USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 764 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 14 HIS : no HE2:sc= 1.35 K(o=2.7,f=-8.7!) USER MOD Set 1.2: A 87 GLN : amide:sc= 0.494 K(o=2.7,f=1.6) USER MOD Set 1.3: A 89 ASN : amide:sc= 0.864 K(o=2.7,f=-2.5) USER MOD Set 2.1: A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -139:sc= 0.892 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 173:sc=-0.000595 (180deg=-0.0691) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.636 K(o=-0.64,f=-1.3) USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0.575 USER MOD Single : A 54 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.0052) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.0198 USER MOD Single : A 72 HIS : no HD1:sc= -0.517 X(o=-0.52,f=-0.29) USER MOD Single : A 74 TYR OH : rot 130:sc= 0 USER MOD Single : A 79 MET CE :methyl -170:sc= -0.923 (180deg=-1.45) USER MOD Single : A 80 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.39) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 ASN : amide:sc= 0.0898 K(o=0.09,f=-0.77) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0199) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.588 0.037 20.513 1.00 0.00 N ATOM 2 CA GLY A 1 -13.105 -1.332 20.732 1.00 0.00 C ATOM 3 C GLY A 1 -11.645 -1.303 21.138 1.00 0.00 C ATOM 4 O GLY A 1 -11.325 -1.437 22.318 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.590 0.011 20.235 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.486 0.586 21.391 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.030 0.485 19.758 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.698 -1.817 21.508 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.227 -1.920 19.823 1.00 0.00 H new ATOM 8 N SER A 2 -10.751 -1.088 20.167 1.00 0.00 N ATOM 9 CA SER A 2 -9.362 -0.662 20.324 1.00 0.00 C ATOM 10 C SER A 2 -8.431 -1.822 20.675 1.00 0.00 C ATOM 11 O SER A 2 -7.439 -2.047 19.980 1.00 0.00 O ATOM 12 CB SER A 2 -9.239 0.467 21.358 1.00 0.00 C ATOM 13 OG SER A 2 -10.261 1.436 21.200 1.00 0.00 O ATOM 0 H SER A 2 -10.998 -1.216 19.186 1.00 0.00 H new ATOM 0 HA SER A 2 -9.044 -0.278 19.355 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.288 0.047 22.363 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.265 0.946 21.260 1.00 0.00 H new ATOM 0 HG SER A 2 -10.153 2.138 21.875 1.00 0.00 H new ATOM 19 N SER A 3 -8.747 -2.542 21.746 1.00 0.00 N ATOM 20 CA SER A 3 -8.021 -3.687 22.256 1.00 0.00 C ATOM 21 C SER A 3 -8.326 -4.926 21.403 1.00 0.00 C ATOM 22 O SER A 3 -8.970 -5.866 21.865 1.00 0.00 O ATOM 23 CB SER A 3 -8.402 -3.841 23.735 1.00 0.00 C ATOM 24 OG SER A 3 -7.922 -2.716 24.463 1.00 0.00 O ATOM 0 H SER A 3 -9.567 -2.324 22.311 1.00 0.00 H new ATOM 0 HA SER A 3 -6.941 -3.554 22.193 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.484 -3.920 23.837 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.975 -4.759 24.139 1.00 0.00 H new ATOM 0 HG SER A 3 -8.165 -2.810 25.408 1.00 0.00 H new ATOM 30 N GLY A 4 -7.861 -4.921 20.152 1.00 0.00 N ATOM 31 CA GLY A 4 -7.968 -6.024 19.205 1.00 0.00 C ATOM 32 C GLY A 4 -9.131 -5.832 18.231 1.00 0.00 C ATOM 33 O GLY A 4 -10.152 -5.229 18.582 1.00 0.00 O ATOM 0 H GLY A 4 -7.380 -4.112 19.758 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.037 -6.113 18.645 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.102 -6.958 19.750 1.00 0.00 H new ATOM 37 N SER A 5 -8.996 -6.365 17.011 1.00 0.00 N ATOM 38 CA SER A 5 -10.071 -6.410 16.027 1.00 0.00 C ATOM 39 C SER A 5 -10.927 -7.647 16.303 1.00 0.00 C ATOM 40 O SER A 5 -10.628 -8.747 15.823 1.00 0.00 O ATOM 41 CB SER A 5 -9.516 -6.391 14.594 1.00 0.00 C ATOM 42 OG SER A 5 -10.586 -6.414 13.666 1.00 0.00 O ATOM 0 H SER A 5 -8.125 -6.781 16.681 1.00 0.00 H new ATOM 0 HA SER A 5 -10.696 -5.522 16.116 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.909 -5.499 14.441 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.865 -7.251 14.435 1.00 0.00 H new ATOM 0 HG SER A 5 -10.359 -7.008 12.920 1.00 0.00 H new ATOM 48 N SER A 6 -12.000 -7.465 17.074 1.00 0.00 N ATOM 49 CA SER A 6 -13.065 -8.446 17.220 1.00 0.00 C ATOM 50 C SER A 6 -13.852 -8.567 15.906 1.00 0.00 C ATOM 51 O SER A 6 -14.966 -8.049 15.775 1.00 0.00 O ATOM 52 CB SER A 6 -13.963 -8.057 18.400 1.00 0.00 C ATOM 53 OG SER A 6 -13.307 -8.355 19.617 1.00 0.00 O ATOM 0 H SER A 6 -12.152 -6.618 17.621 1.00 0.00 H new ATOM 0 HA SER A 6 -12.642 -9.427 17.435 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.200 -6.994 18.354 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.908 -8.597 18.344 1.00 0.00 H new ATOM 0 HG SER A 6 -13.883 -8.104 20.369 1.00 0.00 H new ATOM 59 N GLY A 7 -13.307 -9.289 14.925 1.00 0.00 N ATOM 60 CA GLY A 7 -14.004 -9.676 13.709 1.00 0.00 C ATOM 61 C GLY A 7 -13.126 -9.464 12.498 1.00 0.00 C ATOM 62 O GLY A 7 -12.402 -10.385 12.120 1.00 0.00 O ATOM 0 H GLY A 7 -12.345 -9.626 14.960 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.299 -10.723 13.771 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.919 -9.092 13.607 1.00 0.00 H new ATOM 66 N TYR A 8 -13.268 -8.302 11.853 1.00 0.00 N ATOM 67 CA TYR A 8 -12.751 -8.070 10.508 1.00 0.00 C ATOM 68 C TYR A 8 -11.259 -8.408 10.466 1.00 0.00 C ATOM 69 O TYR A 8 -10.478 -7.969 11.315 1.00 0.00 O ATOM 70 CB TYR A 8 -13.089 -6.654 10.010 1.00 0.00 C ATOM 71 CG TYR A 8 -12.286 -5.542 10.612 1.00 0.00 C ATOM 72 CD1 TYR A 8 -11.052 -5.217 10.034 1.00 0.00 C ATOM 73 CD2 TYR A 8 -12.768 -4.837 11.722 1.00 0.00 C ATOM 74 CE1 TYR A 8 -10.248 -4.217 10.606 1.00 0.00 C ATOM 75 CE2 TYR A 8 -11.983 -3.818 12.280 1.00 0.00 C ATOM 76 CZ TYR A 8 -10.713 -3.512 11.739 1.00 0.00 C ATOM 77 OH TYR A 8 -9.960 -2.530 12.303 1.00 0.00 O ATOM 0 H TYR A 8 -13.747 -7.495 12.254 1.00 0.00 H new ATOM 0 HA TYR A 8 -13.246 -8.738 9.803 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -12.956 -6.628 8.928 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -14.144 -6.462 10.206 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -10.718 -5.736 9.148 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -13.733 -5.076 12.143 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -9.281 -3.989 10.183 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -12.351 -3.262 13.130 1.00 0.00 H new ATOM 0 HH TYR A 8 -10.437 -2.153 13.072 1.00 0.00 H new ATOM 87 N LYS A 9 -10.897 -9.269 9.516 1.00 0.00 N ATOM 88 CA LYS A 9 -9.567 -9.830 9.423 1.00 0.00 C ATOM 89 C LYS A 9 -8.793 -8.826 8.592 1.00 0.00 C ATOM 90 O LYS A 9 -9.165 -8.582 7.446 1.00 0.00 O ATOM 91 CB LYS A 9 -9.624 -11.230 8.772 1.00 0.00 C ATOM 92 CG LYS A 9 -8.926 -12.313 9.610 1.00 0.00 C ATOM 93 CD LYS A 9 -7.397 -12.178 9.572 1.00 0.00 C ATOM 94 CE LYS A 9 -6.681 -13.185 10.480 1.00 0.00 C ATOM 95 NZ LYS A 9 -6.799 -12.847 11.915 1.00 0.00 N ATOM 0 H LYS A 9 -11.531 -9.594 8.786 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.090 -9.984 10.391 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.666 -11.512 8.620 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.159 -11.185 7.787 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.269 -12.249 10.643 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -9.212 -13.297 9.239 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.052 -12.313 8.547 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.120 -11.167 9.871 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.095 -14.179 10.310 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.627 -13.228 10.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.297 -13.560 12.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.380 -11.911 12.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.803 -12.832 12.187 1.00 0.00 H new ATOM 109 N GLU A 10 -7.766 -8.228 9.184 1.00 0.00 N ATOM 110 CA GLU A 10 -6.723 -7.552 8.434 1.00 0.00 C ATOM 111 C GLU A 10 -5.739 -8.643 8.027 1.00 0.00 C ATOM 112 O GLU A 10 -5.466 -9.560 8.803 1.00 0.00 O ATOM 113 CB GLU A 10 -6.023 -6.493 9.311 1.00 0.00 C ATOM 114 CG GLU A 10 -6.520 -5.108 8.899 1.00 0.00 C ATOM 115 CD GLU A 10 -6.094 -3.958 9.812 1.00 0.00 C ATOM 116 OE1 GLU A 10 -4.947 -3.966 10.327 1.00 0.00 O ATOM 117 OE2 GLU A 10 -6.920 -3.034 10.010 1.00 0.00 O ATOM 0 H GLU A 10 -7.636 -8.200 10.195 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.126 -7.028 7.568 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.238 -6.673 10.364 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.942 -6.558 9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.165 -4.899 7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.609 -5.130 8.855 1.00 0.00 H new ATOM 124 N LEU A 11 -5.215 -8.549 6.812 1.00 0.00 N ATOM 125 CA LEU A 11 -4.215 -9.451 6.261 1.00 0.00 C ATOM 126 C LEU A 11 -3.168 -8.556 5.619 1.00 0.00 C ATOM 127 O LEU A 11 -3.439 -7.817 4.679 1.00 0.00 O ATOM 128 CB LEU A 11 -4.769 -10.494 5.255 1.00 0.00 C ATOM 129 CG LEU A 11 -6.216 -10.321 4.747 1.00 0.00 C ATOM 130 CD1 LEU A 11 -6.393 -10.960 3.364 1.00 0.00 C ATOM 131 CD2 LEU A 11 -7.237 -10.961 5.699 1.00 0.00 C ATOM 0 H LEU A 11 -5.486 -7.814 6.159 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.805 -10.070 7.059 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.110 -10.502 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.695 -11.477 5.720 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.395 -9.247 4.693 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -7.421 -10.824 3.029 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.715 -10.486 2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -6.169 -12.025 3.424 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -8.243 -10.817 5.304 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.032 -12.028 5.789 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -7.162 -10.493 6.681 1.00 0.00 H new ATOM 143 N ASP A 12 -1.960 -8.631 6.162 1.00 0.00 N ATOM 144 CA ASP A 12 -0.762 -7.991 5.657 1.00 0.00 C ATOM 145 C ASP A 12 -0.217 -8.802 4.481 1.00 0.00 C ATOM 146 O ASP A 12 -0.282 -10.041 4.468 1.00 0.00 O ATOM 147 CB ASP A 12 0.273 -7.822 6.792 1.00 0.00 C ATOM 148 CG ASP A 12 0.204 -8.880 7.899 1.00 0.00 C ATOM 149 OD1 ASP A 12 0.561 -10.052 7.655 1.00 0.00 O ATOM 150 OD2 ASP A 12 -0.344 -8.582 8.988 1.00 0.00 O ATOM 0 H ASP A 12 -1.785 -9.169 7.011 1.00 0.00 H new ATOM 0 HA ASP A 12 -0.993 -6.990 