USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 758 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 70 SER OG : rot 80:sc= 1.72 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= 0 (180deg=-0.2) USER MOD Single : A 5 SER OG : rot 180:sc= 0.0067 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0384 USER MOD Single : A 11 MET CE :methyl -167:sc= -1.77! (180deg=-2.67) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0881 USER MOD Single : A 26 ASN : amide:sc= -0.487 K(o=-0.49,f=-8!) USER MOD Single : A 30 SER OG : rot -60:sc= 0.101 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.07 X(o=-0.07,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0155 USER MOD Single : A 54 THR OG1 : rot -170:sc= -0.249 USER MOD Single : A 56 ASN : amide:sc= -0.048 K(o=-0.048,f=-2!) USER MOD Single : A 58 MET CE :methyl -157:sc= -1.75 (180deg=-2.29) USER MOD Single : A 60 THR OG1 : rot -37:sc= 0.43 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 155:sc= -0.352 (180deg=-1.23) USER MOD Single : A 79 HIS : no HD1:sc= -1.38 K(o=-1.4,f=-2.7) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot -42:sc= 0.955 USER MOD Single : A 84 THR OG1 : rot 71:sc= 0.186 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 78:sc= 0.279 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -1.28 K(o=-1.3,f=-2.3!) USER MOD Single : A 96 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0218) USER MOD Single : A 97 LYS NZ :NH3+ -114:sc= -1.77! (180deg=-4.06!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.202 -1.016 -15.080 1.00 0.00 N ATOM 2 CA MET A 1 18.159 -0.347 -15.850 1.00 0.00 C ATOM 3 C MET A 1 17.546 0.801 -15.054 1.00 0.00 C ATOM 4 O MET A 1 17.150 0.628 -13.902 1.00 0.00 O ATOM 5 CB MET A 1 17.071 -1.346 -16.248 1.00 0.00 C ATOM 6 CG MET A 1 16.587 -2.210 -15.094 1.00 0.00 C ATOM 7 SD MET A 1 14.893 -2.784 -15.319 1.00 0.00 S ATOM 8 CE MET A 1 14.414 -3.097 -13.621 1.00 0.00 C ATOM 0 H1 MET A 1 19.486 -1.890 -15.566 1.00 0.00 H new ATOM 0 H2 MET A 1 20.025 -0.387 -14.991 1.00 0.00 H new ATOM 0 H3 MET A 1 18.840 -1.248 -14.133 1.00 0.00 H new ATOM 0 HA MET A 1 18.614 0.063 -16.752 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.223 -0.801 -16.663 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.454 -1.991 -17.039 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.247 -3.071 -14.988 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.654 -1.641 -14.167 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.386 -3.459 -13.594 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.075 -3.848 -13.189 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.489 -2.174 -13.046 1.00 0.00 H new ATOM 18 N ALA A 2 17.473 1.973 -15.677 1.00 0.00 N ATOM 19 CA ALA A 2 16.907 3.148 -15.028 1.00 0.00 C ATOM 20 C ALA A 2 15.853 3.810 -15.910 1.00 0.00 C ATOM 21 O ALA A 2 15.959 4.992 -16.237 1.00 0.00 O ATOM 22 CB ALA A 2 18.007 4.140 -14.681 1.00 0.00 C ATOM 0 H ALA A 2 17.799 2.133 -16.630 1.00 0.00 H new ATOM 0 HA ALA A 2 16.420 2.825 -14.108 1.00 0.00 H new ATOM 0 HB1 ALA A 2 17.570 5.013 -14.197 1.00 0.00 H new ATOM 0 HB2 ALA A 2 18.721 3.670 -14.005 1.00 0.00 H new ATOM 0 HB3 ALA A 2 18.519 4.449 -15.592 1.00 0.00 H new ATOM 28 N ARG A 3 14.840 3.040 -16.292 1.00 0.00 N ATOM 29 CA ARG A 3 13.769 3.552 -17.139 1.00 0.00 C ATOM 30 C ARG A 3 12.520 3.850 -16.316 1.00 0.00 C ATOM 31 O ARG A 3 12.084 3.027 -15.511 1.00 0.00 O ATOM 32 CB ARG A 3 13.438 2.545 -18.243 1.00 0.00 C ATOM 33 CG ARG A 3 14.628 2.187 -19.117 1.00 0.00 C ATOM 34 CD ARG A 3 14.862 3.232 -20.198 1.00 0.00 C ATOM 35 NE ARG A 3 15.663 4.351 -19.711 1.00 0.00 N ATOM 36 CZ ARG A 3 15.767 5.512 -20.349 1.00 0.00 C ATOM 37 NH1 ARG A 3 15.122 5.704 -21.492 1.00 0.00 N ATOM 38 NH2 ARG A 3 16.516 6.483 -19.843 1.00 0.00 N ATOM 0 H ARG A 3 14.738 2.060 -16.029 1.00 0.00 H new ATOM 0 HA ARG A 3 14.112 4.481 -17.595 1.00 0.00 H new ATOM 0 HB2 ARG A 3 13.046 1.636 -17.788 1.00 0.00 H new ATOM 0 HB3 ARG A 3 12.647 2.954 -18.871 1.00 0.00 H new ATOM 0 HG2 ARG A 3 15.521 2.096 -18.498 1.00 0.00 H new ATOM 0 HG3 ARG A 3 14.461 1.214 -19.580 1.00 0.00 H new ATOM 0 HD2 ARG A 3 15.364 2.769 -21.047 1.00 0.00 H new ATOM 0 HD3 ARG A 3 13.902 3.603 -20.558 1.00 0.00 H new ATOM 0 HE ARG A 3 16.170 4.235 -18.834 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.545 4.960 -21.883 1.00 0.00 H new ATOM 0 HH12 ARG A 3 15.203 6.596 -21.980 1.00 0.00 H new ATOM 0 HH21 ARG A 3 17.012 6.339 -18.964 1.00 0.00 H new ATOM 0 HH22 ARG A 3 16.595 7.374 -20.333 1.00 0.00 H new ATOM 52 N GLY A 4 11.948 5.031 -16.523 1.00 0.00 N ATOM 53 CA GLY A 4 10.755 5.417 -15.792 1.00 0.00 C ATOM 54 C GLY A 4 9.493 5.261 -16.618 1.00 0.00 C ATOM 55 O GLY A 4 8.444 5.802 -16.269 1.00 0.00 O ATOM 0 H GLY A 4 12.289 5.728 -17.184 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.673 4.810 -14.890 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.849 6.454 -15.471 1.00 0.00 H new ATOM 59 N SER A 5 9.596 4.523 -17.718 1.00 0.00 N ATOM 60 CA SER A 5 8.455 4.302 -18.599 1.00 0.00 C ATOM 61 C SER A 5 7.478 3.304 -17.984 1.00 0.00 C ATOM 62 O SER A 5 7.674 2.838 -16.862 1.00 0.00 O ATOM 63 CB SER A 5 8.928 3.795 -19.964 1.00 0.00 C ATOM 64 OG SER A 5 9.824 2.707 -19.821 1.00 0.00 O ATOM 0 H SER A 5 10.457 4.068 -18.021 1.00 0.00 H new ATOM 0 HA SER A 5 7.940 5.254 -18.731 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.068 3.486 -20.559 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.417 4.604 -20.507 1.00 0.00 H new ATOM 0 HG SER A 5 10.110 2.400 -20.707 1.00 0.00 H new ATOM 70 N VAL A 6 6.425 2.982 -18.728 1.00 0.00 N ATOM 71 CA VAL A 6 5.417 2.039 -18.258 1.00 0.00 C ATOM 72 C VAL A 6 4.639 1.440 -19.424 1.00 0.00 C ATOM 73 O VAL A 6 4.050 2.162 -20.228 1.00 0.00 O ATOM 74 CB VAL A 6 4.428 2.712 -17.288 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.759 3.908 -17.950 1.00 0.00 C ATOM 76 CG2 VAL A 6 3.390 1.710 -16.806 1.00 0.00 C ATOM 0 H VAL A 6 6.248 3.360 -19.659 1.00 0.00 H new ATOM 0 HA VAL A 6 5.947 1.245 -17.732 1.00 0.00 H new ATOM 0 HB VAL A 6 4.984 3.071 -16.422 1.00 0.00 H new ATOM 0 HG11 VAL A 6 3.064 4.370 -17.249 1.00 0.00 H new ATOM 0 HG12 VAL A 6 4.518 4.634 -18.241 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.215 3.577 -18.835 1.00 0.00 H new ATOM 0 HG21 VAL A 6 2.699 2.202 -16.121 1.00 0.00 H new ATOM 0 HG22 VAL A 6 2.837 1.319 -17.660 1.00 0.00 H new ATOM 0 HG23 VAL A 6 3.889 0.889 -16.290 1.00 0.00 H new ATOM 86 N SER A 7 4.641 0.113 -19.510 1.00 0.00 N ATOM 87 CA SER A 7 3.939 -0.586 -20.580 1.00 0.00 C ATOM 88 C SER A 7 2.432 -0.367 -20.473 1.00 0.00 C ATOM 89 O SER A 7 1.931 0.088 -19.445 1.00 0.00 O ATOM 90 CB SER A 7 4.254 -2.081 -20.535 1.00 0.00 C ATOM 91 OG SER A 7 4.333 -2.546 -19.198 1.00 0.00 O ATOM 0 H SER A 7 5.121 -0.500 -18.851 1.00 0.00 H new ATOM 0 HA SER A 7 4.281 -0.180 -21.532 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.483 -2.635 -21.071 1.00 0.00 H new ATOM 0 HB3 SER A 7 5.197 -2.273 -21.046 1.00 0.00 H new ATOM 0 HG SER A 7 4.534 -3.505 -19.197 1.00 0.00 H new ATOM 97 N ASP A 8 1.716 -0.697 -21.542 1.00 0.00 N ATOM 98 CA ASP A 8 0.266 -0.539 -21.570 1.00 0.00 C ATOM 99 C ASP A 8 -0.392 -1.375 -20.478 1.00 0.00 C ATOM 100 O ASP A 8 -1.128 -0.852 -19.642 1.00 0.00 O ATOM 101 CB ASP A 8 -0.286 -0.939 -22.938 1.00 0.00 C ATOM 102 CG ASP A 8 -0.179 0.180 -23.956 1.00 0.00 C ATOM 103 OD1 ASP A 8 0.629 0.048 -24.900 1.00 0.00 O ATOM 104 OD2 ASP A 8 -0.902 1.186 -23.809 1.00 0.00 O ATOM 0 H ASP A 8 2.116 -1.076 -22.401 1.00 0.00 H new ATOM 0 HA ASP A 8 0.036 0.511 -21.388 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.255 -1.812 -23.304 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.331 -1.232 -22.833 1.00 0.00 H new ATOM 109 N GLU A 9 -0.123 -2.677 -20.492 1.00 0.00 N ATOM 110 CA GLU A 9 -0.691 -3.585 -19.504 1.00 0.00 C ATOM 111 C GLU A 9 -0.403 -3.096 -18.086 1.00 0.00 C ATOM 112 O GLU A 9 -1.323 -2.860 -17.304 1.00 0.00 O ATOM 113 CB GLU A 9 -0.129 -4.996 -19.692 1.00 0.00 C ATOM 114 CG GLU A 9 -0.710 -5.728 -20.890 1.00 0.00 C ATOM 115 CD GLU A 9 -0.183 -7.144 -21.020 1.00 0.00 C ATOM 116 OE1 GLU A 9 -0.995 -8.089 -20.929 1.00 0.00 O ATOM 117 OE2 GLU A 9 1.039 -7.308 -21.212 1.00 0.00 O ATOM 0 H GLU A 9 0.485 -3.126 -21.177 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.771 -3.609 -19.650 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.953 -4.935 -19.804 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.324 -5.578 -18.792 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.796 -5.755 -20.803 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.477 -5.173 -21.799 1.00 0.00 H new ATOM 124 N GLU A 10 0.879 -2.949 -17.766 1.00 0.00 N ATOM 125 CA GLU A 10 1.286 -2.490 -16.444 1.00 0.00 C ATOM 126 C GLU A 10 0.621 -1.161 -16.100 1.00 0.00 C ATOM 127 O GLU A 10 0.055 -0.999 -15.019 1.00 0.00 O ATOM 128 CB GLU A 10 2.808 -2.344 -16.378 1.00 0.00 C ATOM 129 CG GLU A 10 3.345 -2.203 -14.963 1.00 0.00 C ATOM 130 CD GLU A 10 3.804 -3.525 -14.379 1.00 0.00 C ATOM 131 OE1 GLU A 10 3.038 -4.507 -14.462 1.00 0.00 O ATOM 132 OE2 GLU A 10 4.929 -3.576 -13.839 1.00 0.00 O ATOM 0 H GLU A 10 1.652 -3.141 -18.403 1.00 0.00 H new ATOM 0 HA GLU A 10 0.967 -3.235 -15.715 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.269 -3.213 -16.848 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.107 -1.472 -16.960 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.179 -1.501 -14.963 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.570 -1.778 -14.325 1.00 0.00 H new ATOM 139 N MET A 11 0.694 -0.212 -17.028 1.00 0.00 N ATOM 140 CA MET A 11 0.098 1.103 -16.823 1.00 0.00 C ATOM 141 C MET A 11 -1.355 0.979 -16.377 1.00 0.00 C ATOM 142 O MET A 11 -1.800 1.688 -15.476 1.00 0.00 O ATOM 143 CB MET A 11 0.180 1.929 -18.108 1.00 0.00 C ATOM 144 CG MET A 11 -0.464 3.301 -17.992 1.00 0.00 C ATOM 145 SD MET A 11 0.530 4.456 -17.029 1.00 0.00 S ATOM 146 CE MET A 11 -0.428 4.551 -15.519 1.00 0.00 C ATOM 0 H MET A 11 1.159 -0.329 -17.928 1.00 0.00 H new ATOM 0 HA MET A 11 0.658 1.609 -16.037 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.227 2.051 -18.385 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.302 1.378 -18.916 1.00 0.00 H new ATOM 0 HG2 MET A 11 -0.623 3.709 -18.990 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.446 3.199 -17.529 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.078 5.390 -14.918 1.00 0.00 H new ATOM 0 HE2 MET A 11 -1.480 4.695 -15.764 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.310 3.626 -14.954 1.00 0.00 H new ATOM 156 N MET A 12 -2.090 0.073 -17.015 1.00 0.00 N ATOM 157 CA MET A 12 -3.492 -0.144 -16.682 1.00 0.00 C ATOM 158 C MET A 12 -3.633 -0.763 -15.294 1.00 0.00 C ATOM 159 O MET A 12 -4.237 -0.171 -14.400 1.00 0.00 O ATOM 160 CB MET A 12 -4.153 -1.049 -17.725 1.00 0.00 C ATOM 161 CG MET A 12 -4.755 -0.288 -18.894 1.00 0.00 C ATOM 162 SD MET A 12 -5.039 -1.337 -20.332 1.00 0.00 S ATOM 163 CE MET A 12 -6.469 -0.539 -21.057 1.00 0.00 C ATOM 0 H MET A 12 -1.737 -0.522 -17.765 1.00 0.00 H new ATOM 0 HA MET A 12 -3.992 0.824 -16.682 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.413 -1.754 -18.103 1.00 0.00 H new ATOM 0 HB3 MET A 12 -4.935 -1.635 -17.242 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.699 0.160 -18.584 1.00 0.00 H new ATOM 0 HG3 MET A 12 -4.090 0.530 -19.171 1.00 0.00 H new ATOM 0 HE1 MET A 12 -6.766 -1.074 -21.959 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.292 -0.548 -20.342 1.00 0.00 H new ATOM 0 HE3 MET A 12 -6.221 0.491 -21.312 1.00 0.00 H new ATOM 173 N GLU A 13 -3.070 -1.955 -15.122 1.00 0.00 N ATOM 174 CA GLU A 13 -3.134 -2.652 -13.843 1.00 0.00 C ATOM 175 C GLU A 13 -2.690 -1.740 -12.704 1.00 0.00 C ATOM 176 O GLU A 13 -3.171 -1.855 -11.576 1.00 0.00 O ATOM 177 CB GLU A 13 -2.261 -3.908 -13.877 1.00 0.00 C ATOM 178 CG GLU A 13 -2.993 -5.146 -14.367 1.00 0.00 C