USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=21 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 149:sc= 0.102 (180deg=0.00563) USER MOD Single : A 5 SER OG : rot 180:sc= -0.206 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -156:sc= -1.55 (180deg=-2.71!) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0443) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0427 USER MOD Single : A 26 ASN : amide:sc= -1.57 K(o=-1.6,f=-13!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -30:sc= -0.429 USER MOD Single : A 32 ASN : amide:sc= -0.302 K(o=-0.3,f=-2.1!) USER MOD Single : A 35 ASN : amide:sc= -0.994 X(o=-0.99,f=-0.62) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 62:sc= 0.632 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 56 ASN : amide:sc=-0.00695 K(o=-0.007,f=-1.3) USER MOD Single : A 58 MET CE :methyl -165:sc= -2.6! (180deg=-3.14) USER MOD Single : A 60 THR OG1 : rot -39:sc= 0.667 USER MOD Single : A 65 GLN : amide:sc= -1.98 K(o=-2,f=-0.11) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0279 USER MOD Single : A 76 LYS NZ :NH3+ 143:sc= 0.189 (180deg=-0.2) USER MOD Single : A 79 HIS : no HE2:sc= -8.21! C(o=-8.2!,f=-8.3!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 43:sc= 0.801 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.678) USER MOD Single : A 89 THR OG1 : rot 74:sc= 0.851 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.228 K(o=-0.23,f=-1.9!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -150:sc= 1.15 (180deg=0.456) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.739 1.077 -22.089 1.00 0.00 N ATOM 2 CA MET A 1 17.679 1.801 -20.825 1.00 0.00 C ATOM 3 C MET A 1 16.232 2.067 -20.420 1.00 0.00 C ATOM 4 O MET A 1 15.340 2.115 -21.266 1.00 0.00 O ATOM 5 CB MET A 1 18.442 3.123 -20.932 1.00 0.00 C ATOM 6 CG MET A 1 19.921 2.997 -20.605 1.00 0.00 C ATOM 7 SD MET A 1 20.917 2.569 -22.046 1.00 0.00 S ATOM 8 CE MET A 1 22.532 2.377 -21.297 1.00 0.00 C ATOM 0 H1 MET A 1 18.603 1.345 -22.602 1.00 0.00 H new ATOM 0 H2 MET A 1 17.750 0.054 -21.903 1.00 0.00 H new ATOM 0 H3 MET A 1 16.907 1.315 -22.665 1.00 0.00 H new ATOM 0 HA MET A 1 18.145 1.182 -20.058 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.334 3.515 -21.943 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.990 3.850 -20.258 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.278 3.938 -20.188 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.056 2.236 -19.836 1.00 0.00 H new ATOM 0 HE1 MET A 1 23.259 2.111 -22.064 1.00 0.00 H new ATOM 0 HE2 MET A 1 22.828 3.314 -20.826 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.493 1.589 -20.545 1.00 0.00 H new ATOM 18 N ALA A 2 16.008 2.241 -19.122 1.00 0.00 N ATOM 19 CA ALA A 2 14.671 2.504 -18.606 1.00 0.00 C ATOM 20 C ALA A 2 14.529 3.955 -18.161 1.00 0.00 C ATOM 21 O ALA A 2 15.308 4.442 -17.341 1.00 0.00 O ATOM 22 CB ALA A 2 14.355 1.563 -17.452 1.00 0.00 C ATOM 0 H ALA A 2 16.736 2.205 -18.408 1.00 0.00 H new ATOM 0 HA ALA A 2 13.958 2.327 -19.411 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.353 1.771 -17.077 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.405 0.531 -17.800 1.00 0.00 H new ATOM 0 HB3 ALA A 2 15.080 1.712 -16.652 1.00 0.00 H new ATOM 28 N ARG A 3 13.532 4.642 -18.707 1.00 0.00 N ATOM 29 CA ARG A 3 13.290 6.039 -18.368 1.00 0.00 C ATOM 30 C ARG A 3 11.990 6.191 -17.583 1.00 0.00 C ATOM 31 O ARG A 3 11.159 7.041 -17.898 1.00 0.00 O ATOM 32 CB ARG A 3 13.234 6.892 -19.637 1.00 0.00 C ATOM 33 CG ARG A 3 12.353 6.305 -20.728 1.00 0.00 C ATOM 34 CD ARG A 3 13.181 5.617 -21.801 1.00 0.00 C ATOM 35 NE ARG A 3 12.584 5.760 -23.127 1.00 0.00 N ATOM 36 CZ ARG A 3 13.217 5.450 -24.255 1.00 0.00 C ATOM 37 NH1 ARG A 3 14.456 4.983 -24.217 1.00 0.00 N ATOM 38 NH2 ARG A 3 12.606 5.608 -25.423 1.00 0.00 N ATOM 0 H ARG A 3 12.878 4.254 -19.387 1.00 0.00 H new ATOM 0 HA ARG A 3 14.114 6.383 -17.743 1.00 0.00 H new ATOM 0 HB2 ARG A 3 12.867 7.886 -19.381 1.00 0.00 H new ATOM 0 HB3 ARG A 3 14.245 7.016 -20.026 1.00 0.00 H new ATOM 0 HG2 ARG A 3 11.657 5.590 -20.290 1.00 0.00 H new ATOM 0 HG3 ARG A 3 11.755 7.096 -21.180 1.00 0.00 H new ATOM 0 HD2 ARG A 3 14.187 6.038 -21.809 1.00 0.00 H new ATOM 0 HD3 ARG A 3 13.280 4.559 -21.560 1.00 0.00 H new ATOM 0 HE ARG A 3 11.631 6.117 -23.191 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.927 4.860 -23.321 1.00 0.00 H new ATOM 0 HH12 ARG A 3 14.939 4.746 -25.084 1.00 0.00 H new ATOM 0 HH21 ARG A 3 11.652 5.967 -25.455 1.00 0.00 H new ATOM 0 HH22 ARG A 3 13.091 5.371 -26.288 1.00 0.00 H new ATOM 52 N GLY A 4 11.824 5.362 -16.557 1.00 0.00 N ATOM 53 CA GLY A 4 10.624 5.419 -15.742 1.00 0.00 C ATOM 54 C GLY A 4 9.358 5.296 -16.567 1.00 0.00 C ATOM 55 O GLY A 4 8.339 5.907 -16.246 1.00 0.00 O ATOM 0 H GLY A 4 12.499 4.651 -16.275 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.652 4.618 -15.003 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.606 6.360 -15.192 1.00 0.00 H new ATOM 59 N SER A 5 9.423 4.506 -17.633 1.00 0.00 N ATOM 60 CA SER A 5 8.274 4.309 -18.509 1.00 0.00 C ATOM 61 C SER A 5 7.349 3.227 -17.959 1.00 0.00 C ATOM 62 O SER A 5 7.658 2.581 -16.958 1.00 0.00 O ATOM 63 CB SER A 5 8.738 3.931 -19.918 1.00 0.00 C ATOM 64 OG SER A 5 9.316 5.043 -20.580 1.00 0.00 O ATOM 0 H SER A 5 10.259 3.992 -17.911 1.00 0.00 H new ATOM 0 HA SER A 5 7.720 5.247 -18.556 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.464 3.120 -19.860 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.892 3.560 -20.496 1.00 0.00 H new ATOM 0 HG SER A 5 9.606 4.775 -21.477 1.00 0.00 H new ATOM 70 N VAL A 6 6.212 3.037 -18.620 1.00 0.00 N ATOM 71 CA VAL A 6 5.242 2.034 -18.199 1.00 0.00 C ATOM 72 C VAL A 6 4.566 1.384 -19.401 1.00 0.00 C ATOM 73 O VAL A 6 4.055 2.071 -20.285 1.00 0.00 O ATOM 74 CB VAL A 6 4.163 2.645 -17.285 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.344 1.550 -16.618 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.798 3.555 -16.247 1.00 0.00 C ATOM 0 H VAL A 6 5.940 3.565 -19.449 1.00 0.00 H new ATOM 0 HA VAL A 6 5.793 1.276 -17.642 1.00 0.00 H new ATOM 0 HB VAL A 6 3.490 3.245 -17.898 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.587 2.001 -15.976 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.857 0.943 -17.382 1.00 0.00 H new ATOM 0 HG13 VAL A 6 4.000 0.920 -16.017 1.00 0.00 H new ATOM 0 HG21 VAL A 6 4.021 3.978 -15.610 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.495 2.980 -15.637 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.334 4.360 -16.749 1.00 0.00 H new ATOM 86 N SER A 7 4.567 0.055 -19.427 1.00 0.00 N ATOM 87 CA SER A 7 3.957 -0.689 -20.522 1.00 0.00 C ATOM 88 C SER A 7 2.437 -0.555 -20.490 1.00 0.00 C ATOM 89 O SER A 7 1.865 -0.085 -19.507 1.00 0.00 O ATOM 90 CB SER A 7 4.352 -2.165 -20.447 1.00 0.00 C ATOM 91 OG SER A 7 4.067 -2.831 -21.665 1.00 0.00 O ATOM 0 H SER A 7 4.984 -0.529 -18.702 1.00 0.00 H new ATOM 0 HA SER A 7 4.322 -0.270 -21.460 1.00 0.00 H new ATOM 0 HB2 SER A 7 5.415 -2.249 -20.223 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.815 -2.648 -19.631 1.00 0.00 H new ATOM 0 HG SER A 7 4.330 -3.772 -21.592 1.00 0.00 H new ATOM 97 N ASP A 8 1.789 -0.972 -21.573 1.00 0.00 N ATOM 98 CA ASP A 8 0.336 -0.899 -21.670 1.00 0.00 C ATOM 99 C ASP A 8 -0.323 -1.691 -20.545 1.00 0.00 C ATOM 100 O ASP A 8 -1.122 -1.151 -19.779 1.00 0.00 O ATOM 101 CB ASP A 8 -0.133 -1.429 -23.025 1.00 0.00 C ATOM 102 CG ASP A 8 0.391 -0.602 -24.184 1.00 0.00 C ATOM 103 OD1 ASP A 8 1.556 -0.811 -24.582 1.00 0.00 O ATOM 104 OD2 ASP A 8 -0.364 0.253 -24.690 1.00 0.00 O ATOM 0 H ASP A 8 2.247 -1.364 -22.396 1.00 0.00 H new ATOM 0 HA ASP A 8 0.042 0.146 -21.576 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.196 -2.462 -23.141 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.223 -1.437 -23.051 1.00 0.00 H new ATOM 109 N GLU A 9 0.016 -2.973 -20.452 1.00 0.00 N ATOM 110 CA GLU A 9 -0.545 -3.839 -19.421 1.00 0.00 C ATOM 111 C GLU A 9 -0.198 -3.320 -18.028 1.00 0.00 C ATOM 112 O GLU A 9 -1.082 -3.082 -17.206 1.00 0.00 O ATOM 113 CB GLU A 9 -0.029 -5.269 -19.589 1.00 0.00 C ATOM 114 CG GLU A 9 -0.461 -5.923 -20.890 1.00 0.00 C ATOM 115 CD GLU A 9 -0.278 -7.428 -20.875 1.00 0.00 C ATOM 116 OE1 GLU A 9 0.885 -7.884 -20.866 1.00 0.00 O ATOM 117 OE2 GLU A 9 -1.296 -8.150 -20.874 1.00 0.00 O ATOM 0 H GLU A 9 0.676 -3.435 -21.078 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.629 -3.838 -19.531 1.00 0.00 H new ATOM 0 HB2 GLU A 9 1.060 -5.261 -19.540 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.381 -5.874 -18.754 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.509 -5.690 -21.079 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.113 -5.499 -21.714 1.00 0.00 H new ATOM 124 N GLU A 10 1.096 -3.150 -17.772 1.00 0.00 N ATOM 125 CA GLU A 10 1.559 -2.663 -16.478 1.00 0.00 C ATOM 126 C GLU A 10 0.832 -1.379 -16.088 1.00 0.00 C ATOM 127 O GLU A 10 0.260 -1.282 -15.002 1.00 0.00 O ATOM 128 CB GLU A 10 3.069 -2.417 -16.512 1.00 0.00 C ATOM 129 CG GLU A 10 3.672 -2.145 -15.144 1.00 0.00 C ATOM 130 CD GLU A 10 3.597 -3.348 -14.224 1.00 0.00 C ATOM 131 OE1 GLU A 10 3.440 -4.476 -14.736 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.694 -3.161 -12.993 1.00 0.00 O ATOM 0 H GLU A 10 1.840 -3.342 -18.442 1.00 0.00 H new ATOM 0 HA GLU A 10 1.339 -3.426 -15.731 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.560 -3.286 -16.950 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.276 -1.570 -17.166 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.714 -1.848 -15.263 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.152 -1.306 -14.682 1.00 0.00 H new ATOM 139 N MET A 11 0.860 -0.396 -16.981 1.00 0.00 N ATOM 140 CA MET A 11 0.204 0.883 -16.732 1.00 0.00 C ATOM 141 C MET A 11 -1.250 0.675 -16.316 1.00 0.00 C ATOM 142 O MET A 11 -1.641 1.021 -15.202 1.00 0.00 O ATOM 143 CB MET A 11 0.269 1.766 -17.979 1.00 0.00 C ATOM 144 CG MET A 11 -0.202 3.192 -17.740 1.00 0.00 C ATOM 145 SD MET A 11 1.054 4.212 -16.944 1.00 0.00 S ATOM 146 CE MET A 11 0.031 5.300 -15.956 1.00 0.00 C ATOM 0 H MET A 11 1.330 -0.460 -17.884 1.00 0.00 H new ATOM 0 HA MET A 11 0.730 1.381 -15.917 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.295 1.788 -18.346 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.340 1.318 -18.764 1.00 0.00 H new ATOM 0 HG2 MET A 11 -0.481 3.643 -18.692 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.098 3.176 -17.120 1.00 0.00 H new ATOM 0 HE1 MET A 11 0.574 6.223 -15.751 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.885 5.531 -16.500 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.219 4.809 -15.015 1.00 0.00 H new ATOM 156 N MET A 12 -2.044 0.110 -17.219 1.00 0.00 N ATOM 157 CA MET A 12 -3.453 -0.144 -16.944 1.00 0.00 C ATOM 158 C MET A 12 -3.634 -0.764 -15.563 1.00 0.00 C ATOM 159 O MET A 12 -4.396 -0.256 -14.740 1.00 0.00 O ATOM 160 CB MET A 12 -4.045 -1.066 -18.012 1.00 0.00 C ATOM 161 CG MET A 12 -5.193 -0.439 -18.788 1.00 0.00 C ATOM 162 SD MET A 12 -5.963 -1.593 -19.939 1.00 0.00 S ATOM 163 CE MET A 12 -7.629 -0.937 -20.011 1.00 0.00 C ATOM 0 H MET A 12 -1.736 -0.181 -18.147 1.00 0.00 H new ATOM 0 HA MET A 12 -3.980 0.810 -16.966 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.258 -1.352 -18.710 1.00 0.00 H new ATOM 0 HB3 MET A 12 -4.396 -1.981 -17.536 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.944 -0.075 -18.087 1.00 0.00 H new ATOM 0 HG3 MET A 12 -4.825 0.426 -19.339 1.00 0.00 H new ATOM 0 HE1 MET A 12 -8.231 -1.546 -20.686 1.00 0.00 H new ATOM 0 HE2 MET A 12 -8.071 -0.955 -19.015 1.00 0.00 H new ATOM 0 HE3 MET A 12 -7.600 0.089 -20.377 1.00 0.00 H new ATOM 173 N GLU A 13 -2.931 -1.865 -15.316 1.00 0.00 N ATOM 174 CA GLU A 13 -3.017 -2.553 -14.033 1.00 0.00 C ATOM 175 C GLU A 13 -2.809 -1.579 -12.876 1.00 0.00 C ATOM 176 O GLU A 13 -3.553 -1.594 -11.896 1.00 0.00 O ATOM 177 CB GLU A 13 -1.979 -3.676 -13.961 