5.293 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.272 -7.839 6.357 1.00 0.00 H new ATOM 0 HB3 ASP A 12 0.138 -6.839 7.242 1.00 0.00 H new ATOM 155 N VAL A 13 0.308 -8.086 3.487 1.00 0.00 N ATOM 156 CA VAL A 13 0.956 -8.613 2.297 1.00 0.00 C ATOM 157 C VAL A 13 2.210 -7.769 2.068 1.00 0.00 C ATOM 158 O VAL A 13 2.117 -6.598 1.703 1.00 0.00 O ATOM 159 CB VAL A 13 -0.005 -8.543 1.087 1.00 0.00 C ATOM 160 CG1 VAL A 13 0.663 -9.181 -0.142 1.00 0.00 C ATOM 161 CG2 VAL A 13 -1.360 -9.207 1.379 1.00 0.00 C ATOM 0 H VAL A 13 0.289 -7.066 3.496 1.00 0.00 H new ATOM 0 HA VAL A 13 1.226 -9.662 2.421 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.210 -7.492 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.016 -9.130 -0.993 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.581 -8.642 -0.378 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.899 -10.223 0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.999 -9.132 0.499 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.205 -10.257 1.626 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.838 -8.704 2.219 1.00 0.00 H new ATOM 171 N HIS A 14 3.395 -8.333 2.301 1.00 0.00 N ATOM 172 CA HIS A 14 4.624 -7.675 1.885 1.00 0.00 C ATOM 173 C HIS A 14 4.829 -7.998 0.409 1.00 0.00 C ATOM 174 O HIS A 14 4.820 -9.177 0.053 1.00 0.00 O ATOM 175 CB HIS A 14 5.815 -8.157 2.728 1.00 0.00 C ATOM 176 CG HIS A 14 6.980 -7.209 2.607 1.00 0.00 C ATOM 177 ND1 HIS A 14 7.075 -6.019 3.279 1.00 0.00 N ATOM 178 CD2 HIS A 14 8.032 -7.269 1.731 1.00 0.00 C ATOM 179 CE1 HIS A 14 8.145 -5.364 2.820 1.00 0.00 C ATOM 180 NE2 HIS A 14 8.782 -6.095 1.884 1.00 0.00 N ATOM 0 H HIS A 14 3.525 -9.230 2.768 1.00 0.00 H new ATOM 0 HA HIS A 14 4.553 -6.597 2.032 1.00 0.00 H new ATOM 0 HB2 HIS A 14 5.516 -8.240 3.773 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.116 -9.153 2.403 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.438 -5.690 4.005 1.00 0.00 H new ATOM 0 HD2 HIS A 14 8.245 -8.076 1.046 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.456 -4.385 3.153 1.00 0.00 H new ATOM 188 N LEU A 15 5.091 -7.007 -0.445 1.00 0.00 N ATOM 189 CA LEU A 15 5.631 -7.253 -1.785 1.00 0.00 C ATOM 190 C LEU A 15 6.954 -6.534 -1.930 1.00 0.00 C ATOM 191 O LEU A 15 7.037 -5.314 -1.818 1.00 0.00 O ATOM 192 CB LEU A 15 4.705 -6.793 -2.920 1.00 0.00 C ATOM 193 CG LEU A 15 3.450 -7.648 -3.121 1.00 0.00 C ATOM 194 CD1 LEU A 15 2.624 -7.043 -4.273 1.00 0.00 C ATOM 195 CD2 LEU A 15 3.735 -9.111 -3.480 1.00 0.00 C ATOM 0 H LEU A 15 4.937 -6.021 -0.232 1.00 0.00 H new ATOM 0 HA LEU A 15 5.742 -8.334 -1.876 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.398 -5.766 -2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.273 -6.784 -3.850 1.00 0.00 H new ATOM 0 HG LEU A 15 2.923 -7.644 -2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.726 -7.640 -4.430 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.341 -6.021 -4.020 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.221 -7.039 -5.185 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.793 -9.645 -3.605 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.302 -9.154 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.313 -9.576 -2.681 1.00 0.00 H new ATOM 207 N ARG A 16 7.985 -7.293 -2.270 1.00 0.00 N ATOM 208 CA ARG A 16 9.249 -6.744 -2.749 1.00 0.00 C ATOM 209 C ARG A 16 9.096 -6.243 -4.186 1.00 0.00 C ATOM 210 O ARG A 16 8.189 -6.680 -4.903 1.00 0.00 O ATOM 211 CB ARG A 16 10.345 -7.813 -2.611 1.00 0.00 C ATOM 212 CG ARG A 16 10.639 -8.037 -1.120 1.00 0.00 C ATOM 213 CD ARG A 16 11.896 -8.875 -0.876 1.00 0.00 C ATOM 214 NE ARG A 16 11.573 -10.308 -0.871 1.00 0.00 N ATOM 215 CZ ARG A 16 12.304 -11.297 -0.356 1.00 0.00 C ATOM 216 NH1 ARG A 16 13.571 -11.089 0.004 1.00 0.00 N ATOM 217 NH2 ARG A 16 11.741 -12.487 -0.197 1.00 0.00 N ATOM 0 H ARG A 16 7.970 -8.312 -2.222 1.00 0.00 H new ATOM 0 HA ARG A 16 9.542 -5.884 -2.147 1.00 0.00 H new ATOM 0 HB2 ARG A 16 10.023 -8.745 -3.075 1.00 0.00 H new ATOM 0 HB3 ARG A 16 11.249 -7.494 -3.130 1.00 0.00 H new ATOM 0 HG2 ARG A 16 10.753 -7.071 -0.629 1.00 0.00 H new ATOM 0 HG3 ARG A 16 9.785 -8.531 -0.657 1.00 0.00 H new ATOM 0 HD2 ARG A 16 12.634 -8.666 -1.651 1.00 0.00 H new ATOM 0 HD3 ARG A 16 12.346 -8.595 0.077 1.00 0.00 H new ATOM 0 HE ARG A 16 10.692 -10.576 -1.310 1.00 0.00 H new ATOM 0 HH11 ARG A 16 13.990 -10.166 -0.114 1.00 0.00 H new ATOM 0 HH12 ARG A 16 14.121 -11.853 0.397 1.00 0.00 H new ATOM 0 HH21 ARG A 16 10.768 -12.631 -0.467 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.281 -13.258 0.195 1.00 0.00 H new ATOM 231 N ARG A 17 9.984 -5.340 -4.617 1.00 0.00 N ATOM 232 CA ARG A 17 10.097 -4.838 -5.984 1.00 0.00 C ATOM 233 C ARG A 17 11.569 -4.928 -6.375 1.00 0.00 C ATOM 234 O ARG A 17 12.342 -4.065 -5.964 1.00 0.00 O ATOM 235 CB ARG A 17 9.601 -3.385 -6.106 1.00 0.00 C ATOM 236 CG ARG A 17 9.857 -2.745 -7.477 1.00 0.00 C ATOM 237 CD ARG A 17 9.758 -1.232 -7.418 1.00 0.00 C ATOM 238 NE ARG A 17 9.889 -0.666 -8.768 1.00 0.00 N ATOM 239 CZ ARG A 17 11.022 -0.485 -9.453 1.00 0.00 C ATOM 240 NH1 ARG A 17 12.209 -0.799 -8.939 1.00 0.00 N ATOM 241 NH2 ARG A 17 10.925 -0.013 -10.686 1.00 0.00 N ATOM 0 H ARG A 17 10.673 -4.923 -3.991 1.00 0.00 H new ATOM 0 HA ARG A 17 9.472 -5.436 -6.648 1.00 0.00 H new ATOM 0 HB2 ARG A 17 8.531 -3.360 -5.900 1.00 0.00 H new ATOM 0 HB3 ARG A 17 10.087 -2.782 -5.340 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.847 -3.031 -7.833 1.00 0.00 H new ATOM 0 HG3 ARG A 17 9.135 -3.129 -8.198 1.00 0.00 H new ATOM 0 HD2 ARG A 17 8.803 -0.939 -6.983 1.00 0.00 H new ATOM 0 HD3 ARG A 17 10.539 -0.833 -6.770 1.00 0.00 H new ATOM 0 HE ARG A 17 9.025 -0.382 -9.230 1.00 0.00 H new ATOM 0 HH11 ARG A 17 12.270 -1.189 -7.999 1.00 0.00 H new ATOM 0 HH12 ARG A 17 13.057 -0.650 -9.486 1.00 0.00 H new ATOM 0 HH21 ARG A 17 10.008 0.199 -11.080 1.00 0.00 H new ATOM 0 HH22 ARG A 17 11.767 0.139 -11.242 1.00 0.00 H new ATOM 255 N MET A 18 11.962 -5.925 -7.164 1.00 0.00 N ATOM 256 CA MET A 18 13.295 -5.980 -7.769 1.00 0.00 C ATOM 257 C MET A 18 13.341 -6.830 -9.048 1.00 0.00 C ATOM 258 O MET A 18 14.426 -7.121 -9.546 1.00 0.00 O ATOM 259 CB MET A 18 14.341 -6.444 -6.736 1.00 0.00 C ATOM 260 CG MET A 18 14.043 -7.803 -6.094 1.00 0.00 C ATOM 261 SD MET A 18 15.410 -8.470 -5.107 1.00 0.00 S ATOM 262 CE MET A 18 15.587 -7.208 -3.822 1.00 0.00 C ATOM 0 H MET A 18 11.367 -6.718 -7.403 1.00 0.00 H new ATOM 0 HA MET A 18 13.545 -4.966 -8.080 1.00 0.00 H new ATOM 0 HB2 MET A 18 15.316 -6.492 -7.222 1.00 0.00 H new ATOM 0 HB3 MET A 18 14.414 -5.693 -5.949 1.00 0.00 H new ATOM 0 HG2 MET A 18 13.163 -7.707 -5.458 1.00 0.00 H new ATOM 0 HG3 MET A 18 13.793 -8.517 -6.879 1.00 0.00 H new ATOM 0 HE1 MET A 18 16.305 -7.547 -3.075 1.00 0.00 H new ATOM 0 HE2 MET A 18 15.941 -6.279 -4.270 1.00 0.00 H new ATOM 0 HE3 MET A 18 14.622 -7.036 -3.345 1.00 0.00 H new ATOM 272 N GLU A 19 12.203 -7.276 -9.587 1.00 0.00 N ATOM 273 CA GLU A 19 12.124 -8.305 -10.620 1.00 0.00 C ATOM 274 C GLU A 19 11.097 -7.858 -11.673 1.00 0.00 C ATOM 275 O GLU A 19 11.493 -7.346 -12.725 1.00 0.00 O ATOM 276 CB GLU A 19 11.809 -9.634 -9.912 1.00 0.00 C ATOM 277 CG GLU A 19 11.540 -10.848 -10.808 1.00 0.00 C ATOM 278 CD GLU A 19 10.491 -11.740 -10.141 1.00 0.00 C ATOM 279 OE1 GLU A 19 10.777 -12.378 -9.100 1.00 0.00 O ATOM 280 OE2 GLU A 19 9.325 -11.740 -10.594 1.00 0.00 O ATOM 0 H GLU A 19 11.289 -6.920 -9.308 1.00 0.00 H new ATOM 0 HA GLU A 19 13.054 -8.454 -11.168 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.645 -9.875 -9.255 1.00 0.00 H new ATOM 0 HB3 GLU A 19 10.937 -9.482 -9.276 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.189 -10.522 -11.787 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.461 -11.407 -10.970 1.00 0.00 H new ATOM 287 N SER A 20 9.796 -7.966 -11.386 1.00 0.00 N ATOM 288 CA SER A 20 8.696 -7.410 -12.181 1.00 0.00 C ATOM 289 C SER A 20 7.936 -6.312 -11.420 1.00 0.00 C ATOM 290 O SER A 20 7.131 -5.605 -12.032 1.00 0.00 O ATOM 291 CB SER A 20 7.739 -8.530 -12.631 1.00 0.00 C ATOM 292 OG SER A 20 7.954 -8.866 -13.990 1.00 0.00 O ATOM 0 H SER A 20 9.467 -8.464 -10.559 1.00 0.00 H new ATOM 0 HA SER A 20 9.130 -6.945 -13.066 1.00 0.00 H new ATOM 0 HB2 SER A 20 7.886 -9.412 -12.007 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.707 -8.209 -12.491 1.00 0.00 H new ATOM 0 HG SER A 20 7.336 -9.580 -14.252 1.00 0.00 H new ATOM 298 N GLY A 21 8.222 -6.096 -10.136 1.00 0.00 N ATOM 299 CA GLY A 21 7.579 -5.083 -9.316 1.00 0.00 C ATOM 300 C GLY A 21 6.159 -5.481 -8.935 1.00 0.00 C ATOM 301 O GLY A 21 5.678 -6.560 -9.287 1.00 0.00 O ATOM 0 H GLY A 21 8.924 -6.636 -9.630 1.00 0.00 H new ATOM 0 HA2 GLY A 21 8.166 -4.921 -8.412 1.00 0.00 H new ATOM 0 HA3 GLY A 21 7.559 -4.137 -9.857 1.00 0.00 H new ATOM 305 N PHE A 22 5.480 -4.617 -8.182 1.00 0.00 N ATOM 306 CA PHE A 22 4.149 -4.914 -7.667 1.00 0.00 C ATOM 307 C PHE A 22 3.199 -5.102 -8.857 1.00 0.00 C ATOM 308 O PHE A 22 3.378 -4.470 -9.904 1.00 0.00 O ATOM 309 CB PHE A 22 3.662 -3.821 -6.694 1.00 0.00 C ATOM 310 CG PHE A 22 4.714 -3.160 -5.809 1.00 0.00 C ATOM 311 CD1 PHE A 22 5.708 -3.920 -5.162 1.00 0.00 C ATOM 312 CD2 PHE A 22 4.725 -1.759 -5.661 1.00 0.00 C ATOM 313 CE1 PHE A 22 6.702 -3.286 -4.400 1.00 0.00 C ATOM 314 CE2 PHE A 22 5.728 -1.121 -4.909 1.00 0.00 C ATOM 315 CZ PHE A 22 6.715 -1.884 -4.266 1.00 0.00 C ATOM 0 H PHE A 22 5.835 -3.699 -7.915 1.00 0.00 H new ATOM 0 HA PHE A 22 4.175 -5.836 -7.086 1.00 0.00 H new ATOM 0 HB2 PHE A 22 3.173 -3.041 -7.278 1.00 0.00 H new ATOM 0 HB3 PHE A 22 2.902 -4.258 -6.047 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.705 -4.996 -5.253 1.00 0.00 H new ATOM 0 HD2 PHE A 22 3.953 -1.167 -6.131 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.463 -3.878 -3.913 1.00 0.00 H new ATOM 0 HE2 PHE A 22 5.739 -0.044 -4.826 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.478 -1.400 -3.674 1.00 0.00 H new ATOM 325 N GLY A 23 2.200 -5.977 -8.726 1.00 0.00 N ATOM 326 CA GLY A 23 1.325 -6.363 -9.832 1.00 0.00 C ATOM 327 C GLY A 23 -0.135 -6.265 -9.424 1.00 0.00 C ATOM 328 O GLY A 23 -0.886 -7.226 -9.585 1.00 0.00 O ATOM 0 H GLY A 23 1.975 -6.439 -7.845 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.511 -5.718 -10.691 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.553 -7.383 -10.143 1.00 0.00 