ATOM 179 CD GLU A 13 -3.931 -5.720 -13.323 1.00 0.00 C ATOM 180 OE1 GLU A 13 -5.038 -5.169 -13.152 1.00 0.00 O ATOM 181 OE2 GLU A 13 -3.557 -6.721 -12.676 1.00 0.00 O ATOM 0 H GLU A 13 -2.565 -2.458 -15.852 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.170 -2.944 -13.668 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.402 -3.725 -14.522 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.873 -4.098 -12.876 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.561 -4.897 -15.263 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.265 -5.905 -14.652 1.00 0.00 H new ATOM 188 N LEU A 14 -1.766 -0.833 -13.005 1.00 0.00 N ATOM 189 CA LEU A 14 -1.254 0.099 -12.007 1.00 0.00 C ATOM 190 C LEU A 14 -2.230 1.251 -11.787 1.00 0.00 C ATOM 191 O LEU A 14 -2.737 1.445 -10.682 1.00 0.00 O ATOM 192 CB LEU A 14 0.107 0.644 -12.440 1.00 0.00 C ATOM 193 CG LEU A 14 1.313 -0.246 -12.139 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.558 0.289 -12.831 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.538 -0.350 -10.638 1.00 0.00 C ATOM 0 H LEU A 14 -1.356 -0.724 -13.933 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.139 -0.440 -11.067 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.077 0.830 -13.514 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.261 1.607 -11.954 1.00 0.00 H new ATOM 0 HG LEU A 14 1.108 -1.244 -12.525 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.406 -0.357 -12.605 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.395 0.310 -13.908 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.766 1.298 -12.476 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.400 -0.987 -10.443 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.720 0.643 -10.228 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.655 -0.781 -10.167 1.00 0.00 H new ATOM 207 N ARG A 15 -2.489 2.011 -12.846 1.00 0.00 N ATOM 208 CA ARG A 15 -3.404 3.143 -12.770 1.00 0.00 C ATOM 209 C ARG A 15 -4.735 2.725 -12.151 1.00 0.00 C ATOM 210 O ARG A 15 -5.343 3.482 -11.396 1.00 0.00 O ATOM 211 CB ARG A 15 -3.639 3.731 -14.162 1.00 0.00 C ATOM 212 CG ARG A 15 -4.758 3.047 -14.931 1.00 0.00 C ATOM 213 CD ARG A 15 -6.106 3.685 -14.637 1.00 0.00 C ATOM 214 NE ARG A 15 -7.055 3.489 -15.731 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.188 4.171 -15.852 1.00 0.00 C ATOM 216 NH1 ARG A 15 -8.513 5.089 -14.952 1.00 0.00 N ATOM 217 NH2 ARG A 15 -8.999 3.936 -16.875 1.00 0.00 N ATOM 0 H ARG A 15 -2.078 1.863 -13.768 1.00 0.00 H new ATOM 0 HA ARG A 15 -2.950 3.903 -12.134 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -3.872 4.791 -14.065 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.717 3.659 -14.738 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.553 3.103 -16.000 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -4.789 1.990 -14.667 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.516 3.260 -13.721 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -5.971 4.752 -14.461 1.00 0.00 H new ATOM 0 HE ARG A 15 -6.835 2.790 -16.441 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -7.892 5.273 -14.164 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.384 5.611 -15.048 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.753 3.231 -17.570 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -9.869 4.460 -16.967 1.00 0.00 H new ATOM 231 N GLU A 16 -5.180 1.516 -12.478 1.00 0.00 N ATOM 232 CA GLU A 16 -6.439 0.999 -11.955 1.00 0.00 C ATOM 233 C GLU A 16 -6.288 0.571 -10.498 1.00 0.00 C ATOM 234 O GLU A 16 -7.195 0.759 -9.688 1.00 0.00 O ATOM 235 CB GLU A 16 -6.920 -0.184 -12.798 1.00 0.00 C ATOM 236 CG GLU A 16 -6.098 -1.447 -12.599 1.00 0.00 C ATOM 237 CD GLU A 16 -6.561 -2.263 -11.408 1.00 0.00 C ATOM 238 OE1 GLU A 16 -7.785 -2.478 -11.276 1.00 0.00 O ATOM 239 OE2 GLU A 16 -5.702 -2.686 -10.607 1.00 0.00 O ATOM 0 H GLU A 16 -4.688 0.877 -13.102 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.179 1.797 -12.007 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -7.961 -0.395 -12.552 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.892 0.096 -13.851 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -6.156 -2.059 -13.499 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.051 -1.177 -12.464 1.00 0.00 H new ATOM 246 N ALA A 17 -5.135 -0.007 -10.172 1.00 0.00 N ATOM 247 CA ALA A 17 -4.865 -0.460 -8.814 1.00 0.00 C ATOM 248 C ALA A 17 -4.936 0.698 -7.824 1.00 0.00 C ATOM 249 O ALA A 17 -5.403 0.536 -6.696 1.00 0.00 O ATOM 250 CB ALA A 17 -3.502 -1.133 -8.744 1.00 0.00 C ATOM 0 H ALA A 17 -4.374 -0.172 -10.831 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.631 -1.185 -8.540 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.313 -1.467 -7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.485 -1.991 -9.416 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.730 -0.424 -9.043 1.00 0.00 H new ATOM 256 N PHE A 18 -4.471 1.867 -8.253 1.00 0.00 N ATOM 257 CA PHE A 18 -4.481 3.051 -7.403 1.00 0.00 C ATOM 258 C PHE A 18 -5.890 3.626 -7.288 1.00 0.00 C ATOM 259 O PHE A 18 -6.389 3.856 -6.186 1.00 0.00 O ATOM 260 CB PHE A 18 -3.530 4.112 -7.960 1.00 0.00 C ATOM 261 CG PHE A 18 -2.251 3.544 -8.507 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.554 2.574 -7.806 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.748 3.980 -9.721 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.378 2.048 -8.307 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.572 3.458 -10.227 1.00 0.00 C ATOM 266 CZ PHE A 18 0.115 2.491 -9.518 1.00 0.00 C ATOM 0 H PHE A 18 -4.083 2.019 -9.184 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.145 2.757 -6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.039 4.666 -8.749 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.293 4.826 -7.171 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -1.934 2.225 -6.857 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.280 4.736 -10.279 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.155 1.291 -7.751 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.191 3.806 -11.176 1.00 0.00 H new ATOM 0 HZ PHE A 18 1.035 2.083 -9.910 1.00 0.00 H new ATOM 276 N ALA A 19 -6.525 3.855 -8.432 1.00 0.00 N ATOM 277 CA ALA A 19 -7.876 4.401 -8.460 1.00 0.00 C ATOM 278 C ALA A 19 -8.841 3.518 -7.676 1.00 0.00 C ATOM 279 O ALA A 19 -9.879 3.982 -7.203 1.00 0.00 O ATOM 280 CB ALA A 19 -8.352 4.560 -9.897 1.00 0.00 C ATOM 0 H ALA A 19 -6.125 3.671 -9.352 1.00 0.00 H new ATOM 0 HA ALA A 19 -7.855 5.382 -7.985 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.362 4.969 -9.902 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.684 5.237 -10.429 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.351 3.588 -10.390 1.00 0.00 H new ATOM 286 N LYS A 20 -8.492 2.243 -7.541 1.00 0.00 N ATOM 287 CA LYS A 20 -9.327 1.294 -6.814 1.00 0.00 C ATOM 288 C LYS A 20 -9.526 1.740 -5.369 1.00 0.00 C ATOM 289 O LYS A 20 -10.652 1.973 -4.930 1.00 0.00 O ATOM 290 CB LYS A 20 -8.697 -0.100 -6.846 1.00 0.00 C ATOM 291 CG LYS A 20 -9.551 -1.137 -7.554 1.00 0.00 C ATOM 292 CD LYS A 20 -9.708 -0.817 -9.031 1.00 0.00 C ATOM 293 CE LYS A 20 -11.086 -1.204 -9.542 1.00 0.00 C ATOM 294 NZ LYS A 20 -11.139 -2.628 -9.974 1.00 0.00 N ATOM 0 H LYS A 20 -7.636 1.843 -7.926 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.301 1.257 -7.302 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.728 -0.040 -7.341 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.513 -0.430 -5.824 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.098 -2.122 -7.440 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.534 -1.182 -7.084 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.545 0.249 -9.193 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.945 -1.346 -9.602 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.824 -1.035 -8.758 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.357 -0.560 -10.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.095 -2.852 -10.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.453 -2.784 -10.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.906 -3.244 -9.169 1.00 0.00 H new ATOM 308 N VAL A 21 -8.424 1.860 -4.634 1.00 0.00 N ATOM 309 CA VAL A 21 -8.478 2.281 -3.240 1.00 0.00 C ATOM 310 C VAL A 21 -8.907 3.739 -3.122 1.00 0.00 C ATOM 311 O VAL A 21 -9.228 4.216 -2.034 1.00 0.00 O ATOM 312 CB VAL A 21 -7.114 2.101 -2.546 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.839 0.627 -2.285 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.005 2.719 -3.384 1.00 0.00 C ATOM 0 H VAL A 21 -7.484 1.671 -4.982 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.215 1.647 -2.747 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.142 2.616 -1.586 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.872 0.519 -1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.619 0.220 -1.642 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.829 0.086 -3.231 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.049 2.583 -2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.973 2.234 -4.360 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.198 3.784 -3.515 1.00 0.00 H new ATOM 324 N ASP A 22 -8.909 4.442 -4.249 1.00 0.00 N ATOM 325 CA ASP A 22 -9.300 5.847 -4.273 1.00 0.00 C ATOM 326 C ASP A 22 -10.812 5.992 -4.135 1.00 0.00 C ATOM 327 O ASP A 22 -11.510 6.289 -5.105 1.00 0.00 O ATOM 328 CB ASP A 22 -8.828 6.507 -5.570 1.00 0.00 C ATOM 329 CG ASP A 22 -8.540 7.986 -5.395 1.00 0.00 C ATOM 330 OD1 ASP A 22 -8.236 8.655 -6.405 1.00 0.00 O ATOM 331 OD2 ASP A 22 -8.618 8.473 -4.248 1.00 0.00 O ATOM 0 H ASP A 22 -8.644 4.062 -5.158 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.827 6.346 -3.427 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -7.928 6.004 -5.924 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.589 6.376 -6.339 1.00 0.00 H new ATOM 336 N THR A 23 -11.313 5.781 -2.922 1.00 0.00 N ATOM 337 CA THR A 23 -12.742 5.887 -2.656 1.00 0.00 C ATOM 338 C THR A 23 -13.198 7.341 -2.668 1.00 0.00 C ATOM 339 O THR A 23 -14.373 7.631 -2.894 1.00 0.00 O ATOM 340 CB THR A 23 -13.110 5.256 -1.300 1.00 0.00 C ATOM 341 OG1 THR A 23 -11.992 5.326 -0.408 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.536 3.806 -1.475 1.00 0.00 C ATOM 0 H THR A 23 -10.750 5.536 -2.108 1.00 0.00 H new ATOM 0 HA THR A 23 -13.252 5.343 -3.451 1.00 0.00 H new ATOM 0 HB THR A 23 -13.946 5.815 -0.879 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.234 4.924 0.452 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.791 3.382 -0.504 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.405 3.759 -2.131 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.717 3.237 -1.916 1.00 0.00 H new ATOM 350 N ASP A 24 -12.262 8.251 -2.424 1.00 0.00 N ATOM 351 CA ASP A 24 -12.568 9.677 -2.408 1.00 0.00 C ATOM 352 C ASP A 24 -12.153 10.336 -3.721 1.00 0.00 C ATOM 353 O ASP A 24 -12.507 11.483 -3.990 1.00 0.00 O ATOM 354 CB ASP A 24 -11.861 10.359 -1.235 1.00 0.00 C ATOM 355 CG ASP A 24 -10.427 9.894 -1.074 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.911 9.943 0.063 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.822 9.478 -2.083 1.00 0.00 O ATOM 0 H ASP A 24 -11.285 8.027 -2.235 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.645 9.791 -2.289 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -11.875 11.439 -1.384 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.411 10.157 -0.316 1.00 0.00 H new ATOM 362 N GLY A 25 -11.400 9.603 -4.533 1.00 0.00 N ATOM 363 CA GLY A 25 -10.950 10.133 -5.806 1.00 0.00 C ATOM 364 C GLY A 25 -10.028 11.326 -5.645 1.00 0.00 C ATOM 365 O GLY A 25 -10.299 12.404 -6.173 1.00 0.00 O ATOM 0 H GLY A 25 -11.093 8.651 -4.332 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.432 9.350 -6.359 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.816 10.424 -6.401 1.00 0.00 H new ATOM 369 N ASN A 26 -8.938 