 12.570 2.848 1.00 0.00 C ATOM 1262 C ASN A1000 7.784 13.458 1.640 1.00 0.00 C ATOM 1263 O ASN A1000 8.470 14.454 1.502 1.00 0.00 O ATOM 1264 CB ASN A1000 9.362 11.958 2.791 1.00 0.00 C ATOM 1265 CG ASN A1000 9.724 11.156 4.023 1.00 0.00 C ATOM 1266 OD1 ASN A1000 10.209 11.701 5.014 1.00 0.00 O ATOM 1267 ND2 ASN A1000 9.517 9.853 3.960 1.00 0.00 N ATOM 0 H ASN A1000 7.167 10.704 2.320 1.00 0.00 H new ATOM 0 HA ASN A1000 7.862 13.144 3.769 1.00 0.00 H new ATOM 0 HB2 ASN A1000 9.432 11.314 1.915 1.00 0.00 H new ATOM 0 HB3 ASN A1000 10.093 12.756 2.659 1.00 0.00 H new ATOM 0 HD21 ASN A1000 9.762 9.259 4.752 1.00 0.00 H new ATOM 0 HD22 ASN A1000 9.112 9.441 3.119 1.00 0.00 H new ATOM 1274 N LYS A1001 6.857 13.090 0.777 1.00 0.00 N ATOM 1275 CA LYS A1001 6.652 13.808 -0.465 1.00 0.00 C ATOM 1276 C LYS A1001 5.728 14.982 -0.226 1.00 0.00 C ATOM 1277 O LYS A1001 6.005 16.098 -0.660 1.00 0.00 O ATOM 1278 CB LYS A1001 6.089 12.895 -1.551 1.00 0.00 C ATOM 1279 CG LYS A1001 6.686 13.150 -2.923 1.00 0.00 C ATOM 1280 CD LYS A1001 8.173 12.834 -2.951 1.00 0.00 C ATOM 1281 CE LYS A1001 8.763 13.046 -4.334 1.00 0.00 C ATOM 1282 NZ LYS A1001 10.188 12.634 -4.398 1.00 0.00 N ATOM 0 H LYS A1001 6.232 12.295 0.914 1.00 0.00 H new ATOM 0 HA LYS A1001 7.617 14.174 -0.815 1.00 0.00 H new ATOM 0 HB2 LYS A1001 6.269 11.857 -1.272 1.00 0.00 H new ATOM 0 HB3 LYS A1001 5.008 13.028 -1.603 1.00 0.00 H new ATOM 0 HG2 LYS A1001 6.169 12.541 -3.665 1.00 0.00 H new ATOM 0 HG3 LYS A1001 6.529 14.192 -3.201 1.00 0.00 H new ATOM 0 HD2 LYS A1001 8.694 13.466 -2.232 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.332 11.801 -2.641 1.00 0.00 H new ATOM 0 HE2 LYS A1001 8.188 12.478 -5.065 1.00 0.00 H new ATOM 0 HE3 LYS A1001 8.677 14.097 -4.608 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 10.632 13.048 -5.242 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 10.684 12.967 -3.547 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.248 11.597 -4.449 1.00 0.00 H new ATOM 1296 N MET A1002 4.625 14.741 0.476 1.00 0.00 N ATOM 1297 CA MET A1002 3.756 15.830 0.850 1.00 0.00 C ATOM 1298 C MET A1002 4.338 16.525 2.051 1.00 0.00 C ATOM 1299 O MET A1002 4.179 17.727 2.208 1.00 0.00 O ATOM 1300 CB MET A1002 2.343 15.381 1.162 1.00 0.00 C ATOM 1301 CG MET A1002 1.477 16.523 1.659 1.00 0.00 C ATOM 1302 SD MET A1002 1.165 17.765 0.388 1.00 0.00 S ATOM 1303 CE MET A1002 0.003 16.890 -0.656 1.00 0.00 C ATOM 0 H MET A1002 4.323 13.818 0.788 1.00 0.00 H new ATOM 0 HA MET A1002 3.691 16.505 -0.003 1.00 0.00 H new ATOM 0 HB2 MET A1002 1.894 14.950 0.267 1.00 0.00 H new ATOM 0 HB3 MET A1002 2.371 14.594 1.915 1.00 0.00 H new ATOM 0 HG2 MET A1002 0.526 16.125 2.013 1.00 0.00 H new ATOM 0 HG3 MET A1002 1.962 16.997 2.513 1.00 0.00 H new ATOM 0 HE1 MET A1002 0.357 16.905 -1.687 1.00 0.00 H new ATOM 0 HE2 MET A1002 -0.084 15.858 -0.317 1.00 0.00 H new ATOM 0 HE3 MET A1002 -0.972 17.374 -0.600 1.00 0.00 H new ATOM 1313 N LYS A1003 5.005 15.763 2.912 1.00 0.00 N ATOM 1314 CA LYS A1003 5.739 16.369 3.999 1.00 0.00 C ATOM 1315 C LYS A1003 6.707 17.377 3.409 1.00 0.00 C ATOM 1316 O LYS A1003 6.763 18.502 3.857 1.00 0.00 O ATOM 1317 CB LYS A1003 6.486 15.327 4.832 1.00 0.00 C ATOM 1318 CG LYS A1003 7.165 15.914 6.059 1.00 0.00 C ATOM 1319 CD LYS A1003 7.855 14.847 6.895 1.00 0.00 C ATOM 1320 CE LYS A1003 6.861 13.849 7.472 1.00 0.00 C ATOM 1321 NZ LYS A1003 7.519 12.878 8.385 1.00 0.00 N ATOM 0 H LYS A1003 5.048 14.745 2.874 1.00 0.00 H new ATOM 0 HA LYS A1003 5.039 16.863 4.674 1.00 0.00 H new ATOM 0 HB2 LYS A1003 5.785 14.554 5.148 1.00 0.00 H new ATOM 0 HB3 LYS A1003 7.236 14.842 4.207 1.00 0.00 H new ATOM 0 HG2 LYS A1003 7.897 16.659 5.747 1.00 0.00 H new ATOM 0 HG3 LYS A1003 6.425 16.431 6.670 1.00 0.00 H new ATOM 0 HD2 LYS A1003 8.584 14.319 6.280 1.00 0.00 H new ATOM 0 HD3 LYS A1003 8.406 15.322 7.707 1.00 0.00 H new ATOM 0 HE2 LYS A1003 6.081 14.385 8.013 1.00 0.00 H new ATOM 0 HE3 LYS A1003 6.373 13.311 6.659 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 6.809 12.215 8.757 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 8.246 12.349 7.863 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 7.963 13.389 9.174 1.00 0.00 H new ATOM 1335 N LEU A1004 7.454 16.943 2.395 1.00 0.00 N ATOM 1336 CA LEU A1004 8.304 17.819 1.586 1.00 0.00 C ATOM 1337 C LEU A1004 7.530 19.002 1.004 1.00 0.00 C ATOM 1338 O LEU A1004 7.959 20.144 1.124 1.00 0.00 O ATOM 1339 CB LEU A1004 8.901 17.007 0.443 1.00 0.00 C ATOM 1340 CG LEU A1004 9.999 17.695 -0.364 1.00 0.00 C ATOM 1341 CD1 LEU A1004 11.219 17.962 0.506 1.00 0.00 C ATOM 1342 CD2 LEU A1004 10.380 16.848 -1.567 1.00 0.00 C ATOM 0 H LEU A1004 7.487 15.965 2.108 1.00 0.00 H new ATOM 0 HA LEU A1004 9.083 18.220 2.234 1.00 0.00 H new ATOM 0 HB2 LEU A1004 9.305 16.081 0.853 1.00 0.00 H new ATOM 0 HB3 LEU A1004 8.097 16.729 -0.238 1.00 0.00 H new ATOM 0 HG LEU A1004 9.616 18.652 -0.719 1.00 0.00 H new ATOM 0 HD11 LEU A1004 11.990 18.453 -0.089 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.938 18.606 1.339 1.00 0.00 H new ATOM 0 HD13 LEU A1004 11.604 17.018 0.892 1.00 0.00 H new ATOM 0 HD21 LEU A1004 11.164 17.351 -2.133 1.00 0.00 H new ATOM 0 HD22 LEU A1004 10.743 15.878 -1.228 1.00 0.00 H new ATOM 0 HD23 LEU A1004 9.507 16.707 -2.204 1.00 0.00 H new ATOM 1354 N ALA A1005 6.403 18.725 0.357 1.00 0.00 N ATOM 1355 CA ALA A1005 5.581 19.779 -0.237 1.00 0.00 C ATOM 1356 C ALA A1005 5.139 20.782 0.815 1.00 0.00 C ATOM 1357 O ALA A1005 5.226 21.990 0.619 1.00 0.00 O ATOM 1358 CB ALA A1005 4.368 19.187 -0.944 1.00 0.00 C ATOM 0 H ALA