H new ATOM 332 N PHE A 24 -0.541 -5.124 -8.872 1.00 0.00 N ATOM 333 CA PHE A 24 -1.936 -4.791 -8.637 1.00 0.00 C ATOM 334 C PHE A 24 -2.168 -3.356 -9.094 1.00 0.00 C ATOM 335 O PHE A 24 -1.250 -2.528 -9.078 1.00 0.00 O ATOM 336 CB PHE A 24 -2.326 -4.996 -7.167 1.00 0.00 C ATOM 337 CG PHE A 24 -1.762 -3.956 -6.220 1.00 0.00 C ATOM 338 CD1 PHE A 24 -0.492 -4.141 -5.642 1.00 0.00 C ATOM 339 CD2 PHE A 24 -2.494 -2.784 -5.941 1.00 0.00 C ATOM 340 CE1 PHE A 24 0.044 -3.156 -4.797 1.00 0.00 C ATOM 341 CE2 PHE A 24 -1.971 -1.814 -5.078 1.00 0.00 C ATOM 342 CZ PHE A 24 -0.706 -2.010 -4.510 1.00 0.00 C ATOM 0 H PHE A 24 0.105 -4.394 -8.571 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.576 -5.461 -9.211 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.413 -4.991 -7.088 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.988 -5.982 -6.848 1.00 0.00 H new ATOM 0 HD1 PHE A 24 0.070 -5.040 -5.848 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.462 -2.634 -6.395 1.00 0.00 H new ATOM 0 HE1 PHE A 24 1.029 -3.282 -4.371 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.538 -0.923 -4.852 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.303 -1.265 -3.840 1.00 0.00 H new ATOM 352 N ARG A 25 -3.412 -3.080 -9.463 1.00 0.00 N ATOM 353 CA ARG A 25 -3.968 -1.766 -9.717 1.00 0.00 C ATOM 354 C ARG A 25 -4.966 -1.474 -8.606 1.00 0.00 C ATOM 355 O ARG A 25 -5.392 -2.398 -7.912 1.00 0.00 O ATOM 356 CB ARG A 25 -4.614 -1.787 -11.111 1.00 0.00 C ATOM 357 CG ARG A 25 -4.854 -0.374 -11.657 1.00 0.00 C ATOM 358 CD ARG A 25 -5.118 -0.410 -13.165 1.00 0.00 C ATOM 359 NE ARG A 25 -5.296 0.953 -13.690 1.00 0.00 N ATOM 360 CZ ARG A 25 -4.312 1.799 -14.021 1.00 0.00 C ATOM 361 NH1 ARG A 25 -3.033 1.452 -13.915 1.00 0.00 N ATOM 362 NH2 ARG A 25 -4.615 3.012 -14.460 1.00 0.00 N ATOM 0 H ARG A 25 -4.101 -3.819 -9.601 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.217 -0.976 -9.715 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.972 -2.337 -11.799 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.562 -2.322 -11.063 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.703 0.079 -11.145 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -3.986 0.253 -11.450 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -4.286 -0.896 -13.674 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.008 -1.004 -13.370 1.00 0.00 H new ATOM 0 HE ARG A 25 -6.253 1.283 -13.813 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.783 0.523 -13.575 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.302 2.114 -14.174 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -5.591 3.295 -14.544 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.872 3.663 -14.714 1.00 0.00 H new ATOM 376 N ILE A 26 -5.361 -0.217 -8.437 1.00 0.00 N ATOM 377 CA ILE A 26 -6.294 0.239 -7.415 1.00 0.00 C ATOM 378 C ILE A 26 -7.276 1.220 -8.053 1.00 0.00 C ATOM 379 O ILE A 26 -6.941 1.891 -9.036 1.00 0.00 O ATOM 380 CB ILE A 26 -5.551 0.825 -6.190 1.00 0.00 C ATOM 381 CG1 ILE A 26 -4.115 1.328 -6.461 1.00 0.00 C ATOM 382 CG2 ILE A 26 -5.528 -0.230 -5.074 1.00 0.00 C ATOM 383 CD1 ILE A 26 -3.654 2.341 -5.408 1.00 0.00 C ATOM 0 H ILE A 26 -5.027 0.541 -9.032 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.863 -0.605 -7.024 1.00 0.00 H new ATOM 0 HB ILE A 26 -6.109 1.715 -5.901 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.430 0.480 -6.473 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.072 1.787 -7.449 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.007 0.171 -4.205 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -6.550 -0.489 -4.797 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -5.011 -1.122 -5.427 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.640 2.668 -5.637 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.323 3.202 -5.414 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.671 1.875 -4.423 1.00 0.00 H new ATOM 395 N LEU A 27 -8.493 1.260 -7.510 1.00 0.00 N ATOM 396 CA LEU A 27 -9.667 1.955 -8.038 1.00 0.00 C ATOM 397 C LEU A 27 -10.343 2.709 -6.891 1.00 0.00 C ATOM 398 O LEU A 27 -9.821 2.735 -5.772 1.00 0.00 O ATOM 399 CB LEU A 27 -10.628 0.942 -8.703 1.00 0.00 C ATOM 400 CG LEU A 27 -10.060 0.278 -9.972 1.00 0.00 C ATOM 401 CD1 LEU A 27 -10.924 -0.894 -10.453 1.00 0.00 C ATOM 402 CD2 LEU A 27 -9.890 1.275 -11.126 1.00 0.00 C ATOM 0 H LEU A 27 -8.698 0.778 -6.635 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.374 2.673 -8.804 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.878 0.165 -7.980 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.557 1.452 -8.957 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.079 -0.100 -9.683 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.482 -1.328 -11.350 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.977 -1.652 -9.671 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.928 -0.536 -10.681 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -9.487 0.758 -11.997 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.858 1.709 -11.377 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.204 2.067 -10.825 1.00 0.00 H new ATOM 414 N GLY A 28 -11.470 3.361 -7.174 1.00 0.00 N ATOM 415 CA GLY A 28 -12.211 4.111 -6.178 1.00 0.00 C ATOM 416 C GLY A 28 -11.414 5.323 -5.720 1.00 0.00 C ATOM 417 O GLY A 28 -10.814 6.028 -6.538 1.00 0.00 O ATOM 0 H GLY A 28 -11.890 3.380 -8.103 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -13.166 4.433 -6.593 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -12.434 3.471 -5.324 1.00 0.00 H new ATOM 421 N GLY A 29 -11.480 5.599 -4.418 1.00 0.00 N ATOM 422 CA GLY A 29 -10.864 6.711 -3.705 1.00 0.00 C ATOM 423 C GLY A 29 -11.158 8.062 -4.345 1.00 0.00 C ATOM 424 O GLY A 29 -10.399 9.019 -4.179 1.00 0.00 O ATOM 0 H GLY A 29 -12.010 5.000 -3.785 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.220 6.717 -2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.785 6.559 -3.668 1.00 0.00 H new ATOM 428 N ASP A 30 -12.255 8.152 -5.096 1.00 0.00 N ATOM 429 CA ASP A 30 -12.702 9.409 -5.665 1.00 0.00 C ATOM 430 C ASP A 30 -13.157 10.357 -4.563 1.00 0.00 C ATOM 431 O ASP A 30 -13.064 11.571 -4.729 1.00 0.00 O ATOM 432 CB ASP A 30 -13.843 9.169 -6.649 1.00 0.00 C ATOM 433 CG ASP A 30 -14.298 10.488 -7.262 1.00 0.00 C ATOM 434 OD1 ASP A 30 -13.434 11.154 -7.883 1.00 0.00 O ATOM 435 OD2 ASP A 30 -15.502 10.816 -7.115 1.00 0.00 O ATOM 0 H ASP A 30 -12.852 7.356 -5.322 1.00 0.00 H new ATOM 0 HA ASP A 30 -11.867 9.863 -6.198 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.517 8.488 -7.435 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -14.678 8.690 -6.138 1.00 0.00 H new ATOM 440 N GLU A 31 -13.581 9.826 -3.416 1.00 0.00 N ATOM 441 CA GLU A 31 -14.001 10.615 -2.277 1.00 0.00 C ATOM 442 C GLU A 31 -13.153 10.266 -1.053 1.00 0.00 C ATOM 443 O GLU A 31 -12.563 9.182 -1.001 1.00 0.00 O ATOM 444 CB GLU A 31 -15.485 10.369 -2.037 1.00 0.00 C ATOM 445 CG GLU A 31 -16.396 11.149 -2.989 1.00 0.00 C ATOM 446 CD GLU A 31 -16.343 12.645 -2.700 1.00 0.00 C ATOM 447 OE1 GLU A 31 -17.047 13.091 -1.771 1.00 0.00 O ATOM 448 OE2 GLU A 31 -15.561 13.370 -3.365 1.00 0.00 O ATOM 0 H GLU A 31 -13.640 8.820 -3.258 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.854 11.677 -2.472 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -15.690 9.304 -2.142 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.729 10.641 -1.010 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -16.093 10.964 -4.020 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.421 10.793 -2.889 1.00 0.00 H new ATOM 455 N PRO A 32 -13.038 11.184 -0.078 1.00 0.00 N ATOM 456 CA PRO A 32 -12.251 10.946 1.115 1.00 0.00 C ATOM 457 C PRO A 32 -12.918 9.851 1.927 1.00 0.00 C ATOM 458 O PRO A 32 -14.133 9.867 2.145 1.00 0.00 O ATOM 459 CB PRO A 32 -12.184 12.279 1.867 1.00 0.00 C ATOM 460 CG PRO A 32 -13.146 13.231 1.146 1.00 0.00 C ATOM 461 CD PRO A 32 -13.821 12.402 0.056 1.00 0.00 C ATOM 0 HA PRO A 32 -11.238 10.608 0.896 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -12.473 12.151 2.910 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -11.169 12.676 1.864 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -13.883 13.639 1.838 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -12.609 14.077 0.717 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -14.852 12.173 0.325 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -13.851 12.950 -0.886 1.00 0.00 H new ATOM 469 N GLY A 33 -12.103 8.900 2.362 1.00 0.00 N ATOM 470 CA GLY A 33 -12.512 7.858 3.273 1.00 0.00 C ATOM 471 C GLY A 33 -13.476 6.848 2.664 1.00 0.00 C ATOM 472 O GLY A 33 -14.165 6.148 3.402 1.00 0.00 O ATOM 0 H GLY A 33 -11.124 8.836 2.083 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.626 7.331 3.628 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.982 8.315 4.144 1.00 0.00 H new ATOM 476 N GLN A 34 -13.548 6.755 1.337 1.00 0.00 N ATOM 477 CA GLN A 34 -14.242 5.672 0.670 1.00 0.00 C ATOM 478 C GLN A 34 -13.438 4.362 0.796 1.00 0.00 C ATOM 479 O GLN A 34 -12.239 4.386 1.113 1.00 0.00 O ATOM 480 CB GLN A 34 -14.550 6.135 -0.767 1.00 0.00 C ATOM 481 CG GLN A 34 -15.859 6.925 -0.838 1.00 0.00 C ATOM 482 CD GLN A 34 -17.115 6.140 -0.458 1.00 0.00 C ATOM 483 OE1 GLN A 34 -17.436 5.938 0.713 1.00 0.00 O ATOM 484 NE2 GLN A 34 -17.859 5.685 -1.448 1.00 0.00 N ATOM 0 H GLN A 34 -13.125 7.431 0.701 1.00 0.00 H new ATOM 0 HA GLN A 34 -15.198 5.435 1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -13.731 6.754 -1.134 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -14.612 5.267 -1.424 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -15.778 7.791 -0.181 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -15.981 7.305 -1.852 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -17.583 5.858 -2.415 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -18.710 5.160 -1.247 1.00 0.00 H new ATOM 493 N PRO A 35 -14.061 3.194 0.567 1.00 0.00 N ATOM 494 CA PRO A 35 -13.354 1.924 0.566 1.00 0.00 C ATOM 495 C PRO A 35 -12.475 1.834 -0.663 1.00 0.00 C ATOM 496 O PRO A 35 -12.960 1.945 -1.790 1.00 0.00 O ATOM 497 CB PRO A 35 -14.399 0.826 0.561 1.00 0.00 C ATOM 498 CG PRO A 35 -15.705 1.513 0.138 1.00 0.00 C ATOM 499 CD PRO A 35 -15.436 3.023 0.138 1.00 0.00 C ATOM 0 HA PRO A 35 -12.714 1.827 1.443 