11.135 -4.910 1.00 0.00 N ATOM 370 CA ASN A 26 -7.975 12.205 -4.677 1.00 0.00 C ATOM 371 C ASN A 26 -6.749 12.037 -5.569 1.00 0.00 C ATOM 372 O ASN A 26 -5.964 12.968 -5.746 1.00 0.00 O ATOM 373 CB ASN A 26 -7.551 12.228 -3.207 1.00 0.00 C ATOM 374 CG ASN A 26 -6.628 11.078 -2.854 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.674 10.017 -3.476 1.00 0.00 O ATOM 376 ND2 ASN A 26 -5.785 11.284 -1.849 1.00 0.00 N ATOM 0 H ASN A 26 -8.699 10.249 -4.465 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.455 13.152 -4.924 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.050 13.172 -2.991 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.438 12.186 -2.575 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -5.141 10.546 -1.564 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.782 12.180 -1.362 1.00 0.00 H new ATOM 383 N GLY A 27 -6.591 10.842 -6.130 1.00 0.00 N ATOM 384 CA GLY A 27 -5.458 10.573 -6.997 1.00 0.00 C ATOM 385 C GLY A 27 -4.198 10.249 -6.221 1.00 0.00 C ATOM 386 O GLY A 27 -3.092 10.331 -6.757 1.00 0.00 O ATOM 0 H GLY A 27 -7.227 10.055 -6.000 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.699 9.739 -7.657 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.277 11.440 -7.632 1.00 0.00 H new ATOM 390 N TYR A 28 -4.362 9.882 -4.954 1.00 0.00 N ATOM 391 CA TYR A 28 -3.228 9.549 -4.102 1.00 0.00 C ATOM 392 C TYR A 28 -3.567 8.387 -3.172 1.00 0.00 C ATOM 393 O TYR A 28 -4.718 7.956 -3.096 1.00 0.00 O ATOM 394 CB TYR A 28 -2.806 10.768 -3.279 1.00 0.00 C ATOM 395 CG TYR A 28 -1.775 11.635 -3.967 1.00 0.00 C ATOM 396 CD1 TYR A 28 -2.152 12.572 -4.922 1.00 0.00 C ATOM 397 CD2 TYR A 28 -0.425 11.517 -3.662 1.00 0.00 C ATOM 398 CE1 TYR A 28 -1.214 13.365 -5.552 1.00 0.00 C ATOM 399 CE2 TYR A 28 0.520 12.307 -4.287 1.00 0.00 C ATOM 400 CZ TYR A 28 0.121 13.230 -5.232 1.00 0.00 C ATOM 401 OH TYR A 28 1.059 14.018 -5.857 1.00 0.00 O ATOM 0 H TYR A 28 -5.270 9.808 -4.495 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.400 9.248 -4.744 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -3.687 11.371 -3.060 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.405 10.430 -2.323 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -3.196 12.681 -5.175 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -0.109 10.795 -2.923 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -1.524 14.088 -6.292 1.00 0.00 H new ATOM 0 HE2 TYR A 28 1.566 12.203 -4.037 1.00 0.00 H new ATOM 0 HH TYR A 28 1.951 13.797 -5.516 1.00 0.00 H new ATOM 411 N ILE A 29 -2.558 7.887 -2.468 1.00 0.00 N ATOM 412 CA ILE A 29 -2.748 6.777 -1.544 1.00 0.00 C ATOM 413 C ILE A 29 -2.051 7.044 -0.214 1.00 0.00 C ATOM 414 O ILE A 29 -0.873 7.401 -0.179 1.00 0.00 O ATOM 415 CB ILE A 29 -2.219 5.456 -2.132 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.009 5.078 -3.387 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.296 4.345 -1.095 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.505 3.823 -4.064 1.00 0.00 C ATOM 0 H ILE A 29 -1.600 8.233 -2.520 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.821 6.686 -1.378 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.174 5.593 -2.411 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.057 4.941 -3.119 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.967 5.905 -4.096 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -1.918 3.418 -1.526 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.693 4.614 -0.228 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.332 4.206 -0.787 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.112 3.616 -4.945 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.466 3.963 -4.363 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.573 2.984 -3.372 1.00 0.00 H new ATOM 430 N SER A 30 -2.785 6.866 0.879 1.00 0.00 N ATOM 431 CA SER A 30 -2.237 7.088 2.212 1.00 0.00 C ATOM 432 C SER A 30 -1.936 5.763 2.905 1.00 0.00 C ATOM 433 O SER A 30 -2.030 4.696 2.297 1.00 0.00 O ATOM 434 CB SER A 30 -3.215 7.908 3.058 1.00 0.00 C ATOM 435 OG SER A 30 -4.370 7.151 3.378 1.00 0.00 O ATOM 0 H SER A 30 -3.761 6.569 0.868 1.00 0.00 H new ATOM 0 HA SER A 30 -1.304 7.642 2.106 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.724 8.233 3.975 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.505 8.808 2.515 1.00 0.00 H new ATOM 0 HG SER A 30 -4.821 6.877 2.552 1.00 0.00 H new ATOM 441 N PHE A 31 -1.574 5.838 4.181 1.00 0.00 N ATOM 442 CA PHE A 31 -1.257 4.645 4.958 1.00 0.00 C ATOM 443 C PHE A 31 -2.529 3.973 5.465 1.00 0.00 C ATOM 444 O PHE A 31 -2.533 2.784 5.778 1.00 0.00 O ATOM 445 CB PHE A 31 -0.350 5.004 6.136 1.00 0.00 C ATOM 446 CG PHE A 31 -0.355 3.975 7.232 1.00 0.00 C ATOM 447 CD1 PHE A 31 -1.275 4.049 8.264 1.00 0.00 C ATOM 448 CD2 PHE A 31 0.561 2.936 7.227 1.00 0.00 C ATOM 449 CE1 PHE A 31 -1.283 3.104 9.273 1.00 0.00 C ATOM 450 CE2 PHE A 31 0.558 1.987 8.233 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.365 2.072 9.258 1.00 0.00 C ATOM 0 H PHE A 31 -1.493 6.713 4.700 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.733 3.945 4.307 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.670 5.132 5.773 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.665 5.963 6.547 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.995 4.854 8.281 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.285 2.866 6.429 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.006 3.173 10.072 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.276 1.180 8.218 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.369 1.333 10.046 1.00 0.00 H new ATOM 461 N ASN A 32 -3.608 4.746 5.545 1.00 0.00 N ATOM 462 CA ASN A 32 -4.886 4.226 6.016 1.00 0.00 C ATOM 463 C ASN A 32 -5.420 3.153 5.072 1.00 0.00 C ATOM 464 O ASN A 32 -5.618 2.006 5.469 1.00 0.00 O ATOM 465 CB ASN A 32 -5.905 5.361 6.144 1.00 0.00 C ATOM 466 CG ASN A 32 -7.183 4.917 6.830 1.00 0.00 C ATOM 467 OD1 ASN A 32 -8.199 4.676 6.178 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.137 4.806 8.152 1.00 0.00 N ATOM 0 H ASN A 32 -3.622 5.733 5.290 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.727 3.775 6.996 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.461 6.183 6.706 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.143 5.745 5.152 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.966 4.511 8.668 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -6.273 5.016 8.652 1.00 0.00 H new ATOM 475 N GLU A 33 -5.647 3.536 3.819 1.00 0.00 N ATOM 476 CA GLU A 33 -6.158 2.606 2.819 1.00 0.00 C ATOM 477 C GLU A 33 -5.178 1.457 2.593 1.00 0.00 C ATOM 478 O GLU A 33 -5.583 0.314 2.380 1.00 0.00 O ATOM 479 CB GLU A 33 -6.418 3.335 1.498 1.00 0.00 C ATOM 480 CG GLU A 33 -5.222 4.125 0.994 1.00 0.00 C ATOM 481 CD GLU A 33 -5.622 5.260 0.070 1.00 0.00 C ATOM 482 OE1 GLU A 33 -6.086 4.974 -1.054 1.00 0.00 O ATOM 483 OE2 GLU A 33 -5.468 6.433 0.469 1.00 0.00 O ATOM 0 H GLU A 33 -5.485 4.482 3.473 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.096 2.194 3.190 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.706 2.606 0.741 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -7.262 4.012 1.626 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.674 4.530 1.845 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.543 3.454 0.467 1.00 0.00 H new ATOM 490 N LEU A 34 -3.887 1.771 2.642 1.00 0.00 N ATOM 491 CA LEU A 34 -2.849 0.766 2.443 1.00 0.00 C ATOM 492 C LEU A 34 -2.962 -0.347 3.480 1.00 0.00 C ATOM 493 O LEU A 34 -3.150 -1.514 3.135 1.00 0.00 O ATOM 494 CB LEU A 34 -1.464 1.412 2.522 1.00 0.00 C ATOM 495 CG LEU A 34 -0.855 1.857 1.191 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.492 2.525 1.419 1.00 0.00 C ATOM 497 CD2 LEU A 34 -0.713 0.672 0.247 1.00 0.00 C ATOM 0 H LEU A 34 -3.535 2.712 2.818 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.985 0.331 1.453 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.527 2.280 3.178 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.781 0.705 2.993 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.525 2.583 0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.911 2.835 0.462 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.362 3.398 2.058 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.170 1.821 1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.278 1.007 -0.695 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.064 -0.078 0.700 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.695 0.237 0.059 1.00 0.00 H new ATOM 509 N ASN A 35 -2.849 0.021 4.752 1.00 0.00 N ATOM 510 CA ASN A 35 -2.941 -0.946 5.838 1.00 0.00 C ATOM 511 C ASN A 35 -4.281 -1.674 5.808 1.00 0.00 C ATOM 512 O ASN A 35 -4.333 -2.904 5.829 1.00 0.00 O ATOM 513 CB ASN A 35 -2.758 -0.247 7.188 1.00 0.00 C ATOM 514 CG ASN A 35 -3.216 -1.106 8.351 1.00 0.00 C ATOM 515 OD1 ASN A 35 -3.983 -0.658 9.203 1.00 0.00 O ATOM 516 ND2 ASN A 35 -2.746 -2.347 8.390 1.00 0.00 N ATOM 0 H ASN A 35 -2.694 0.982 5.055 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.146 -1.680 5.705 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.707 0.010 7.321 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.317 0.688 7.188 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.019 -2.972 9.148 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.112 -2.675 7.661 1.00 0.00 H new ATOM 523 N ASP A 36 -5.364 -0.906 5.757 1.00 0.00 N ATOM 524 CA ASP A 36 -6.705 -1.476 5.722 1.00 0.00 C ATOM 525 C ASP A 36 -6.854 -2.442 4.550 1.00 0.00 C ATOM 526 O ASP A 36 -7.574 -3.437 4.640 1.00 0.00 O ATOM 527 CB ASP A 36 -7.752 -0.367 5.619 1.00 0.00 C ATOM 528 CG ASP A 36 -9.110 -0.803 6.135 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.980 0.072 6.330 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.303 -2.019 6.341 1.00 0.00 O ATOM 0 H ASP A 36 -5.339 0.114 5.739 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.862 -2.028 6.649 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.414 0.502 6.184 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.845 -0.054 4.579 1.00 0.00 H new ATOM 535 N LEU A 37 -6.170 -2.141 3.452 1.00 0.00 N ATOM 536 CA LEU A 37 -6.226 -2.982 2.261 1.00 0.00 C ATOM 537 C LEU A 37 -5.537 -4.321 2.506 1.00 0.00 C ATOM 538 O LEU A 37 -6.169 -5.376 2.449 1.00 0.00 O ATOM 539 CB LEU A 37 -5.572 -2.268 1.077 1.00 0.00 C ATOM 540 CG LEU A 37 -5.185 -3.151 -0.109 1.00 0.00 C ATOM 541 CD1 LEU A 37 -6.367 -4.000 -0.550 1.00 0.00 C ATOM 542 CD2 LEU A 37 -4.677 -2.301 -1.264 1.00 0.00 C ATOM 0 H LEU A 37 -5.570 -1.321 3.361 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.274 -3.171 2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.255 -1.496 0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.676 -1.761 1.434 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.382 -3.817 0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.073 -4.622 -1.395 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.686 -4.636 0.275 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.191 -3.351 -0.847 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.406 -2.947 -2.099 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.459 -1.610 -1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.801 -1.737 -0.943 1.00 0.00 H new ATOM 554 N PHE A 38 -4.238 -4.269 2.782 1.00 0.00 N ATOM 555 CA PHE A 38 -3.463 -5.478 3.038 1.00 0.00 C ATOM 556 C PHE A 38 -4.038 -6.252 4.220 1.00 0.00 C ATOM 557 O PHE A 38 -3.862 -7.467 4.327 1.00 0.00 O ATOM 558 CB PHE A 38 -2.000 -5.123 3.309 1.00 0.00 C ATOM 559 CG PHE A 38 -1.396 -4.231 2.262 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.359 -3.368 2.583 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.865 -4.253 0.958 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.199 -2.547 1.622 1.00 0.00 C ATOM 563 CE2 PHE A 38 -1.310 -3.434 -0.006 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.278 -2.578 0.326 