A1005 6.036 17.782 0.229 1.00 0.00 H new ATOM 0 HA ALA A1005 6.191 20.301 -0.974 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.772 19.990 -1.378 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.700 18.514 -1.734 1.00 0.00 H new ATOM 0 HB3 ALA A1005 3.763 18.633 -0.226 1.00 0.00 H new ATOM 1364 N GLN A1006 4.668 20.263 1.930 1.00 0.00 N ATOM 1365 CA GLN A1006 4.238 21.080 3.047 1.00 0.00 C ATOM 1366 C GLN A1006 5.444 21.594 3.821 1.00 0.00 C ATOM 1367 O GLN A1006 5.317 22.415 4.726 1.00 0.00 O ATOM 1368 CB GLN A1006 3.270 20.281 3.927 1.00 0.00 C ATOM 1369 CG GLN A1006 2.011 19.908 3.190 1.00 0.00 C ATOM 1370 CD GLN A1006 1.510 21.026 2.293 1.00 0.00 C ATOM 1371 OE1 GLN A1006 0.788 21.910 2.731 1.00 0.00 O ATOM 1372 NE2 GLN A1006 1.863 20.970 1.020 1.00 0.00 N ATOM 0 H GLN A1006 4.572 19.260 2.088 1.00 0.00 H new ATOM 0 HA GLN A1006 3.702 21.956 2.682 1.00 0.00 H new ATOM 0 HB2 GLN A1006 3.765 19.376 4.280 1.00 0.00 H new ATOM 0 HB3 GLN A1006 3.013 20.868 4.808 1.00 0.00 H new ATOM 0 HG2 GLN A1006 2.196 19.019 2.588 1.00 0.00 H new ATOM 0 HG3 GLN A1006 1.235 19.649 3.910 1.00 0.00 H new ATOM 0 HE21 GLN A1006 2.467 20.217 0.691 1.00 0.00 H new ATOM 0 HE22 GLN A1006 1.531 21.680 0.367 1.00 0.00 H new ATOM 1381 N GLN A1007 6.616 21.093 3.452 1.00 0.00 N ATOM 1382 CA GLN A1007 7.864 21.553 4.008 1.00 0.00 C ATOM 1383 C GLN A1007 8.391 22.707 3.165 1.00 0.00 C ATOM 1384 O GLN A1007 9.344 23.392 3.532 1.00 0.00 O ATOM 1385 CB GLN A1007 8.855 20.390 4.024 1.00 0.00 C ATOM 1386 CG GLN A1007 9.639 20.261 5.312 1.00 0.00 C ATOM 1387 CD GLN A1007 8.735 20.088 6.523 1.00 0.00 C ATOM 1388 OE1 GLN A1007 9.098 20.476 7.634 1.00 0.00 O ATOM 1389 NE2 GLN A1007 7.543 19.524 6.322 1.00 0.00 N ATOM 0 H GLN A1007 6.719 20.354 2.756 1.00 0.00 H new ATOM 0 HA GLN A1007 7.722 21.908 5.029 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.311 19.462 3.848 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.554 20.512 3.197 1.00 0.00 H new ATOM 0 HG2 GLN A1007 10.314 19.408 5.240 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.259 21.147 5.448 1.00 0.00 H new ATOM 0 HE21 GLN A1007 7.276 19.215 5.387 1.00 0.00 H new ATOM 0 HE22 GLN A1007 6.898 19.402 7.103 1.00 0.00 H new ATOM 1398 N TYR A1008 7.735 22.909 2.034 1.00 0.00 N ATOM 1399 CA TYR A1008 8.097 23.942 1.082 1.00 0.00 C ATOM 1400 C TYR A1008 6.847 24.734 0.706 1.00 0.00 C ATOM 1401 O TYR A1008 6.833 25.491 -0.264 1.00 0.00 O ATOM 1402 CB TYR A1008 8.724 23.267 -0.142 1.00 0.00 C ATOM 1403 CG TYR A1008 9.147 24.194 -1.262 1.00 0.00 C ATOM 1404 CD1 TYR A1008 10.132 25.150 -1.065 1.00 0.00 C ATOM 1405 CD2 TYR A1008 8.563 24.097 -2.523 1.00 0.00 C ATOM 1406 CE1 TYR A1008 10.526 25.987 -2.088 1.00 0.00 C ATOM 1407 CE2 TYR A1008 8.957 24.930 -3.556 1.00 0.00 C ATOM 1408 CZ TYR A1008 9.939 25.873 -3.332 1.00 0.00 C ATOM 1409 OH TYR A1008 10.337 26.709 -4.353 1.00 0.00 O ATOM 0 H TYR A1008 6.928 22.354 1.750 1.00 0.00 H new ATOM 0 HA TYR A1008 8.820 24.637 1.509 1.00 0.00 H new ATOM 0 HB2 TYR A1008 9.597 22.702 0.186 1.00 0.00 H new ATOM 0 HB3 TYR A1008 8.010 22.547 -0.542 1.00 0.00 H new ATOM 0 HD1 TYR A1008 10.598 25.241 -0.095 1.00 0.00 H new ATOM 0 HD2 TYR A1008 7.792 23.361 -2.697 1.00 0.00 H new ATOM 0 HE1 TYR A1008 11.291 26.729 -1.916 1.00 0.00 H new ATOM 0 HE2 TYR A1008 8.499 24.842 -4.530 1.00 0.00 H new ATOM 0 HH TYR A1008 9.828 26.500 -5.164 1.00 0.00 H new ATOM 1496 N GLN A1014 4.089 26.032 -3.750 1.00 0.00 N ATOM 1497 CA GLN A1014 3.543 24.832 -3.129 1.00 0.00 C ATOM 1498 C GLN A1014 3.231 23.780 -4.198 1.00 0.00 C ATOM 1499 O GLN A1014 3.575 22.607 -4.048 1.00 0.00 O ATOM 1500 CB GLN A1014 2.279 25.186 -2.334 1.00 0.00 C ATOM 1501 CG GLN A1014 1.936 24.212 -1.214 1.00 0.00 C ATOM 1502 CD GLN A1014 1.192 22.990 -1.704 1.00 0.00 C ATOM 1503 OE1 GLN A1014 -0.034 22.977 -1.765 1.00 0.00 O ATOM 1504 NE2 GLN A1014 1.922 21.949 -2.051 1.00 0.00 N ATOM 0 HA GLN A1014 4.281 24.416 -2.443 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.402 26.181 -1.906 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.436 25.237 -3.023 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.855 23.897 -0.719 1.00 0.00 H new ATOM 0 HG3 GLN A1014 1.330 24.724 -0.467 1.00 0.00 H new ATOM 0 HE21 GLN A1014 2.939 21.995 -1.987 1.00 0.00 H new ATOM 0 HE22 GLN A1014 1.470 21.097 -2.383 1.00 0.00 H new ATOM 1513 N GLN A1015 2.636 24.218 -5.305 1.00 0.00 N ATOM 1514 CA GLN A1015 2.190 23.300 -6.352 1.00 0.00 C ATOM 1515 C GLN A1015 3.385 22.644 -7.045 1.00 0.00 C ATOM 1516 O GLN A1015 3.252 21.589 -7.656 1.00 0.00 O ATOM 1517 CB GLN A1015 1.314 24.022 -7.377 1.00 0.00 C ATOM 1518 CG GLN A1015 2.068 25.027 -8.226 1.00 0.00 C ATOM 1519 CD GLN A1015 1.167 25.813 -9.154 1.00 0.00 C ATOM 1520 OE1 GLN A1015 1.585 26.224 -10.235 1.00 0.00 O ATOM 1521 NE2 GLN A1015 -0.070 26.034 -8.740 1.00 0.00 N ATOM 0 H GLN A1015 2.451 25.202 -5.501 1.00 0.00 H new ATOM 0 HA GLN A1015 1.593 22.520 -5.879 1.00 0.00 H new ATOM 0 HB2 GLN A1015 0.851 23.283 -8.031 1.00 0.00 H new ATOM 0 HB3 GLN A1015 0.507 24.535 -6.854 1.00 0.00 H new ATOM 0 HG2 GLN A1015 2.600 25.719 -7.573 1.00 0.00 H new ATOM 0 HG3 GLN A1015 2.820 24.504 -8.816 1.00 0.00 H new ATOM 0 HE21 GLN A1015 -0.377 25.675 -7.836 1.00 0.00 H new ATOM 0 HE22 GLN A1015 -0.717 26.563 -9.325 1.00 0.00 H new ATOM 1530 N GLU A1016 4.537 23.290 -6.944 1.00 0.00 N ATOM 1531 CA GLU A1016 5.775 22.717 -7.467 1.00 0.00 C ATOM 1532 C GLU A1016 6.028 21.366 -6.810 1.00 0.00 C ATOM 1533 O GLU A1016 6.143 20.338 -7.479 1.00 0.00 O ATOM 1534 CB GLU A1016 6.971 23.644 -7.249 