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.130 0.030 -0.134 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -14.495 0.370 1.546 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.015 1.176 -0.851 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.512 1.265 0.827 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.588 3.445 -0.856 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.120 3.539 0.811 1.00 0.00 H new ATOM 507 N ILE A 36 -11.176 1.707 -0.441 1.00 0.00 N ATOM 508 CA ILE A 36 -10.202 1.557 -1.511 1.00 0.00 C ATOM 509 C ILE A 36 -10.069 0.072 -1.743 1.00 0.00 C ATOM 510 O ILE A 36 -9.378 -0.605 -0.987 1.00 0.00 O ATOM 511 CB ILE A 36 -8.867 2.268 -1.184 1.00 0.00 C ATOM 512 CG1 ILE A 36 -9.112 3.790 -1.238 1.00 0.00 C ATOM 513 CG2 ILE A 36 -7.753 1.873 -2.181 1.00 0.00 C ATOM 514 CD1 ILE A 36 -7.914 4.644 -0.827 1.00 0.00 C ATOM 0 H ILE A 36 -10.765 1.705 0.493 1.00 0.00 H new ATOM 0 HA ILE A 36 -10.528 2.045 -2.429 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.532 1.965 -0.192 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.404 4.062 -2.253 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.953 4.032 -0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.830 2.392 -1.920 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.589 0.796 -2.136 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -8.053 2.152 -3.191 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.179 5.699 -0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.633 4.407 0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.075 4.437 -1.491 1.00 0.00 H new ATOM 526 N LEU A 37 -10.771 -0.449 -2.742 1.00 0.00 N ATOM 527 CA LEU A 37 -10.619 -1.849 -3.082 1.00 0.00 C ATOM 528 C LEU A 37 -9.416 -2.011 -3.993 1.00 0.00 C ATOM 529 O LEU A 37 -9.076 -1.117 -4.777 1.00 0.00 O ATOM 530 CB LEU A 37 -11.900 -2.429 -3.696 1.00 0.00 C ATOM 531 CG LEU A 37 -13.151 -2.202 -2.824 1.00 0.00 C ATOM 532 CD1 LEU A 37 -14.307 -3.069 -3.332 1.00 0.00 C ATOM 533 CD2 LEU A 37 -12.915 -2.483 -1.338 1.00 0.00 C ATOM 0 H LEU A 37 -11.436 0.068 -3.317 1.00 0.00 H new ATOM 0 HA LEU A 37 -10.444 -2.422 -2.171 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.062 -1.978 -4.675 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.766 -3.499 -3.856 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.400 -1.144 -2.911 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.187 -2.903 -2.711 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.536 -2.802 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -14.022 -4.120 -3.284 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -13.836 -2.303 -0.783 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -12.610 -3.521 -1.208 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.131 -1.825 -0.963 1.00 0.00 H new ATOM 545 N ILE A 38 -8.802 -3.190 -3.925 1.00 0.00 N ATOM 546 CA ILE A 38 -7.854 -3.647 -4.915 1.00 0.00 C ATOM 547 C ILE A 38 -8.596 -3.580 -6.249 1.00 0.00 C ATOM 548 O ILE A 38 -9.667 -4.174 -6.418 1.00 0.00 O ATOM 549 CB ILE A 38 -7.362 -5.067 -4.590 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.657 -5.151 -3.219 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.441 -5.607 -5.701 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.330 -4.393 -3.130 1.00 0.00 C ATOM 0 H ILE A 38 -8.957 -3.856 -3.168 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.955 -3.031 -4.941 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.251 -5.695 -4.536 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.332 -4.764 -2.455 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.476 -6.200 -2.983 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -6.110 -6.613 -5.442 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.987 -5.636 -6.644 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.574 -4.955 -5.804 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.910 -4.510 -2.131 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.632 -4.793 -3.866 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.501 -3.335 -3.330 1.00 0.00 H new ATOM 564 N GLY A 39 -8.028 -2.820 -7.175 1.00 0.00 N ATOM 565 CA GLY A 39 -8.577 -2.565 -8.485 1.00 0.00 C ATOM 566 C GLY A 39 -8.562 -3.850 -9.282 1.00 0.00 C ATOM 567 O GLY A 39 -9.615 -4.371 -9.639 1.00 0.00 O ATOM 0 H GLY A 39 -7.137 -2.349 -7.021 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.596 -2.187 -8.399 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.994 -1.798 -8.995 1.00 0.00 H new ATOM 571 N ALA A 40 -7.365 -4.383 -9.530 1.00 0.00 N ATOM 572 CA ALA A 40 -7.173 -5.686 -10.138 1.00 0.00 C ATOM 573 C ALA A 40 -5.756 -6.162 -9.842 1.00 0.00 C ATOM 574 O ALA A 40 -4.817 -5.406 -10.084 1.00 0.00 O ATOM 575 CB ALA A 40 -7.369 -5.575 -11.650 1.00 0.00 C ATOM 0 H ALA A 40 -6.491 -3.907 -9.307 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.894 -6.396 -9.733 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.225 -6.553 -12.108 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.378 -5.220 -11.861 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.644 -4.872 -12.060 1.00 0.00 H new ATOM 581 N VAL A 41 -5.560 -7.377 -9.329 1.00 0.00 N ATOM 582 CA VAL A 41 -4.279 -8.029 -9.310 1.00 0.00 C ATOM 583 C VAL A 41 -4.059 -8.664 -10.685 1.00 0.00 C ATOM 584 O VAL A 41 -4.936 -9.342 -11.219 1.00 0.00 O ATOM 585 CB VAL A 41 -4.151 -8.930 -8.079 1.00 0.00 C ATOM 586 CG1 VAL A 41 -4.948 -8.510 -6.843 1.00 0.00 C ATOM 587 CG2 VAL A 41 -4.292 -10.408 -8.339 1.00 0.00 C ATOM 0 H VAL A 41 -6.307 -7.932 -8.912 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.446 -7.339 -9.175 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.105 -8.754 -7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.776 -9.225 -6.039 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.627 -7.519 -6.522 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.010 -8.486 -7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.185 -10.954 -7.402 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.274 -10.610 -8.767 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.519 -10.730 -9.037 1.00 0.00 H new ATOM 597 N ILE A 42 -2.914 -8.366 -11.288 1.00 0.00 N ATOM 598 CA ILE A 42 -2.542 -8.775 -12.631 1.00 0.00 C ATOM 599 C ILE A 42 -2.334 -10.296 -12.640 1.00 0.00 C ATOM 600 O ILE A 42 -1.618 -10.807 -11.774 1.00 0.00 O ATOM 601 CB ILE A 42 -1.277 -7.978 -13.018 1.00 0.00 C ATOM 602 CG1 ILE A 42 -1.502 -6.446 -12.944 1.00 0.00 C ATOM 603 CG2 ILE A 42 -0.714 -8.375 -14.388 1.00 0.00 C ATOM 604 CD1 ILE A 42 -2.679 -5.905 -13.770 1.00 0.00 C ATOM 0 H ILE A 42 -2.191 -7.809 -10.832 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.314 -8.561 -13.370 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.529 -8.245 -12.272 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.657 -6.170 -11.901 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.591 -5.947 -13.274 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.174 -7.780 -14.603 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.449 -9.432 -14.380 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -1.466 -8.195 -15.156 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.745 -4.824 -13.645 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.523 -6.140 -14.823 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.606 -6.366 -13.429 1.00 0.00 H new ATOM 616 N ALA A 43 -2.906 -10.994 -13.627 1.00 0.00 N ATOM 617 CA ALA A 43 -2.898 -12.458 -13.730 1.00 0.00 C ATOM 618 C ALA A 43 -1.495 -13.069 -13.756 1.00 0.00 C ATOM 619 O ALA A 43 -1.308 -14.186 -13.285 1.00 0.00 O ATOM 620 CB ALA A 43 -3.632 -12.894 -15.000 1.00 0.00 C ATOM 0 H ALA A 43 -3.401 -10.544 -14.397 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.397 -12.821 -12.831 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.622 -13.982 -15.071 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.663 -12.542 -14.964 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.134 -12.470 -15.872 1.00 0.00 H new ATOM 626 N MET A 44 -0.504 -12.358 -14.297 1.00 0.00 N ATOM 627 CA MET A 44 0.903 -12.735 -14.213 1.00 0.00 C ATOM 628 C MET A 44 1.682 -11.549 -13.658 1.00 0.00 C ATOM 629 O MET A 44 2.601 -11.030 -14.288 1.00 0.00 O ATOM 630 CB MET A 44 1.457 -13.205 -15.560 1.00 0.00 C ATOM 631 CG MET A 44 0.730 -14.395 -16.175 1.00 0.00 C ATOM 632 SD MET A 44 1.684 -15.079 -17.558 1.00 0.00 S ATOM 633 CE MET A 44 0.752 -16.598 -17.830 1.00 0.00 C ATOM 0 H MET A 44 -0.661 -11.492 -14.813 1.00 0.00 H new ATOM 0 HA MET A 44 1.009 -13.588 -13.543 1.00 0.00 H new ATOM 0 HB2 MET A 44 1.419 -12.372 -16.262 1.00 0.00 H new ATOM 0 HB3 MET A 44 2.508 -13.466 -15.433 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.574 -15.164 -15.418 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.255 -14.086 -16.523 1.00 0.00 H new ATOM 0 HE1 MET A 44 1.198 -17.156 -18.653 1.00 0.00 H new ATOM 0 HE2 MET A 44 0.775 -17.206 -16.925 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.281 -16.352 -18.076 1.00 0.00 H new ATOM 643 N GLY A 45 1.267 -11.055 -12.497 1.00 0.00 N ATOM 644 CA GLY A 45 2.009 -10.067 -11.741 1.00 0.00 C ATOM 645 C GLY A 45 2.501 -10.696 -10.445 1.00 0.00 C ATOM 646 O GLY A 45 2.078 -11.783 -10.041 1.00 0.00 O ATOM 0 H GLY A 45 0.393 -11.337 -12.053 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.853 -9.703 -12.326 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.376 -9.206 -11.524 1.00 0.00 H new ATOM 650 N SER A 46 3.378 -9.976 -9.754 1.00 0.00 N ATOM 651 CA SER A 46 4.001 -10.449 -8.527 1.00 0.00 C ATOM 652 C SER A 46 3.028 -10.604 -7.350 1.00 0.00 C ATOM 653 O SER A 46 3.480 -11.050 -6.301 1.00 0.00 O ATOM 654 CB SER A 46 5.150 -9.503 -8.160 1.00 0.00 C ATOM 655 OG SER A 46 6.282 -10.220 -7.709 1.00 0.00 O ATOM 0 H SER A 46 3.677 -9.042 -10.033 1.00 0.00 H new ATOM 0 HA SER A 46 4.374 -11.454 -8.722 1.00 0.00 H new ATOM 0 HB2 SER A 46 5.420 -8.902 -9.028 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.821 -8.812 -7.383 1.00 0.00 H new ATOM 0 HG SER A 46 6.999 -9.591 -7.484 1.00 0.00 H new ATOM 661 N ALA A 47 1.764 -10.181 -7.466 1.00 0.00 N ATOM 662 CA ALA A 47 0.792 -10.308 -6.395 1.00 0.00 C ATOM 663 C ALA A 47 0.092 -11.666 -6.465 1.00 0.00 C ATOM 664 O ALA A 47 0.147 -12.410 -5.488 1.00 0.00 O ATOM 665 CB ALA A 47 -0.192 -9.143 -6.448 1.00 0.00 