1.00 0.00 C ATOM 0 H PHE A 38 -3.700 -3.404 2.834 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.518 -6.110 2.152 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.927 -4.632 4.279 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.417 -6.042 3.372 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.016 -3.337 3.595 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.674 -4.918 0.693 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.008 -1.881 1.884 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.683 -3.463 -1.019 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.155 -1.935 -0.426 1.00 0.00 H new ATOM 574 N LYS A 39 -4.724 -5.542 5.107 1.00 0.00 N ATOM 575 CA LYS A 39 -5.327 -6.160 6.283 1.00 0.00 C ATOM 576 C LYS A 39 -6.667 -6.799 5.935 1.00 0.00 C ATOM 577 O LYS A 39 -7.010 -7.863 6.449 1.00 0.00 O ATOM 578 CB LYS A 39 -5.518 -5.120 7.390 1.00 0.00 C ATOM 579 CG LYS A 39 -5.736 -5.729 8.765 1.00 0.00 C ATOM 580 CD LYS A 39 -4.548 -6.571 9.197 1.00 0.00 C ATOM 581 CE LYS A 39 -4.818 -8.056 9.003 1.00 0.00 C ATOM 582 NZ LYS A 39 -5.273 -8.706 10.263 1.00 0.00 N ATOM 0 H LYS A 39 -4.877 -4.536 5.035 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.654 -6.940 6.638 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.642 -4.472 7.423 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.372 -4.489 7.141 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.904 -4.935 9.493 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.635 -6.346 8.752 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.668 -6.282 8.623 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.323 -6.375 10.245 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.576 -8.190 8.231 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.912 -8.547 8.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.446 -9.717 10.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.539 -8.601 10.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.152 -8.255 10.589 1.00 0.00 H new ATOM 596 N ALA A 40 -7.421 -6.144 5.058 1.00 0.00 N ATOM 597 CA ALA A 40 -8.721 -6.651 4.639 1.00 0.00 C ATOM 598 C ALA A 40 -8.585 -7.997 3.935 1.00 0.00 C ATOM 599 O ALA A 40 -9.466 -8.850 4.031 1.00 0.00 O ATOM 600 CB ALA A 40 -9.412 -5.645 3.730 1.00 0.00 C ATOM 0 H ALA A 40 -7.153 -5.261 4.624 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.331 -6.797 5.531 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.382 -6.037 3.425 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.552 -4.706 4.266 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.797 -5.470 2.847 1.00 0.00 H new ATOM 606 N ALA A 41 -7.476 -8.179 3.226 1.00 0.00 N ATOM 607 CA ALA A 41 -7.224 -9.421 2.506 1.00 0.00 C ATOM 608 C ALA A 41 -7.294 -10.622 3.443 1.00 0.00 C ATOM 609 O ALA A 41 -7.559 -11.744 3.011 1.00 0.00 O ATOM 610 CB ALA A 41 -5.869 -9.366 1.816 1.00 0.00 C ATOM 0 H ALA A 41 -6.737 -7.482 3.135 1.00 0.00 H new ATOM 0 HA ALA A 41 -8.000 -9.537 1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.694 -10.300 1.282 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.854 -8.536 1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.087 -9.222 2.561 1.00 0.00 H new ATOM 616 N CYS A 42 -7.054 -10.379 4.727 1.00 0.00 N ATOM 617 CA CYS A 42 -7.088 -11.442 5.725 1.00 0.00 C ATOM 618 C CYS A 42 -5.968 -12.449 5.487 1.00 0.00 C ATOM 619 O CYS A 42 -6.108 -13.634 5.791 1.00 0.00 O ATOM 620 CB CYS A 42 -8.442 -12.152 5.699 1.00 0.00 C ATOM 621 SG CYS A 42 -8.896 -12.936 7.264 1.00 0.00 S ATOM 0 H CYS A 42 -6.834 -9.456 5.101 1.00 0.00 H new ATOM 0 HA CYS A 42 -6.942 -10.989 6.706 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.213 -11.430 5.430 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.427 -12.910 4.916 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.057 -13.508 7.142 1.00 0.00 H new ATOM 627 N LEU A 43 -4.856 -11.970 4.938 1.00 0.00 N ATOM 628 CA LEU A 43 -3.711 -12.829 4.656 1.00 0.00 C ATOM 629 C LEU A 43 -3.334 -13.654 5.882 1.00 0.00 C ATOM 630 O LEU A 43 -3.639 -13.296 7.020 1.00 0.00 O ATOM 631 CB LEU A 43 -2.516 -11.987 4.206 1.00 0.00 C ATOM 632 CG LEU A 43 -2.324 -10.655 4.932 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.207 -10.875 6.431 1.00 0.00 C ATOM 634 CD2 LEU A 43 -1.094 -9.932 4.400 1.00 0.00 C ATOM 0 H LEU A 43 -4.723 -10.992 4.680 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.989 -13.512 3.853 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.611 -12.581 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.620 -11.786 3.140 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.198 -10.032 4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.071 -9.916 6.930 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.115 -11.351 6.801 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.351 -11.517 6.639 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.972 -8.986 4.927 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.211 -10.552 4.557 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.217 -9.740 3.334 1.00 0.00 H new ATOM 646 N PRO A 44 -2.653 -14.785 5.648 1.00 0.00 N ATOM 647 CA PRO A 44 -2.216 -15.683 6.721 1.00 0.00 C ATOM 648 C PRO A 44 -1.106 -15.074 7.571 1.00 0.00 C ATOM 649 O PRO A 44 -0.729 -15.627 8.605 1.00 0.00 O ATOM 650 CB PRO A 44 -1.700 -16.912 5.968 1.00 0.00 C ATOM 651 CG PRO A 44 -1.303 -16.396 4.628 1.00 0.00 C ATOM 652 CD PRO A 44 -2.255 -15.274 4.317 1.00 0.00 C ATOM 0 HA PRO A 44 -3.022 -15.903 7.421 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -0.854 -17.366 6.484 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.471 -17.678 5.885 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.272 -16.042 4.636 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.365 -17.181 3.874 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -1.776 -14.492 3.728 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.114 -15.623 3.744 1.00 0.00 H new ATOM 660 N LEU A 45 -0.586 -13.935 7.128 1.00 0.00 N ATOM 661 CA LEU A 45 0.481 -13.250 7.849 1.00 0.00 C ATOM 662 C LEU A 45 -0.052 -12.598 9.122 1.00 0.00 C ATOM 663 O LEU A 45 -1.224 -12.236 9.218 1.00 0.00 O ATOM 664 CB LEU A 45 1.131 -12.194 6.954 1.00 0.00 C ATOM 665 CG LEU A 45 2.265 -12.683 6.052 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.819 -13.891 5.243 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.734 -11.566 5.132 1.00 0.00 C ATOM 0 H LEU A 45 -0.886 -13.466 6.273 1.00 0.00 H new ATOM 0 HA LEU A 45 1.230 -13.990 8.130 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.357 -11.754 6.325 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.517 -11.397 7.589 1.00 0.00 H new ATOM 0 HG LEU A 45 3.102 -12.982 6.682 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.638 -14.226 4.607 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.533 -14.696 5.919 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.966 -13.618 4.622 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.541 -11.932 4.497 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.903 -11.236 4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.094 -10.729 5.730 1.00 0.00 H new ATOM 679 N PRO A 46 0.829 -12.442 10.120 1.00 0.00 N ATOM 680 CA PRO A 46 0.471 -11.830 11.403 1.00 0.00 C ATOM 681 C PRO A 46 0.201 -10.334 11.277 1.00 0.00 C ATOM 682 O PRO A 46 0.027 -9.816 10.175 1.00 0.00 O ATOM 683 CB PRO A 46 1.707 -12.078 12.272 1.00 0.00 C ATOM 684 CG PRO A 46 2.830 -12.213 11.304 1.00 0.00 C ATOM 685 CD PRO A 46 2.244 -12.850 10.074 1.00 0.00 C ATOM 0 HA PRO A 46 -0.447 -12.251 11.813 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.877 -11.252 12.963 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.593 -12.979 12.874 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.263 -11.240 11.071 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.630 -12.827 11.718 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.735 -12.498 9.167 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.350 -13.935 10.094 1.00 0.00 H new ATOM 693 N GLY A 47 0.167 -9.645 12.413 1.00 0.00 N ATOM 694 CA GLY A 47 -0.082 -8.216 12.407 1.00 0.00 C ATOM 695 C GLY A 47 1.149 -7.414 12.031 1.00 0.00 C ATOM 696 O GLY A 47 1.098 -6.569 11.137 1.00 0.00 O ATOM 0 H GLY A 47 0.308 -10.051 13.338 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.885 -7.993 11.705 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.426 -7.906 13.394 1.00 0.00 H new ATOM 700 N TYR A 48 2.256 -7.678 12.714 1.00 0.00 N ATOM 701 CA TYR A 48 3.505 -6.972 12.450 1.00 0.00 C ATOM 702 C TYR A 48 3.910 -7.113 10.985 1.00 0.00 C ATOM 703 O TYR A 48 4.550 -6.226 10.419 1.00 0.00 O ATOM 704 CB TYR A 48 4.618 -7.505 13.352 1.00 0.00 C ATOM 705 CG TYR A 48 5.005 -8.937 13.056 1.00 0.00 C ATOM 706 CD1 TYR A 48 5.869 -9.240 12.010 1.00 0.00 C ATOM 707 CD2 TYR A 48 4.507 -9.985 13.819 1.00 0.00 C ATOM 708 CE1 TYR A 48 6.226 -10.547 11.735 1.00 0.00 C ATOM 709 CE2 TYR A 48 4.859 -11.294 13.552 1.00 0.00 C ATOM 710 CZ TYR A 48 5.718 -11.570 12.508 1.00 0.00 C ATOM 711 OH TYR A 48 6.070 -12.872 12.238 1.00 0.00 O ATOM 0 H TYR A 48 2.315 -8.376 13.455 1.00 0.00 H new ATOM 0 HA TYR A 48 3.348 -5.915 12.666 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.497 -6.870 13.243 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.298 -7.431 14.391 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.268 -8.441 11.402 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.833 -9.773 14.636 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.899 -10.766 10.919 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.464 -12.097 14.157 1.00 0.00 H new ATOM 0 HH TYR A 48 5.627 -13.470 12.876 1.00 0.00 H new ATOM 721 N ARG A 49 3.532 -8.234 10.379 1.00 0.00 N ATOM 722 CA ARG A 49 3.857 -8.493 8.981 1.00 0.00 C ATOM 723 C ARG A 49 3.198 -7.462 8.071 1.00 0.00 C ATOM 724 O ARG A 49 3.878 -6.699 7.383 1.00 0.00 O ATOM 725 CB ARG A 49 3.409 -9.901 8.584 1.00 0.00 C ATOM 726 CG ARG A 49 4.562 -10.852 8.307 1.00 0.00 C ATOM 727 CD ARG A 49 5.467 -10.323 7.205 1.00 0.00 C ATOM 728 NE ARG A 49 6.109 -11.403 6.460 1.00 0.00 N ATOM 729 CZ ARG A 49 7.168 -12.072 6.903 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.700 -11.774 8.080 1.00 0.00 N ATOM 731 NH2 ARG A 49 7.697 -13.042 6.168 1.00 0.00 N ATOM 0 H ARG A 49 3.001 -8.977 10.834 1.00 0.00 H new ATOM 0 HA ARG A 49 4.938 -8.417 8.864 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.791 -10.315 9.381 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.781 -9.836 7.695 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.143 -10.997 9.218 1.00 0.00 H new ATOM 0 HG3 ARG A 49 4.170 -11.828 8.020 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.883 -9.707 6.521 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.231 -9.679 7.641 1.00 0.00 H new ATOM 0 HE ARG A 49 5.723 -11.657 5.551 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.296 -11.029 8.648 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.513 -12.289 8.417 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.291 -13.275 5.262 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.510 -13.555 6.509 1.00 0.00 H new ATOM 745 N VAL A 50 1.868 -7.444 8.069 1.00 0.00 N ATOM 746 CA VAL A 50 1.116 -6.507 7.243 1.00 0.00 C ATOM 747 C VAL A 50 1.524 -5.067 7.537 1.00 0.00 C ATOM 748 O VAL A 50 1.571 -4.229 6.637 1.00 0.00 O ATOM 749 CB VAL A 50 -0.401 -6.655 7.465 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.733 -6.586 8.948 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.159 -5.588 6.690 1.00 0.00 C ATOM 0 H VAL A 50 1.289 -8.068 8.631 1.00 0.00 H new ATOM 0 HA VAL A 50 1.348 -6.743 6.204 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.712 -7.631 7.093 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.809 -6.692 9.085 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.219 -7.391 9.474 