1.00 0.00 C ATOM 1535 CG GLU A1016 8.269 23.065 -7.791 1.00 0.00 C ATOM 1536 CD GLU A1016 9.365 24.095 -7.928 1.00 0.00 C ATOM 1537 OE1 GLU A1016 9.181 25.064 -8.695 1.00 0.00 O ATOM 1538 OE2 GLU A1016 10.428 23.930 -7.298 1.00 0.00 O ATOM 0 H GLU A1016 4.644 24.206 -6.508 1.00 0.00 H new ATOM 0 HA GLU A1016 5.658 22.588 -8.543 1.00 0.00 H new ATOM 0 HB2 GLU A1016 6.776 24.602 -7.731 1.00 0.00 H new ATOM 0 HB3 GLU A1016 7.083 23.841 -6.183 1.00 0.00 H new ATOM 0 HG2 GLU A1016 8.608 22.268 -7.130 1.00 0.00 H new ATOM 0 HG3 GLU A1016 8.080 22.613 -8.765 1.00 0.00 H new ATOM 1545 N TYR A1017 6.067 21.363 -5.489 1.00 0.00 N ATOM 1546 CA TYR A1017 6.251 20.130 -4.747 1.00 0.00 C ATOM 1547 C TYR A1017 4.971 19.293 -4.744 1.00 0.00 C ATOM 1548 O TYR A1017 4.999 18.103 -4.435 1.00 0.00 O ATOM 1549 CB TYR A1017 6.710 20.424 -3.319 1.00 0.00 C ATOM 1550 CG TYR A1017 8.197 20.676 -3.191 1.00 0.00 C ATOM 1551 CD1 TYR A1017 8.965 20.990 -4.305 1.00 0.00 C ATOM 1552 CD2 TYR A1017 8.835 20.583 -1.958 1.00 0.00 C ATOM 1553 CE1 TYR A1017 10.322 21.209 -4.199 1.00 0.00 C ATOM 1554 CE2 TYR A1017 10.196 20.799 -1.846 1.00 0.00 C ATOM 1555 CZ TYR A1017 10.933 21.113 -2.968 1.00 0.00 C ATOM 1556 OH TYR A1017 12.290 21.331 -2.859 1.00 0.00 O ATOM 0 H TYR A1017 5.974 22.198 -4.911 1.00 0.00 H new ATOM 0 HA TYR A1017 7.028 19.550 -5.245 1.00 0.00 H new ATOM 0 HB2 TYR A1017 6.171 21.295 -2.947 1.00 0.00 H new ATOM 0 HB3 TYR A1017 6.438 19.584 -2.680 1.00 0.00 H new ATOM 0 HD1 TYR A1017 8.490 21.064 -5.272 1.00 0.00 H new ATOM 0 HD2 TYR A1017 8.260 20.339 -1.077 1.00 0.00 H new ATOM 0 HE1 TYR A1017 10.903 21.454 -5.076 1.00 0.00 H new ATOM 0 HE2 TYR A1017 10.680 20.722 -0.883 1.00 0.00 H new ATOM 0 HH TYR A1017 12.564 21.226 -1.924 1.00 0.00 H new ATOM 1566 N LYS A1018 3.852 19.910 -5.110 1.00 0.00 N ATOM 1567 CA LYS A1018 2.578 19.199 -5.156 1.00 0.00 C ATOM 1568 C LYS A1018 2.486 18.342 -6.419 1.00 0.00 C ATOM 1569 O LYS A1018 2.054 17.196 -6.363 1.00 0.00 O ATOM 1570 CB LYS A1018 1.400 20.175 -5.084 1.00 0.00 C ATOM 1571 CG LYS A1018 0.050 19.489 -4.931 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.082 20.496 -4.780 1.00 0.00 C ATOM 1573 CE LYS A1018 -1.262 21.336 -6.036 1.00 0.00 C ATOM 1574 NZ LYS A1018 -2.366 22.322 -5.895 1.00 0.00 N ATOM 0 H LYS A1018 3.800 20.893 -5.377 1.00 0.00 H new ATOM 0 HA LYS A1018 2.527 18.543 -4.287 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.551 20.853 -4.244 1.00 0.00 H new ATOM 0 HB3 LYS A1018 1.388 20.785 -5.987 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -0.138 18.859 -5.800 1.00 0.00 H new ATOM 0 HG3 LYS A1018 0.072 18.834 -4.060 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -2.010 19.969 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -0.877 21.149 -3.932 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -0.333 21.862 -6.257 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -1.467 20.682 -6.883 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -2.454 22.873 -6.773 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -3.258 21.820 -5.710 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -2.159 22.964 -5.103 1.00 0.00 H new ATOM 1588 N LYS A1019 2.916 18.892 -7.553 1.00 0.00 N ATOM 1589 CA LYS A1019 2.942 18.135 -8.804 1.00 0.00 C ATOM 1590 C LYS A1019 4.012 17.050 -8.718 1.00 0.00 C ATOM 1591 O LYS A1019 3.974 16.046 -9.434 1.00 0.00 O ATOM 1592 CB LYS A1019 3.217 19.062 -9.998 1.00 0.00 C ATOM 1593 CG LYS A1019 4.645 19.591 -10.052 1.00 0.00 C ATOM 1594 CD LYS A1019 4.837 20.609 -11.165 1.00 0.00 C ATOM 1595 CE LYS A1019 4.079 21.896 -10.885 1.00 0.00 C ATOM 1596 NZ LYS A1019 4.306 22.912 -11.943 1.00 0.00 N ATOM 0 H LYS A1019 3.249 19.853 -7.632 1.00 0.00 H new ATOM 0 HA LYS A1019 1.967 17.671 -8.956 1.00 0.00 H new ATOM 0 HB2 LYS A1019 3.005 18.522 -10.921 1.00 0.00 H new ATOM 0 HB3 LYS A1019 2.528 19.906 -9.956 1.00 0.00 H new ATOM 0 HG2 LYS A1019 4.898 20.048 -9.096 1.00 0.00 H new ATOM 0 HG3 LYS A1019 5.334 18.759 -10.200 1.00 0.00 H new ATOM 0 HD2 LYS A1019 5.899 20.829 -11.278 1.00 0.00 H new ATOM 0 HD3 LYS A1019 4.497 20.184 -12.110 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.013 21.681 -10.811 1.00 0.00 H new ATOM 0 HE3 LYS A1019 4.391 22.299 -9.921 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 3.772 23.775 -11.716 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 5.320 23.136 -11.997 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 3.985 22.537 -12.859 1.00 0.00 H new ATOM 1610 N GLN A1020 4.949 17.260 -7.805 1.00 0.00 N ATOM 1611 CA GLN A1020 6.011 16.305 -7.559 1.00 0.00 C ATOM 1612 C GLN A1020 5.492 15.153 -6.705 1.00 0.00 C ATOM 1613 O GLN A1020 5.778 13.986 -6.979 1.00 0.00 O ATOM 1614 CB GLN A1020 7.194 17.002 -6.886 1.00 0.00 C ATOM 1615 CG GLN A1020 8.214 16.055 -6.278 1.00 0.00 C ATOM 1616 CD GLN A1020 9.537 16.736 -6.001 1.00 0.00 C ATOM 1617 OE1 GLN A1020 10.584 16.090 -5.960 1.00 0.00 O ATOM 1618 NE2 GLN A1020 9.504 18.051 -5.833 1.00 0.00 N ATOM 0 H GLN A1020 4.992 18.093 -7.219 1.00 0.00 H new ATOM 0 HA GLN A1020 6.353 15.894 -8.509 1.00 0.00 H new ATOM 0 HB2 GLN A1020 7.694 17.633 -7.620 1.00 0.00 H new ATOM 0 HB3 GLN A1020 6.816 17.661 -6.104 1.00 0.00 H new ATOM 0 HG2 GLN A1020 7.817 15.645 -5.349 1.00 0.00 H new ATOM 0 HG3 GLN A1020 8.375 15.215 -6.954 1.00 0.00 H new ATOM 0 HE21 GLN A1020 8.614 18.548 -5.875 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.368 18.565 -5.662 1.00 0.00 H new ATOM 1627 N MET A1021 4.706 15.478 -5.682 1.00 0.00 N ATOM 1628 CA MET A1021 4.140 14.451 -4.822 1.00 0.00 C ATOM 1629 