C ATOM 0 H ALA A 47 1.394 -9.742 -8.309 1.00 0.00 H new ATOM 0 HA ALA A 47 1.302 -10.265 -5.432 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.919 -9.244 -5.642 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.349 -8.204 -6.333 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.710 -9.148 -7.407 1.00 0.00 H new ATOM 671 N ASP A 48 -0.534 -12.001 -7.596 1.00 0.00 N ATOM 672 CA ASP A 48 -1.245 -13.277 -7.753 1.00 0.00 C ATOM 673 C ASP A 48 -0.286 -14.450 -7.576 1.00 0.00 C ATOM 674 O ASP A 48 -0.556 -15.383 -6.817 1.00 0.00 O ATOM 675 CB ASP A 48 -1.918 -13.390 -9.126 1.00 0.00 C ATOM 676 CG ASP A 48 -2.541 -14.777 -9.299 1.00 0.00 C ATOM 677 OD1 ASP A 48 -3.257 -15.233 -8.385 1.00 0.00 O ATOM 678 OD2 ASP A 48 -2.275 -15.429 -10.334 1.00 0.00 O ATOM 0 H ASP A 48 -0.564 -11.404 -8.422 1.00 0.00 H new ATOM 0 HA ASP A 48 -2.016 -13.307 -6.983 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.686 -12.624 -9.226 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.186 -13.212 -9.913 1.00 0.00 H new ATOM 683 N ARG A 49 0.882 -14.371 -8.217 1.00 0.00 N ATOM 684 CA ARG A 49 1.926 -15.384 -8.091 1.00 0.00 C ATOM 685 C ARG A 49 2.422 -15.561 -6.659 1.00 0.00 C ATOM 686 O ARG A 49 3.113 -16.531 -6.375 1.00 0.00 O ATOM 687 CB ARG A 49 3.074 -15.054 -9.054 1.00 0.00 C ATOM 688 CG ARG A 49 3.981 -13.917 -8.598 1.00 0.00 C ATOM 689 CD ARG A 49 5.135 -14.356 -7.677 1.00 0.00 C ATOM 690 NE ARG A 49 6.160 -13.307 -7.563 1.00 0.00 N ATOM 691 CZ ARG A 49 7.475 -13.460 -7.749 1.00 0.00 C ATOM 692 NH1 ARG A 49 8.013 -14.661 -7.919 1.00 0.00 N ATOM 693 NH2 ARG A 49 8.254 -12.391 -7.800 1.00 0.00 N ATOM 0 H ARG A 49 1.129 -13.601 -8.838 1.00 0.00 H new ATOM 0 HA ARG A 49 1.491 -16.346 -8.363 1.00 0.00 H new ATOM 0 HB2 ARG A 49 3.680 -15.949 -9.196 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.652 -14.797 -10.026 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.400 -13.427 -9.477 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.378 -13.174 -8.076 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.743 -14.593 -6.688 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.587 -15.268 -8.067 1.00 0.00 H new ATOM 0 HE ARG A 49 5.836 -12.371 -7.318 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.421 -15.491 -7.909 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.019 -14.754 -8.059 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.850 -11.460 -7.698 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.258 -12.498 -7.942 1.00 0.00 H new ATOM 707 N ASP A 50 2.180 -14.582 -5.792 1.00 0.00 N ATOM 708 CA ASP A 50 2.599 -14.580 -4.397 1.00 0.00 C ATOM 709 C ASP A 50 1.483 -15.072 -3.465 1.00 0.00 C ATOM 710 O ASP A 50 1.755 -15.500 -2.345 1.00 0.00 O ATOM 711 CB ASP A 50 3.099 -13.180 -4.048 1.00 0.00 C ATOM 712 CG ASP A 50 3.468 -13.029 -2.587 1.00 0.00 C ATOM 713 OD1 ASP A 50 4.614 -13.395 -2.241 1.00 0.00 O ATOM 714 OD2 ASP A 50 2.631 -12.501 -1.821 1.00 0.00 O ATOM 0 H ASP A 50 1.668 -13.739 -6.053 1.00 0.00 H new ATOM 0 HA ASP A 50 3.416 -15.287 -4.252 1.00 0.00 H new ATOM 0 HB2 ASP A 50 3.969 -12.948 -4.662 1.00 0.00 H new ATOM 0 HB3 ASP A 50 2.328 -12.452 -4.299 1.00 0.00 H new ATOM 719 N GLY A 51 0.227 -15.089 -3.921 1.00 0.00 N ATOM 720 CA GLY A 51 -0.867 -15.800 -3.266 1.00 0.00 C ATOM 721 C GLY A 51 -1.313 -15.169 -1.948 1.00 0.00 C ATOM 722 O GLY A 51 -1.522 -15.891 -0.967 1.00 0.00 O ATOM 0 H GLY A 51 -0.059 -14.600 -4.769 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.719 -15.841 -3.945 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.559 -16.829 -3.079 1.00 0.00 H new ATOM 726 N ARG A 52 -1.479 -13.840 -1.917 1.00 0.00 N ATOM 727 CA ARG A 52 -2.162 -13.153 -0.819 1.00 0.00 C ATOM 728 C ARG A 52 -3.172 -12.137 -1.340 1.00 0.00 C ATOM 729 O ARG A 52 -4.293 -12.100 -0.829 1.00 0.00 O ATOM 730 CB ARG A 52 -1.180 -12.469 0.145 1.00 0.00 C ATOM 731 CG ARG A 52 -0.017 -13.334 0.649 1.00 0.00 C ATOM 732 CD ARG A 52 0.691 -12.694 1.863 1.00 0.00 C ATOM 733 NE ARG A 52 -0.077 -12.794 3.115 1.00 0.00 N ATOM 734 CZ ARG A 52 -0.402 -13.941 3.727 1.00 0.00 C ATOM 735 NH1 ARG A 52 0.145 -15.101 3.358 1.00 0.00 N ATOM 736 NH2 ARG A 52 -1.253 -13.920 4.741 1.00 0.00 N ATOM 0 H ARG A 52 -1.144 -13.215 -2.650 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.694 -13.924 -0.262 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.765 -11.592 -0.352 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.740 -12.110 1.008 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.391 -14.320 0.925 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.703 -13.480 -0.156 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.660 -13.174 2.002 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.883 -11.643 1.648 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.385 -11.924 3.550 1.00 0.00 H new ATOM 0 HH11 ARG A 52 0.824 -15.126 2.597 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.116 -15.963 3.837 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -1.656 -13.035 5.051 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -1.506 -14.788 5.213 1.00 0.00 H new ATOM 750 N LEU A 53 -2.797 -11.270 -2.293 1.00 0.00 N ATOM 751 CA LEU A 53 -3.757 -10.282 -2.779 1.00 0.00 C ATOM 752 C LEU A 53 -4.797 -10.941 -3.676 1.00 0.00 C ATOM 753 O LEU A 53 -4.461 -11.802 -4.488 1.00 0.00 O ATOM 754 CB LEU A 53 -3.134 -9.135 -3.582 1.00 0.00 C ATOM 755 CG LEU A 53 -2.446 -8.023 -2.789 1.00 0.00 C ATOM 756 CD1 LEU A 53 -1.885 -7.013 -3.798 1.00 0.00 C ATOM 757 CD2 LEU A 53 -3.376 -7.284 -1.822 1.00 0.00 C ATOM 0 H LEU A 53 -1.873 -11.235 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.199 -9.864 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.404 -9.561 -4.270 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.918 -8.682 -4.189 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.671 -8.487 -2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.386 -6.204 -3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.170 -7.511 -4.452 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.700 -6.605 -4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.815 -6.511 -1.297 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.191 -6.824 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.785 -7.990 -1.099 1.00 0.00 H new ATOM 769 N HIS A 54 -6.013 -10.395 -3.647 1.00 0.00 N ATOM 770 CA HIS A 54 -7.097 -10.716 -4.561 1.00 0.00 C ATOM 771 C HIS A 54 -7.888 -9.472 -4.987 1.00 0.00 C ATOM 772 O HIS A 54 -7.992 -8.494 -4.243 1.00 0.00 O ATOM 773 CB HIS A 54 -8.018 -11.770 -3.941 1.00 0.00 C ATOM 774 CG HIS A 54 -7.493 -13.163 -4.173 1.00 0.00 C ATOM 775 ND1 HIS A 54 -7.072 -14.076 -3.232 1.00 0.00 N ATOM 776 CD2 HIS A 54 -7.289 -13.719 -5.405 1.00 0.00 C ATOM 777 CE1 HIS A 54 -6.666 -15.172 -3.898 1.00 0.00 C ATOM 778 NE2 HIS A 54 -6.787 -15.005 -5.228 1.00 0.00 N ATOM 0 H HIS A 54 -6.275 -9.690 -2.958 1.00 0.00 H new ATOM 0 HA HIS A 54 -6.652 -11.127 -5.467 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -8.112 -11.589 -2.870 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -9.017 -11.680 -4.369 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -7.484 -13.242 -6.354 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -6.292 -16.069 -3.427 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -6.558 -15.682 -5.956 1.00 0.00 H new ATOM 786 N PRO A 55 -8.425 -9.479 -6.221 1.00 0.00 N ATOM 787 CA PRO A 55 -9.103 -8.338 -6.815 1.00 0.00 C ATOM 788 C PRO A 55 -10.517 -8.148 -6.266 1.00 0.00 C ATOM 789 O PRO A 55 -11.491 -8.705 -6.786 1.00 0.00 O ATOM 790 CB PRO A 55 -9.052 -8.588 -8.315 1.00 0.00 C ATOM 791 CG PRO A 55 -8.982 -10.103 -8.457 1.00 0.00 C ATOM 792 CD PRO A 55 -8.268 -10.552 -7.197 1.00 0.00 C ATOM 0 HA PRO A 55 -8.617 -7.395 -6.565 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.934 -8.185 -8.813 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.184 -8.108 -8.766 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.976 -10.544 -8.532 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.435 -10.396 -9.353 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.694 -11.482 -6.821 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -7.213 -10.742 -7.397 1.00 0.00 H new ATOM 800 N GLY A 56 -10.594 -7.322 -5.227 1.00 0.00 N ATOM 801 CA GLY A 56 -11.815 -6.910 -4.542 1.00 0.00 C ATOM 802 C GLY A 56 -11.611 -6.675 -3.047 1.00 0.00 C ATOM 803 O GLY A 56 -12.470 -6.072 -2.410 1.00 0.00 O ATOM 0 H GLY A 56 -9.761 -6.899 -4.818 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.191 -5.995 -5.000 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.579 -7.674 -4.683 1.00 0.00 H new ATOM 807 N ASP A 57 -10.489 -7.113 -2.471 1.00 0.00 N ATOM 808 CA ASP A 57 -10.169 -6.885 -1.057 1.00 0.00 C ATOM 809 C ASP A 57 -10.049 -5.382 -0.791 1.00 0.00 C ATOM 810 O ASP A 57 -9.722 -4.634 -1.712 1.00 0.00 O ATOM 811 CB ASP A 57 -8.848 -7.583 -0.706 1.00 0.00 C ATOM 812 CG ASP A 57 -8.953 -9.101 -0.520 1.00 0.00 C ATOM 813 OD1 ASP A 57 -9.963 -9.709 -0.930 1.00 0.00 O ATOM 814 OD2 ASP A 57 -8.007 -9.712 0.032 1.00 0.00 O ATOM 0 H ASP A 57 -9.773 -7.638 -2.973 1.00 0.00 H new ATOM 0 HA ASP A 57 -10.966 -7.296 -0.437 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -8.124 -7.377 -1.494 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -8.454 -7.145 0.211 1.00 0.00 H new ATOM 819 N GLU A 58 -10.282 -4.921 0.442 1.00 0.00 N ATOM 820 CA GLU A 58 -10.210 -3.503 0.798 1.00 0.00 C ATOM 821 C GLU A 58 -8.830 -3.226 1.385 1.00 0.00 C ATOM 822 O GLU A 58 -8.363 -3.991 2.223 1.00 0.00 O ATOM 823 CB GLU A 58 -11.333 -3.159 1.792 1.00 0.00 C ATOM 824 CG GLU A 58 -11.692 -1.652 1.810 1.00 0.00 C ATOM 825 CD GLU A 58 -11.480 -0.925 3.147 1.00 0.00 C ATOM 826 OE1 GLU A 58 -11.562 -1.560 4.227 1.00 0.00 O ATOM 827 OE2 GLU A 58 -11.425 0.329 3.131 1.00 0.00 O ATOM 0 H GLU A 58 -10.527 -5.527 1.225 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.350 -2.874 -0.081 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.223 -3.735 1.538 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.030 -3.466 2.793 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.098 -1.148 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.738 -1.545 1.523 1.00 0.00 H new ATOM 834 N LEU A 59 -8.148 -2.178 0.932 1.00 0.00 N ATOM 835 CA LEU A 59 -6.852 -1.760 