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.409 -5.626 9.349 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.229 -5.707 6.858 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.846 -4.601 7.029 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.945 -5.690 5.626 1.00 0.00 H new ATOM 761 N ARG A 51 1.819 -4.788 8.803 1.00 0.00 N ATOM 762 CA ARG A 51 2.221 -3.449 9.215 1.00 0.00 C ATOM 763 C ARG A 51 3.614 -3.114 8.689 1.00 0.00 C ATOM 764 O ARG A 51 3.931 -1.950 8.442 1.00 0.00 O ATOM 765 CB ARG A 51 2.200 -3.333 10.740 1.00 0.00 C ATOM 766 CG ARG A 51 2.290 -1.903 11.244 1.00 0.00 C ATOM 767 CD ARG A 51 1.473 -1.706 12.512 1.00 0.00 C ATOM 768 NE ARG A 51 1.994 -2.492 13.627 1.00 0.00 N ATOM 769 CZ ARG A 51 1.382 -2.600 14.801 1.00 0.00 C ATOM 770 NH1 ARG A 51 0.231 -1.975 15.011 1.00 0.00 N ATOM 771 NH2 ARG A 51 1.919 -3.334 15.766 1.00 0.00 N ATOM 0 H ARG A 51 1.787 -5.471 9.560 1.00 0.00 H new ATOM 0 HA ARG A 51 1.510 -2.738 8.793 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.283 -3.785 11.117 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.031 -3.907 11.151 1.00 0.00 H new ATOM 0 HG2 ARG A 51 3.332 -1.650 11.438 1.00 0.00 H new ATOM 0 HG3 ARG A 51 1.935 -1.221 10.472 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.472 -0.650 12.782 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.437 -1.987 12.323 1.00 0.00 H new ATOM 0 HE ARG A 51 2.877 -2.986 13.497 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -0.185 -1.411 14.270 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -0.238 -2.059 15.913 1.00 0.00 H new ATOM 0 HH21 ARG A 51 2.803 -3.817 15.607 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.448 -3.416 16.667 1.00 0.00 H new ATOM 785 N GLU A 52 4.441 -4.141 8.521 1.00 0.00 N ATOM 786 CA GLU A 52 5.799 -3.954 8.025 1.00 0.00 C ATOM 787 C GLU A 52 5.798 -3.675 6.525 1.00 0.00 C ATOM 788 O GLU A 52 6.489 -2.774 6.050 1.00 0.00 O ATOM 789 CB GLU A 52 6.649 -5.191 8.324 1.00 0.00 C ATOM 790 CG GLU A 52 7.754 -4.941 9.337 1.00 0.00 C ATOM 791 CD GLU A 52 8.594 -3.726 8.994 1.00 0.00 C ATOM 792 OE1 GLU A 52 9.083 -3.647 7.848 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.764 -2.854 9.872 1.00 0.00 O ATOM 0 H GLU A 52 4.194 -5.110 8.721 1.00 0.00 H new ATOM 0 HA GLU A 52 6.229 -3.093 8.536 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.001 -5.985 8.694 1.00 0.00 H new ATOM 0 HB3 GLU A 52 7.093 -5.549 7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.313 -4.806 10.325 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.397 -5.819 9.392 1.00 0.00 H new ATOM 800 N ILE A 53 5.016 -4.455 5.784 1.00 0.00 N ATOM 801 CA ILE A 53 4.923 -4.291 4.340 1.00 0.00 C ATOM 802 C ILE A 53 4.273 -2.960 3.977 1.00 0.00 C ATOM 803 O ILE A 53 4.693 -2.287 3.035 1.00 0.00 O ATOM 804 CB ILE A 53 4.120 -5.435 3.693 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.717 -5.509 4.301 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.849 -6.759 3.869 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.874 -6.631 3.740 1.00 0.00 C ATOM 0 H ILE A 53 4.438 -5.206 6.161 1.00 0.00 H new ATOM 0 HA ILE A 53 5.943 -4.311 3.955 1.00 0.00 H new ATOM 0 HB ILE A 53 4.024 -5.234 2.626 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.804 -5.635 5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.206 -4.561 4.131 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.269 -7.558 3.407 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.829 -6.701 3.395 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.972 -6.968 4.932 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.894 -6.623 4.216 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.756 -6.495 2.665 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.363 -7.586 3.933 1.00 0.00 H new ATOM 819 N THR A 54 3.245 -2.585 4.732 1.00 0.00 N ATOM 820 CA THR A 54 2.537 -1.334 4.491 1.00 0.00 C ATOM 821 C THR A 54 3.391 -0.134 4.882 1.00 0.00 C ATOM 822 O THR A 54 3.396 0.886 4.193 1.00 0.00 O ATOM 823 CB THR A 54 1.209 -1.281 5.273 1.00 0.00 C ATOM 824 OG1 THR A 54 0.454 -0.131 4.877 1.00 0.00 O ATOM 825 CG2 THR A 54 1.466 -1.235 6.771 1.00 0.00 C ATOM 0 H THR A 54 2.884 -3.130 5.515 1.00 0.00 H new ATOM 0 HA THR A 54 2.324 -1.292 3.423 1.00 0.00 H new ATOM 0 HB THR A 54 0.641 -2.183 5.046 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.307 -0.015 5.483 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.515 -1.198 7.302 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.016 -2.126 7.073 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.051 -0.348 7.013 1.00 0.00 H new ATOM 833 N GLU A 55 4.113 -0.263 5.990 1.00 0.00 N ATOM 834 CA GLU A 55 4.972 0.812 6.471 1.00 0.00 C ATOM 835 C GLU A 55 6.127 1.061 5.505 1.00 0.00 C ATOM 836 O GLU A 55 6.456 2.205 5.197 1.00 0.00 O ATOM 837 CB GLU A 55 5.519 0.476 7.861 1.00 0.00 C ATOM 838 CG GLU A 55 4.586 0.872 8.993 1.00 0.00 C ATOM 839 CD GLU A 55 5.209 0.664 10.360 1.00 0.00 C ATOM 840 OE1 GLU A 55 4.485 0.804 11.369 1.00 0.00 O ATOM 841 OE2 GLU A 55 6.419 0.362 10.422 1.00 0.00 O ATOM 0 H GLU A 55 4.120 -1.101 6.571 1.00 0.00 H new ATOM 0 HA GLU A 55 4.372 1.720 6.534 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.711 -0.595 7.918 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.476 0.979 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.307 1.920 8.880 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.668 0.289 8.923 1.00 0.00 H new ATOM 848 N ASN A 56 6.737 -0.021 5.031 1.00 0.00 N ATOM 849 CA ASN A 56 7.854 0.079 4.100 1.00 0.00 C ATOM 850 C ASN A 56 7.396 0.633 2.756 1.00 0.00 C ATOM 851 O ASN A 56 8.034 1.521 2.187 1.00 0.00 O ATOM 852 CB ASN A 56 8.505 -1.292 3.904 1.00 0.00 C ATOM 853 CG ASN A 56 9.471 -1.640 5.021 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.782 -0.804 5.870 1.00 0.00 O ATOM 855 ND2 ASN A 56 9.948 -2.879 5.025 1.00 0.00 N ATOM 0 H ASN A 56 6.476 -0.976 5.276 1.00 0.00 H new ATOM 0 HA ASN A 56 8.587 0.766 4.524 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.729 -2.055 3.848 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.035 -1.306 2.952 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.600 -3.172 5.752 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.662 -3.538 4.301 1.00 0.00 H new ATOM 862 N LEU A 57 6.285 0.106 2.252 1.00 0.00 N ATOM 863 CA LEU A 57 5.739 0.549 0.973 1.00 0.00 C ATOM 864 C LEU A 57 5.422 2.040 1.005 1.00 0.00 C ATOM 865 O LEU A 57 5.712 2.766 0.055 1.00 0.00 O ATOM 866 CB LEU A 57 4.478 -0.246 0.633 1.00 0.00 C ATOM 867 CG LEU A 57 4.187 -0.437 -0.856 1.00 0.00 C ATOM 868 CD1 LEU A 57 2.812 -1.055 -1.057 1.00 0.00 C ATOM 869 CD2 LEU A 57 4.290 0.889 -1.594 1.00 0.00 C ATOM 0 H LEU A 57 5.745 -0.628 2.709 1.00 0.00 H new ATOM 0 HA LEU A 57 6.490 0.373 0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.556 -1.229 1.097 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.623 0.254 1.089 1.00 0.00 H new ATOM 0 HG LEU A 57 4.932 -1.118 -1.267 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.623 -1.183 -2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.773 -2.026 -0.562 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.053 -0.400 -0.630 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.080 0.734 -2.652 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.568 1.593 -1.180 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.296 1.292 -1.479 1.00 0.00 H new ATOM 881 N MET A 58 4.825 2.490 2.104 1.00 0.00 N ATOM 882 CA MET A 58 4.470 3.896 2.259 1.00 0.00 C ATOM 883 C MET A 58 5.721 4.764 2.355 1.00 0.00 C ATOM 884 O MET A 58 5.791 5.837 1.755 1.00 0.00 O ATOM 885 CB MET A 58 3.605 4.091 3.506 1.00 0.00 C ATOM 886 CG MET A 58 2.390 4.975 3.270 1.00 0.00 C ATOM 887 SD MET A 58 2.831 6.607 2.642 1.00 0.00 S ATOM 888 CE MET A 58 1.214 7.268 2.252 1.00 0.00 C ATOM 0 H MET A 58 4.577 1.902 2.900 1.00 0.00 H new ATOM 0 HA MET A 58 3.902 4.201 1.380 1.00 0.00 H new ATOM 0 HB2 MET A 58 3.272 3.117 3.863 1.00 0.00 H new ATOM 0 HB3 MET A 58 4.215 4.529 4.297 1.00 0.00 H new ATOM 0 HG2 MET A 58 1.721 4.486 2.562 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.839 5.086 4.204 1.00 0.00 H new ATOM 0 HE1 MET A 58 1.313 8.056 1.506 1.00 0.00 H new ATOM 0 HE2 MET A 58 0.581 6.473 1.858 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.761 7.678 3.155 1.00 0.00 H new ATOM 898 N ALA A 59 6.707 4.294 3.111 1.00 0.00 N ATOM 899 CA ALA A 59 7.955 5.026 3.283 1.00 0.00 C ATOM 900 C ALA A 59 8.720 5.124 1.968 1.00 0.00 C ATOM 901 O ALA A 59 9.085 6.215 1.528 1.00 0.00 O ATOM 902 CB ALA A 59 8.814 4.362 4.349 1.00 0.00 C ATOM 0 H ALA A 59 6.665 3.408 3.615 1.00 0.00 H new ATOM 0 HA ALA A 59 7.712 6.038 3.607 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.743 4.920 4.467 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.275 4.351 5.296 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.040 3.339 4.049 1.00 0.00 H new ATOM 908 N THR A 60 8.961 3.976 1.342 1.00 0.00 N ATOM 909 CA THR A 60 9.684 3.930 0.078 1.00 0.00 C ATOM 910 C THR A 60 8.797 4.376 -1.079 1.00 0.00 C ATOM 911 O THR A 60 9.253 4.489 -2.216 1.00 0.00 O ATOM 912 CB THR A 60 10.218 2.515 -0.214 1.00 0.00 C ATOM 913 OG1 THR A 60 11.110 2.550 -1.333 1.00 0.00 O ATOM 914 CG2 THR A 60 9.074 1.554 -0.500 1.00 0.00 C ATOM 0 H THR A 60 8.665 3.064 1.691 1.00 0.00 H new ATOM 0 HA THR A 60 10.527 4.615 0.171 1.00 0.00 H new ATOM 0 HB THR A 60 10.755 2.163 0.667 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.777 3.190 -1.997 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.475 0.561 -0.703 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.413 1.508 0.365 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.513 1.903 -1.367 1.00 0.00 H new ATOM 922 N GLY A 61 7.525 4.628 -0.781 1.00 0.00 N ATOM 923 CA GLY A 61 6.595 5.059 -1.808 1.00 0.00 C ATOM 924 C GLY A 61 6.368 6.557 -1.792 1.00 0.00 C ATOM 925 O GLY A 61 5.920 7.134 -2.784 1.00 0.00 O ATOM 0 H GLY A 61 7.123 4.541 0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.975 4.763 -2.786 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.642 4.549 -1.668 1.00 0.00 H new ATOM 929 N ASP A 62 6.674 7.189 -0.665 1.00 0.00 N ATOM 930 CA ASP A 62 6.499 8.629 -0.523 1.00 0.00 C ATOM 931 C ASP A 62 7.798 9.368 -0.835 1.00 0.00 C ATOM 932 O ASP A 62 8.753 9.319 -0.059 1.00 0.00 O ATOM 933 CB ASP A 62 6.031 8.972 0.891 1.00 0.00 C ATOM 934 CG ASP A 62 5.062 10.138 0.914 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.285 11.110 0.161 1.00 0.00 O ATOM 936 OD2 ASP A 62 4.082 10.080 1.685 1.00 0.00 O ATOM 0 H ASP A 62 7.045 6.726 0.165 1.00 0.00 H new ATOM 0 HA ASP A 62 5.739 8.949 -1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.554 8.098 1.334 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.897 9.211 1.509 1.00 0.00 H new ATOM 941 N LEU A 63 7.827 10.049 -1.975 1.00 0.00 N ATOM 942 CA LEU A 63 9.009 10.796 -2.390 1.00 0.00 C ATOM 943 C LEU A 63 9.070 12.151 -1.691 1.00 0.00 C ATOM 944 O LEU A 63 10.059 12.480 -1.038 1.00 0.00 O ATOM 945 CB LEU A 63 9.006 10.991 -3.907 1.00 0.00 C ATOM 946 CG LEU A 63 9.766 9.943 -4.720 1.00 0.00 C ATOM 947 CD1 LEU A 63 9.067 8.594 -4.638 1.00 0.00 C ATOM 948 CD2 LEU A 63 9.904 10.387 -6.168 1.00 0.00 C ATOM 0 H LEU A 63 7.045 10.099 -2.629 1.00 0.00 H new ATOM 0 HA LEU A 63 9.891 10.222 -2.106 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.971 11.007 -4.249 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.430 11.971 -4.128 1.00 0.00 H new ATOM 0 HG LEU A 63 10.765 9.838 -4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.622 7.860 -5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.022 8.270 -3.598 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.056 8.684 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.448 9.628 -6.731 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.914 10.522 -6.603 1.00 0.00 H new ATOM 0 HD23 LEU A 63 10.450 