1.00 0.00 C ATOM 178 CG GLU A 13 -2.511 -5.026 -14.412 1.00 0.00 C ATOM 179 CD GLU A 13 -2.980 -5.016 -15.854 1.00 0.00 C ATOM 180 OE1 GLU A 13 -2.342 -5.690 -16.689 1.00 0.00 O ATOM 181 OE2 GLU A 13 -3.985 -4.335 -16.147 1.00 0.00 O ATOM 0 H GLU A 13 -2.297 -2.299 -15.986 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.015 -2.983 -13.947 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.122 -3.408 -14.579 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.618 -3.761 -12.936 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.731 -5.778 -14.293 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.339 -5.320 -13.767 1.00 0.00 H new ATOM 188 N LEU A 14 -1.791 -0.734 -12.999 1.00 0.00 N ATOM 189 CA LEU A 14 -1.483 0.248 -11.965 1.00 0.00 C ATOM 190 C LEU A 14 -2.643 1.222 -11.777 1.00 0.00 C ATOM 191 O LEU A 14 -3.069 1.485 -10.652 1.00 0.00 O ATOM 192 CB LEU A 14 -0.211 1.017 -12.327 1.00 0.00 C ATOM 193 CG LEU A 14 1.080 0.199 -12.357 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.026 0.734 -13.422 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.751 0.210 -10.992 1.00 0.00 C ATOM 0 H LEU A 14 -1.165 -0.709 -13.804 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.324 -0.285 -11.028 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.352 1.473 -13.307 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.086 1.830 -11.612 1.00 0.00 H new ATOM 0 HG LEU A 14 0.828 -0.832 -12.607 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.940 0.140 -13.429 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.546 0.673 -14.399 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.271 1.773 -13.202 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.668 -0.377 -11.033 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.989 1.236 -10.712 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.077 -0.221 -10.252 1.00 0.00 H new ATOM 207 N ARG A 15 -3.150 1.751 -12.885 1.00 0.00 N ATOM 208 CA ARG A 15 -4.261 2.695 -12.842 1.00 0.00 C ATOM 209 C ARG A 15 -5.422 2.131 -12.027 1.00 0.00 C ATOM 210 O ARG A 15 -5.820 2.708 -11.016 1.00 0.00 O ATOM 211 CB ARG A 15 -4.732 3.026 -14.259 1.00 0.00 C ATOM 212 CG ARG A 15 -3.629 3.560 -15.157 1.00 0.00 C ATOM 213 CD ARG A 15 -3.245 4.984 -14.783 1.00 0.00 C ATOM 214 NE ARG A 15 -3.617 5.942 -15.820 1.00 0.00 N ATOM 215 CZ ARG A 15 -3.048 7.136 -15.955 1.00 0.00 C ATOM 216 NH1 ARG A 15 -2.088 7.514 -15.124 1.00 0.00 N ATOM 217 NH2 ARG A 15 -3.441 7.952 -16.924 1.00 0.00 N ATOM 0 H ARG A 15 -2.810 1.542 -13.824 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.911 3.608 -12.360 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -5.155 2.129 -14.711 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -5.533 3.763 -14.204 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -2.754 2.915 -15.083 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.959 3.532 -16.196 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -3.732 5.256 -13.847 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -2.170 5.036 -14.610 1.00 0.00 H new ATOM 0 HE ARG A 15 -4.353 5.681 -16.476 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -1.784 6.888 -14.378 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -1.653 8.431 -15.230 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -4.180 7.663 -17.565 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.005 8.868 -17.028 1.00 0.00 H new ATOM 231 N GLU A 16 -5.960 1.001 -12.476 1.00 0.00 N ATOM 232 CA GLU A 16 -7.076 0.361 -11.789 1.00 0.00 C ATOM 233 C GLU A 16 -6.713 0.044 -10.342 1.00 0.00 C ATOM 234 O GLU A 16 -7.551 0.142 -9.445 1.00 0.00 O ATOM 235 CB GLU A 16 -7.483 -0.921 -12.517 1.00 0.00 C ATOM 236 CG GLU A 16 -6.367 -1.948 -12.612 1.00 0.00 C ATOM 237 CD GLU A 16 -6.806 -3.225 -13.303 1.00 0.00 C ATOM 238 OE1 GLU A 16 -6.436 -4.316 -12.822 1.00 0.00 O ATOM 239 OE2 GLU A 16 -7.518 -3.132 -14.324 1.00 0.00 O ATOM 0 H GLU A 16 -5.641 0.510 -13.312 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.917 1.054 -11.791 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.333 -1.367 -12.001 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -7.818 -0.667 -13.523 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.526 -1.516 -13.155 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.011 -2.186 -11.610 1.00 0.00 H new ATOM 246 N ALA A 17 -5.460 -0.337 -10.121 1.00 0.00 N ATOM 247 CA ALA A 17 -4.985 -0.667 -8.783 1.00 0.00 C ATOM 248 C ALA A 17 -5.169 0.508 -7.830 1.00 0.00 C ATOM 249 O ALA A 17 -5.606 0.336 -6.691 1.00 0.00 O ATOM 250 CB ALA A 17 -3.523 -1.086 -8.830 1.00 0.00 C ATOM 0 H ALA A 17 -4.754 -0.425 -10.852 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.579 -1.501 -8.409 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.182 -1.329 -7.824 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.416 -1.961 -9.471 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.923 -0.268 -9.229 1.00 0.00 H new ATOM 256 N PHE A 18 -4.833 1.705 -8.301 1.00 0.00 N ATOM 257 CA PHE A 18 -4.961 2.909 -7.488 1.00 0.00 C ATOM 258 C PHE A 18 -6.420 3.339 -7.379 1.00 0.00 C ATOM 259 O PHE A 18 -6.919 3.602 -6.284 1.00 0.00 O ATOM 260 CB PHE A 18 -4.126 4.045 -8.088 1.00 0.00 C ATOM 261 CG PHE A 18 -2.753 3.616 -8.516 1.00 0.00 C ATOM 262 CD1 PHE A 18 -2.003 2.756 -7.730 1.00 0.00 C ATOM 263 CD2 PHE A 18 -2.209 4.075 -9.706 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.738 2.360 -8.122 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.944 3.682 -10.103 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.208 2.824 -9.310 1.00 0.00 C ATOM 0 H PHE A 18 -4.470 1.867 -9.241 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.592 2.683 -6.488 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.654 4.458 -8.948 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.036 4.846 -7.354 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.412 2.391 -6.800 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.780 4.747 -10.330 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -0.165 1.689 -7.500 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.532 4.046 -11.033 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.780 2.516 -9.618 1.00 0.00 H new ATOM 276 N ALA A 19 -7.098 3.409 -8.519 1.00 0.00 N ATOM 277 CA ALA A 19 -8.500 3.806 -8.551 1.00 0.00 C ATOM 278 C ALA A 19 -9.345 2.909 -7.653 1.00 0.00 C ATOM 279 O ALA A 19 -10.406 3.313 -7.175 1.00 0.00 O ATOM 280 CB ALA A 19 -9.026 3.772 -9.978 1.00 0.00 C ATOM 0 H ALA A 19 -6.699 3.196 -9.433 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.572 4.826 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.074 4.071 -9.987 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -8.448 4.459 -10.595 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.934 2.761 -10.376 1.00 0.00 H new ATOM 286 N LYS A 20 -8.870 1.689 -7.427 1.00 0.00 N ATOM 287 CA LYS A 20 -9.581 0.734 -6.586 1.00 0.00 C ATOM 288 C LYS A 20 -9.724 1.264 -5.163 1.00 0.00 C ATOM 289 O LYS A 20 -10.836 1.428 -4.661 1.00 0.00 O ATOM 290 CB LYS A 20 -8.845 -0.608 -6.569 1.00 0.00 C ATOM 291 CG LYS A 20 -9.653 -1.752 -7.157 1.00 0.00 C ATOM 292 CD LYS A 20 -9.974 -1.511 -8.623 1.00 0.00 C ATOM 293 CE LYS A 20 -11.024 -2.487 -9.132 1.00 0.00 C ATOM 294 NZ LYS A 20 -12.385 -2.144 -8.637 1.00 0.00 N ATOM 0 H LYS A 20 -7.994 1.338 -7.815 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.577 0.591 -7.004 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.913 -0.509 -7.125 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.578 -0.853 -5.541 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.096 -2.683 -7.054 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.580 -1.871 -6.595 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.331 -0.490 -8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.065 -1.610 -9.217 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.023 -2.486 -10.222 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.766 -3.497 -8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.091 -2.722 -9.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -12.441 -2.333 -7.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -12.575 -1.137 -8.814 1.00 0.00 H new ATOM 308 N VAL A 21 -8.594 1.533 -4.519 1.00 0.00 N ATOM 309 CA VAL A 21 -8.594 2.048 -3.155 1.00 0.00 C ATOM 310 C VAL A 21 -8.943 3.531 -3.127 1.00 0.00 C ATOM 311 O VAL A 21 -9.327 4.070 -2.089 1.00 0.00 O ATOM 312 CB VAL A 21 -7.226 1.840 -2.476 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.975 0.362 -2.221 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.116 2.440 -3.325 1.00 0.00 C ATOM 0 H VAL A 21 -7.665 1.403 -4.920 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.352 1.489 -2.606 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.235 2.352 -1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.005 0.235 -1.741 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.756 -0.033 -1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.985 -0.177 -3.168 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.156 2.285 -2.832 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.104 1.957 -4.302 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.291 3.509 -3.450 1.00 0.00 H new ATOM 324 N ASP A 22 -8.808 4.186 -4.275 1.00 0.00 N ATOM 325 CA ASP A 22 -9.111 5.609 -4.383 1.00 0.00 C ATOM 326 C ASP A 22 -10.615 5.852 -4.303 1.00 0.00 C ATOM 327 O ASP A 22 -11.288 5.991 -5.324 1.00 0.00 O ATOM 328 CB ASP A 22 -8.561 6.170 -5.695 1.00 0.00 C ATOM 329 CG ASP A 22 -8.472 7.684 -5.685 1.00 0.00 C ATOM 330 OD1 ASP A 22 -8.221 8.271 -6.759 1.00 0.00 O ATOM 331 OD2 ASP A 22 -8.654 8.281 -4.603 1.00 0.00 O ATOM 0 H ASP A 22 -8.491 3.755 -5.143 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.633 6.122 -3.548 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -7.571 5.752 -5.879 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.200 5.852 -6.519 1.00 0.00 H new ATOM 336 N THR A 23 -11.136 5.902 -3.081 1.00 0.00 N ATOM 337 CA THR A 23 -12.561 6.125 -2.866 1.00 0.00 C ATOM 338 C THR A 23 -12.941 7.570 -3.168 1.00 0.00 C ATOM 339 O THR A 23 -13.865 7.829 -3.941 1.00 0.00 O ATOM 340 CB THR A 23 -12.971 5.790 -1.419 1.00 0.00 C ATOM 341 OG1 THR A 23 -11.923 6.159 -0.516 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.275 4.307 -1.273 1.00 0.00 C ATOM 0 H THR A 23 -10.593 5.791 -2.225 1.00 0.00 H new ATOM 0 HA THR A 23 -13.092 5.461 -3.548 1.00 0.00 H new ATOM 0 HB THR A 23 -13.872 6.354 -1.179 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.191 5.945 0.402 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.562 4.094 -0.243 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.092 4.036 -1.941 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.389 3.727 -1.530 1.00 0.00 H new ATOM 350 N ASP A 24 -12.226 8.506 -2.557 1.00 0.00 N ATOM 351 CA ASP A 24 -12.488 9.926 -2.762 1.00 0.00 C ATOM 352 C ASP A 24 -12.093 10.352 -4.173 1.00 0.00 C ATOM 353 O ASP A 24 -12.422 11.453 -4.614 1.00 0.00 O ATOM 354 CB ASP A 24 -11.727 10.762 -1.732 1.00 0.00 C ATOM 355 CG ASP A 24 -10.250 10.427 -1.692 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.631 10.342 -2.773 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.711 10.252 -0.579 1.00 0.00 O ATOM 0 H ASP A 24 -11.459 8.308 -1.914 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.557 10.095 -2.636 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -11.850 11.820 -1.964 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.160 10.600 -0.745 1.00 0.00 H new ATOM 362 N GLY A 25 -11.384 9.474 -4.875 1.00 0.00 N ATOM 363 CA GLY A 25 -10.954 9.779 -6.227 1.00 0.00 C ATOM 364 C GLY A 25 -10.055 10.997 -6.289 1.00 0.00 C ATOM 365 O GLY A 25 -10.343 11.953 -7.008 1.00 0.00 O ATOM 0 H GLY A 25 -11.100 8.557 -4.532 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.425 8.920 -6.639 