1.451 1.00 0.00 C ATOM 836 C LEU A 59 -7.025 -0.974 2.746 1.00 0.00 C ATOM 837 O LEU A 59 -8.056 -0.346 2.980 1.00 0.00 O ATOM 838 CB LEU A 59 -6.087 -0.917 0.409 1.00 0.00 C ATOM 839 CG LEU A 59 -5.066 -1.737 -0.401 1.00 0.00 C ATOM 840 CD1 LEU A 59 -4.439 -0.859 -1.480 1.00 0.00 C ATOM 841 CD2 LEU A 59 -3.910 -2.250 0.471 1.00 0.00 C ATOM 0 H LEU A 59 -8.490 -1.583 0.177 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.266 -2.655 1.661 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.802 -0.460 -0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.569 -0.104 0.918 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.612 -2.581 -0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.717 -1.443 -2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.218 -0.492 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.933 -0.014 -1.013 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.216 -2.822 -0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.387 -1.404 0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.306 -2.888 1.261 1.00 0.00 H new ATOM 853 N VAL A 60 -5.973 -0.971 3.560 1.00 0.00 N ATOM 854 CA VAL A 60 -5.927 -0.328 4.864 1.00 0.00 C ATOM 855 C VAL A 60 -4.636 0.458 4.991 1.00 0.00 C ATOM 856 O VAL A 60 -4.673 1.635 5.353 1.00 0.00 O ATOM 857 CB VAL A 60 -5.996 -1.364 6.002 1.00 0.00 C ATOM 858 CG1 VAL A 60 -6.334 -0.637 7.303 1.00 0.00 C ATOM 859 CG2 VAL A 60 -7.017 -2.466 5.763 1.00 0.00 C ATOM 0 H VAL A 60 -5.097 -1.435 3.318 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.788 0.335 4.946 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.022 -1.851 6.053 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.387 -1.357 8.119 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.561 0.100 7.519 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.296 -0.135 7.200 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.009 -3.158 6.605 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -8.010 -2.027 5.663 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.765 -3.004 4.849 1.00 0.00 H new ATOM 869 N TYR A 61 -3.504 -0.187 4.720 1.00 0.00 N ATOM 870 CA TYR A 61 -2.191 0.405 4.844 1.00 0.00 C ATOM 871 C TYR A 61 -1.425 0.081 3.577 1.00 0.00 C ATOM 872 O TYR A 61 -1.624 -0.973 2.975 1.00 0.00 O ATOM 873 CB TYR A 61 -1.459 -0.125 6.077 1.00 0.00 C ATOM 874 CG TYR A 61 -2.044 0.282 7.412 1.00 0.00 C ATOM 875 CD1 TYR A 61 -1.679 1.522 7.962 1.00 0.00 C ATOM 876 CD2 TYR A 61 -2.961 -0.541 8.094 1.00 0.00 C ATOM 877 CE1 TYR A 61 -2.257 1.979 9.155 1.00 0.00 C ATOM 878 CE2 TYR A 61 -3.534 -0.105 9.302 1.00 0.00 C ATOM 879 CZ TYR A 61 -3.213 1.174 9.816 1.00 0.00 C ATOM 880 OH TYR A 61 -3.903 1.660 10.884 1.00 0.00 O ATOM 0 H TYR A 61 -3.482 -1.156 4.402 1.00 0.00 H new ATOM 0 HA TYR A 61 -2.276 1.484 4.972 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.440 -1.214 6.026 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -0.424 0.214 6.036 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.943 2.132 7.459 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -3.224 -1.507 7.689 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.974 2.937 9.565 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.219 -0.746 9.837 1.00 0.00 H new ATOM 0 HH TYR A 61 -4.519 0.974 11.215 1.00 0.00 H new ATOM 890 N VAL A 62 -0.568 1.008 3.179 1.00 0.00 N ATOM 891 CA VAL A 62 0.223 0.973 1.969 1.00 0.00 C ATOM 892 C VAL A 62 1.547 1.609 2.365 1.00 0.00 C ATOM 893 O VAL A 62 1.558 2.772 2.752 1.00 0.00 O ATOM 894 CB VAL A 62 -0.507 1.751 0.855 1.00 0.00 C ATOM 895 CG1 VAL A 62 0.404 1.956 -0.361 1.00 0.00 C ATOM 896 CG2 VAL A 62 -1.785 1.031 0.400 1.00 0.00 C ATOM 0 H VAL A 62 -0.400 1.852 3.727 1.00 0.00 H new ATOM 0 HA VAL A 62 0.382 -0.030 1.572 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.778 2.718 1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.136 2.507 -1.131 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.287 2.520 -0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.709 0.986 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.270 1.611 -0.385 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.529 0.043 0.016 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.465 0.927 1.246 1.00 0.00 H new ATOM 906 N ASP A 63 2.647 0.857 2.313 1.00 0.00 N ATOM 907 CA ASP A 63 3.947 1.201 2.906 1.00 0.00 C ATOM 908 C ASP A 63 3.831 1.438 4.421 1.00 0.00 C ATOM 909 O ASP A 63 4.613 2.169 5.032 1.00 0.00 O ATOM 910 CB ASP A 63 4.607 2.374 2.162 1.00 0.00 C ATOM 911 CG ASP A 63 6.104 2.521 2.443 1.00 0.00 C ATOM 912 OD1 ASP A 63 6.730 1.628 3.056 1.00 0.00 O ATOM 913 OD2 ASP A 63 6.676 3.537 1.983 1.00 0.00 O ATOM 0 H ASP A 63 2.661 -0.046 1.838 1.00 0.00 H new ATOM 0 HA ASP A 63 4.612 0.346 2.783 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.460 2.241 1.090 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.102 3.299 2.441 1.00 0.00 H new ATOM 918 N GLY A 64 2.818 0.835 5.046 1.00 0.00 N ATOM 919 CA GLY A 64 2.468 1.047 6.439 1.00 0.00 C ATOM 920 C GLY A 64 1.784 2.392 6.680 1.00 0.00 C ATOM 921 O GLY A 64 1.479 2.710 7.831 1.00 0.00 O ATOM 0 H GLY A 64 2.205 0.168 4.578 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.808 0.245 6.769 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.370 0.989 7.048 1.00 0.00 H new ATOM 925 N ILE A 65 1.558 3.215 5.653 1.00 0.00 N ATOM 926 CA ILE A 65 0.846 4.480 5.741 1.00 0.00 C ATOM 927 C ILE A 65 -0.640 4.154 5.585 1.00 0.00 C ATOM 928 O ILE A 65 -1.018 3.450 4.647 1.00 0.00 O ATOM 929 CB ILE A 65 1.317 5.429 4.625 1.00 0.00 C ATOM 930 CG1 ILE A 65 2.819 5.334 4.304 1.00 0.00 C ATOM 931 CG2 ILE A 65 0.910 6.879 4.910 1.00 0.00 C ATOM 932 CD1 ILE A 65 3.834 5.502 5.432 1.00 0.00 C ATOM 0 H ILE A 65 1.879 3.006 4.708 1.00 0.00 H new ATOM 0 HA ILE A 65 1.034 4.979 6.691 1.00 0.00 H new ATOM 0 HB ILE A 65 0.801 5.087 3.728 1.00 0.00 H new ATOM 0 HG12 ILE A 65 2.996 4.361 3.846 1.00 0.00 H new ATOM 0 HG13 ILE A 65 3.041 6.087 3.548 1.00 0.00 H new ATOM 0 HG21 ILE A 65 1.259 7.521 4.101 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.176 6.945 4.982 1.00 0.00 H new ATOM 0 HG23 ILE A 65 1.357 7.204 5.850 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.843 5.406 5.031 1.00 0.00 H new ATOM 0 HD12 ILE A 65 3.715 6.487 5.885 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.669 4.733 6.187 1.00 0.00 H new ATOM 944 N PRO A 66 -1.495 4.606 6.505 1.00 0.00 N ATOM 945 CA PRO A 66 -2.922 4.355 6.463 1.00 0.00 C ATOM 946 C PRO A 66 -3.536 5.138 5.310 1.00 0.00 C ATOM 947 O PRO A 66 -3.350 6.356 5.205 1.00 0.00 O ATOM 948 CB PRO A 66 -3.478 4.810 7.811 1.00 0.00 C ATOM 949 CG PRO A 66 -2.412 5.751 8.350 1.00 0.00 C ATOM 950 CD PRO A 66 -1.126 5.397 7.650 1.00 0.00 C ATOM 0 HA PRO A 66 -3.154 3.303 6.298 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.437 5.316 7.697 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.641 3.966 8.481 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -2.682 6.790 8.161 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.308 5.640 9.429 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.589 6.295 7.346 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.464 4.838 8.312 1.00 0.00 H new ATOM 958 N VAL A 67 -4.297 4.456 4.462 1.00 0.00 N ATOM 959 CA VAL A 67 -5.014 5.090 3.364 1.00 0.00 C ATOM 960 C VAL A 67 -6.437 5.488 3.771 1.00 0.00 C ATOM 961 O VAL A 67 -7.132 6.118 2.977 1.00 0.00 O ATOM 962 CB VAL A 67 -4.972 4.190 2.111 1.00 0.00 C ATOM 963 CG1 VAL A 67 -3.515 3.893 1.713 1.00 0.00 C ATOM 964 CG2 VAL A 67 -5.716 2.854 2.269 1.00 0.00 C ATOM 0 H VAL A 67 -4.434 3.447 4.517 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.511 6.023 3.109 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.487 4.756 1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.502 3.257 0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.999 4.828 1.496 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.010 3.383 2.534 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -5.638 2.282 1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.272 2.285 3.086 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -6.766 3.046 2.489 1.00 0.00 H new ATOM 974 N ALA A 68 -6.882 5.165 4.993 1.00 0.00 N ATOM 975 CA ALA A 68 -8.255 5.457 5.388 1.00 0.00 C ATOM 976 C ALA A 68 -8.417 6.970 5.529 1.00 0.00 C ATOM 977 O ALA A 68 -7.451 7.673 5.842 1.00 0.00 O ATOM 978 CB ALA A 68 -8.615 4.715 6.674 1.00 0.00 C ATOM 0 H ALA A 68 -6.318 4.709 5.710 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.947 5.106 4.623 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -9.643 4.946 6.952 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.515 3.641 6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.944 5.027 7.474 1.00 0.00 H new ATOM 984 N GLY A 69 -9.612 7.490 5.261 1.00 0.00 N ATOM 985 CA GLY A 69 -9.907 8.924 5.182 1.00 0.00 C ATOM 986 C GLY A 69 -9.282 9.639 3.975 1.00 0.00 C ATOM 987 O GLY A 69 -9.827 10.628 3.490 1.00 0.00 O ATOM 0 H GLY A 69 -10.431 6.908 5.087 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -10.988 9.058 5.147 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -9.555 9.405 6.095 1.00 0.00 H new ATOM 991 N LYS A 70 -8.151 9.157 3.460 1.00 0.00 N ATOM 992 CA LYS A 70 -7.484 9.676 2.273 1.00 0.00 C ATOM 993 C LYS A 70 -8.260 9.245 1.022 1.00 0.00 C ATOM 994 O LYS A 70 -9.238 8.487 1.095 1.00 0.00 O ATOM 995 CB LYS A 70 -6.018 9.219 2.284 1.00 0.00 C ATOM 996 CG LYS A 70 -5.284 9.609 3.586 1.00 0.00 C ATOM 997 CD LYS A 70 -5.145 11.134 3.722 1.00 0.00 C ATOM 998 CE LYS A 70 -4.103 11.559 4.766 1.00 0.00 C ATOM 999 NZ LYS A 70 -4.690 11.765 6.103 1.00 0.00 N ATOM 0 H LYS A 70 -7.659 8.366 3.875 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.474 10.766 2.266 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -5.978 8.137 2.159 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.498 9.658 1.433 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.829 9.215 4.444 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.295 9.150 3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.872 11.554 2.754 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.113 11.557 3.992 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.325 10.798 4.828 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.622 12.481 4.