C MET A1021 3.000 13.734 -5.532 1.00 0.00 C ATOM 1630 O MET A1021 2.730 12.574 -5.253 1.00 0.00 O ATOM 1631 CB MET A1021 3.682 15.024 -3.464 1.00 0.00 C ATOM 1632 CG MET A1021 2.485 15.969 -3.512 1.00 0.00 C ATOM 1633 SD MET A1021 0.903 15.125 -3.750 1.00 0.00 S ATOM 1634 CE MET A1021 0.928 13.941 -2.405 1.00 0.00 C ATOM 0 H MET A1021 4.451 16.434 -5.433 1.00 0.00 H new ATOM 0 HA MET A1021 4.925 13.725 -4.609 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.438 14.192 -2.804 1.00 0.00 H new ATOM 0 HB3 MET A1021 4.521 15.553 -3.013 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.446 16.540 -2.584 1.00 0.00 H new ATOM 0 HG3 MET A1021 2.630 16.685 -4.321 1.00 0.00 H new ATOM 0 HE1 MET A1021 1.173 12.953 -2.795 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.678 14.238 -1.672 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.052 13.911 -1.929 1.00 0.00 H new ATOM 1644 N LEU A1022 2.346 14.422 -6.460 1.00 0.00 N ATOM 1645 CA LEU A1022 1.261 13.826 -7.231 1.00 0.00 C ATOM 1646 C LEU A1022 1.788 12.672 -8.077 1.00 0.00 C ATOM 1647 O LEU A1022 1.186 11.597 -8.136 1.00 0.00 O ATOM 1648 CB LEU A1022 0.605 14.883 -8.123 1.00 0.00 C ATOM 1649 CG LEU A1022 -0.612 14.406 -8.917 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -1.730 13.973 -7.979 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -1.097 15.504 -9.848 1.00 0.00 C ATOM 0 H LEU A1022 2.548 15.393 -6.697 1.00 0.00 H new ATOM 0 HA LEU A1022 0.512 13.438 -6.541 1.00 0.00 H new ATOM 0 HB2 LEU A1022 0.304 15.725 -7.499 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.351 15.257 -8.824 1.00 0.00 H new ATOM 0 HG LEU A1022 -0.316 13.545 -9.517 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -2.586 13.637 -8.564 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -1.379 13.157 -7.348 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -2.026 14.815 -7.353 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -1.964 15.151 -10.407 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -1.375 16.381 -9.263 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -0.301 15.770 -10.543 1.00 0.00 H new ATOM 1663 N THR A1023 2.929 12.897 -8.712 1.00 0.00 N ATOM 1664 CA THR A1023 3.576 11.872 -9.513 1.00 0.00 C ATOM 1665 C THR A1023 4.049 10.715 -8.627 1.00 0.00 C ATOM 1666 O THR A1023 4.051 9.552 -9.039 1.00 0.00 O ATOM 1667 CB THR A1023 4.766 12.470 -10.290 1.00 0.00 C ATOM 1668 OG1 THR A1023 4.315 13.596 -11.062 1.00 0.00 O ATOM 1669 CG2 THR A1023 5.395 11.441 -11.217 1.00 0.00 C ATOM 0 H THR A1023 3.427 13.787 -8.687 1.00 0.00 H new ATOM 0 HA THR A1023 2.850 11.485 -10.228 1.00 0.00 H new ATOM 0 HB THR A1023 5.520 12.786 -9.569 1.00 0.00 H new ATOM 0 HG1 THR A1023 4.202 14.372 -10.474 1.00 0.00 H new ATOM 0 HG21 THR A1023 6.231 11.894 -11.750 1.00 0.00 H new ATOM 0 HG22 THR A1023 5.754 10.595 -10.631 1.00 0.00 H new ATOM 0 HG23 THR A1023 4.651 11.095 -11.935 1.00 0.00 H new ATOM 1677 N ALA A1024 4.405 11.036 -7.388 1.00 0.00 N ATOM 1678 CA ALA A1024 4.863 10.025 -6.443 1.00 0.00 C ATOM 1679 C ALA A1024 3.674 9.267 -5.863 1.00 0.00 C ATOM 1680 O ALA A1024 3.749 8.071 -5.609 1.00 0.00 O ATOM 1681 CB ALA A1024 5.692 10.660 -5.337 1.00 0.00 C ATOM 0 H ALA A1024 4.385 11.985 -7.016 1.00 0.00 H new ATOM 0 HA ALA A1024 5.498 9.315 -6.974 1.00 0.00 H new ATOM 0 HB1 ALA A1024 6.024 9.888 -4.642 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.560 11.155 -5.772 1.00 0.00 H new ATOM 0 HB3 ALA A1024 5.086 11.392 -4.803 1.00 0.00 H new ATOM 1687 N ALA A1025 2.570 9.977 -5.668 1.00 0.00 N ATOM 1688 CA ALA A1025 1.340 9.372 -5.178 1.00 0.00 C ATOM 1689 C ALA A1025 0.799 8.383 -6.195 1.00 0.00 C ATOM 1690 O ALA A1025 0.161 7.394 -5.841 1.00 0.00 O ATOM 1691 CB ALA A1025 0.303 10.443 -4.871 1.00 0.00 C ATOM 0 H ALA A1025 2.502 10.980 -5.843 1.00 0.00 H new ATOM 0 HA ALA A1025 1.561 8.836 -4.255 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.610 9.972 -4.506 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.692 11.119 -4.109 1.00 0.00 H new ATOM 0 HB3 ALA A1025 0.083 11.007 -5.778 1.00 0.00 H new ATOM 1697 N HIS A1026 1.046 8.670 -7.464 1.00 0.00 N ATOM 1698 CA HIS A1026 0.684 7.760 -8.534 1.00 0.00 C ATOM 1699 C HIS A1026 1.537 6.496 -8.448 1.00 0.00 C ATOM 1700 O HIS A1026 1.073 5.399 -8.751 1.00 0.00 O ATOM 1701 CB HIS A1026 0.863 8.448 -9.894 1.00 0.00 C ATOM 1702 CG HIS A1026 0.419 7.632 -11.074 1.00 0.00 C ATOM 1703 ND1 HIS A1026 -0.815 7.778 -11.667 1.00 0.00 N ATOM 1704 CD2 HIS A1026 1.061 6.675 -11.785 1.00 0.00 C ATOM 1705 CE1 HIS A1026 -0.912 6.950 -12.688 1.00 0.00 C ATOM 1706 NE2 HIS A1026 0.212 6.270 -12.782 1.00 0.00 N ATOM 0 H HIS A1026 1.497 9.530 -7.776 1.00 0.00 H new ATOM 0 HA HIS A1026 -0.364 7.479 -8.429 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.306 9.385 -9.888 1.00 0.00 H new ATOM 0 HB3 HIS A1026 1.915 8.703 -10.021 1.00 0.00 H new ATOM 0 HD2 HIS A1026 2.057 6.300 -11.601 1.00 0.00 H new ATOM 0 HE1 HIS A1026 -1.768 6.847 -13.338 1.00 0.00 H new ATOM 0 HE2 HIS A1026 0.417 5.558 -13.483 1.00 0.00 H new ATOM 1715 N ALA A1027 2.781 6.667 -8.015 1.00 0.00 N ATOM 1716 CA ALA A1027 3.707 5.550 -7.870 1.00 0.00 C ATOM 1717 C ALA A1027 3.383 4.724 -6.631 1.00 0.00 C ATOM 1718 O ALA A1027 3.410 3.494 -6.678 1.00 0.00 O ATOM 1719 CB ALA A1027 5.138 6.058 -7.810 1.00 0.00 C ATOM 0 H ALA A1027 3.173 7.573 -7.757 1.00 0.00 H new ATOM 0 HA ALA A1027 3.598 4.904 -8.741 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.819 5.214 -7.702 1.00 0.00 H new ATOM 0 HB2 ALA A1027 5.371 6.597 -8.728 1.00 0.00 H new ATOM 0 HB3 ALA A1027 5.251 