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.830 9.945 -6.855 1.00 0.00 H new ATOM 369 N ASN A 26 -8.963 10.963 -5.532 1.00 0.00 N ATOM 370 CA ASN A 26 -8.019 12.074 -5.502 1.00 0.00 C ATOM 371 C ASN A 26 -6.698 11.684 -6.158 1.00 0.00 C ATOM 372 O ASN A 26 -5.869 12.540 -6.467 1.00 0.00 O ATOM 373 CB ASN A 26 -7.773 12.523 -4.060 1.00 0.00 C ATOM 374 CG ASN A 26 -7.114 11.443 -3.224 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.958 10.306 -3.669 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.727 11.794 -2.003 1.00 0.00 N ATOM 0 H ASN A 26 -8.710 10.178 -4.931 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.452 12.901 -6.064 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.143 13.413 -4.062 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.722 12.805 -3.603 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.280 11.109 -1.393 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.876 12.748 -1.675 1.00 0.00 H new ATOM 383 N GLY A 27 -6.509 10.385 -6.368 1.00 0.00 N ATOM 384 CA GLY A 27 -5.288 9.903 -6.986 1.00 0.00 C ATOM 385 C GLY A 27 -4.137 9.814 -6.004 1.00 0.00 C ATOM 386 O GLY A 27 -2.973 9.754 -6.403 1.00 0.00 O ATOM 0 H GLY A 27 -7.180 9.658 -6.121 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.468 8.920 -7.420 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.012 10.567 -7.805 1.00 0.00 H new ATOM 390 N TYR A 28 -4.460 9.805 -4.715 1.00 0.00 N ATOM 391 CA TYR A 28 -3.444 9.727 -3.672 1.00 0.00 C ATOM 392 C TYR A 28 -3.689 8.527 -2.762 1.00 0.00 C ATOM 393 O TYR A 28 -4.832 8.127 -2.538 1.00 0.00 O ATOM 394 CB TYR A 28 -3.432 11.014 -2.845 1.00 0.00 C ATOM 395 CG TYR A 28 -2.570 12.105 -3.436 1.00 0.00 C ATOM 396 CD1 TYR A 28 -3.138 13.264 -3.952 1.00 0.00 C ATOM 397 CD2 TYR A 28 -1.187 11.978 -3.480 1.00 0.00 C ATOM 398 CE1 TYR A 28 -2.354 14.264 -4.494 1.00 0.00 C ATOM 399 CE2 TYR A 28 -0.395 12.974 -4.019 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.982 14.115 -4.525 1.00 0.00 C ATOM 401 OH TYR A 28 -0.197 15.108 -5.064 1.00 0.00 O ATOM 0 H TYR A 28 -5.418 9.851 -4.368 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.474 9.603 -4.154 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.453 11.382 -2.747 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.077 10.787 -1.840 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.211 13.385 -3.929 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -0.723 11.086 -3.086 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.812 15.158 -4.891 1.00 0.00 H new ATOM 0 HE2 TYR A 28 0.679 12.859 -4.044 1.00 0.00 H new ATOM 0 HH TYR A 28 0.746 14.847 -5.007 1.00 0.00 H new ATOM 411 N ILE A 29 -2.607 7.958 -2.242 1.00 0.00 N ATOM 412 CA ILE A 29 -2.704 6.804 -1.356 1.00 0.00 C ATOM 413 C ILE A 29 -1.870 7.009 -0.095 1.00 0.00 C ATOM 414 O ILE A 29 -0.655 7.193 -0.165 1.00 0.00 O ATOM 415 CB ILE A 29 -2.241 5.514 -2.059 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.188 5.169 -3.210 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.169 4.366 -1.064 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.790 3.919 -3.965 1.00 0.00 C ATOM 0 H ILE A 29 -1.654 8.276 -2.418 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.754 6.702 -1.083 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.244 5.677 -2.468 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.196 5.040 -2.815 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.223 6.008 -3.905 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -1.840 3.461 -1.575 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.461 4.614 -0.273 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.154 4.199 -0.629 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.505 3.735 -4.767 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.795 4.052 -4.390 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.783 3.069 -3.283 1.00 0.00 H new ATOM 430 N SER A 30 -2.532 6.975 1.057 1.00 0.00 N ATOM 431 CA SER A 30 -1.851 7.158 2.335 1.00 0.00 C ATOM 432 C SER A 30 -1.630 5.819 3.030 1.00 0.00 C ATOM 433 O SER A 30 -1.866 4.758 2.450 1.00 0.00 O ATOM 434 CB SER A 30 -2.664 8.087 3.238 1.00 0.00 C ATOM 435 OG SER A 30 -3.058 9.259 2.546 1.00 0.00 O ATOM 0 H SER A 30 -3.538 6.823 1.133 1.00 0.00 H new ATOM 0 HA SER A 30 -0.878 7.610 2.140 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.547 7.563 3.603 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.072 8.359 4.112 1.00 0.00 H new ATOM 0 HG SER A 30 -2.389 9.476 1.863 1.00 0.00 H new ATOM 441 N PHE A 31 -1.175 5.874 4.277 1.00 0.00 N ATOM 442 CA PHE A 31 -0.921 4.666 5.052 1.00 0.00 C ATOM 443 C PHE A 31 -2.229 3.996 5.462 1.00 0.00 C ATOM 444 O PHE A 31 -2.270 2.794 5.717 1.00 0.00 O ATOM 445 CB PHE A 31 -0.094 4.998 6.296 1.00 0.00 C ATOM 446 CG PHE A 31 -0.145 3.932 7.353 1.00 0.00 C ATOM 447 CD1 PHE A 31 -1.123 3.956 8.334 1.00 0.00 C ATOM 448 CD2 PHE A 31 0.785 2.905 7.365 1.00 0.00 C ATOM 449 CE1 PHE A 31 -1.173 2.975 9.307 1.00 0.00 C ATOM 450 CE2 PHE A 31 0.739 1.922 8.335 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.240 1.958 9.308 1.00 0.00 C ATOM 0 H PHE A 31 -0.975 6.743 4.773 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.360 3.973 4.424 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.943 5.156 6.001 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.452 5.936 6.720 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.855 4.750 8.339 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.554 2.872 6.608 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.941 3.005 10.065 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.469 1.126 8.332 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.276 1.192 10.068 1.00 0.00 H new ATOM 461 N ASN A 32 -3.298 4.786 5.524 1.00 0.00 N ATOM 462 CA ASN A 32 -4.608 4.270 5.903 1.00 0.00 C ATOM 463 C ASN A 32 -5.159 3.340 4.827 1.00 0.00 C ATOM 464 O ASN A 32 -5.603 2.230 5.121 1.00 0.00 O ATOM 465 CB ASN A 32 -5.583 5.425 6.143 1.00 0.00 C ATOM 466 CG ASN A 32 -6.838 4.980 6.867 1.00 0.00 C ATOM 467 OD1 ASN A 32 -7.431 3.954 6.533 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.251 5.753 7.865 1.00 0.00 N ATOM 0 H ASN A 32 -3.282 5.785 5.317 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.494 3.701 6.826 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.086 6.201 6.726 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.857 5.870 5.187 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.090 5.505 8.389 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -6.729 6.595 8.108 1.00 0.00 H new ATOM 475 N GLU A 33 -5.125 3.799 3.581 1.00 0.00 N ATOM 476 CA GLU A 33 -5.621 3.007 2.461 1.00 0.00 C ATOM 477 C GLU A 33 -4.835 1.707 2.323 1.00 0.00 C ATOM 478 O GLU A 33 -5.412 0.619 2.295 1.00 0.00 O ATOM 479 CB GLU A 33 -5.533 3.809 1.160 1.00 0.00 C ATOM 480 CG GLU A 33 -6.041 5.235 1.290 1.00 0.00 C ATOM 481 CD GLU A 33 -7.096 5.574 0.254 1.00 0.00 C ATOM 482 OE1 GLU A 33 -8.145 6.132 0.637 1.00 0.00 O ATOM 483 OE2 GLU A 33 -6.873 5.281 -0.939 1.00 0.00 O ATOM 0 H GLU A 33 -4.759 4.715 3.321 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.665 2.762 2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.496 3.831 0.826 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.106 3.297 0.387 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.456 5.379 2.287 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.204 5.926 1.190 1.00 0.00 H new ATOM 490 N LEU A 34 -3.515 1.827 2.239 1.00 0.00 N ATOM 491 CA LEU A 34 -2.647 0.662 2.104 1.00 0.00 C ATOM 492 C LEU A 34 -2.854 -0.309 3.263 1.00 0.00 C ATOM 493 O LEU A 34 -3.078 -1.500 3.055 1.00 0.00 O ATOM 494 CB LEU A 34 -1.182 1.096 2.043 1.00 0.00 C ATOM 495 CG LEU A 34 -0.440 0.773 0.746 1.00 0.00 C ATOM 496 CD1 LEU A 34 -1.233 1.255 -0.458 1.00 0.00 C ATOM 497 CD2 LEU A 34 0.949 1.396 0.757 1.00 0.00 C ATOM 0 H LEU A 34 -3.022 2.720 2.262 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.907 0.152 1.176 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.136 2.173 2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.650 0.625 2.870 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.331 -0.309 0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.689 1.016 -1.372 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.205 0.761 -0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.375 2.334 -0.392 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.463 1.156 -0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.862 2.478 0.855 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.518 1.001 1.598 1.00 0.00 H new ATOM 509 N ASN A 35 -2.779 0.212 4.483 1.00 0.00 N ATOM 510 CA ASN A 35 -2.960 -0.608 5.676 1.00 0.00 C ATOM 511 C ASN A 35 -4.330 -1.278 5.673 1.00 0.00 C ATOM 512 O ASN A 35 -4.437 -2.496 5.812 1.00 0.00 O ATOM 513 CB ASN A 35 -2.799 0.246 6.936 1.00 0.00 C ATOM 514 CG ASN A 35 -2.713 -0.594 8.196 1.00 0.00 C ATOM 515 OD1 ASN A 35 -1.642 -0.738 8.787 1.00 0.00 O ATOM 516 ND2 ASN A 35 -3.843 -1.151 8.614 1.00 0.00 N ATOM 0 H ASN A 35 -2.594 1.197 4.672 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.196 -1.385 5.672 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.900 0.855 6.846 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.642 0.932 7.017 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.847 -1.726 9.457 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.707 -1.004 8.092 1.00 0.00 H new ATOM 523 N ASP A 36 -5.375 -0.473 5.513 1.00 0.00 N ATOM 524 CA ASP A 36 -6.740 -0.988 5.490 1.00 0.00 C ATOM 525 C ASP A 36 -6.909 -2.030 4.388 1.00 0.00 C ATOM 526 O ASP A 36 -7.718 -2.951 4.509 1.00 0.00 O ATOM 527 CB ASP A 36 -7.735 0.155 5.286 1.00 0.00 C ATOM 528 CG ASP A 36 -9.136 -0.210 5.737 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.699 0.524 6.578 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.670 -1.228 5.250 1.00 0.00 O ATOM 0 H ASP A 36 -5.303 0.538 5.397 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.939 -1.465 6.450 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.395 1.031 5.838 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.756 0.431 4.232 1.00 0.00 H new ATOM 535 N LEU A 37 -6.142 -1.877 3.314 1.00 0.00 N ATOM 536 CA LEU A 37 -6.208 -2.805 2.190 1.00 0.00 C ATOM 537 C LEU A 37 -5.594 -4.151 2.558 1.00 0.00 C ATOM 538 O LEU A 37 -6.276 -5.177 2.558 1.00 0.00 O ATOM 539 CB LEU A 37 -5.485 -2.216 0.977 1.00 0.00 C ATOM 540 CG LEU A 37 -5.116 -3.206 -0.129 1.00 0.00 C ATOM 541 CD1 LEU A 37 -6.301 -4.099 -0.465 1.00 0.00 C ATOM 542 CD2 LEU A 37 -4.636 -2.466 -1.369 1.00 0.00 C ATOM 0 H LEU A 37 -5.468 -1.120 3.198 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.257 -2.962 1.940 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.115 -1.438 0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.572 -1.731 1.323 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.303 -3.836 0.232 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.019 -4.796 -1.254 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.600 -4.657 0.423 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.135 -3.485 -0.805 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.378 -3.186 -2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.428 -1.811 -1.731 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.758 -1.870 -1.120 1.00 0.00 H new ATOM 554 N PHE A 38 -4.304 -4.141 2.875 1.00 0.00 N ATOM 555 CA PHE A 38 -3.597 -5.362 3.247 1.00 0.00 C ATOM 556 C PHE A 38 -4.195 -5.971 4.512 1.00 0.00 C ATOM 557 O PHE A 38 -4.025 -7.160 4.782 1.00 0.00 O ATOM 558 CB PHE A 38 -2.111 -5.072 3.459 1.00 0.00 C ATOM 559 CG PHE A 38 -1.487 -4.285 2.342 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.455 -3.397 2.595 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.935 -4.434 1.039 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.121 -2.670 1.569 1.00 0.00 C ATOM 563 CE2 PHE A 38 -1.363 -3.711 0.010 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.335 -2.828 0.274 1.00 0.00 C ATOM 0 H PHE A 38 -3.726 -3.301 2.882 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.706 -6.079 2.433 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.986 -4.524 4.393 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.577 -6.016 3.570 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.096 -3.271 3.606 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.739 -5.122 0.826 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.925 -1.980 1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.720 -3.837 -1.001 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.112 -2.262 -0.530 1.00 0.00 H new ATOM 574 N LYS A 39 -4.894 -5.148 5.284 1.00 0.00 N ATOM 575 CA LYS A 39 -5.518 -5.603 6.521 1.00 0.00 C ATOM 576 C LYS A 39 -6.881 -6.229 6.245 1.00 0.00 C ATOM 577 O LYS A 39 -7.229 -7.261 6.819 1.00 0.00 O ATOM 578 CB LYS A 39 -5.670 -4.436 7.500 1.00 0.00 C ATOM 579 CG LYS A 39 -6.127 -4.859 8.885 1.00 0.00 C ATOM 580 CD LYS A 39 -4.953 -5.012 9.838 1.00 0.00 C ATOM 581 CE LYS A 39 -5.126 -4.149 11.078 1.00 0.00 C ATOM 582 NZ LYS A 39 -3.816 -3.753 11.664 1.00 0.00 N ATOM 0 H LYS A 39 -5.043 -4.161 5.075 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.873 -6.361 6.966 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.715 -3.917 7.584 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.386 -3.722 7.093 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.824 -4.120 9.281 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.668 -5.803 8.818 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.855 -6.057 10.132 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.030 -4.736 9.327 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.695 -3.255 10.822 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.707 -4.694 11.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.976 -3.166 12.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.284 -4.605 11.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.272 -3.211 10.963 1.00 0.00 H new ATOM 596 N ALA A 40 -7.648 -5.599 5.362 1.00 0.00 N ATOM 597 CA ALA A 40 -8.971 -6.097 5.006 1.00 0.00 C ATOM 598 C ALA A 40 -8.873 -7.331 4.115 1.00 0.00 C ATOM 599 O ALA A 40 -9.784 -8.156 4.080 1.00 0.00 O ATOM 600 CB ALA A 40 -9.778 -5.008 4.316 1.00 0.00 C ATOM 0 H ALA A 40 -7.376 -4.742 4.880 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.482 -6.385 5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.763 -5.395 4.056 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.888 -4.156 4.987 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.262 -4.692 3.410 1.00 0.00 H new ATOM 606 N ALA A 41 -7.761 -7.449 3.397 1.00 0.00 N ATOM 607 CA ALA A 41 -7.544 -8.582 2.507 1.00 0.00 C ATOM 608 C ALA A 41 -7.646 -9.902 3.264 1.00 0.00 C ATOM 609 O ALA A 41 -7.918 -10.948 2.672 1.00 0.00 O ATOM 610 CB ALA A 41 -6.188 -8.466 1.826 1.00 0.00 C ATOM 0 H ALA A 41 -6.997 -6.774 3.415 1.00 0.00 H new ATOM 0 HA ALA A 41 -8.324 -8.569 1.745 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.039 -9.319 1.164 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -6.150 -7.545 1.245 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.402 -8.451 2.581 1.00 0.00 H new ATOM 616 N CYS A 42 -7.426 -9.847 4.572 1.00 0.00 N ATOM 617 CA CYS A 42 -7.492 -11.040 5.410 1.00 0.00 C ATOM 618 C CYS A 42 -6.495 -12.092 4.937 1.00 0.00 C ATOM 619 O CYS A 42 -6.852 -13.018 4.209 1.00 0.00 O ATOM 620 CB CYS A 42 -8.907 -11.619 5.398 1.00 0.00 C ATOM 621 SG CYS A 42 -10.150 -10.550 6.161 1.00 0.00 S ATOM 0 H CYS A 42 -7.200 -8.990 5.076 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.233 -10.753 6.429 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.198 -11.817 4.366 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.900 -12.577 5.917 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.230 -9.435 5.497 1.00 0.00 H new ATOM 627 N LEU A 43 -5.242 -11.942 5.355 1.00 0.00 N ATOM 628 CA LEU A 43 -4.192 -12.879 4.973 1.00 0.00 C ATOM 629 C LEU A 43 -3.728 -13.696 6.174 1.00 0.00 C ATOM 630 O LEU A 43 -3.926 -13.317 7.329 1.00 0.00 O ATOM 631 CB LEU A 43 -3.006 -12.127 4.366 1.00 0.00 C ATOM 632 CG LEU A 43 -2.887 -12.178 2.843 1.00 0.00 C ATOM 633 CD1 LEU A 43 -4.077 -11.491 2.191 1.00 0.00 C ATOM 634 CD2 LEU A 43 -1.584 -11.536 2.388 1.00 0.00 C ATOM 0 H LEU A 43 -4.929 -11.181 5.958 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.602 -13.561 4.228 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.070 -11.082 4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.088 -12.529 4.796 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.882 -13.223 2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.975 -11.537 1.107 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.996 -11.994 2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.114 -10.449 2.508 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.516 -11.581 1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.559 -10.495 2.710 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.742 -12.071 2.827 1.00 0.00 H new ATOM 646 N PRO A 44 -3.095 -14.846 5.899 1.00 0.00 N ATOM 647 CA PRO A 44 -2.588 -15.741 6.945 1.00 0.00 C ATOM 648 C PRO A 44 -1.395 -15.148 7.687 1.00 0.00 C ATOM 649 O PRO A 44 -0.941 -15.697 8.691 1.00 0.00 O ATOM 650 CB PRO A 44 -2.167 -16.992 6.167 1.00 0.00 C ATOM 651 CG PRO A 44 -1.875 -16.502 4.792 1.00 0.00 C ATOM 652 CD PRO A 44 -2.825 -15.363 4.547 1.00 0.00 C ATOM 0 HA PRO A 44 -3.335 -15.932 7.716 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.291 -17.460 6.615 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.960 -17.740 6.161 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.840 -16.172 4.707 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.018 -17.294 4.057 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.381 -14.601 3.907 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.738 -15.700 4.056 1.00 0.00 H new ATOM 660 N LEU A 45 -0.892 -14.025 7.185 1.00 0.00 N ATOM 661 CA LEU A 45 0.249 -13.357 7.802 1.00 0.00 C ATOM 662 C LEU A 45 -0.159 -12.673 9.103 1.00 0.00 C ATOM 663 O LEU A 45 -1.316 -12.303 9.303 1.00 0.00 O ATOM 664 CB LEU A 45 0.845 -12.330 6.838 1.00 0.00 C ATOM 665 CG LEU A 45 1.977 -12.831 5.940 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.500 -13.982 5.070 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.517 -11.697 5.081 1.00 0.00 C ATOM 0 H LEU A 45 -1.256 -13.559 6.354 1.00 0.00 H new ATOM 0 HA LEU A 45 1.001 -14.112 8.030 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.045 -11.951 6.203 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.216 -11.487 7.421 1.00 0.00 H new ATOM 0 HG LEU A 45 2.785 -13.195 6.575 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.320 -14.325 4.438 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.163 -14.802 5.704 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.674 -13.646 4.443 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.322 -12.071 4.448 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.717 -11.302 4.455 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.900 -10.904 5.724 1.00 0.00 H new ATOM 679 N PRO A 46 0.815 -12.497 10.010 1.00 0.00 N ATOM 680 CA PRO A 46 0.582 -11.854 11.306 1.00 0.00 C ATOM 681 C PRO A 46 0.304 -10.361 11.171 1.00 0.00 C ATOM 682 O PRO A 46 0.072 -9.860 10.072 1.00 0.00 O ATOM 683 CB PRO A 46 1.895 -12.087 12.058 1.00 0.00 C ATOM 684 CG PRO A 46 2.920 -12.248 10.990 1.00 0.00 C ATOM 685 CD PRO A 46 2.217 -12.912 9.838 1.00 0.00 C ATOM 0 HA PRO A 46 -0.294 -12.261 11.812 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.132 -11.247 12.711 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.838 -12.974 12.689 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.329 -11.282 10.693 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.756 -12.855 11.339 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.619 -12.584 8.879 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.323 -13.996 9.874 1.00 0.00 H new ATOM 693 N GLY A 47 0.330 -9.654 12.297 1.00 0.00 N ATOM 694 CA GLY A 47 0.079 -8.225 12.281 1.00 0.00 C ATOM 695 C GLY A 47 1.303 -7.425 11.882 1.00 0.00 C ATOM 696 O GLY A 47 1.222 -6.532 11.039 1.00 0.00 O ATOM 0 H GLY A 47 0.520 -10.045 13.219 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.734 -8.010 11.587 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.253 -7.907 13.269 1.00 0.00 H new ATOM 700 N TYR A 48 2.440 -7.745 12.489 1.00 0.00 N ATOM 701 CA TYR A 48 3.687 -7.048 12.196 1.00 0.00 C ATOM 702 C TYR A 48 4.041 -7.166 10.716 1.00 0.00 C ATOM 703 O TYR A 48 4.656 -6.269 10.139 1.00 0.00 O ATOM 704 CB TYR A 48 4.824 -7.609 13.050 1.00 0.00 C ATOM 705 CG TYR A 48 5.506 -8.811 12.437 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.596 -8.658 11.588 1.00 0.00 C ATOM 707 CD2 TYR A 48 5.060 -10.099 12.704 1.00 0.00 C ATOM 708 CE1 TYR A 48 7.222 -9.753 11.025 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.680 -11.200 12.146 1.00 0.00 C ATOM 710 CZ TYR A 48 6.761 -11.022 11.308 1.00 0.00 C ATOM 711 OH TYR A 48 7.381 -12.116 10.749 1.00 0.00 O ATOM 0 H TYR A 48 2.524 -8.483 13.188 1.00 0.00 H new ATOM 0 HA TYR A 48 3.549 -5.994 12.436 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.564 -6.826 13.214 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.430 -7.885 14.028 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.960 -7.666 11.365 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.214 -10.242 13.359 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.067 -9.616 10.367 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.320 -12.195 12.365 1.00 0.00 H new ATOM 0 HH TYR A 48 6.935 -12.935 11.051 1.00 0.00 H new ATOM 721 N ARG A 49 3.647 -8.280 10.107 1.00 0.00 N ATOM 722 CA ARG A 49 3.923 -8.517 8.695 1.00 0.00 C ATOM 723 C ARG A 49 3.252 -7.460 7.824 1.00 0.00 C ATOM 724 O ARG A 49 3.921 -6.700 7.125 1.00 0.00 O ATOM 725 CB ARG A 49 3.441 -9.911 8.287 1.00 0.00 C ATOM 726 CG ARG A 49 4.567 -10.912 8.096 1.00 0.00 C ATOM 727 CD ARG A 49 5.524 -10.472 6.999 1.00 0.00 C ATOM 728 NE ARG A 49 5.851 -11.564 6.085 1.00 0.00 N ATOM 729 CZ ARG A 49 6.703 -11.446 5.074 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.314 -10.291 4.848 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.949 -12.485 4.286 1.00 0.00 N ATOM 0 H ARG A 49 3.136 -9.032 10.569 1.00 0.00 H new ATOM 0 HA ARG A 49 5.001 -8.454 8.546 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.757 -10.287 9.048 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.874 -9.833 7.359 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.114 -11.029 9.032 1.00 0.00 H new ATOM 0 HG3 ARG A 49 4.150 -11.887 7.846 1.00 0.00 H new ATOM 0 HD2 ARG A 49 5.078 -9.651 6.437 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.440 -10.090 7.449 1.00 0.00 H new ATOM 0 HE ARG A 49 5.400 -12.467 6.232 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.130 -9.490 5.452 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.968 -10.204 4.070 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.483 -13.376 4.457 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.604 -12.392 3.510 1.00 0.00 H new ATOM 745 N VAL A 50 1.923 -7.415 7.873 1.00 0.00 N ATOM 746 CA VAL A 50 1.162 -6.451 7.090 1.00 0.00 C ATOM 747 C VAL A 50 1.587 -5.023 7.412 1.00 0.00 C ATOM 748 O VAL A 50 1.676 -4.175 6.523 1.00 0.00 O ATOM 749 CB VAL A 50 -0.351 -6.593 7.342 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.652 -6.534 8.833 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.120 -5.517 6.591 1.00 0.00 C ATOM 0 H VAL A 50 1.353 -8.036 8.447 1.00 0.00 H new ATOM 0 HA VAL A 50 1.370 -6.661 6.041 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.674 -7.565 6.969 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.726 -6.636 8.992 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.131 -7.345 9.342 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.315 -5.578 9.235 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.187 -5.633 6.781 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.796 -4.534 6.931 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.929 -5.612 5.522 1.00 0.00 H new ATOM 761 N ARG A 51 1.849 -4.763 8.689 1.00 0.00 N ATOM 762 CA ARG A 51 2.266 -3.436 9.129 1.00 0.00 C ATOM 763 C ARG A 51 3.664 -3.107 8.614 1.00 0.00 C ATOM 764 O ARG A 51 3.999 -1.942 8.405 1.00 0.00 O ATOM 765 CB ARG A 51 2.239 -3.350 10.655 1.00 0.00 C ATOM 766 CG ARG A 51 2.003 -1.945 11.183 1.00 0.00 C ATOM 767 CD ARG A 51 0.522 -1.667 11.388 1.00 0.00 C ATOM 768 NE ARG A 51 0.067 -2.080 12.713 1.00 0.00 N ATOM 769 CZ ARG A 51 0.376 -1.432 13.831 1.00 0.00 C ATOM 770 NH1 ARG A 51 1.137 -0.347 13.784 1.00 0.00 N ATOM 771 NH2 ARG A 51 -0.077 -1.869 15.000 1.00 0.00 N ATOM 0 H ARG A 51 1.780 -5.453 9.437 1.00 0.00 H new ATOM 0 HA ARG A 51 1.566 -2.708 8.719 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.456 -4.007 11.033 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.185 -3.722 11.048 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.532 -1.817 12.127 1.00 0.00 H new ATOM 0 HG3 ARG A 51 2.417 -1.218 10.484 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.331 -0.602 11.254 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.054 -2.192 10.626 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.520 -2.911 12.784 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.487 -0.008 12.888 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.373 0.148 14.644 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.663 -2.703 15.040 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.161 -1.371 15.858 1.00 0.00 H new ATOM 785 N GLU A 52 4.474 -4.141 8.415 1.00 0.00 N ATOM 786 CA GLU A 52 5.836 -3.960 7.926 1.00 0.00 C ATOM 787 C GLU A 52 5.841 -3.637 6.435 1.00 0.00 C ATOM 788 O GLU A 52 6.512 -2.703 5.994 1.00 0.00 O ATOM 789 CB GLU A 52 6.667 -5.218 8.189 1.00 0.00 C ATOM 790 CG GLU A 52 8.134 -5.065 7.822 1.00 0.00 C ATOM 791 CD GLU A 52 8.541 -5.953 6.662 1.00 0.00 C ATOM 792 OE1 GLU A 52 8.444 -5.496 5.504 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.954 -7.104 6.912 1.00 0.00 O ATOM 0 H GLU A 52 4.212 -5.112 8.584 1.00 0.00 H new ATOM 0 HA GLU A 52 6.279 -3.121 8.463 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.590 -5.480 9.244 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.244 -6.048 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.334 -4.025 7.566 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.749 -5.303 8.690 1.00 0.00 H new ATOM 800 N ILE A 53 5.089 -4.414 5.664 1.00 0.00 N ATOM 801 CA ILE A 53 5.005 -4.210 4.223 1.00 0.00 C ATOM 802 C ILE A 53 4.382 -2.858 3.895 1.00 0.00 C ATOM 803 O ILE A 53 4.814 -2.171 2.968 1.00 0.00 O ATOM 804 CB ILE A 53 4.183 -5.320 3.544 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.795 -5.418 4.179 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.910 -6.653 3.641 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.928 -6.501 3.575 1.00 0.00 C ATOM 0 H ILE A 53 4.528 -5.191 6.013 1.00 0.00 H new ATOM 0 HA ILE A 53 6.025 -4.240 3.840 1.00 0.00 H new ATOM 0 HB ILE A 53 4.063 -5.069 2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.906 -5.606 5.247 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.288 -4.458 4.075 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.316 -7.428 3.156 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.878 -6.576 3.147 1.00 0.00 H new ATOM 0 HG23 ILE A 53 5.057 -6.912 4.690 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.959 -6.512 4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.786 -6.303 2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.413 -7.469 3.703 1.00 0.00 H new ATOM 819 N THR A 54 3.364 -2.479 4.661 1.00 0.00 N ATOM 820 CA THR A 54 2.681 -1.209 4.453 1.00 0.00 C ATOM 821 C THR A 54 3.548 -0.038 4.902 1.00 0.00 C ATOM 822 O THR A 54 3.557 1.017 4.269 1.00 0.00 O ATOM 823 CB THR A 54 1.340 -1.161 5.210 1.00 0.00 C ATOM 824 OG1 THR A 54 0.604 0.007 4.828 1.00 0.00 O ATOM 825 CG2 THR A 54 1.569 -1.154 6.714 1.00 0.00 C ATOM 0 H THR A 54 2.994 -3.035 5.432 1.00 0.00 H new ATOM 0 HA THR A 54 2.489 -1.126 3.383 1.00 0.00 H new ATOM 0 HB THR A 54 0.768 -2.051 4.950 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.248 0.030 5.312 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.608 -1.120 7.228 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.104 -2.058 7.005 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.159 -0.279 6.988 1.00 0.00 H new ATOM 833 N GLU A 55 4.275 -0.233 5.998 1.00 0.00 N ATOM 834 CA GLU A 55 5.146 0.808 6.530 1.00 0.00 C ATOM 835 C GLU A 55 6.315 1.075 5.588 1.00 0.00 C ATOM 836 O GLU A 55 6.602 2.221 5.246 1.00 0.00 O ATOM 837 CB GLU A 55 5.670 0.408 7.911 1.00 0.00 C ATOM 838 CG GLU A 55 4.736 0.784 9.049 1.00 0.00 C ATOM 839 CD GLU A 55 5.282 0.387 10.407 1.00 0.00 C ATOM 840 OE1 GLU A 55 4.964 1.076 11.398 1.00 0.00 O ATOM 841 OE2 GLU A 55 6.027 -0.612 10.479 1.00 0.00 O ATOM 0 H GLU A 55 4.278 -1.101 6.534 1.00 0.00 H new ATOM 0 HA GLU A 55 4.561 1.723 6.622 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.836 -0.669 7.929 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.638 0.882 8.075 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.563 1.860 9.032 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.770 0.303 8.895 1.00 0.00 H new ATOM 848 N ASN A 56 6.987 0.007 5.171 1.00 0.00 N ATOM 849 CA ASN A 56 8.127 0.125 4.269 1.00 0.00 C ATOM 850 C ASN A 56 7.687 0.637 2.901 1.00 0.00 C ATOM 851 O ASN A 56 8.344 1.491 2.303 1.00 0.00 O ATOM 852 CB ASN A 56 8.827 -1.227 4.118 1.00 0.00 C ATOM 853 CG ASN A 56 9.515 -1.668 5.396 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.431 -0.995 6.423 1.00 0.00 O ATOM 855 ND2 ASN A 56 10.201 -2.803 5.337 1.00 0.00 N ATOM 0 H ASN A 56 6.762 -0.950 5.443 1.00 0.00 H new ATOM 0 HA ASN A 56 8.826 0.843 4.699 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.096 -1.980 3.823 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.562 -1.165 3.316 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.686 -3.150 6.165 1.00 0.00 H new ATOM 0 HD22 ASN A 56 10.243 -3.328 4.464 1.00 0.00 H new ATOM 862 N LEU A 57 6.571 0.111 2.410 1.00 0.00 N ATOM 863 CA LEU A 57 6.041 0.515 1.111 1.00 0.00 C ATOM 864 C LEU A 57 5.727 2.008 1.092 1.00 0.00 C ATOM 865 O LEU A 57 6.069 2.712 0.142 1.00 0.00 O ATOM 866 CB LEU A 57 4.781 -0.287 0.780 1.00 0.00 C ATOM 867 CG LEU A 57 4.166 -0.034 -0.597 1.00 0.00 C ATOM 868 CD1 LEU A 57 5.242 -0.045 -1.672 1.00 0.00 C ATOM 869 CD2 LEU A 57 3.094 -1.069 -0.900 1.00 0.00 C ATOM 0 H LEU A 57 6.015 -0.596 2.891 1.00 0.00 H new ATOM 0 HA LEU A 57 6.801 0.312 0.357 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.018 -1.348 0.860 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.028 -0.071 1.537 1.00 0.00 H new ATOM 0 HG LEU A 57 3.699 0.951 -0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.786 0.137 -2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.973 0.736 -1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.739 -1.015 -1.680 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.667 -0.874 -1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.536 -2.065 -0.888 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.309 -1.011 -0.146 1.00 0.00 H new ATOM 881 N MET A 58 5.076 2.484 2.148 1.00 0.00 N ATOM 882 CA MET A 58 4.720 3.894 2.253 1.00 0.00 C ATOM 883 C MET A 58 5.968 4.764 2.368 1.00 0.00 C ATOM 884 O MET A 58 6.054 5.827 1.756 1.00 0.00 O ATOM 885 CB MET A 58 3.812 4.123 3.463 1.00 0.00 C ATOM 886 CG MET A 58 2.395 3.607 3.266 1.00 0.00 C ATOM 887 SD MET A 58 1.507 4.494 1.973 1.00 0.00 S ATOM 888 CE MET A 58 1.549 6.165 2.617 1.00 0.00 C ATOM 0 H MET A 58 4.784 1.915 2.942 1.00 0.00 H new ATOM 0 HA MET A 58 4.185 4.176 1.346 1.00 0.00 H new ATOM 0 HB2 MET A 58 4.250 3.634 4.333 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.774 5.190 3.682 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.430 2.547 3.016 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.847 3.695 4.204 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.826 6.780 2.081 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.299 6.152 3.678 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.548 6.581 2.484 1.00 0.00 H new ATOM 898 N ALA A 59 6.934 4.303 3.157 1.00 0.00 N ATOM 899 CA ALA A 59 8.178 5.037 3.350 1.00 0.00 C ATOM 900 C ALA A 59 8.971 5.126 2.050 1.00 0.00 C ATOM 901 O ALA A 59 9.486 6.186 1.695 1.00 0.00 O ATOM 902 CB ALA A 59 9.015 4.383 4.438 1.00 0.00 C ATOM 0 H ALA A 59 6.878 3.425 3.672 1.00 0.00 H new ATOM 0 HA ALA A 59 7.927 6.051 3.662 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.941 4.943 4.571 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.456 4.379 5.374 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.249 3.358 4.151 1.00 0.00 H new ATOM 908 N THR A 60 9.066 4.004 1.344 1.00 0.00 N ATOM 909 CA THR A 60 9.797 3.954 0.084 1.00 0.00 C ATOM 910 C THR A 60 8.904 4.348 -1.087 1.00 0.00 C ATOM 911 O THR A 60 9.314 4.274 -2.244 1.00 0.00 O ATOM 912 CB THR A 60 10.374 2.549 -0.175 1.00 0.00 C ATOM 913 OG1 THR A 60 11.267 2.585 -1.295 1.00 0.00 O ATOM 914 CG2 THR A 60 9.260 1.547 -0.440 1.00 0.00 C ATOM 0 H THR A 60 8.646 3.118 1.623 1.00 0.00 H new ATOM 0 HA THR A 60 10.618 4.667 0.167 1.00 0.00 H new ATOM 0 HB THR A 60 10.920 2.235 0.715 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.906 3.183 -1.982 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.692 0.562 -0.620 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.599 1.501 0.425 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.690 1.859 -1.315 1.00 0.00 H new ATOM 922 N GLY A 61 7.682 4.768 -0.777 1.00 0.00 N ATOM 923 CA GLY A 61 6.749 5.169 -1.816 1.00 0.00 C ATOM 924 C GLY A 61 6.466 6.658 -1.798 1.00 0.00 C ATOM 925 O GLY A 61 5.828 7.186 -2.709 1.00 0.00 O ATOM 0 H GLY A 61 7.320 4.838 0.174 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.153 4.891 -2.790 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.814 4.623 -1.691 1.00 0.00 H new ATOM 929 N ASP A 62 6.940 7.335 -0.758 1.00 0.00 N ATOM 930 CA ASP A 62 6.733 8.773 -0.625 1.00 0.00 C ATOM 931 C ASP A 62 8.047 9.529 -0.799 1.00 0.00 C ATOM 932 O ASP A 62 9.013 9.292 -0.073 1.00 0.00 O ATOM 933 CB ASP A 62 6.121 9.097 0.738 1.00 0.00 C ATOM 934 CG ASP A 62 4.631 9.369 0.654 1.00 0.00 C ATOM 935 OD1 ASP A 62 4.254 10.511 0.319 1.00 0.00 O ATOM 936 OD2 ASP A 62 3.843 8.438 0.922 1.00 0.00 O ATOM 0 H ASP A 62 7.469 6.912 0.004 1.00 0.00 H new ATOM 0 HA ASP A 62 6.045 9.091 -1.408 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.298 8.265 1.419 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.623 9.967 1.161 1.00 0.00 H new ATOM 941 N LEU A 63 8.076 10.438 -1.767 1.00 0.00 N ATOM 942 CA LEU A 63 9.271 11.230 -2.038 1.00 0.00 C ATOM 943 C LEU A 63 9.305 12.482 -1.168 1.00 0.00 C ATOM 944 O LEU A 63 10.362 12.883 -0.682 1.00 0.00 O ATOM 945 CB LEU A 63 9.325 11.620 -3.516 1.00 0.00 C ATOM 946 CG LEU A 63 8.829 10.567 -4.507 1.00 0.00 C ATOM 947 CD1 LEU A 63 9.078 11.020 -5.937 1.00 0.00 C ATOM 948 CD2 LEU A 63 9.504 9.228 -4.244 1.00 0.00 C ATOM 0 H LEU A 63 7.286 10.645 -2.378 1.00 0.00 H new ATOM 0 HA LEU A 63 10.142 10.620 -1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.735 12.526 -3.654 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.356 11.870 -3.768 1.00 0.00 H new ATOM 0 HG LEU A 63 7.755 10.443 -4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.718 10.258 -6.628 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.548 11.955 -6.120 1.00 0.00 H new ATOM 0 HD13 LEU A 63 10.146 11.173 -6.089 