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.944 12.050 6.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.414 12.510 6.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.127 10.880 6.431 1.00 0.00 H new ATOM 1013 N THR A 71 -7.835 9.758 -0.124 1.00 0.00 N ATOM 1014 CA THR A 71 -8.402 9.490 -1.437 1.00 0.00 C ATOM 1015 C THR A 71 -7.488 8.526 -2.201 1.00 0.00 C ATOM 1016 O THR A 71 -6.468 8.073 -1.689 1.00 0.00 O ATOM 1017 CB THR A 71 -8.581 10.839 -2.158 1.00 0.00 C ATOM 1018 OG1 THR A 71 -7.384 11.587 -2.091 1.00 0.00 O ATOM 1019 CG2 THR A 71 -9.719 11.648 -1.531 1.00 0.00 C ATOM 0 H THR A 71 -7.047 10.404 -0.165 1.00 0.00 H new ATOM 0 HA THR A 71 -9.377 9.007 -1.365 1.00 0.00 H new ATOM 0 HB THR A 71 -8.828 10.634 -3.200 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.506 12.442 -2.553 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.825 12.596 -2.058 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.650 11.085 -1.606 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.494 11.839 -0.482 1.00 0.00 H new ATOM 1027 N HIS A 72 -7.835 8.218 -3.446 1.00 0.00 N ATOM 1028 CA HIS A 72 -7.042 7.459 -4.395 1.00 0.00 C ATOM 1029 C HIS A 72 -5.704 8.144 -4.638 1.00 0.00 C ATOM 1030 O HIS A 72 -4.676 7.504 -4.423 1.00 0.00 O ATOM 1031 CB HIS A 72 -7.875 7.253 -5.658 1.00 0.00 C ATOM 1032 CG HIS A 72 -7.138 6.834 -6.895 1.00 0.00 C ATOM 1033 ND1 HIS A 72 -6.862 5.543 -7.276 1.00 0.00 N ATOM 1034 CD2 HIS A 72 -6.776 7.663 -7.915 1.00 0.00 C ATOM 1035 CE1 HIS A 72 -6.352 5.590 -8.518 1.00 0.00 C ATOM 1036 NE2 HIS A 72 -6.284 6.860 -8.947 1.00 0.00 N ATOM 0 H HIS A 72 -8.730 8.510 -3.838 1.00 0.00 H new ATOM 0 HA HIS A 72 -6.791 6.473 -4.004 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.635 6.501 -5.445 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.399 8.184 -5.874 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.855 8.740 -7.924 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.041 4.728 -9.090 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.939 7.178 -9.853 1.00 0.00 H new ATOM 1044 N ARG A 73 -5.683 9.428 -5.037 1.00 0.00 N ATOM 1045 CA ARG A 73 -4.430 10.103 -5.387 1.00 0.00 C ATOM 1046 C ARG A 73 -3.405 10.056 -4.252 1.00 0.00 C ATOM 1047 O ARG A 73 -2.218 9.872 -4.517 1.00 0.00 O ATOM 1048 CB ARG A 73 -4.697 11.534 -5.872 1.00 0.00 C ATOM 1049 CG ARG A 73 -3.367 12.217 -6.239 1.00 0.00 C ATOM 1050 CD ARG A 73 -3.427 13.133 -7.457 1.00 0.00 C ATOM 1051 NE ARG A 73 -4.285 14.310 -7.264 1.00 0.00 N ATOM 1052 CZ ARG A 73 -4.253 15.396 -8.041 1.00 0.00 C ATOM 1053 NH1 ARG A 73 -3.303 15.541 -8.963 1.00 0.00 N ATOM 1054 NH2 ARG A 73 -5.177 16.337 -7.888 1.00 0.00 N ATOM 0 H ARG A 73 -6.515 10.012 -5.123 1.00 0.00 H new ATOM 0 HA ARG A 73 -3.983 9.553 -6.215 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.359 11.517 -6.738 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.206 12.103 -5.094 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.026 12.798 -5.382 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.618 11.446 -6.419 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -2.418 13.465 -7.702 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -3.792 12.564 -8.312 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.947 14.297 -6.488 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -2.592 14.819 -9.080 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -3.287 16.374 -9.552 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.904 16.228 -7.181 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -5.160 17.169 -8.477 1.00 0.00 H new ATOM 1068 N TYR A 74 -3.859 10.130 -3.000 1.00 0.00 N ATOM 1069 CA TYR A 74 -3.017 9.916 -1.831 1.00 0.00 C ATOM 1070 C TYR A 74 -2.159 8.655 -1.990 1.00 0.00 C ATOM 1071 O TYR A 74 -0.948 8.682 -1.764 1.00 0.00 O ATOM 1072 CB TYR A 74 -3.891 9.808 -0.590 1.00 0.00 C ATOM 1073 CG TYR A 74 -3.085 9.679 0.677 1.00 0.00 C ATOM 1074 CD1 TYR A 74 -2.638 10.840 1.316 1.00 0.00 C ATOM 1075 CD2 TYR A 74 -2.835 8.414 1.241 1.00 0.00 C ATOM 1076 CE1 TYR A 74 -1.894 10.740 2.498 1.00 0.00 C ATOM 1077 CE2 TYR A 74 -2.121 8.310 2.447 1.00 0.00 C ATOM 1078 CZ TYR A 74 -1.639 9.479 3.078 1.00 0.00 C ATOM 1079 OH TYR A 74 -1.009 9.419 4.279 1.00 0.00 O ATOM 0 H TYR A 74 -4.830 10.342 -2.771 1.00 0.00 H new ATOM 0 HA TYR A 74 -2.342 10.766 -1.728 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.529 10.689 -0.522 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.549 8.944 -0.687 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -2.866 11.810 0.899 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.192 7.523 0.747 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -1.513 11.634 2.969 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -1.942 7.341 2.889 1.00 0.00 H new ATOM 0 HH TYR A 74 -1.514 8.838 4.885 1.00 0.00 H new ATOM 1089 N VAL A 75 -2.798 7.543 -2.350 1.00 0.00 N ATOM 1090 CA VAL A 75 -2.162 6.250 -2.523 1.00 0.00 C ATOM 1091 C VAL A 75 -1.318 6.240 -3.794 1.00 0.00 C ATOM 1092 O VAL A 75 -0.263 5.624 -3.801 1.00 0.00 O ATOM 1093 CB VAL A 75 -3.225 5.134 -2.557 1.00 0.00 C ATOM 1094 CG1 VAL A 75 -2.534 3.781 -2.403 1.00 0.00 C ATOM 1095 CG2 VAL A 75 -4.263 5.285 -1.438 1.00 0.00 C ATOM 0 H VAL A 75 -3.801 7.523 -2.533 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.501 6.065 -1.676 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.746 5.205 -3.512 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.280 2.987 -2.426 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.827 3.639 -3.220 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.001 3.751 -1.453 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.990 4.475 -1.504 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -3.763 5.245 -0.470 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.775 6.242 -1.543 1.00 0.00 H new ATOM 1105 N ILE A 76 -1.729 6.907 -4.869 1.00 0.00 N ATOM 1106 CA ILE A 76 -0.955 6.947 -6.110 1.00 0.00 C ATOM 1107 C ILE A 76 0.380 7.688 -5.887 1.00 0.00 C ATOM 1108 O ILE A 76 1.380 7.376 -6.536 1.00 0.00 O ATOM 1109 CB ILE A 76 -1.841 7.507 -7.251 1.00 0.00 C ATOM 1110 CG1 ILE A 76 -3.191 6.765 -7.405 1.00 0.00 C ATOM 1111 CG2 ILE A 76 -1.173 7.474 -8.632 1.00 0.00 C ATOM 1112 CD1 ILE A 76 -3.082 5.233 -7.334 1.00 0.00 C ATOM 0 H ILE A 76 -2.602 7.433 -4.907 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.665 5.945 -6.425 1.00 0.00 H new ATOM 0 HB ILE A 76 -2.003 8.538 -6.936 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.871 7.106 -6.624 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.638 7.042 -8.360 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.856 7.882 -9.377 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -0.262 8.071 -8.610 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.926 6.445 -8.892 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.072 4.792 -7.451 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -2.430 4.877 -8.132 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -2.667 4.942 -6.369 1.00 0.00 H new ATOM 1124 N ASP A 77 0.456 8.625 -4.940 1.00 0.00 N ATOM 1125 CA ASP A 77 1.731 9.202 -4.495 1.00 0.00 C ATOM 1126 C ASP A 77 2.549 8.167 -3.703 1.00 0.00 C ATOM 1127 O ASP A 77 3.752 8.007 -3.916 1.00 0.00 O ATOM 1128 CB ASP A 77 1.472 10.470 -3.668 1.00 0.00 C ATOM 1129 CG ASP A 77 2.618 11.472 -3.802 1.00 0.00 C ATOM 1130 OD1 ASP A 77 3.789 11.144 -3.533 1.00 0.00 O ATOM 1131 OD2 ASP A 77 2.360 12.628 -4.205 1.00 0.00 O ATOM 0 H ASP A 77 -0.360 9.006 -4.460 1.00 0.00 H new ATOM 0 HA ASP A 77 2.320 9.482 -5.369 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.542 10.934 -3.995 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.343 10.201 -2.619 1.00 0.00 H new ATOM 1136 N LEU A 78 1.895 7.386 -2.835 1.00 0.00 N ATOM 1137 CA LEU A 78 2.541 6.308 -2.083 1.00 0.00 C ATOM 1138 C LEU A 78 3.025 5.175 -2.994 1.00 0.00 C ATOM 1139 O LEU A 78 4.006 4.509 -2.661 1.00 0.00 O ATOM 1140 CB LEU A 78 1.593 5.735 -1.013 1.00 0.00 C ATOM 1141 CG LEU A 78 1.250 6.694 0.138 1.00 0.00 C ATOM 1142 CD1 LEU A 78 0.251 5.996 1.066 1.00 0.00 C ATOM 1143 CD2 LEU A 78 2.488 7.120 0.932 1.00 0.00 C ATOM 0 H LEU A 78 0.900 7.486 -2.635 1.00 0.00 H new ATOM 0 HA LEU A 78 3.411 6.749 -1.597 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.666 5.429 -1.498 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.045 4.836 -0.593 1.00 0.00 H new ATOM 0 HG LEU A 78 0.820 7.601 -0.287 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.006 6.661 1.891 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.651 5.746 0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.698 5.084 1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.191 7.797 1.733 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.967 6.239 1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 78 3.189 7.628 0.269 1.00 0.00 H new ATOM 1155 N MET A 79 2.351 4.907 -4.114 1.00 0.00 N ATOM 1156 CA MET A 79 2.743 3.912 -5.112 1.00 0.00 C ATOM 1157 C MET A 79 4.025 4.364 -5.811 1.00 0.00 C ATOM 1158 O MET A 79 4.879 3.533 -6.137 1.00 0.00 O ATOM 1159 CB MET A 79 1.624 3.720 -6.152 1.00 0.00 C ATOM 1160 CG MET A 79 0.333 3.100 -5.599 1.00 0.00 C ATOM 1161 SD MET A 79 -0.159 1.531 -6.369 1.00 0.00 S ATOM 1162 CE MET A 79 1.060 0.457 -5.578 1.00 0.00 C ATOM 0 H MET A 79 1.488 5.393 -4.359 1.00 0.00 H new ATOM 0 HA MET A 79 2.917 2.961 -4.609 1.00 0.00 H new ATOM 0 HB2 MET A 79 1.386 4.688 -6.592 1.00 0.00 H new ATOM 0 HB3 MET A 79 1.999 3.087 -6.956 1.00 0.00 H new ATOM 0 HG2 MET A 79 0.456 2.939 -4.528 1.00 0.00 H new ATOM 0 HG3 MET A 79 -0.478 3.818 -5.722 1.00 0.00 H new ATOM 0 HE1 MET A 79 1.042 -0.525 -6.052 1.00 0.00 H new ATOM 0 HE2 MET A 79 2.053 0.893 -5.685 1.00 0.00 H new ATOM 0 HE3 MET A 79 0.821 0.353 -4.520 1.00 0.00 H new ATOM 1172 N HIS A 80 4.173 5.678 -6.011 1.00 0.00 N ATOM 1173 CA HIS A 80 5.400 6.280 -6.486 1.00 0.00 C ATOM 1174 C HIS A 80 6.525 6.032 -5.482 1.00 0.00 C ATOM 1175 O HIS A 80 7.510 5.379 -5.831 1.00 0.00 O ATOM 1176 CB HIS A 80 5.183 7.766 -6.818 1.00 0.00 C ATOM 1177 CG HIS A 80 4.950 8.054 -8.280 1.00 0.00 C ATOM 1178 ND1 HIS A 80 5.548 7.430 -9.356 1.00 0.00 N ATOM 1179 CD2 HIS A 80 4.152 9.053 -8.767 1.00 0.00 C ATOM 1180 CE1 HIS A 80 5.134 8.065 -10.465 1.00 0.00 C ATOM 1181 NE2 HIS A 80 4.298 