6.727 -6.957 1.00 0.00 H new ATOM 1725 N LEU A1028 3.060 5.398 -5.531 1.00 0.00 N ATOM 1726 CA LEU A1028 2.732 4.700 -4.293 1.00 0.00 C ATOM 1727 C LEU A1028 1.366 4.009 -4.408 1.00 0.00 C ATOM 1728 O LEU A1028 1.131 2.958 -3.820 1.00 0.00 O ATOM 1729 CB LEU A1028 2.829 5.646 -3.068 1.00 0.00 C ATOM 1730 CG LEU A1028 1.613 5.692 -2.127 1.00 0.00 C ATOM 1731 CD1 LEU A1028 1.999 6.314 -0.803 1.00 0.00 C ATOM 1732 CD2 LEU A1028 0.461 6.488 -2.727 1.00 0.00 C ATOM 0 H LEU A1028 3.019 6.415 -5.471 1.00 0.00 H new ATOM 0 HA LEU A1028 3.472 3.916 -4.129 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.701 5.354 -2.482 1.00 0.00 H new ATOM 0 HB3 LEU A1028 3.014 6.656 -3.433 1.00 0.00 H new ATOM 0 HG LEU A1028 1.284 4.664 -1.979 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.129 6.341 -0.146 1.00 0.00 H new ATOM 0 HD12 LEU A1028 2.787 5.721 -0.338 1.00 0.00 H new ATOM 0 HD13 LEU A1028 2.359 7.329 -0.969 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -0.378 6.496 -2.031 1.00 0.00 H new ATOM 0 HD22 LEU A1028 0.785 7.511 -2.916 1.00 0.00 H new ATOM 0 HD23 LEU A1028 0.150 6.027 -3.665 1.00 0.00 H new ATOM 1744 N ALA A1029 0.461 4.607 -5.176 1.00 0.00 N ATOM 1745 CA ALA A1029 -0.803 3.952 -5.496 1.00 0.00 C ATOM 1746 C ALA A1029 -0.547 2.600 -6.155 1.00 0.00 C ATOM 1747 O ALA A1029 -1.266 1.626 -5.914 1.00 0.00 O ATOM 1748 CB ALA A1029 -1.646 4.836 -6.400 1.00 0.00 C ATOM 0 H ALA A1029 0.577 5.534 -5.585 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.353 3.786 -4.570 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -2.585 4.332 -6.629 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -1.854 5.779 -5.895 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -1.104 5.032 -7.325 1.00 0.00 H new ATOM 1754 N VAL A1030 0.470 2.552 -7.008 1.00 0.00 N ATOM 1755 CA VAL A1030 0.899 1.305 -7.619 1.00 0.00 C ATOM 1756 C VAL A1030 1.466 0.328 -6.591 1.00 0.00 C ATOM 1757 O VAL A1030 1.257 -0.875 -6.711 1.00 0.00 O ATOM 1758 CB VAL A1030 1.950 1.552 -8.729 1.00 0.00 C ATOM 1759 CG1 VAL A1030 2.427 0.241 -9.336 1.00 0.00 C ATOM 1760 CG2 VAL A1030 1.384 2.461 -9.810 1.00 0.00 C ATOM 0 H VAL A1030 1.013 3.368 -7.291 1.00 0.00 H new ATOM 0 HA VAL A1030 0.009 0.859 -8.063 1.00 0.00 H new ATOM 0 HB VAL A1030 2.808 2.045 -8.272 1.00 0.00 H new ATOM 0 HG11 VAL A1030 3.164 0.446 -10.112 1.00 0.00 H new ATOM 0 HG12 VAL A1030 2.880 -0.376 -8.560 1.00 0.00 H new ATOM 0 HG13 VAL A1030 1.579 -0.288 -9.772 1.00 0.00 H new ATOM 0 HG21 VAL A1030 2.138 2.623 -10.581 1.00 0.00 H new ATOM 0 HG22 VAL A1030 0.505 1.994 -10.254 1.00 0.00 H new ATOM 0 HG23 VAL A1030 1.104 3.418 -9.370 1.00 0.00 H new ATOM 1770 N ASP A1031 2.136 0.828 -5.560 1.00 0.00 N ATOM 1771 CA ASP A1031 2.834 -0.068 -4.642 1.00 0.00 C ATOM 1772 C ASP A1031 1.843 -0.819 -3.757 1.00 0.00 C ATOM 1773 O ASP A1031 2.004 -2.023 -3.521 1.00 0.00 O ATOM 1774 CB ASP A1031 3.917 0.651 -3.814 1.00 0.00 C ATOM 1775 CG ASP A1031 3.416 1.543 -2.679 1.00 0.00 C ATOM 1776 OD1 ASP A1031 2.643 1.072 -1.822 1.00 0.00 O ATOM 1777 OD2 ASP A1031 3.840 2.708 -2.623 1.00 0.00 O ATOM 0 H ASP A1031 2.212 1.821 -5.340 1.00 0.00 H new ATOM 0 HA ASP A1031 3.363 -0.801 -5.251 1.00 0.00 H new ATOM 0 HB2 ASP A1031 4.581 -0.102 -3.390 1.00 0.00 H new ATOM 0 HB3 ASP A1031 4.517 1.261 -4.490 1.00 0.00 H new ATOM 1782 N ALA A1032 0.800 -0.126 -3.306 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.270 -0.756 -2.556 1.00 0.00 C ATOM 1784 C ALA A1032 -0.953 -1.824 -3.399 1.00 0.00 C ATOM 1785 O ALA A1032 -1.028 -2.988 -3.010 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.285 0.293 -2.136 1.00 0.00 C ATOM 0 H ALA A1032 0.678 0.876 -3.451 1.00 0.00 H new ATOM 0 HA ALA A1032 0.153 -1.229 -1.670 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -2.088 -0.183 -1.573 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.797 1.041 -1.511 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.699 0.774 -3.022 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.407 -1.435 -4.581 1.00 0.00 N ATOM 1793 CA LYS A1033 -2.203 -2.327 -5.412 1.00 0.00 C ATOM 1794 C LYS A1033 -1.348 -3.448 -6.004 1.00 0.00 C ATOM 1795 O LYS A1033 -1.862 -4.508 -6.352 1.00 0.00 O ATOM 1796 CB LYS A1033 -2.916 -1.552 -6.523 1.00 0.00 C ATOM 1797 CG LYS A1033 -4.276 -2.138 -6.883 1.00 0.00 C ATOM 1798 CD LYS A1033 -4.952 -1.355 -7.997 1.00 0.00 C ATOM 1799 CE LYS A1033 -4.335 -1.656 -9.350 1.00 0.00 C ATOM 1800 NZ LYS A1033 -4.924 -0.823 -10.431 1.00 0.00 N ATOM 0 H LYS A1033 -1.240 -0.513 -4.985 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.959 -2.782 -4.772 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -3.045 -0.516 -6.210 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -2.285 -1.540 -7.412 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -4.154 -3.176 -7.191 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -4.916 -2.140 -6.001 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -6.014 -1.598 -8.020 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -4.873 -0.288 -7.791 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -3.260 -1.483 -9.304 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -4.478 -2.710 -9.587 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 -4.474 -1.061 -11.338 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -5.946 -1.007 -10.493 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -4.765 0.183 -10.220 1.00 0.00 H new ATOM 1814 N ASN A1034 -0.045 -3.227 -6.103 1.00 0.00 N ATOM 1815 CA ASN A1034 0.847 -4.259 -6.612 1.00 0.00 C ATOM 1816 C ASN A1034 1.038 -5.350 -5.567 1.00 