11.330 -6.209 1.00 0.00 H new ATOM 960 N ASP A 64 8.003 12.932 -1.833 1.00 0.00 N ATOM 961 CA ASP A 64 7.934 14.250 -1.213 1.00 0.00 C ATOM 962 C ASP A 64 7.769 14.131 0.299 1.00 0.00 C ATOM 963 O ASP A 64 7.960 15.102 1.031 1.00 0.00 O ATOM 964 CB ASP A 64 6.774 15.054 -1.804 1.00 0.00 C ATOM 965 CG ASP A 64 6.676 14.907 -3.310 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.722 14.681 -3.954 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.552 15.016 -3.843 1.00 0.00 O ATOM 0 H ASP A 64 7.176 12.675 -2.371 1.00 0.00 H new ATOM 0 HA ASP A 64 8.869 14.771 -1.418 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.839 14.727 -1.348 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.900 16.107 -1.552 1.00 0.00 H new ATOM 972 N GLN A 65 7.413 12.936 0.758 1.00 0.00 N ATOM 973 CA GLN A 65 7.221 12.693 2.183 1.00 0.00 C ATOM 974 C GLN A 65 6.065 13.526 2.727 1.00 0.00 C ATOM 975 O GLN A 65 6.092 13.967 3.876 1.00 0.00 O ATOM 976 CB GLN A 65 8.503 13.012 2.954 1.00 0.00 C ATOM 977 CG GLN A 65 9.755 12.428 2.322 1.00 0.00 C ATOM 978 CD GLN A 65 11.024 12.871 3.022 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.652 12.097 3.745 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.410 14.124 2.811 1.00 0.00 N ATOM 0 H GLN A 65 7.252 12.122 0.165 1.00 0.00 H new ATOM 0 HA GLN A 65 6.979 11.639 2.316 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.614 14.094 3.026 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.409 12.632 3.971 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.694 11.340 2.343 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.800 12.725 1.274 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.860 14.732 2.204 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.257 14.479 3.256 1.00 0.00 H new ATOM 989 N ASP A 66 5.051 13.736 1.894 1.00 0.00 N ATOM 990 CA ASP A 66 3.885 14.517 2.292 1.00 0.00 C ATOM 991 C ASP A 66 2.855 13.635 2.992 1.00 0.00 C ATOM 992 O ASP A 66 1.916 14.133 3.611 1.00 0.00 O ATOM 993 CB ASP A 66 3.255 15.189 1.072 1.00 0.00 C ATOM 994 CG ASP A 66 2.910 14.197 -0.023 1.00 0.00 C ATOM 995 OD1 ASP A 66 2.560 14.641 -1.137 1.00 0.00 O ATOM 996 OD2 ASP A 66 2.993 12.979 0.234 1.00 0.00 O ATOM 0 H ASP A 66 5.013 13.377 0.940 1.00 0.00 H new ATOM 0 HA ASP A 66 4.214 15.286 2.991 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.352 15.717 1.378 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.943 15.937 0.677 1.00 0.00 H new ATOM 1001 N GLY A 67 3.038 12.322 2.887 1.00 0.00 N ATOM 1002 CA GLY A 67 2.116 11.392 3.513 1.00 0.00 C ATOM 1003 C GLY A 67 1.113 10.820 2.532 1.00 0.00 C ATOM 1004 O GLY A 67 0.032 10.382 2.923 1.00 0.00 O ATOM 0 H GLY A 67 3.808 11.886 2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.680 10.577 3.968 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.584 11.899 4.318 1.00 0.00 H new ATOM 1008 N ARG A 68 1.469 10.828 1.252 1.00 0.00 N ATOM 1009 CA ARG A 68 0.591 10.309 0.210 1.00 0.00 C ATOM 1010 C ARG A 68 1.393 9.881 -1.014 1.00 0.00 C ATOM 1011 O ARG A 68 2.387 10.515 -1.370 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.443 11.364 -0.186 1.00 0.00 C ATOM 1013 CG ARG A 68 0.152 12.743 -0.421 1.00 0.00 C ATOM 1014 CD ARG A 68 -0.924 13.767 -0.744 1.00 0.00 C ATOM 1015 NE ARG A 68 -2.016 13.737 0.225 1.00 0.00 N ATOM 1016 CZ ARG A 68 -1.958 14.321 1.417 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -0.865 14.977 1.784 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -2.992 14.249 2.244 1.00 0.00 N ATOM 0 H ARG A 68 2.360 11.188 0.911 1.00 0.00 H new ATOM 0 HA ARG A 68 0.074 9.435 0.607 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -0.953 11.038 -1.093 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.198 11.432 0.597 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.702 13.059 0.466 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.869 12.696 -1.241 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.483 14.763 -0.762 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -1.319 13.575 -1.742 1.00 0.00 H new ATOM 0 HE ARG A 68 -2.870 13.240 -0.027 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.067 15.034 1.151 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -0.822 15.425 2.699 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -3.834 13.745 1.965 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -2.946 14.698 3.159 1.00 0.00 H new ATOM 1032 N ILE A 69 0.955 8.803 -1.655 1.00 0.00 N ATOM 1033 CA ILE A 69 1.632 8.292 -2.841 1.00 0.00 C ATOM 1034 C ILE A 69 0.837 8.600 -4.105 1.00 0.00 C ATOM 1035 O ILE A 69 -0.381 8.422 -4.143 1.00 0.00 O ATOM 1036 CB ILE A 69 1.857 6.770 -2.749 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.388 6.394 -1.365 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.818 6.311 -3.834 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.697 4.921 -1.215 1.00 0.00 C ATOM 0 H ILE A 69 0.135 8.266 -1.373 1.00 0.00 H new ATOM 0 HA ILE A 69 2.599 8.793 -2.892 1.00 0.00 H new ATOM 0 HB ILE A 69 0.902 6.266 -2.900 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.292 6.969 -1.163 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.653 6.681 -0.613 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.967 5.234 -3.756 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.403 6.550 -4.813 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.774 6.819 -3.712 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.069 4.728 -0.209 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.790 4.340 -1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.455 4.632 -1.944 1.00 0.00 H new ATOM 1051 N SER A 70 1.534 9.064 -5.138 1.00 0.00 N ATOM 1052 CA SER A 70 0.893 9.400 -6.403 1.00 0.00 C ATOM 1053 C SER A 70 1.066 8.272 -7.417 1.00 0.00 C ATOM 1054 O SER A 70 1.907 7.390 -7.243 1.00 0.00 O ATOM 1055 CB SER A 70 1.473 10.699 -6.964 1.00 0.00 C ATOM 1056 OG SER A 70 0.458 11.512 -7.524 1.00 0.00 O ATOM 0 H SER A 70 2.543 9.216 -5.123 1.00 0.00 H new ATOM 0 HA SER A 70 -0.172 9.537 -6.217 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.984 11.245 -6.171 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.219 10.469 -7.724 1.00 0.00 H new ATOM 0 HG SER A 70 -0.013 11.987 -6.808 1.00 0.00 H new ATOM 1062 N PHE A 71 0.264 8.309 -8.475 1.00 0.00 N ATOM 1063 CA PHE A 71 0.328 7.291 -9.517 1.00 0.00 C ATOM 1064 C PHE A 71 1.766 7.069 -9.975 1.00 0.00 C ATOM 1065 O PHE A 71 2.261 5.942 -9.981 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.542 7.696 -10.710 1.00 0.00 C ATOM 1067 CG PHE A 71 -1.994 7.351 -10.537 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.618 7.516 -9.311 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.733 6.860 -11.601 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -3.953 7.201 -9.149 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.069 6.542 -11.445 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.681 6.711 -10.217 1.00 0.00 C ATOM 0 H PHE A 71 -0.438 9.032 -8.634 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.050 6.357 -9.100 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.448 8.770 -10.870 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.165 7.206 -11.608 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.054 7.895 -8.472 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.260 6.724 -12.562 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.428 7.337 -8.189 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.635 6.161 -12.283 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.724 6.461 -10.093 1.00 0.00 H new ATOM 1082 N ASP A 72 2.432 8.153 -10.359 1.00 0.00 N ATOM 1083 CA ASP A 72 3.814 8.079 -10.819 1.00 0.00 C ATOM 1084 C ASP A 72 4.709 7.454 -9.752 1.00 0.00 C ATOM 1085 O ASP A 72 5.580 6.641 -10.058 1.00 0.00 O ATOM 1086 CB ASP A 72 4.329 9.473 -11.180 1.00 0.00 C ATOM 1087 CG ASP A 72 3.582 10.080 -12.352 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.436 10.534 -12.154 1.00 0.00 O ATOM 1089 OD2 ASP A 72 4.144 10.101 -13.467 1.00 0.00 O ATOM 0 H ASP A 72 2.037 9.093 -10.361 1.00 0.00 H new ATOM 0 HA ASP A 72 3.842 7.448 -11.707 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.234 10.128 -10.314 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.391 9.414 -11.420 1.00 0.00 H new ATOM 1094 N GLU A 73 4.486 7.841 -8.500 1.00 0.00 N ATOM 1095 CA GLU A 73 5.274 7.319 -7.389 1.00 0.00 C ATOM 1096 C GLU A 73 5.200 5.796 -7.338 1.00 0.00 C ATOM 1097 O GLU A 73 6.209 5.109 -7.501 1.00 0.00 O ATOM 1098 CB GLU A 73 4.783 7.909 -6.065 1.00 0.00 C ATOM 1099 CG GLU A 73 5.602 9.096 -5.586 1.00 0.00 C ATOM 1100 CD GLU A 73 4.866 9.939 -4.564 1.00 0.00 C ATOM 1101 OE1 GLU A 73 5.021 9.672 -3.354 1.00 0.00 O ATOM 1102 OE2 GLU A 73 4.134 10.865 -4.974 1.00 0.00 O ATOM 0 H GLU A 73 3.768 8.513 -8.230 1.00 0.00 H new ATOM 0 HA GLU A 73 6.313 7.610 -7.545 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.744 8.217 -6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.804 7.132 -5.301 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.535 8.737 -5.151 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.867 9.718 -6.441 1.00 0.00 H new ATOM 1109 N PHE A 74 3.999 5.275 -7.109 1.00 0.00 N ATOM 1110 CA PHE A 74 3.793 3.833 -7.035 1.00 0.00 C ATOM 1111 C PHE A 74 4.366 3.137 -8.266 1.00 0.00 C ATOM 1112 O PHE A 74 5.226 2.264 -8.154 1.00 0.00 O ATOM 1113 CB PHE A 74 2.302 3.516 -6.904 1.00 0.00 C ATOM 1114 CG PHE A 74 1.967 2.698 -5.689 1.00 0.00 C ATOM 1115 CD1 PHE A 74 1.170 3.220 -4.684 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.452 1.407 -5.552 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.860 2.470 -3.565 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.145 0.652 -4.436 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.349 1.184 -3.441 1.00 0.00 C ATOM 0 H PHE A 74 3.154 5.829 -6.972 1.00 0.00 H new ATOM 0 HA PHE A 74 4.316 3.462 -6.154 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.742 4.450 -6.869 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.973 2.981 -7.795 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.786 4.225 -4.776 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.077 0.986 -6.326 1.00 0.00 H new ATOM 0 HE1 PHE A 74 0.237 2.889 -2.789 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.527 -0.354 -4.342 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.109 0.596 -2.568 1.00 0.00 H new ATOM 1129 N ILE A 75 3.882 3.531 -9.440 1.00 0.00 N ATOM 1130 CA ILE A 75 4.345 2.945 -10.691 1.00 0.00 C ATOM 1131 C ILE A 75 5.867 2.971 -10.779 1.00 0.00 C ATOM 1132 O ILE A 75 6.496 1.978 -11.147 1.00 0.00 O ATOM 1133 CB ILE A 75 3.760 3.685 -11.909 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.231 3.663 -11.860 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.263 3.059 -13.201 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.580 4.598 -12.853 1.00 0.00 C ATOM 0 H ILE A 75 3.170 4.253 -9.550 1.00 0.00 H new ATOM 0 HA ILE A 75 3.999 1.911 -10.703 1.00 0.00 H new ATOM 0 HB ILE A 75 4.091 4.723 -11.878 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.884 2.647 -12.049 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.904 3.929 -10.855 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.841 3.593 -14.052 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.351 3.122 -13.236 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.958 2.013 -13.241 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.496 4.529 -12.761 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.897 5.621 -12.651 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.877 4.319 -13.864 1.00 0.00 H new ATOM 1148 N LYS A 76 6.456 4.113 -10.439 1.00 0.00 N ATOM 1149 CA LYS A 76 7.905 4.268 -10.476 1.00 0.00 C ATOM 1150 C LYS A 76 8.587 3.218 -9.606 1.00 0.00 C ATOM 1151 O LYS A 76 9.663 2.723 -9.943 1.00 0.00 O ATOM 1152 CB LYS A 76 8.300 5.670 -10.006 1.00 0.00 C ATOM 1153 CG LYS A 76 8.277 6.711 -11.111 1.00 0.00 C ATOM 1154 CD LYS A 76 9.599 6.762 -11.857 1.00 0.00 C ATOM 1155 CE LYS A 76 10.568 7.741 -11.211 1.00 0.00 C ATOM 1156 NZ LYS A 76 11.272 7.136 -10.047 1.00 0.00 N ATOM 0 H LYS A 76 5.951 4.945 -10.134 1.00 0.00 H new ATOM 0 HA LYS A 76 8.234 4.130 -11.506 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.623 5.982 -9.211 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.301 5.631 -9.576 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.472 6.483 -11.810 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.061 7.691 -10.685 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.045 5.768 -11.877 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.422 7.053 -12.892 1.00 0.00 H new ATOM 0 HE2 LYS A 76 11.301 8.068 -11.949 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.025 8.629 -10.