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.139 8.490 -4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.583 9.337 -4.354 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.274 8.897 -3.231 1.00 0.00 H new ATOM 960 N ASP A 64 8.142 13.092 -0.973 1.00 0.00 N ATOM 961 CA ASP A 64 8.036 14.297 -0.158 1.00 0.00 C ATOM 962 C ASP A 64 7.753 13.944 1.299 1.00 0.00 C ATOM 963 O ASP A 64 7.826 14.801 2.179 1.00 0.00 O ATOM 964 CB ASP A 64 6.934 15.209 -0.699 1.00 0.00 C ATOM 965 CG ASP A 64 7.087 15.486 -2.181 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.821 16.433 -2.536 1.00 0.00 O ATOM 967 OD2 ASP A 64 6.472 14.756 -2.987 1.00 0.00 O ATOM 0 H ASP A 64 7.258 12.772 -1.368 1.00 0.00 H new ATOM 0 HA ASP A 64 8.989 14.824 -0.207 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.963 14.748 -0.517 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.946 16.152 -0.153 1.00 0.00 H new ATOM 972 N GLN A 65 7.430 12.678 1.544 1.00 0.00 N ATOM 973 CA GLN A 65 7.133 12.215 2.894 1.00 0.00 C ATOM 974 C GLN A 65 5.902 12.919 3.455 1.00 0.00 C ATOM 975 O GLN A 65 5.698 12.960 4.668 1.00 0.00 O ATOM 976 CB GLN A 65 8.334 12.452 3.812 1.00 0.00 C ATOM 977 CG GLN A 65 9.636 11.881 3.271 1.00 0.00 C ATOM 978 CD GLN A 65 9.717 10.374 3.417 1.00 0.00 C ATOM 979 OE1 GLN A 65 10.479 9.858 4.234 1.00 0.00 O ATOM 980 NE2 GLN A 65 8.930 9.660 2.621 1.00 0.00 N ATOM 0 H GLN A 65 7.367 11.956 0.826 1.00 0.00 H new ATOM 0 HA GLN A 65 6.925 11.146 2.846 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.455 13.524 3.969 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.129 12.008 4.786 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.735 12.146 2.218 1.00 0.00 H new ATOM 0 HG3 GLN A 65 10.475 12.339 3.795 1.00 0.00 H new ATOM 0 HE21 GLN A 65 8.314 10.130 1.958 1.00 0.00 H new ATOM 0 HE22 GLN A 65 8.942 8.641 2.672 1.00 0.00 H new ATOM 989 N ASP A 66 5.087 13.471 2.564 1.00 0.00 N ATOM 990 CA ASP A 66 3.874 14.174 2.970 1.00 0.00 C ATOM 991 C ASP A 66 2.851 13.202 3.547 1.00 0.00 C ATOM 992 O ASP A 66 1.966 13.595 4.306 1.00 0.00 O ATOM 993 CB ASP A 66 3.272 14.923 1.781 1.00 0.00 C ATOM 994 CG ASP A 66 2.456 14.017 0.880 1.00 0.00 C ATOM 995 OD1 ASP A 66 1.332 14.412 0.502 1.00 0.00 O ATOM 996 OD2 ASP A 66 2.940 12.915 0.551 1.00 0.00 O ATOM 0 H ASP A 66 5.243 13.446 1.556 1.00 0.00 H new ATOM 0 HA ASP A 66 4.141 14.893 3.744 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.640 15.732 2.147 1.00 0.00 H new ATOM 0 HB3 ASP A 66 4.073 15.382 1.201 1.00 0.00 H new ATOM 1001 N GLY A 67 2.977 11.930 3.180 1.00 0.00 N ATOM 1002 CA GLY A 67 2.055 10.922 3.670 1.00 0.00 C ATOM 1003 C GLY A 67 1.053 10.492 2.617 1.00 0.00 C ATOM 1004 O GLY A 67 0.021 9.902 2.937 1.00 0.00 O ATOM 0 H GLY A 67 3.701 11.580 2.552 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.618 10.052 4.008 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.522 11.312 4.537 1.00 0.00 H new ATOM 1008 N ARG A 68 1.356 10.790 1.358 1.00 0.00 N ATOM 1009 CA ARG A 68 0.472 10.432 0.254 1.00 0.00 C ATOM 1010 C ARG A 68 1.277 10.040 -0.981 1.00 0.00 C ATOM 1011 O ARG A 68 2.257 10.698 -1.331 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.458 11.600 -0.080 1.00 0.00 C ATOM 1013 CG ARG A 68 -1.098 12.237 1.142 1.00 0.00 C ATOM 1014 CD ARG A 68 -2.367 12.992 0.777 1.00 0.00 C ATOM 1015 NE ARG A 68 -3.555 12.150 0.886 1.00 0.00 N ATOM 1016 CZ ARG A 68 -4.174 11.896 2.034 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -3.718 12.417 3.165 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -5.249 11.121 2.052 1.00 0.00 N ATOM 0 H ARG A 68 2.206 11.278 1.077 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.127 9.575 0.563 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.106 12.359 -0.622 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.243 11.248 -0.749 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.331 11.465 1.876 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.389 12.920 1.611 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -2.475 13.857 1.431 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.283 13.371 -0.242 1.00 0.00 H new ATOM 0 HE ARG A 68 -3.930 11.734 0.034 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -2.891 13.014 3.155 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.194 12.221 4.045 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.602 10.719 1.184 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -5.723 10.927 2.934 1.00 0.00 H new ATOM 1032 N ILE A 69 0.857 8.963 -1.636 1.00 0.00 N ATOM 1033 CA ILE A 69 1.538 8.483 -2.832 1.00 0.00 C ATOM 1034 C ILE A 69 0.704 8.744 -4.082 1.00 0.00 C ATOM 1035 O ILE A 69 -0.490 8.444 -4.117 1.00 0.00 O ATOM 1036 CB ILE A 69 1.845 6.976 -2.739 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.491 6.647 -1.391 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.749 6.548 -3.885 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.853 5.187 -1.235 1.00 0.00 C ATOM 0 H ILE A 69 0.049 8.406 -1.359 1.00 0.00 H new ATOM 0 HA ILE A 69 2.476 9.033 -2.903 1.00 0.00 H new ATOM 0 HB ILE A 69 0.908 6.424 -2.816 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.391 7.251 -1.271 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.808 6.931 -0.591 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.957 5.481 -3.805 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.254 6.751 -4.834 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.685 7.104 -3.837 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.306 5.027 -0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.953 4.578 -1.322 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.561 4.902 -2.013 1.00 0.00 H new ATOM 1051 N SER A 70 1.342 9.303 -5.106 1.00 0.00 N ATOM 1052 CA SER A 70 0.658 9.607 -6.358 1.00 0.00 C ATOM 1053 C SER A 70 0.835 8.472 -7.362 1.00 0.00 C ATOM 1054 O SER A 70 1.678 7.593 -7.181 1.00 0.00 O ATOM 1055 CB SER A 70 1.188 10.914 -6.948 1.00 0.00 C ATOM 1056 OG SER A 70 0.387 11.344 -8.035 1.00 0.00 O ATOM 0 H SER A 70 2.330 9.554 -5.093 1.00 0.00 H new ATOM 0 HA SER A 70 -0.405 9.718 -6.146 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.205 11.684 -6.177 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.216 10.775 -7.282 1.00 0.00 H new ATOM 0 HG SER A 70 0.745 12.183 -8.394 1.00 0.00 H new ATOM 1062 N PHE A 71 0.034 8.498 -8.422 1.00 0.00 N ATOM 1063 CA PHE A 71 0.100 7.472 -9.457 1.00 0.00 C ATOM 1064 C PHE A 71 1.540 7.252 -9.911 1.00 0.00 C ATOM 1065 O PHE A 71 2.055 6.134 -9.860 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.771 7.866 -10.651 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.205 7.445 -10.512 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.912 6.973 -11.605 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.847 7.523 -9.287 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.233 6.586 -11.480 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.168 7.136 -9.155 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.862 6.668 -10.253 1.00 0.00 C ATOM 0 H PHE A 71 -0.669 9.219 -8.587 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.276 6.539 -9.036 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.729 8.948 -10.780 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.356 7.421 -11.555 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.425 6.906 -12.567 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.310 7.890 -8.425 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.773 6.220 -12.341 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.656 7.200 -8.194 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.894 6.367 -10.153 1.00 0.00 H new ATOM 1082 N ASP A 72 2.183 8.324 -10.359 1.00 0.00 N ATOM 1083 CA ASP A 72 3.563 8.249 -10.824 1.00 0.00 C ATOM 1084 C ASP A 72 4.473 7.685 -9.737 1.00 0.00 C ATOM 1085 O ASP A 72 5.348 6.865 -10.012 1.00 0.00 O ATOM 1086 CB ASP A 72 4.056 9.634 -11.250 1.00 0.00 C ATOM 1087 CG ASP A 72 5.199 9.561 -12.243 1.00 0.00 C ATOM 1088 OD1 ASP A 72 5.535 8.440 -12.681 1.00 0.00 O ATOM 1089 OD2 ASP A 72 5.757 10.625 -12.584 1.00 0.00 O ATOM 0 H ASP A 72 1.771 9.256 -10.410 1.00 0.00 H new ATOM 0 HA ASP A 72 3.595 7.579 -11.684 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.230 10.191 -11.692 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.379 10.189 -10.369 1.00 0.00 H new ATOM 1094 N GLU A 73 4.260 8.131 -8.503 1.00 0.00 N ATOM 1095 CA GLU A 73 5.062 7.670 -7.376 1.00 0.00 C ATOM 1096 C GLU A 73 5.018 6.149 -7.263 1.00 0.00 C ATOM 1097 O GLU A 73 6.038 5.475 -7.409 1.00 0.00 O ATOM 1098 CB GLU A 73 4.566 8.304 -6.075 1.00 0.00 C ATOM 1099 CG GLU A 73 5.310 9.573 -5.693 1.00 0.00 C ATOM 1100 CD GLU A 73 4.676 10.289 -4.517 1.00 0.00 C ATOM 1101 OE1 GLU A 73 4.038 11.340 -4.736 1.00 0.00 O ATOM 1102 OE2 GLU A 73 4.816 9.799 -3.377 1.00 0.00 O ATOM 0 H GLU A 73 3.540 8.810 -8.259 1.00 0.00 H new ATOM 0 HA GLU A 73 6.094 7.974 -7.549 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.504 8.531 -6.173 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.663 7.579 -5.267 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.343 9.325 -5.448 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.338 10.245 -6.551 1.00 0.00 H new ATOM 1109 N PHE A 74 3.830 5.615 -7.000 1.00 0.00 N ATOM 1110 CA PHE A 74 3.653 4.173 -6.866 1.00 0.00 C ATOM 1111 C PHE A 74 4.196 3.442 -8.089 1.00 0.00 C ATOM 1112 O PHE A 74 5.089 2.601 -7.976 1.00 0.00 O ATOM 1113 CB PHE A 74 2.173 3.836 -6.671 1.00 0.00 C ATOM 1114 CG PHE A 74 1.888 3.105 -5.391 1.00 0.00 C ATOM 1115 CD1 PHE A 74 2.685 2.043 -4.992 1.00 0.00 C ATOM 1116 CD2 PHE A 74 0.823 3.476 -4.588 1.00 0.00 C ATOM 1117 CE1 PHE A 74 2.426 1.368 -3.814 1.00 0.00 C ATOM 1118 CE2 PHE A 74 0.559 2.804 -3.409 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.361 1.748 -3.022 1.00 0.00 C ATOM 0 H PHE A 74 2.976 6.158 -6.875 1.00 0.00 H new ATOM 0 HA PHE A 74 4.212 3.843 -5.990 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.593 4.759 -6.690 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.833 3.229 -7.510 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.518 1.740 -5.609 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.191 4.300 -4.886 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.056 0.544 -3.513 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.274 3.105 -2.791 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.155 1.221 -2.102 1.00 0.00 H new ATOM 1129 N ILE A 75 3.651 3.767 -9.256 1.00 0.00 N ATOM 1130 CA ILE A 75 4.081 3.142 -10.501 1.00 0.00 C ATOM 1131 C ILE A 75 5.601 3.152 -10.624 1.00 0.00 C ATOM 1132 O ILE A 75 6.216 2.131 -10.930 1.00 0.00 O ATOM 1133 CB ILE A 75 3.473 3.850 -11.725 1.00 0.00 C ATOM 1134 CG1 ILE A 75 1.945 3.808 -11.660 1.00 0.00 C ATOM 1135 CG2 ILE A 75 3.971 3.206 -13.010 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.272 4.711 -12.670 1.00 0.00 C ATOM 0 H ILE A 75 2.910 4.460 -9.366 1.00 0.00 H new ATOM 0 HA ILE A 75 3.728 2.111 -10.476 1.00 0.00 H new ATOM 0 HB ILE A 75 3.789 4.893 -11.717 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.611 2.783 -11.821 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.624 4.094 -10.658 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.532 3.717 -13.867 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.057 3.283 -13.058 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.681 2.156 -13.027 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.190 4.630 -12.566 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.577 5.743 -12.496 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.563 4.412 -13.677 1.00 0.00 H new ATOM 1148 N LYS A 76 6.201 4.312 -10.383 1.00 0.00 N ATOM 1149 CA LYS A 76 7.650 4.456 -10.464 1.00 0.00 C ATOM 1150 C LYS A 76 8.347 3.479 -9.522 1.00 0.00 C ATOM 1151 O LYS A 76 9.386 2.912 -9.860 1.00 0.00 O ATOM 1152 CB LYS A 76 8.060 5.891 -10.123 1.00 0.00 C ATOM 1153 CG LYS A 76 7.937 6.852 -11.292 1.00 0.00 C ATOM 1154 CD LYS A 76 9.243 6.967 -12.060 1.00 0.00 C ATOM 1155 CE LYS A 76 9.060 7.735 -13.360 1.00 0.00 C ATOM 1156 NZ LYS A 76 8.412 9.057 -13.136 1.00 0.00 N ATOM 0 H LYS A 76 5.706 5.167 -10.130 1.00 0.00 H new ATOM 0 HA LYS A 76 7.957 4.230 -11.485 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.442 6.251 -9.301 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.091 5.891 -9.770 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.148 6.511 -11.963 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.641 7.835 -10.926 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.987 7.469 -11.441 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.628 5.970 -12.276 1.00 0.00 H new ATOM 0 HE2 LYS A 76 10.030 7.882 -13.835 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.454 7.145 -14.