0.00 C ATOM 1817 O ASN A1034 1.192 -6.521 -5.907 1.00 0.00 O ATOM 1818 CB ASN A1034 2.198 -3.671 -7.029 1.00 0.00 C ATOM 1819 CG ASN A1034 3.070 -4.680 -7.759 1.00 0.00 C ATOM 1820 OD1 ASN A1034 2.951 -4.852 -8.971 1.00 0.00 O ATOM 1821 ND2 ASN A1034 3.967 -5.334 -7.038 1.00 0.00 N ATOM 0 H ASN A1034 0.414 -2.354 -5.841 1.00 0.00 H new ATOM 0 HA ASN A1034 0.388 -4.696 -7.499 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.032 -2.807 -7.672 1.00 0.00 H new ATOM 0 HB3 ASN A1034 2.724 -3.314 -6.144 1.00 0.00 H new ATOM 0 HD21 ASN A1034 4.589 -6.007 -7.486 1.00 0.00 H new ATOM 0 HD22 ASN A1034 4.036 -5.165 -6.035 1.00 0.00 H new ATOM 1828 N LEU A1035 1.003 -4.973 -4.292 1.00 0.00 N ATOM 1829 CA LEU A1035 1.086 -5.959 -3.224 1.00 0.00 C ATOM 1830 C LEU A1035 -0.251 -6.665 -3.085 1.00 0.00 C ATOM 1831 O LEU A1035 -0.292 -7.844 -2.773 1.00 0.00 O ATOM 1832 CB LEU A1035 1.494 -5.334 -1.885 1.00 0.00 C ATOM 1833 CG LEU A1035 1.563 -6.329 -0.727 1.00 0.00 C ATOM 1834 CD1 LEU A1035 2.827 -7.160 -0.826 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.491 -5.623 0.613 1.00 0.00 C ATOM 0 H LEU A1035 0.919 -4.006 -3.978 1.00 0.00 H new ATOM 0 HA LEU A1035 1.862 -6.676 -3.492 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.468 -4.859 -2.000 1.00 0.00 H new ATOM 0 HB3 LEU A1035 0.783 -4.547 -1.632 1.00 0.00 H new ATOM 0 HG LEU A1035 0.700 -6.991 -0.798 1.00 0.00 H new ATOM 0 HD11 LEU A1035 2.865 -7.865 0.004 1.00 0.00 H new ATOM 0 HD12 LEU A1035 2.829 -7.708 -1.768 1.00 0.00 H new ATOM 0 HD13 LEU A1035 3.697 -6.505 -0.786 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.543 -6.359 1.415 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.326 -4.928 0.704 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.552 -5.073 0.685 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.338 -5.932 -3.336 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.684 -6.496 -3.354 1.00 0.00 C ATOM 1849 C LEU A1036 -2.698 -7.762 -4.198 1.00 0.00 C ATOM 1850 O LEU A1036 -3.257 -8.759 -3.792 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.714 -5.405 -3.810 1.00 0.00 C ATOM 1852 CG LEU A1036 -4.898 -5.791 -4.732 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -4.463 -6.084 -6.160 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -5.675 -6.958 -4.164 1.00 0.00 C ATOM 0 H LEU A1036 -1.307 -4.932 -3.532 1.00 0.00 H new ATOM 0 HA LEU A1036 -2.992 -6.797 -2.353 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -4.137 -4.962 -2.908 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -3.152 -4.621 -4.317 1.00 0.00 H new ATOM 0 HG LEU A1036 -5.552 -4.920 -4.771 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -5.335 -6.349 -6.759 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -3.986 -5.200 -6.584 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -3.756 -6.914 -6.162 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -6.499 -7.206 -4.832 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -5.016 -7.820 -4.065 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -6.070 -6.690 -3.184 1.00 0.00 H new ATOM 1866 N ASP A1037 -2.032 -7.729 -5.332 1.00 0.00 N ATOM 1867 CA ASP A1037 -1.923 -8.902 -6.195 1.00 0.00 C ATOM 1868 C ASP A1037 -0.986 -9.928 -5.567 1.00 0.00 C ATOM 1869 O ASP A1037 -1.285 -11.116 -5.521 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.411 -8.490 -7.577 1.00 0.00 C ATOM 1871 CG ASP A1037 -1.492 -9.612 -8.590 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -2.610 -9.893 -9.075 1.00 0.00 O ATOM 1873 OD2 ASP A1037 -0.447 -10.209 -8.916 1.00 0.00 O ATOM 0 H ASP A1037 -1.553 -6.901 -5.686 1.00 0.00 H new ATOM 0 HA ASP A1037 -2.909 -9.353 -6.307 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -1.991 -7.640 -7.936 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.377 -8.157 -7.492 1.00 0.00 H new ATOM 1878 N VAL A1038 0.146 -9.433 -5.079 1.00 0.00 N ATOM 1879 CA VAL A1038 1.132 -10.238 -4.357 1.00 0.00 C ATOM 1880 C VAL A1038 0.503 -11.101 -3.268 1.00 0.00 C ATOM 1881 O VAL A1038 0.577 -12.314 -3.333 1.00 0.00 O ATOM 1882 CB VAL A1038 2.191 -9.332 -3.705 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.021 -10.102 -2.697 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.079 -8.711 -4.762 1.00 0.00 C ATOM 0 H VAL A1038 0.410 -8.452 -5.173 1.00 0.00 H new ATOM 0 HA VAL A1038 1.589 -10.896 -5.097 1.00 0.00 H new ATOM 0 HB VAL A1038 1.673 -8.534 -3.174 1.00 0.00 H new ATOM 0 HG11 VAL A1038 3.761 -9.437 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.371 -10.496 -1.916 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.528 -10.927 -3.198 1.00 0.00 H new ATOM 0 HG21 VAL A1038 3.822 -8.073 -4.284 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.583 -9.498 -5.322 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.472 -8.113 -5.442 1.00 0.00 H new ATOM 1894 N ILE A1039 -0.088 -10.462 -2.269 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.622 -11.155 -1.094 1.00 0.00 C ATOM 1896 C ILE A1039 -1.979 -11.814 -1.355 1.00 0.00 C ATOM 1897 O ILE A1039 -2.309 -12.814 -0.713 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.689 -10.230 0.145 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -1.136 -8.809 -0.202 1.00 0.00 C ATOM 1900 CG2 ILE A1039 0.669 -10.175 0.818 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -2.530 -8.702 -0.764 1.00 0.00 C ATOM 0 H ILE A1039 -0.213 -9.450 -2.245 1.00 0.00 H new ATOM 0 HA ILE A1039 0.085 -11.956 -0.879 1.00 0.00 H new ATOM 0 HB ILE A1039 -1.434 -10.654 0.818 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.074 -8.195 0.696 