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.179 7.623 -9.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.683 7.234 -9.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.447 6.128 -10.233 1.00 0.00 H new ATOM 1170 N ILE A 77 7.955 2.880 -8.487 1.00 0.00 N ATOM 1171 CA ILE A 77 8.500 1.886 -7.572 1.00 0.00 C ATOM 1172 C ILE A 77 8.338 0.477 -8.130 1.00 0.00 C ATOM 1173 O ILE A 77 9.169 -0.399 -7.885 1.00 0.00 O ATOM 1174 CB ILE A 77 7.821 1.960 -6.191 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.557 2.954 -5.289 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.779 0.583 -5.547 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.074 4.379 -5.440 1.00 0.00 C ATOM 0 H ILE A 77 7.064 3.281 -8.193 1.00 0.00 H new ATOM 0 HA ILE A 77 9.561 2.110 -7.459 1.00 0.00 H new ATOM 0 HB ILE A 77 6.797 2.309 -6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.438 2.647 -4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.623 2.915 -5.513 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.296 0.652 -4.572 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.215 -0.099 -6.183 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.795 0.208 -5.423 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.640 5.028 -4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.219 4.705 -6.470 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.015 4.433 -5.188 1.00 0.00 H new ATOM 1189 N PHE A 78 7.265 0.264 -8.883 1.00 0.00 N ATOM 1190 CA PHE A 78 6.994 -1.040 -9.478 1.00 0.00 C ATOM 1191 C PHE A 78 7.854 -1.260 -10.718 1.00 0.00 C ATOM 1192 O PHE A 78 8.102 -2.397 -11.121 1.00 0.00 O ATOM 1193 CB PHE A 78 5.513 -1.159 -9.843 1.00 0.00 C ATOM 1194 CG PHE A 78 4.648 -1.609 -8.700 1.00 0.00 C ATOM 1195 CD1 PHE A 78 4.771 -1.026 -7.450 1.00 0.00 C ATOM 1196 CD2 PHE A 78 3.713 -2.616 -8.877 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.977 -1.437 -6.396 1.00 0.00 C ATOM 1198 CE2 PHE A 78 2.916 -3.031 -7.827 1.00 0.00 C ATOM 1199 CZ PHE A 78 3.049 -2.442 -6.584 1.00 0.00 C ATOM 0 H PHE A 78 6.568 0.978 -9.096 1.00 0.00 H new ATOM 0 HA PHE A 78 7.243 -1.806 -8.744 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.156 -0.193 -10.200 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.406 -1.863 -10.668 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.496 -0.241 -7.297 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.606 -3.082 -9.846 1.00 0.00 H new ATOM 0 HE1 PHE A 78 4.082 -0.973 -5.427 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.189 -3.816 -7.978 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.429 -2.767 -5.762 1.00 0.00 H new ATOM 1209 N HIS A 79 8.306 -0.165 -11.321 1.00 0.00 N ATOM 1210 CA HIS A 79 9.139 -0.238 -12.516 1.00 0.00 C ATOM 1211 C HIS A 79 10.617 -0.125 -12.156 1.00 0.00 C ATOM 1212 O HIS A 79 11.476 -0.688 -12.833 1.00 0.00 O ATOM 1213 CB HIS A 79 8.756 0.869 -13.499 1.00 0.00 C ATOM 1214 CG HIS A 79 8.200 0.357 -14.792 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.864 0.474 -15.996 1.00 0.00 N ATOM 1216 CD2 HIS A 79 7.038 -0.280 -15.065 1.00 0.00 C ATOM 1217 CE1 HIS A 79 8.133 -0.067 -16.953 1.00 0.00 C ATOM 1218 NE2 HIS A 79 7.020 -0.532 -16.415 1.00 0.00 N ATOM 0 H HIS A 79 8.109 0.784 -11.002 1.00 0.00 H new ATOM 0 HA HIS A 79 8.971 -1.206 -12.987 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.020 1.521 -13.030 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.635 1.479 -13.707 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.268 -0.542 -14.354 1.00 0.00 H new ATOM 0 HE1 HIS A 79 8.400 -0.120 -17.998 1.00 0.00 H new ATOM 0 HE2 HIS A 79 6.269 -1.002 -16.920 1.00 0.00 H new ATOM 1226 N GLY A 80 10.906 0.608 -11.085 1.00 0.00 N ATOM 1227 CA GLY A 80 12.281 0.782 -10.654 1.00 0.00 C ATOM 1228 C GLY A 80 12.711 -0.270 -9.650 1.00 0.00 C ATOM 1229 O GLY A 80 13.695 -0.979 -9.866 1.00 0.00 O ATOM 0 H GLY A 80 10.213 1.084 -10.508 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.939 0.742 -11.522 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.398 1.771 -10.212 1.00 0.00 H new ATOM 1233 N LEU A 81 11.975 -0.371 -8.549 1.00 0.00 N ATOM 1234 CA LEU A 81 12.288 -1.344 -7.507 1.00 0.00 C ATOM 1235 C LEU A 81 11.192 -2.399 -7.401 1.00 0.00 C ATOM 1236 O LEU A 81 10.418 -2.413 -6.444 1.00 0.00 O ATOM 1237 CB LEU A 81 12.464 -0.639 -6.161 1.00 0.00 C ATOM 1238 CG LEU A 81 11.633 0.629 -5.953 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.197 0.750 -4.501 1.00 0.00 C ATOM 1240 CD2 LEU A 81 12.421 1.859 -6.379 1.00 0.00 C ATOM 0 H LEU A 81 11.158 0.208 -8.354 1.00 0.00 H new ATOM 0 HA LEU A 81 13.220 -1.841 -7.776 1.00 0.00 H new ATOM 0 HB2 LEU A 81 12.217 -1.345 -5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.517 -0.383 -6.043 1.00 0.00 H new ATOM 0 HG LEU A 81 10.740 0.561 -6.574 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.607 1.658 -4.373 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.594 -0.116 -4.229 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.077 0.795 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 81 11.814 2.751 -6.224 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.332 1.932 -5.785 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.682 1.776 -7.434 1.00 0.00 H new ATOM 1252 N LYS A 82 11.132 -3.284 -8.390 1.00 0.00 N ATOM 1253 CA LYS A 82 10.135 -4.347 -8.409 1.00 0.00 C ATOM 1254 C LYS A 82 10.634 -5.575 -7.655 1.00 0.00 C ATOM 1255 O LYS A 82 10.015 -6.639 -7.702 1.00 0.00 O ATOM 1256 CB LYS A 82 9.790 -4.726 -9.851 1.00 0.00 C ATOM 1257 CG LYS A 82 8.358 -5.201 -10.029 1.00 0.00 C ATOM 1258 CD LYS A 82 8.267 -6.718 -10.004 1.00 0.00 C ATOM 1259 CE LYS A 82 7.114 -7.220 -10.860 1.00 0.00 C ATOM 1260 NZ LYS A 82 7.588 -7.792 -12.150 1.00 0.00 N ATOM 0 H LYS A 82 11.764 -3.286 -9.191 1.00 0.00 H new ATOM 0 HA LYS A 82 9.238 -3.978 -7.913 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.961 -3.863 -10.495 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.469 -5.512 -10.184 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.735 -4.785 -9.238 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.964 -4.827 -10.974 1.00 0.00 H new ATOM 0 HD2 LYS A 82 9.203 -7.146 -10.364 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.135 -7.059 -8.977 1.00 0.00 H new ATOM 0 HE2 LYS A 82 6.557 -7.978 -10.310 1.00 0.00 H new ATOM 0 HE3 LYS A 82 6.425 -6.399 -11.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 6.772 -8.123 -12.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 8.098 -7.062 -12.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.226 -8.592 -11.962 1.00 0.00 H new ATOM 1274 N SER A 83 11.756 -5.421 -6.959 1.00 0.00 N ATOM 1275 CA SER A 83 12.339 -6.518 -6.196 1.00 0.00 C ATOM 1276 C SER A 83 11.875 -6.478 -4.744 1.00 0.00 C ATOM 1277 O SER A 83 12.542 -7.002 -3.851 1.00 0.00 O ATOM 1278 CB SER A 83 13.867 -6.454 -6.258 1.00 0.00 C ATOM 1279 OG SER A 83 14.450 -7.567 -5.602 1.00 0.00 O ATOM 0 H SER A 83 12.279 -4.547 -6.908 1.00 0.00 H new ATOM 0 HA SER A 83 12.003 -7.455 -6.640 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.191 -6.430 -7.298 1.00 0.00 H new ATOM 0 HB3 SER A 83 14.215 -5.531 -5.794 1.00 0.00 H new ATOM 0 HG SER A 83 13.973 -7.740 -4.764 1.00 0.00 H new ATOM 1285 N THR A 84 10.726 -5.850 -4.514 1.00 0.00 N ATOM 1286 CA THR A 84 10.171 -5.738 -3.170 1.00 0.00 C ATOM 1287 C THR A 84 8.886 -6.546 -3.038 1.00 0.00 C ATOM 1288 O THR A 84 8.104 -6.648 -3.984 1.00 0.00 O ATOM 1289 CB THR A 84 9.884 -4.271 -2.802 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.459 -3.398 -3.779 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.443 -3.939 -1.426 1.00 0.00 C ATOM 0 H THR A 84 10.161 -5.411 -5.241 1.00 0.00 H new ATOM 0 HA THR A 84 10.919 -6.136 -2.484 1.00 0.00 H new ATOM 0 HB THR A 84 8.803 -4.130 -2.782 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.957 -3.470 -4.618 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.228 -2.897 -1.188 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.980 -4.585 -0.680 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.522 -4.097 -1.424 1.00 0.00 H new ATOM 1299 N ASP A 85 8.670 -7.117 -1.858 1.00 0.00 N ATOM 1300 CA ASP A 85 7.477 -7.914 -1.601 1.00 0.00 C ATOM 1301 C ASP A 85 6.237 -7.028 -1.521 1.00 0.00 C ATOM 1302 O ASP A 85 5.160 -7.405 -1.983 1.00 0.00 O ATOM 1303 CB ASP A 85 7.636 -8.706 -0.301 1.00 0.00 C ATOM 1304 CG ASP A 85 9.011 -9.331 -0.170 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.789 -8.879 0.696 1.00 0.00 O ATOM 1306 OD2 ASP A 85 9.309 -10.273 -0.933 1.00 0.00 O ATOM 0 H ASP A 85 9.306 -7.042 -1.064 1.00 0.00 H new ATOM 0 HA ASP A 85 7.352 -8.611 -2.430 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.458 -8.046 0.548 1.00 0.00 H new ATOM 0 HB3 ASP A 85 6.879 -9.489 -0.261 1.00 0.00 H new ATOM 1311 N VAL A 86 6.398 -5.847 -0.931 1.00 0.00 N ATOM 1312 CA VAL A 86 5.292 -4.907 -0.791 1.00 0.00 C ATOM 1313 C VAL A 86 4.620 -4.644 -2.134 1.00 0.00 C ATOM 1314 O VAL A 86 3.405 -4.460 -2.206 1.00 0.00 O ATOM 1315 CB VAL A 86 5.767 -3.567 -0.197 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.352 -3.776 1.191 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.781 -2.906 -1.118 1.00 0.00 C ATOM 0 H VAL A 86 7.282 -5.519 -0.543 1.00 0.00 H new ATOM 0 HA VAL A 86 4.573 -5.364 -0.111 1.00 0.00 H new ATOM 0 HB VAL A 86 4.907 -2.904 -0.106 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.682 -2.819 1.595 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.592 -4.203 1.846 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.202 -4.456 1.129 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.106 -1.961 -0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.642 -3.563 -1.243 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.323 -2.720 -2.089 1.00 0.00 H new ATOM 1327 N ALA A 87 5.419 -4.630 -3.196 1.00 0.00 N ATOM 1328 CA ALA A 87 4.901 -4.392 -4.538 1.00 0.00 C ATOM 1329 C ALA A 87 3.941 -5.500 -4.959 1.00 0.00 C ATOM 1330 O ALA A 87 2.758 -5.254 -5.198 1.00 0.00 O ATOM 1331 CB ALA A 87 6.046 -4.277 -5.533 1.00 0.00 C ATOM 0 H ALA A 87 6.427 -4.781 -3.153 1.00 0.00 H new ATOM 0 HA ALA A 87 4.349 -3.452 -4.527 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.645 -4.099 -6.531 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.693 -3.447 -5.249 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.622 -5.202 -5.533 1.00 0.00 H new ATOM 1337 N LYS A 88 4.457 -6.721 -5.052 1.00 0.00 N ATOM 1338 CA LYS A 88 3.646 -7.867 -5.444 1.00 0.00 C ATOM 1339 C LYS A 88 2.410 -7.988 -4.559 1.00 0.00 C ATOM 1340 O LYS A 88 1.301 -8.199 -5.050 1.00 0.00 O ATOM 1341 CB LYS A 88 4.472 -9.153 -5.363 1.00 0.00 C ATOM 1342 CG LYS A 88 3.872 -10.311 -6.141 1.00 0.00 C ATOM 1343 CD LYS A 88 4.344 -11.651 -5.601 1.00 0.00 C ATOM 1344 CE LYS A 88 4.247 -12.743 -6.656 1.00 0.00 C ATOM 1345 NZ LYS A 88 5.436 -12.754 -7.553 1.00 0.00 N ATOM 0 H LYS A 88 5.434 -6.942 -4.861 1.00 0.00 H new ATOM 0 HA LYS A 88 3.320 -7.715 -6.473 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.476 -8.955 -5.739 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.575 -9.443 -4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.784 -10.260 -6.090 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.146 -10.225 -7.192 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.376 -11.564 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.744 -11.927 -4.734 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.152 -13.713 -6.167 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.345 -12.595 -7.