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.827 9.760 -13.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.391 8.979 -13.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.565 9.356 -12.152 1.00 0.00 H new ATOM 1170 N ILE A 77 7.768 3.288 -8.342 1.00 0.00 N ATOM 1171 CA ILE A 77 8.333 2.378 -7.353 1.00 0.00 C ATOM 1172 C ILE A 77 8.151 0.924 -7.777 1.00 0.00 C ATOM 1173 O ILE A 77 8.881 0.039 -7.328 1.00 0.00 O ATOM 1174 CB ILE A 77 7.691 2.581 -5.968 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.464 3.635 -5.174 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.646 1.265 -5.207 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.337 5.032 -5.741 1.00 0.00 C ATOM 0 H ILE A 77 6.908 3.751 -8.047 1.00 0.00 H new ATOM 0 HA ILE A 77 9.397 2.605 -7.287 1.00 0.00 H new ATOM 0 HB ILE A 77 6.669 2.934 -6.106 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.108 3.636 -4.144 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.518 3.357 -5.147 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.190 1.425 -4.230 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.057 0.540 -5.768 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.659 0.886 -5.076 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.910 5.727 -5.128 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.720 5.047 -6.761 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.289 5.330 -5.743 1.00 0.00 H new ATOM 1189 N PHE A 78 7.174 0.685 -8.645 1.00 0.00 N ATOM 1190 CA PHE A 78 6.896 -0.662 -9.132 1.00 0.00 C ATOM 1191 C PHE A 78 7.882 -1.059 -10.226 1.00 0.00 C ATOM 1192 O PHE A 78 8.394 -2.179 -10.241 1.00 0.00 O ATOM 1193 CB PHE A 78 5.464 -0.750 -9.662 1.00 0.00 C ATOM 1194 CG PHE A 78 4.503 -1.381 -8.694 1.00 0.00 C ATOM 1195 CD1 PHE A 78 4.457 -0.964 -7.374 1.00 0.00 C ATOM 1196 CD2 PHE A 78 3.648 -2.391 -9.106 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.575 -1.543 -6.481 1.00 0.00 C ATOM 1198 CE2 PHE A 78 2.764 -2.973 -8.217 1.00 0.00 C ATOM 1199 CZ PHE A 78 2.727 -2.549 -6.903 1.00 0.00 C ATOM 0 H PHE A 78 6.561 1.406 -9.026 1.00 0.00 H new ATOM 0 HA PHE A 78 7.010 -1.354 -8.298 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.114 0.253 -9.907 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.463 -1.324 -10.589 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.117 -0.178 -7.039 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.673 -2.727 -10.132 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.549 -1.209 -5.454 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.102 -3.759 -8.550 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.037 -3.003 -6.207 1.00 0.00 H new ATOM 1209 N HIS A 79 8.142 -0.133 -11.144 1.00 0.00 N ATOM 1210 CA HIS A 79 9.067 -0.386 -12.244 1.00 0.00 C ATOM 1211 C HIS A 79 10.371 0.380 -12.045 1.00 0.00 C ATOM 1212 O HIS A 79 11.157 0.540 -12.977 1.00 0.00 O ATOM 1213 CB HIS A 79 8.428 0.010 -13.576 1.00 0.00 C ATOM 1214 CG HIS A 79 8.109 1.470 -13.676 1.00 0.00 C ATOM 1215 ND1 HIS A 79 9.078 2.448 -13.765 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.921 2.117 -13.704 1.00 0.00 C ATOM 1217 CE1 HIS A 79 8.500 3.632 -13.841 1.00 0.00 C ATOM 1218 NE2 HIS A 79 7.190 3.460 -13.806 1.00 0.00 N ATOM 0 H HIS A 79 7.726 0.798 -11.148 1.00 0.00 H new ATOM 0 HA HIS A 79 9.292 -1.453 -12.259 1.00 0.00 H new ATOM 0 HB2 HIS A 79 9.102 -0.263 -14.388 1.00 0.00 H new ATOM 0 HB3 HIS A 79 7.512 -0.564 -13.715 1.00 0.00 H new ATOM 0 HD1 HIS A 79 10.084 2.282 -13.771 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.943 1.662 -13.655 1.00 0.00 H new ATOM 0 HE1 HIS A 79 9.011 4.580 -13.919 1.00 0.00 H new ATOM 1226 N GLY A 80 10.594 0.851 -10.820 1.00 0.00 N ATOM 1227 CA GLY A 80 11.804 1.594 -10.522 1.00 0.00 C ATOM 1228 C GLY A 80 12.754 0.820 -9.629 1.00 0.00 C ATOM 1229 O GLY A 80 13.928 1.174 -9.506 1.00 0.00 O ATOM 0 H GLY A 80 9.959 0.731 -10.031 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.310 1.847 -11.454 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.540 2.534 -10.038 1.00 0.00 H new ATOM 1233 N LEU A 81 12.248 -0.237 -9.005 1.00 0.00 N ATOM 1234 CA LEU A 81 13.059 -1.062 -8.117 1.00 0.00 C ATOM 1235 C LEU A 81 12.781 -2.544 -8.346 1.00 0.00 C ATOM 1236 O LEU A 81 11.714 -2.919 -8.833 1.00 0.00 O ATOM 1237 CB LEU A 81 12.783 -0.700 -6.657 1.00 0.00 C ATOM 1238 CG LEU A 81 12.836 0.789 -6.313 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.434 1.379 -6.276 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.543 1.005 -4.983 1.00 0.00 C ATOM 0 H LEU A 81 11.279 -0.543 -9.097 1.00 0.00 H new ATOM 0 HA LEU A 81 14.108 -0.869 -8.340 1.00 0.00 H new ATOM 0 HB2 LEU A 81 11.797 -1.079 -6.390 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.506 -1.223 -6.031 1.00 0.00 H new ATOM 0 HG LEU A 81 13.403 1.301 -7.090 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.492 2.439 -6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.963 1.258 -7.251 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.842 0.863 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.571 2.070 -4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.004 0.479 -4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.561 0.620 -5.045 1.00 0.00 H new ATOM 1252 N LYS A 82 13.747 -3.385 -7.989 1.00 0.00 N ATOM 1253 CA LYS A 82 13.605 -4.827 -8.152 1.00 0.00 C ATOM 1254 C LYS A 82 12.305 -5.320 -7.528 1.00 0.00 C ATOM 1255 O LYS A 82 11.711 -4.643 -6.689 1.00 0.00 O ATOM 1256 CB LYS A 82 14.795 -5.551 -7.518 1.00 0.00 C ATOM 1257 CG LYS A 82 16.119 -5.264 -8.205 1.00 0.00 C ATOM 1258 CD LYS A 82 16.286 -6.098 -9.464 1.00 0.00 C ATOM 1259 CE LYS A 82 17.422 -5.578 -10.330 1.00 0.00 C ATOM 1260 NZ LYS A 82 18.745 -6.094 -9.881 1.00 0.00 N ATOM 0 H LYS A 82 14.637 -3.092 -7.585 1.00 0.00 H new ATOM 0 HA LYS A 82 13.580 -5.046 -9.219 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.869 -5.261 -6.470 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.609 -6.625 -7.540 1.00 0.00 H new ATOM 0 HG2 LYS A 82 16.177 -4.205 -8.458 1.00 0.00 H new ATOM 0 HG3 LYS A 82 16.939 -5.472 -7.518 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.480 -7.135 -9.191 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.357 -6.087 -10.035 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.251 -5.870 -11.366 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.429 -4.488 -10.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.492 -5.716 -10.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 18.920 -5.794 -8.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.748 -7.133 -9.931 1.00 0.00 H new ATOM 1274 N SER A 83 11.867 -6.505 -7.943 1.00 0.00 N ATOM 1275 CA SER A 83 10.635 -7.088 -7.425 1.00 0.00 C ATOM 1276 C SER A 83 10.640 -7.106 -5.900 1.00 0.00 C ATOM 1277 O SER A 83 11.296 -7.943 -5.278 1.00 0.00 O ATOM 1278 CB SER A 83 10.453 -8.509 -7.961 1.00 0.00 C ATOM 1279 OG SER A 83 11.537 -9.340 -7.584 1.00 0.00 O ATOM 0 H SER A 83 12.347 -7.079 -8.636 1.00 0.00 H new ATOM 0 HA SER A 83 9.802 -6.470 -7.761 1.00 0.00 H new ATOM 0 HB2 SER A 83 9.521 -8.927 -7.581 1.00 0.00 H new ATOM 0 HB3 SER A 83 10.371 -8.483 -9.048 1.00 0.00 H new ATOM 0 HG SER A 83 11.767 -9.173 -6.646 1.00 0.00 H new ATOM 1285 N THR A 84 9.905 -6.174 -5.300 1.00 0.00 N ATOM 1286 CA THR A 84 9.824 -6.080 -3.849 1.00 0.00 C ATOM 1287 C THR A 84 8.559 -6.747 -3.323 1.00 0.00 C ATOM 1288 O THR A 84 7.509 -6.700 -3.963 1.00 0.00 O ATOM 1289 CB THR A 84 9.851 -4.614 -3.377 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.233 -3.759 -4.461 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.819 -4.436 -2.218 1.00 0.00 C ATOM 0 H THR A 84 9.357 -5.473 -5.799 1.00 0.00 H new ATOM 0 HA THR A 84 10.697 -6.598 -3.452 1.00 0.00 H new ATOM 0 HB THR A 84 8.851 -4.345 -3.037 1.00 0.00 H new ATOM 0 HG1 THR A 84 10.247 -2.828 -4.154 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.821 -3.393 -1.902 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.509 -5.067 -1.385 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.822 -4.721 -2.535 1.00 0.00 H new ATOM 1299 N ASP A 85 8.665 -7.368 -2.153 1.00 0.00 N ATOM 1300 CA ASP A 85 7.527 -8.045 -1.540 1.00 0.00 C ATOM 1301 C ASP A 85 6.319 -7.116 -1.465 1.00 0.00 C ATOM 1302 O ASP A 85 5.210 -7.491 -1.845 1.00 0.00 O ATOM 1303 CB ASP A 85 7.894 -8.539 -0.140 1.00 0.00 C ATOM 1304 CG ASP A 85 9.245 -9.227 -0.105 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.306 -10.433 -0.422 1.00 0.00 O ATOM 1306 OD2 ASP A 85 10.242 -8.558 0.240 1.00 0.00 O ATOM 0 H ASP A 85 9.527 -7.417 -1.610 1.00 0.00 H new ATOM 0 HA ASP A 85 7.266 -8.901 -2.162 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.901 -7.695 0.550 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.128 -9.231 0.211 1.00 0.00 H new ATOM 1311 N VAL A 86 6.542 -5.902 -0.971 1.00 0.00 N ATOM 1312 CA VAL A 86 5.473 -4.920 -0.845 1.00 0.00 C ATOM 1313 C VAL A 86 4.740 -4.732 -2.169 1.00 0.00 C ATOM 1314 O VAL A 86 3.512 -4.673 -2.207 1.00 0.00 O ATOM 1315 CB VAL A 86 6.015 -3.557 -0.373 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.446 -3.629 1.084 1.00 0.00 C ATOM 1317 CG2 VAL A 86 7.168 -3.108 -1.257 1.00 0.00 C ATOM 0 H VAL A 86 7.454 -5.576 -0.652 1.00 0.00 H new ATOM 0 HA VAL A 86 4.777 -5.304 -0.099 1.00 0.00 H new ATOM 0 HB VAL A 86 5.216 -2.820 -0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.826 -2.657 1.399 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.592 -3.903 1.703 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.230 -4.378 1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.539 -2.144 -0.910 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.971 -3.844 -1.210 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.822 -3.014 -2.286 1.00 0.00 H new ATOM 1327 N ALA A 87 5.503 -4.639 -3.253 1.00 0.00 N ATOM 1328 CA ALA A 87 4.928 -4.460 -4.580 1.00 0.00 C ATOM 1329 C ALA A 87 4.002 -5.619 -4.936 1.00 0.00 C ATOM 1330 O ALA A 87 2.830 -5.415 -5.255 1.00 0.00 O ATOM 1331 CB ALA A 87 6.030 -4.325 -5.620 1.00 0.00 C ATOM 0 H ALA A 87 6.522 -4.685 -3.238 1.00 0.00 H new ATOM 0 HA ALA A 87 4.337 -3.544 -4.573 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.585 -4.192 -6.606 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.651 -3.461 -5.382 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.645 -5.225 -5.618 1.00 0.00 H new ATOM 1337 N LYS A 88 4.535 -6.835 -4.883 1.00 0.00 N ATOM 1338 CA LYS A 88 3.757 -8.026 -5.200 1.00 0.00 C ATOM 1339 C LYS A 88 2.494 -8.094 -4.347 1.00 0.00 C ATOM 1340 O LYS A 88 1.407 -8.382 -4.849 1.00 0.00 O ATOM 1341 CB LYS A 88 4.601 -9.284 -4.983 1.00 0.00 C ATOM 1342 CG LYS A 88 3.886 -10.570 -5.362 1.00 0.00 C ATOM 1343 CD LYS A 88 4.513 -11.777 -4.686 1.00 0.00 C ATOM 1344 CE LYS A 88 5.707 -12.298 -5.470 1.00 0.00 C ATOM 1345 NZ LYS A 88 6.953 -11.548 -5.149 1.00 0.00 N ATOM 0 H LYS A 88 5.504 -7.021 -4.623 1.00 0.00 H new ATOM 0 HA LYS A 88 3.463 -7.970 -6.248 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.517 -9.202 -5.568 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.895 -9.337 -3.935 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.835 -10.499 -5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.918 -10.700 -6.444 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.828 -11.508 -3.678 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.769 -12.567 -4.587 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.853 -13.355 -5.249 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.502 -12.221 -6.