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -0.436 -8.390 -0.924 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.617 -9.523 1.690 1.00 0.00 H new ATOM 0 HG22 ILE A1039 0.960 -11.177 1.132 1.00 0.00 H new ATOM 0 HG23 ILE A1039 1.407 -9.785 0.117 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.757 -7.658 -0.979 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -2.598 -9.284 -1.683 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -3.246 -9.086 -0.037 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.766 -11.254 -2.271 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.932 -11.961 -2.807 1.00 0.00 C ATOM 1915 C ASP A1040 -3.472 -13.334 -3.248 1.00 0.00 C ATOM 1916 O ASP A1040 -4.032 -14.376 -2.872 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.507 -11.171 -3.994 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.477 -11.934 -4.876 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -5.029 -12.793 -5.665 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -6.687 -11.627 -4.835 1.00 0.00 O ATOM 0 H ASP A1040 -2.621 -10.321 -2.656 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.715 -12.057 -2.055 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -5.013 -10.286 -3.608 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.679 -10.822 -4.611 1.00 0.00 H new ATOM 1925 N GLN A1041 -2.385 -13.308 -3.992 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.738 -14.518 -4.432 1.00 0.00 C ATOM 1927 C GLN A1041 -0.979 -15.177 -3.299 1.00 0.00 C ATOM 1928 O GLN A1041 -0.886 -16.373 -3.288 1.00 0.00 O ATOM 1929 CB GLN A1041 -0.789 -14.257 -5.591 1.00 0.00 C ATOM 1930 CG GLN A1041 -1.497 -13.984 -6.907 1.00 0.00 C ATOM 1931 CD GLN A1041 -0.538 -13.587 -8.007 1.00 0.00 C ATOM 1932 OE1 GLN A1041 -0.754 -13.901 -9.177 1.00 0.00 O ATOM 1933 NE2 GLN A1041 0.516 -12.877 -7.643 1.00 0.00 N ATOM 0 H GLN A1041 -1.930 -12.450 -4.305 1.00 0.00 H new ATOM 0 HA GLN A1041 -2.526 -15.190 -4.771 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -0.155 -13.405 -5.346 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -0.132 -15.118 -5.713 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -2.047 -14.874 -7.212 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -2.230 -13.190 -6.764 1.00 0.00 H new ATOM 0 HE21 GLN A1041 0.656 -12.639 -6.661 1.00 0.00 H new ATOM 0 HE22 GLN A1041 1.189 -12.567 -8.344 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.427 -14.404 -2.360 1.00 0.00 N ATOM 1943 CA ALA A1042 0.299 -14.956 -1.220 1.00 0.00 C ATOM 1944 C ALA A1042 -0.511 -16.002 -0.480 1.00 0.00 C ATOM 1945 O ALA A1042 -0.054 -17.124 -0.264 1.00 0.00 O ATOM 1946 CB ALA A1042 0.667 -13.847 -0.258 1.00 0.00 C ATOM 0 H ALA A1042 -0.472 -13.385 -2.371 1.00 0.00 H new ATOM 0 HA ALA A1042 1.197 -15.435 -1.610 1.00 0.00 H new ATOM 0 HB1 ALA A1042 1.208 -14.266 0.590 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.298 -13.118 -0.767 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.240 -13.357 0.097 1.00 0.00 H new ATOM 1952 N ARG A1043 -1.698 -15.618 -0.058 1.00 0.00 N ATOM 1953 CA ARG A1043 -2.614 -16.565 0.554 1.00 0.00 C ATOM 1954 C ARG A1043 -2.845 -17.764 -0.376 1.00 0.00 C ATOM 1955 O ARG A1043 -2.971 -18.904 0.077 1.00 0.00 O ATOM 1956 CB ARG A1043 -3.930 -15.876 0.893 1.00 0.00 C ATOM 1957 CG ARG A1043 -4.522 -16.319 2.220 1.00 0.00 C ATOM 1958 CD ARG A1043 -3.581 -16.027 3.379 1.00 0.00 C ATOM 1959 NE ARG A1043 -4.265 -16.117 4.669 1.00 0.00 N ATOM 1960 CZ ARG A1043 -3.664 -16.008 5.854 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -2.345 -15.886 5.938 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -4.390 -16.025 6.961 1.00 0.00 N ATOM 0 H ARG A1043 -2.052 -14.664 -0.126 1.00 0.00 H new ATOM 0 HA ARG A1043 -2.173 -16.936 1.479 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -3.771 -14.798 0.917 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.650 -16.074 0.099 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.471 -15.809 2.384 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -4.736 -17.387 2.185 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -2.749 -16.731 3.358 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -3.157 -15.030 3.261 1.00 0.00 H new ATOM 0 HE ARG A1043 -5.273 -16.274 4.661 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -1.779 -15.875 5.090 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -1.898 -15.803 6.851 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -5.404 -16.121 6.905 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -3.935 -15.942 7.870 1.00 0.00 H new ATOM 1976 N LEU A1044 -2.880 -17.506 -1.682 1.00 0.00 N ATOM 1977 CA LEU A1044 -3.000 -18.579 -2.669 1.00 0.00 C ATOM 1978 C LEU A1044 -1.668 -19.346 -2.829 1.00 0.00 C ATOM 1979 O LEU A1044 -1.664 -20.515 -3.197 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.482 -17.997 -4.009 1.00 0.00 C ATOM 1981 CG LEU A1044 -3.813 -19.009 -5.114 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -4.922 -18.467 -6.004 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -2.582 -19.318 -5.958 1.00 0.00 C ATOM 0 H LEU A1044 -2.827 -16.569 -2.081 1.00 0.00 H new ATOM 0 HA LEU A1044 -3.738 -19.300 -2.318 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -4.371 -17.395 -3.820 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.713 -17.321 -4.384 1.00 0.00 H new ATOM 0 HG LEU A1044 -4.147 -19.931 -4.639 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -5.149 -19.193 -6.785 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -5.815 -18.287 -5.405 