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 5.332 -13.512 -8.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.513 -11.838 -8.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.294 -12.920 -6.990 1.00 0.00 H new ATOM 1359 N THR A 89 2.609 -7.851 -3.251 1.00 0.00 N ATOM 1360 CA THR A 89 1.509 -7.944 -2.298 1.00 0.00 C ATOM 1361 C THR A 89 0.457 -6.874 -2.564 1.00 0.00 C ATOM 1362 O THR A 89 -0.742 -7.127 -2.452 1.00 0.00 O ATOM 1363 CB THR A 89 2.011 -7.806 -0.848 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.938 -8.855 -0.547 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.849 -7.851 0.133 1.00 0.00 C ATOM 0 H THR A 89 3.520 -7.676 -2.828 1.00 0.00 H new ATOM 0 HA THR A 89 1.060 -8.929 -2.428 1.00 0.00 H new ATOM 0 HB THR A 89 2.511 -6.842 -0.751 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.811 -8.642 -0.938 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.228 -7.752 1.150 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.161 -7.032 -0.080 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.324 -8.801 0.032 1.00 0.00 H new ATOM 1373 N PHE A 90 0.915 -5.678 -2.921 1.00 0.00 N ATOM 1374 CA PHE A 90 0.011 -4.568 -3.203 1.00 0.00 C ATOM 1375 C PHE A 90 -0.885 -4.887 -4.397 1.00 0.00 C ATOM 1376 O PHE A 90 -2.108 -4.937 -4.272 1.00 0.00 O ATOM 1377 CB PHE A 90 0.809 -3.292 -3.476 1.00 0.00 C ATOM 1378 CG PHE A 90 0.001 -2.209 -4.133 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.708 -1.295 -3.369 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.052 -2.105 -5.513 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.452 -0.297 -3.971 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.793 -1.109 -6.120 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.496 -0.205 -5.348 1.00 0.00 C ATOM 0 H PHE A 90 1.905 -5.453 -3.022 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.621 -4.414 -2.328 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.210 -2.915 -2.535 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.661 -3.535 -4.111 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.679 -1.363 -2.292 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.493 -2.811 -6.122 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.998 0.410 -3.365 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.822 -1.038 -7.197 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.079 0.572 -5.820 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.265 -5.100 -5.553 1.00 0.00 N ATOM 1394 CA ARG A 91 -1.006 -5.412 -6.769 1.00 0.00 C ATOM 1395 C ARG A 91 -1.852 -6.668 -6.585 1.00 0.00 C ATOM 1396 O ARG A 91 -2.901 -6.821 -7.211 1.00 0.00 O ATOM 1397 CB ARG A 91 -0.044 -5.602 -7.944 1.00 0.00 C ATOM 1398 CG ARG A 91 1.061 -6.608 -7.668 1.00 0.00 C ATOM 1399 CD ARG A 91 2.294 -6.327 -8.515 1.00 0.00 C ATOM 1400 NE ARG A 91 2.816 -7.540 -9.140 1.00 0.00 N ATOM 1401 CZ ARG A 91 3.603 -7.535 -10.210 1.00 0.00 C ATOM 1402 NH1 ARG A 91 3.959 -6.387 -10.770 1.00 0.00 N ATOM 1403 NH2 ARG A 91 4.038 -8.681 -10.720 1.00 0.00 N ATOM 0 H ARG A 91 0.747 -5.062 -5.673 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.671 -4.575 -6.982 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -0.610 -5.927 -8.817 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.405 -4.641 -8.194 1.00 0.00 H new ATOM 0 HG2 ARG A 91 1.329 -6.576 -6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.698 -7.615 -7.874 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.045 -5.599 -9.287 1.00 0.00 H new ATOM 0 HD3 ARG A 91 3.068 -5.878 -7.892 1.00 0.00 H new ATOM 0 HE ARG A 91 2.562 -8.440 -8.732 1.00 0.00 H new ATOM 0 HH11 ARG A 91 3.628 -5.505 -10.379 1.00 0.00 H new ATOM 0 HH12 ARG A 91 4.563 -6.386 -11.592 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.768 -9.566 -10.290 1.00 0.00 H new ATOM 0 HH22 ARG A 91 4.642 -8.677 -11.542 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.390 -7.565 -5.720 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.103 -8.807 -5.450 1.00 0.00 C ATOM 1419 C LYS A 92 -3.349 -8.547 -4.608 1.00 0.00 C ATOM 1420 O LYS A 92 -4.440 -9.010 -4.939 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.187 -9.800 -4.731 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.386 -10.681 -5.675 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.117 -12.048 -5.069 1.00 0.00 C ATOM 1424 CE LYS A 92 -1.296 -12.988 -5.269 1.00 0.00 C ATOM 1425 NZ LYS A 92 -0.954 -14.391 -4.908 1.00 0.00 N ATOM 0 H LYS A 92 -0.523 -7.454 -5.194 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.413 -9.233 -6.404 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.499 -9.249 -4.090 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.790 -10.433 -4.081 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.929 -10.798 -6.613 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.560 -10.195 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.775 -12.479 -5.523 1.00 0.00 H new ATOM 0 HD3 LYS A 92 0.088 -11.941 -4.004 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.136 -12.651 -4.662 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.619 -12.949 -6.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.783 -15.000 -5.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.169 -14.722 -5.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.670 -14.433 -3.908 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.178 -7.805 -3.520 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.288 -7.482 -2.633 1.00 0.00 C ATOM 1441 C ALA A 93 -5.234 -6.477 -3.282 1.00 0.00 C ATOM 1442 O ALA A 93 -6.378 -6.322 -2.853 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.767 -6.941 -1.310 1.00 0.00 C ATOM 0 H ALA A 93 -2.281 -7.416 -3.231 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.847 -8.398 -2.443 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.607 -6.704 -0.658 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.137 -7.692 -0.833 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.182 -6.039 -1.491 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.749 -5.797 -4.315 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.552 -4.807 -5.022 1.00 0.00 C ATOM 1451 C ILE A 94 -6.232 -5.422 -6.242 1.00 0.00 C ATOM 1452 O ILE A 94 -7.228 -4.897 -6.739 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.699 -3.608 -5.475 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.480 -2.304 -5.301 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.264 -3.783 -6.922 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.870 -1.366 -4.283 1.00 0.00 C ATOM 0 H ILE A 94 -3.804 -5.913 -4.681 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.311 -4.458 -4.322 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.806 -3.560 -4.852 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.540 -1.794 -6.263 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.501 -2.539 -5.001 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.662 -2.927 -7.227 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.673 -4.694 -7.017 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.144 -3.853 -7.561 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.476 -0.463 -4.212 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.835 -1.857 -3.311 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.859 -1.101 -4.592 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.688 -6.537 -6.717 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.243 -7.224 -7.878 1.00 0.00 C ATOM 1470 C ASN A 95 -7.279 -8.261 -7.452 1.00 0.00 C ATOM 1471 O ASN A 95 -7.646 -9.142 -8.229 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.128 -7.900 -8.678 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.414 -6.933 -9.604 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -4.994 -5.944 -10.054 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.150 -7.216 -9.895 1.00 0.00 N ATOM 0 H ASN A 95 -4.864 -6.984 -6.316 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.734 -6.482 -8.508 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.406 -8.340 -7.990 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.549 -8.717 -9.264 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -2.620 -6.603 -10.514 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -2.709 -8.046 -9.499 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.746 -8.147 -6.214 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.741 -9.073 -5.684 1.00 0.00 C ATOM 1484 C LYS A 96 -8.185 -10.492 -5.619 1.00 0.00 C ATOM 1485 O LYS A 96 -8.934 -11.457 -5.474 1.00 0.00 O ATOM 1486 CB LYS A 96 -10.003 -9.048 -6.550 1.00 0.00 C ATOM 1487 CG LYS A 96 -11.140 -8.242 -5.946 1.00 0.00 C ATOM 1488 CD LYS A 96 -12.456 -8.520 -6.652 1.00 0.00 C ATOM 1489 CE LYS A 96 -13.627 -7.878 -5.922 1.00 0.00 C ATOM 1490 NZ LYS A 96 -13.525 -6.393 -5.909 1.00 0.00 N ATOM 0 H LYS A 96 -7.452 -7.423 -5.558 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.994 -8.755 -4.673 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.755 -8.634 -7.527 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.341 -10.071 -6.714 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -11.236 -8.483 -4.887 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.908 -7.179 -6.011 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.410 -8.140 -7.673 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.614 -9.596 -6.719 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.560 -8.174 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.664 -8.249 -4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.374 -5.991 -5.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.682 -6.108 -5.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.448 -6.042 -6.885 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.865 -10.609 -5.723 1.00 0.00 N ATOM 1505 CA LYS A 97 -6.207 -11.909 -5.672 1.00 0.00 C ATOM 1506 C LYS A 97 -6.727 -12.826 -6.775 1.00 0.00 C ATOM 1507 O LYS A 97 -6.921 -14.014 -6.527 1.00 0.00 O ATOM 1508 CB LYS A 97 -6.426 -12.563 -4.306 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.669 -11.884 -3.179 1.00 0.00 C ATOM 1510 CD LYS A 97 -6.372 -10.617 -2.718 1.00 0.00 C ATOM 1511 CE LYS A 97 -6.137 -10.356 -1.238 1.00 0.00 C ATOM 1512 NZ LYS A 97 -6.959 -11.253 -0.379 1.00 0.00 N ATOM 0 H LYS A 97 -6.231 -9.819 -5.843 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.139 -11.753 -5.826 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.491 -12.554 -4.074 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.121 -13.608 -4.360 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -5.570 -12.572 -2.340 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.660 -11.641 -3.512 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.013 -9.768 -3.300 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -7.442 -10.704 -2.908 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -5.081 -10.499 -1.007 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.375 -9.317 -1.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -7.657 -10.688 0.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -7.453 -11.947 -0.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -6.342 -11.751 0.293 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.360 7.742 -1.534 1.00 0.00 CA HETATM 1528 CA CA A 102 4.444 12.533 -2.426 1.00 0.00 CA