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.776 -12.171 -5.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.038 -10.729 -5.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.916 -11.219 -4.163 1.00 0.00 H new ATOM 1359 N THR A 89 2.645 -7.828 -3.053 1.00 0.00 N ATOM 1360 CA THR A 89 1.518 -7.858 -2.131 1.00 0.00 C ATOM 1361 C THR A 89 0.434 -6.871 -2.552 1.00 0.00 C ATOM 1362 O THR A 89 -0.756 -7.182 -2.502 1.00 0.00 O ATOM 1363 CB THR A 89 1.960 -7.533 -0.691 1.00 0.00 C ATOM 1364 OG1 THR A 89 3.006 -8.425 -0.287 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.790 -7.646 0.273 1.00 0.00 C ATOM 0 H THR A 89 3.537 -7.589 -2.621 1.00 0.00 H new ATOM 0 HA THR A 89 1.115 -8.870 -2.160 1.00 0.00 H new ATOM 0 HB THR A 89 2.329 -6.507 -0.670 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.839 -8.180 -0.742 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.127 -7.412 1.283 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.008 -6.945 -0.020 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.395 -8.662 0.248 1.00 0.00 H new ATOM 1373 N PHE A 90 0.854 -5.681 -2.968 1.00 0.00 N ATOM 1374 CA PHE A 90 -0.080 -4.648 -3.399 1.00 0.00 C ATOM 1375 C PHE A 90 -0.874 -5.107 -4.619 1.00 0.00 C ATOM 1376 O PHE A 90 -2.104 -5.148 -4.593 1.00 0.00 O ATOM 1377 CB PHE A 90 0.669 -3.354 -3.721 1.00 0.00 C ATOM 1378 CG PHE A 90 -0.191 -2.309 -4.370 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.811 -1.331 -3.609 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.380 -2.303 -5.743 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.603 -0.367 -4.204 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -1.171 -1.342 -6.343 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.784 -0.374 -5.573 1.00 0.00 C ATOM 0 H PHE A 90 1.836 -5.408 -3.016 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.778 -4.461 -2.583 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.088 -2.948 -2.800 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.507 -3.583 -4.379 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.674 -1.322 -2.538 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.096 -3.058 -6.351 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.079 0.390 -3.599 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.310 -1.348 -7.414 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.404 0.377 -6.040 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.159 -5.450 -5.686 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.796 -5.903 -6.917 1.00 0.00 C ATOM 1395 C ARG A 91 -1.803 -7.014 -6.632 1.00 0.00 C ATOM 1396 O ARG A 91 -2.957 -6.944 -7.055 1.00 0.00 O ATOM 1397 CB ARG A 91 0.258 -6.399 -7.908 1.00 0.00 C ATOM 1398 CG ARG A 91 0.153 -5.756 -9.282 1.00 0.00 C ATOM 1399 CD ARG A 91 1.399 -6.011 -10.114 1.00 0.00 C ATOM 1400 NE ARG A 91 1.161 -5.796 -11.539 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.177 -4.599 -12.114 1.00 0.00 C ATOM 1402 NH1 ARG A 91 1.419 -3.515 -11.390 1.00 0.00 N ATOM 1403 NH2 ARG A 91 0.950 -4.485 -13.417 1.00 0.00 N ATOM 0 H ARG A 91 0.860 -5.423 -5.723 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.328 -5.057 -7.354 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.249 -6.203 -7.499 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.165 -7.480 -8.014 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.720 -6.149 -9.803 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.002 -4.682 -9.172 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.200 -5.353 -9.777 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.738 -7.034 -9.954 1.00 0.00 H new ATOM 0 HE ARG A 91 0.972 -6.610 -12.124 1.00 0.00 H new ATOM 0 HH11 ARG A 91 1.594 -3.599 -10.389 1.00 0.00 H new ATOM 0 HH12 ARG A 91 1.431 -2.597 -11.834 1.00 0.00 H new ATOM 0 HH21 ARG A 91 0.763 -5.317 -13.977 1.00 0.00 H new ATOM 0 HH22 ARG A 91 0.962 -3.565 -13.858 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.358 -8.037 -5.911 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.219 -9.163 -5.568 1.00 0.00 C ATOM 1419 C LYS A 92 -3.399 -8.705 -4.717 1.00 0.00 C ATOM 1420 O LYS A 92 -4.555 -8.853 -5.113 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.420 -10.232 -4.817 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.985 -11.393 -5.693 1.00 0.00 C ATOM 1423 CD LYS A 92 -1.639 -12.694 -5.261 1.00 0.00 C ATOM 1424 CE LYS A 92 -1.021 -13.891 -5.967 1.00 0.00 C ATOM 1425 NZ LYS A 92 -1.330 -13.897 -7.424 1.00 0.00 N ATOM 0 H LYS A 92 -0.406 -8.110 -5.553 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.605 -9.589 -6.494 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.537 -9.770 -4.375 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.025 -10.615 -3.995 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.242 -11.183 -6.731 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.099 -11.497 -5.648 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -1.536 -12.813 -4.182 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -2.707 -12.655 -5.477 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.060 -13.878 -5.825 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.391 -14.811 -5.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.891 -14.728 -7.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.360 -13.935 -7.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.955 -13.032 -7.862 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.101 -8.148 -3.548 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.139 -7.666 -2.645 1.00 0.00 C ATOM 1441 C ALA A 93 -5.151 -6.798 -3.385 1.00 0.00 C ATOM 1442 O ALA A 93 -6.348 -7.085 -3.381 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.516 -6.889 -1.494 1.00 0.00 C ATOM 0 H ALA A 93 -2.149 -8.019 -3.204 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.667 -8.530 -2.243 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.302 -6.534 -0.827 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.837 -7.539 -0.942 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.963 -6.037 -1.888 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.662 -5.736 -4.016 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.526 -4.827 -4.761 1.00 0.00 C ATOM 1451 C ILE A 94 -6.318 -5.573 -5.830 1.00 0.00 C ATOM 1452 O ILE A 94 -7.384 -5.126 -6.250 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.715 -3.702 -5.430 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.422 -2.357 -5.251 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.508 -4.005 -6.907 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.671 -1.393 -4.360 1.00 0.00 C ATOM 0 H ILE A 94 -3.674 -5.484 -4.027 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.217 -4.387 -4.042 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.738 -3.644 -4.950 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.565 -1.898 -6.229 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.413 -2.530 -4.832 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.933 -3.201 -7.366 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.966 -4.945 -7.013 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.476 -4.087 -7.401 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.231 -0.461 -4.279 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.550 -1.832 -3.369 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.690 -1.190 -4.789 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.789 -6.712 -6.263 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.447 -7.521 -7.282 1.00 0.00 C ATOM 1470 C ASN A 95 -7.324 -8.595 -6.643 1.00 0.00 C ATOM 1471 O ASN A 95 -7.618 -9.620 -7.258 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.407 -8.174 -8.196 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.923 -7.234 -9.282 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.394 -6.103 -9.397 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.976 -7.701 -10.088 1.00 0.00 N ATOM 0 H ASN A 95 -4.907 -7.096 -5.924 1.00 0.00 H new ATOM 0 HA ASN A 95 -7.082 -6.864 -7.876 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.557 -8.503 -7.598 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.838 -9.064 -8.655 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.611 -7.115 -10.839 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.614 -8.646 -9.956 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.738 -8.351 -5.403 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.582 -9.295 -4.680 1.00 0.00 C ATOM 1484 C LYS A 96 -7.889 -10.646 -4.538 1.00 0.00 C ATOM 1485 O LYS A 96 -8.534 -11.661 -4.271 1.00 0.00 O ATOM 1486 CB LYS A 96 -9.920 -9.469 -5.399 1.00 0.00 C ATOM 1487 CG LYS A 96 -10.832 -8.258 -5.290 1.00 0.00 C ATOM 1488 CD LYS A 96 -12.007 -8.527 -4.364 1.00 0.00 C ATOM 1489 CE LYS A 96 -13.001 -7.376 -4.378 1.00 0.00 C ATOM 1490 NZ LYS A 96 -13.829 -7.343 -3.142 1.00 0.00 N ATOM 0 H LYS A 96 -7.503 -7.508 -4.879 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.763 -8.893 -3.683 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.732 -9.678 -6.452 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.433 -10.338 -4.988 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.263 -7.405 -4.920 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.201 -7.989 -6.280 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.508 -9.446 -4.668 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -11.643 -8.683 -3.348 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.463 -6.433 -4.480 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.651 -7.468 -5.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.494 -6.544 -3.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.362 -8.232 -3.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.211 -7.229 -2.313 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.573 -10.653 -4.716 1.00 0.00 N ATOM 1505 CA LYS A 97 -5.791 -11.879 -4.605 1.00 0.00 C ATOM 1506 C LYS A 97 -6.255 -12.914 -5.626 1.00 0.00 C ATOM 1507 O LYS A 97 -6.275 -14.102 -5.311 1.00 0.00 O ATOM 1508 CB LYS A 97 -5.906 -12.456 -3.191 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.538 -11.467 -2.100 1.00 0.00 C ATOM 1510 CD LYS A 97 -6.055 -11.915 -0.743 1.00 0.00 C ATOM 1511 CE LYS A 97 -7.548 -11.656 -0.604 1.00 0.00 C ATOM 1512 NZ LYS A 97 -8.179 -12.570 0.388 1.00 0.00 N ATOM 0 H LYS A 97 -6.024 -9.822 -4.938 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.748 -11.635 -4.808 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.928 -12.799 -3.029 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.260 -13.330 -3.111 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.454 -11.356 -2.059 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.950 -10.487 -2.342 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -5.855 -12.978 -0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -5.518 -11.387 0.045 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.711 -10.622 -0.300 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.030 -11.783 -1.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.169 -12.743 0.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -7.662 -13.472 0.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.147 -12.134 1.331 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.769 8.136 -1.680 1.00 0.00 CA HETATM 1528 CA CA A 102 4.636 12.522 -1.965 1.00 0.00 CA