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -4.598 -17.532 -6.461 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -2.844 -20.038 -6.734 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -2.219 -18.401 -6.422 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -1.801 -19.737 -5.323 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.546 -18.682 -2.541 1.00 0.00 N ATOM 1996 CA LYS A1045 0.777 -19.310 -2.582 1.00 0.00 C ATOM 1997 C LYS A1045 0.849 -20.373 -1.509 1.00 0.00 C ATOM 1998 O LYS A1045 1.528 -21.386 -1.654 1.00 0.00 O ATOM 1999 CB LYS A1045 1.900 -18.297 -2.314 1.00 0.00 C ATOM 2000 CG LYS A1045 1.911 -17.064 -3.197 1.00 0.00 C ATOM 2001 CD LYS A1045 2.356 -17.345 -4.622 1.00 0.00 C ATOM 2002 CE LYS A1045 2.399 -16.053 -5.428 1.00 0.00 C ATOM 2003 NZ LYS A1045 2.914 -16.252 -6.809 1.00 0.00 N ATOM 0 H LYS A1045 -0.529 -17.698 -2.274 1.00 0.00 H new ATOM 0 HA LYS A1045 0.913 -19.731 -3.578 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.830 -17.974 -1.275 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.857 -18.808 -2.426 1.00 0.00 H new ATOM 0 HG2 LYS A1045 0.911 -16.631 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A1045 2.573 -16.318 -2.758 1.00 0.00 H new ATOM 0 HD2 LYS A1045 3.341 -17.811 -4.617 1.00 0.00 H new ATOM 0 HD3 LYS A1045 1.671 -18.052 -5.091 1.00 0.00 H new ATOM 0 HE2 LYS A1045 1.397 -15.627 -5.477 1.00 0.00 H new ATOM 0 HE3 LYS A1045 3.028 -15.329 -4.911 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 3.130 -15.328 -7.235 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 3.779 -16.829 -6.777 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 2.194 -16.738 -7.381 1.00 0.00 H new ATOM 2017 N MET A1046 0.155 -20.117 -0.415 1.00 0.00 N ATOM 2018 CA MET A1046 0.059 -21.089 0.659 1.00 0.00 C ATOM 2019 C MET A1046 -0.678 -22.319 0.144 1.00 0.00 C ATOM 2020 O MET A1046 -0.304 -23.458 0.436 1.00 0.00 O ATOM 2021 CB MET A1046 -0.652 -20.483 1.870 1.00 0.00 C ATOM 2022 CG MET A1046 -0.656 -21.380 3.099 1.00 0.00 C ATOM 2023 SD MET A1046 -1.923 -22.663 3.037 1.00 0.00 S ATOM 2024 CE MET A1046 -1.609 -23.513 4.579 1.00 0.00 C ATOM 0 H MET A1046 -0.349 -19.247 -0.247 1.00 0.00 H new ATOM 0 HA MET A1046 1.058 -21.382 0.983 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.172 -19.538 2.124 1.00 0.00 H new ATOM 0 HB3 MET A1046 -1.682 -20.254 1.597 1.00 0.00 H new ATOM 0 HG2 MET A1046 0.322 -21.849 3.202 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.811 -20.768 3.987 1.00 0.00 H new ATOM 0 HE1 MET A1046 -2.313 -24.337 4.690 1.00 0.00 H new ATOM 0 HE2 MET A1046 -0.591 -23.903 4.579 1.00 0.00 H new ATOM 0 HE3 MET A1046 -1.731 -22.817 5.409 1.00 0.00 H new ATOM 2034 N ILE A1047 -1.712 -22.072 -0.652 1.00 0.00 N ATOM 2035 CA ILE A1047 -2.413 -23.141 -1.352 1.00 0.00 C ATOM 2036 C ILE A1047 -1.478 -23.800 -2.370 1.00 0.00 C ATOM 2037 O ILE A1047 -1.507 -25.011 -2.553 1.00 0.00 O ATOM 2038 CB ILE A1047 -3.680 -22.615 -2.071 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -4.617 -21.928 -1.072 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -4.408 -23.744 -2.791 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.071 -22.827 0.061 1.00 0.00 C ATOM 0 H ILE A1047 -2.084 -21.139 -0.829 1.00 0.00 H new ATOM 0 HA ILE A1047 -2.726 -23.876 -0.610 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.366 -21.884 -2.816 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -4.111 -21.059 -0.653 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -5.494 -21.560 -1.605 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -5.294 -23.347 -3.287 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -3.745 -24.190 -3.533 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -4.707 -24.504 -2.068 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -5.731 -22.270 0.726 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -5.607 -23.684 -0.347 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -4.202 -23.175 0.620 1.00 0.00 H new ATOM 2053 N SER A1048 -0.635 -22.988 -3.008 1.00 0.00 N ATOM 2054 CA SER A1048 0.361 -23.477 -3.961 1.00 0.00 C ATOM 2055 C SER A1048 1.307 -24.468 -3.286 1.00 0.00 C ATOM 2056 O SER A1048 1.725 -25.457 -3.886 1.00 0.00 O ATOM 2057 CB SER A1048 1.164 -22.300 -4.540 1.00 0.00 C ATOM 2058 OG SER A1048 2.083 -22.732 -5.533 1.00 0.00 O ATOM 0 H SER A1048 -0.623 -21.976 -2.879 1.00 0.00 H new ATOM 0 HA SER A1048 -0.160 -23.987 -4.772 1.00 0.00 H new ATOM 0 HB2 SER A1048 0.480 -21.569 -4.970 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.704 -21.798 -3.738 1.00 0.00 H new ATOM 0 HG SER A1048 2.576 -21.960 -5.881 1.00 0.00 H new ATOM 2064 N GLN A1049 1.638 -24.186 -2.032 1.00 0.00 N ATOM 2065 CA GLN A1049 2.510 -25.047 -1.248 1.00 0.00 C ATOM 2066 C GLN A1049 1.774 -26.326 -0.850 1.00 0.00 C ATOM 2067 O GLN A1049 2.381 -27.385 -0.689 1.00 0.00 O ATOM 2068 CB GLN A1049 3.009 -24.282 -0.011 1.00 0.00 C ATOM 2069 CG GLN A1049 3.995 -25.050 0.863 1.00 0.00 C ATOM 2070 CD GLN A1049 3.323 -25.963 1.875 1.00 0.00 C ATOM 2071 OE1 GLN A1049 3.855 -27.013 2.227 1.00 0.00 O ATOM 2072 NE2 GLN A1049 2.153 -25.567 2.358 1.00 0.00 N ATOM 0 H GLN A1049 1.311 -23.358 -1.533 1.00 0.00 H new ATOM 0 HA GLN A1049 3.373 -25.335 -1.848 1.00 0.00 H new ATOM 0 HB2 GLN A1049 3.482 -23.357 -0.340 1.00 0.00 H new ATOM 0 HB3 GLN A1049 2.149 -24.002 0.597 1.00 0.00 H new ATOM 0 HG2 GLN A1049 4.647 -25.646 0.224 1.00 0.00 H new ATOM 0 HG3 GLN A1049 4.630 -24.339 1.392 1.00 0.00 H new ATOM 0 HE21 GLN A1049 1.742 -24.689 2.042 1.00 0.00 H new ATOM 0 HE22 GLN A1049 1.664 -26.141 3.045 1.00 0.00 H new