9.071 -10.156 1.00 0.00 N ATOM 0 H HIS A 80 3.427 6.353 -5.842 1.00 0.00 H new ATOM 0 HA HIS A 80 5.707 5.809 -7.420 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.328 8.131 -6.248 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.054 8.331 -6.484 1.00 0.00 H new ATOM 0 HD2 HIS A 80 3.523 9.709 -8.183 1.00 0.00 H new ATOM 0 HE1 HIS A 80 5.433 7.803 -11.469 1.00 0.00 H new ATOM 0 HE2 HIS A 80 3.857 9.720 -10.808 1.00 0.00 H new ATOM 1189 N HIS A 81 6.374 6.509 -4.244 1.00 0.00 N ATOM 1190 CA HIS A 81 7.379 6.417 -3.204 1.00 0.00 C ATOM 1191 C HIS A 81 7.803 4.971 -2.929 1.00 0.00 C ATOM 1192 O HIS A 81 8.995 4.670 -2.906 1.00 0.00 O ATOM 1193 CB HIS A 81 6.805 7.072 -1.947 1.00 0.00 C ATOM 1194 CG HIS A 81 7.040 8.560 -1.887 1.00 0.00 C ATOM 1195 ND1 HIS A 81 8.242 9.171 -1.613 1.00 0.00 N ATOM 1196 CD2 HIS A 81 6.106 9.542 -2.063 1.00 0.00 C ATOM 1197 CE1 HIS A 81 8.036 10.498 -1.593 1.00 0.00 C ATOM 1198 NE2 HIS A 81 6.754 10.775 -1.901 1.00 0.00 N ATOM 0 H HIS A 81 5.523 6.981 -3.938 1.00 0.00 H new ATOM 0 HA HIS A 81 8.283 6.933 -3.528 1.00 0.00 H new ATOM 0 HB2 HIS A 81 5.733 6.879 -1.903 1.00 0.00 H new ATOM 0 HB3 HIS A 81 7.250 6.606 -1.068 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.060 9.395 -2.286 1.00 0.00 H new ATOM 0 HE1 HIS A 81 8.790 11.237 -1.363 1.00 0.00 H new ATOM 0 HE2 HIS A 81 6.336 11.701 -1.997 1.00 0.00 H new ATOM 1206 N ALA A 82 6.850 4.056 -2.738 1.00 0.00 N ATOM 1207 CA ALA A 82 7.168 2.679 -2.374 1.00 0.00 C ATOM 1208 C ALA A 82 7.941 1.964 -3.484 1.00 0.00 C ATOM 1209 O ALA A 82 8.844 1.175 -3.207 1.00 0.00 O ATOM 1210 CB ALA A 82 5.894 1.923 -2.032 1.00 0.00 C ATOM 0 H ALA A 82 5.852 4.247 -2.830 1.00 0.00 H new ATOM 0 HA ALA A 82 7.813 2.704 -1.496 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.142 0.896 -1.762 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.396 2.409 -1.193 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.229 1.920 -2.896 1.00 0.00 H new ATOM 1216 N ALA A 83 7.650 2.260 -4.755 1.00 0.00 N ATOM 1217 CA ALA A 83 8.436 1.713 -5.852 1.00 0.00 C ATOM 1218 C ALA A 83 9.875 2.255 -5.867 1.00 0.00 C ATOM 1219 O ALA A 83 10.730 1.634 -6.497 1.00 0.00 O ATOM 1220 CB ALA A 83 7.735 1.951 -7.190 1.00 0.00 C ATOM 0 H ALA A 83 6.884 2.869 -5.042 1.00 0.00 H new ATOM 0 HA ALA A 83 8.512 0.637 -5.692 1.00 0.00 H new ATOM 0 HB1 ALA A 83 8.339 1.535 -7.996 1.00 0.00 H new ATOM 0 HB2 ALA A 83 6.759 1.466 -7.181 1.00 0.00 H new ATOM 0 HB3 ALA A 83 7.607 3.022 -7.348 1.00 0.00 H new ATOM 1226 N ARG A 84 10.181 3.362 -5.176 1.00 0.00 N ATOM 1227 CA ARG A 84 11.568 3.765 -4.915 1.00 0.00 C ATOM 1228 C ARG A 84 12.130 2.996 -3.730 1.00 0.00 C ATOM 1229 O ARG A 84 13.251 2.491 -3.791 1.00 0.00 O ATOM 1230 CB ARG A 84 11.708 5.276 -4.665 1.00 0.00 C ATOM 1231 CG ARG A 84 11.025 6.101 -5.757 1.00 0.00 C ATOM 1232 CD ARG A 84 11.604 7.512 -5.842 1.00 0.00 C ATOM 1233 NE ARG A 84 11.014 8.215 -6.981 1.00 0.00 N ATOM 1234 CZ ARG A 84 10.979 9.533 -7.173 1.00 0.00 C ATOM 1235 NH1 ARG A 84 11.653 10.364 -6.386 1.00 0.00 N ATOM 1236 NH2 ARG A 84 10.241 10.003 -8.168 1.00 0.00 N ATOM 0 H ARG A 84 9.483 3.996 -4.787 1.00 0.00 H new ATOM 0 HA ARG A 84 12.137 3.527 -5.814 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.274 5.525 -3.697 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.765 5.540 -4.618 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.142 5.601 -6.718 1.00 0.00 H new ATOM 0 HG3 ARG A 84 9.955 6.158 -5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.400 8.056 -4.920 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.688 7.466 -5.951 1.00 0.00 H new ATOM 0 HE ARG A 84 10.585 7.636 -7.703 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.212 9.997 -5.616 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.612 11.370 -6.552 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.719 9.360 -8.763 1.00 0.00 H new ATOM 0 HH22 ARG A 84 10.195 11.008 -8.339 1.00 0.00 H new ATOM 1250 N ASN A 85 11.330 2.844 -2.671 1.00 0.00 N ATOM 1251 CA ASN A 85 11.706 2.116 -1.457 1.00 0.00 C ATOM 1252 C ASN A 85 12.012 0.653 -1.777 1.00 0.00 C ATOM 1253 O ASN A 85 12.751 0.005 -1.039 1.00 0.00 O ATOM 1254 CB ASN A 85 10.618 2.220 -0.369 1.00 0.00 C ATOM 1255 CG ASN A 85 10.402 3.645 0.140 1.00 0.00 C ATOM 1256 OD1 ASN A 85 11.186 4.555 -0.146 1.00 0.00 O ATOM 1257 ND2 ASN A 85 9.355 3.894 0.910 1.00 0.00 N ATOM 0 H ASN A 85 10.387 3.230 -2.633 1.00 0.00 H new ATOM 0 HA ASN A 85 12.609 2.581 -1.063 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.678 1.838 -0.768 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.891 1.580 0.470 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.197 4.837 1.266 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.706 3.143 1.147 1.00 0.00 H new ATOM 1264 N GLY A 86 11.526 0.146 -2.914 1.00 0.00 N ATOM 1265 CA GLY A 86 11.907 -1.146 -3.459 1.00 0.00 C ATOM 1266 C GLY A 86 11.091 -2.282 -2.857 1.00 0.00 C ATOM 1267 O GLY A 86 11.421 -3.455 -3.030 1.00 0.00 O ATOM 0 H GLY A 86 10.842 0.639 -3.488 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.773 -1.137 -4.541 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.966 -1.321 -3.270 1.00 0.00 H new ATOM 1271 N GLN A 87 10.027 -1.951 -2.137 1.00 0.00 N ATOM 1272 CA GLN A 87 9.148 -2.869 -1.452 1.00 0.00 C ATOM 1273 C GLN A 87 7.922 -2.074 -1.018 1.00 0.00 C ATOM 1274 O GLN A 87 7.921 -0.839 -1.057 1.00 0.00 O ATOM 1275 CB GLN A 87 9.869 -3.487 -0.239 1.00 0.00 C ATOM 1276 CG GLN A 87 10.453 -2.445 0.732 1.00 0.00 C ATOM 1277 CD GLN A 87 11.295 -3.017 1.868 1.00 0.00 C ATOM 1278 OE1 GLN A 87 12.179 -2.331 2.379 1.00 0.00 O ATOM 1279 NE2 GLN A 87 11.069 -4.246 2.315 1.00 0.00 N ATOM 0 H GLN A 87 9.745 -0.979 -2.013 1.00 0.00 H new ATOM 0 HA GLN A 87 8.851 -3.692 -2.102 1.00 0.00 H new ATOM 0 HB2 GLN A 87 9.169 -4.123 0.303 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.674 -4.130 -0.595 1.00 0.00 H new ATOM 0 HG2 GLN A 87 11.066 -1.745 0.164 1.00 0.00 H new ATOM 0 HG3 GLN A 87 9.632 -1.872 1.163 1.00 0.00 H new ATOM 0 HE21 GLN A 87 10.336 -4.816 1.892 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.628 -4.621 3.081 1.00 0.00 H new ATOM 1288 N VAL A 88 6.888 -2.781 -0.594 1.00 0.00 N ATOM 1289 CA VAL A 88 5.722 -2.210 0.030 1.00 0.00 C ATOM 1290 C VAL A 88 5.170 -3.254 0.989 1.00 0.00 C ATOM 1291 O VAL A 88 5.254 -4.461 0.757 1.00 0.00 O ATOM 1292 CB VAL A 88 4.724 -1.770 -1.067 1.00 0.00 C ATOM 1293 CG1 VAL A 88 4.164 -2.941 -1.884 1.00 0.00 C ATOM 1294 CG2 VAL A 88 3.607 -0.916 -0.460 1.00 0.00 C ATOM 0 H VAL A 88 6.842 -3.796 -0.680 1.00 0.00 H new ATOM 0 HA VAL A 88 5.945 -1.312 0.606 1.00 0.00 H new ATOM 0 HB VAL A 88 5.282 -1.161 -1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.471 -2.562 -2.635 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.983 -3.465 -2.377 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.640 -3.629 -1.221 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.913 -0.614 -1.244 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.074 -1.496 0.293 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.038 -0.029 0.004 1.00 0.00 H new ATOM 1304 N ASN A 89 4.536 -2.758 2.036 1.00 0.00 N ATOM 1305 CA ASN A 89 3.652 -3.496 2.911 1.00 0.00 C ATOM 1306 C ASN A 89 2.256 -3.033 2.526 1.00 0.00 C ATOM 1307 O ASN A 89 2.026 -1.825 2.452 1.00 0.00 O ATOM 1308 CB ASN A 89 3.974 -3.091 4.353 1.00 0.00 C ATOM 1309 CG ASN A 89 5.135 -3.882 4.922 1.00 0.00 C ATOM 1310 OD1 ASN A 89 5.092 -5.104 4.978 1.00 0.00 O ATOM 1311 ND2 ASN A 89 6.221 -3.230 5.295 1.00 0.00 N ATOM 0 H ASN A 89 4.631 -1.780 2.310 1.00 0.00 H new ATOM 0 HA ASN A 89 3.749 -4.578 2.828 1.00 0.00 H new ATOM 0 HB2 ASN A 89 4.210 -2.027 4.386 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.093 -3.242 4.977 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.034 -3.745 5.634 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.247 -2.212 5.245 1.00 0.00 H new ATOM 1318 N LEU A 90 1.352 -3.949 2.203 1.00 0.00 N ATOM 1319 CA LEU A 90 -0.009 -3.668 1.769 1.00 0.00 C ATOM 1320 C LEU A 90 -0.887 -4.453 2.735 1.00 0.00 C ATOM 1321 O LEU A 90 -0.996 -5.672 2.617 1.00 0.00 O ATOM 1322 CB LEU A 90 -0.245 -4.102 0.305 1.00 0.00 C ATOM 1323 CG LEU A 90 0.737 -3.527 -0.737 1.00 0.00 C ATOM 1324 CD1 LEU A 90 0.918 -4.528 -1.880 1.00 0.00 C ATOM 1325 CD2 LEU A 90 0.335 -2.127 -1.232 1.00 0.00 C ATOM 0 H LEU A 90 1.556 -4.948 2.238 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.231 -2.601 1.785 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.199 -5.190 0.257 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.257 -3.813 0.020 1.00 0.00 H new ATOM 0 HG LEU A 90 1.701 -3.382 -0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.612 -4.120 -2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 90 1.316 -5.463 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.045 -4.715 -2.355 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.064 -1.776 -1.963 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -0.650 -2.174 -1.696 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.306 -1.437 -0.388 1.00 0.00 H new ATOM 1337 N THR A 91 -1.436 -3.796 3.748 1.00 0.00 N ATOM 1338 CA THR A 91 -2.395 -4.426 4.640 1.00 0.00 C ATOM 1339 C THR A 91 -3.760 -4.234 3.996 1.00 0.00 C ATOM 1340 O THR A 91 -4.195 -3.092 3.836 1.00 0.00 O ATOM 1341 CB THR A 91 -2.312 -3.819 6.050 1.00 0.00 C ATOM 1342 OG1 THR A 91 -0.983 -3.887 6.546 1.00 0.00 O ATOM 1343 CG2 THR A 91 -3.233 -4.544 7.036 1.00 0.00 C ATOM 0 H THR A 91 -1.231 -2.822 3.972 1.00 0.00 H new ATOM 0 HA THR A 91 -2.191 -5.488 4.773 1.00 0.00 H new ATOM 0 HB THR A 91 -2.630 -2.780 5.964 1.00 0.00 H new ATOM 0 HG1 THR A 91 -0.948 -3.495 7.443 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.145 -4.085 8.021 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.265 -4.470 6.692 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.946 -5.594 7.098 1.00 0.00 H new ATOM 1351 N VAL A 92 -4.422 -5.326 3.621 1.00 0.00 N ATOM 1352 CA VAL A 92 -5.818 -5.341 3.206 1.00 0.00 C ATOM 1353 C VAL A 92 -6.679 -5.862 4.366 1.00 0.00 C ATOM 1354 O VAL A 92 -6.151 -6.353 5.367 1.00 0.00 O ATOM 1355 CB VAL A 92 -5.990 -6.162 1.909 1.00 0.00 C ATOM 1356 CG1 VAL A 92 -5.279 -5.519 0.709 1.00 0.00 C ATOM 1357 CG2 VAL A 92 -5.519 -7.613 2.048 1.00 0.00 C ATOM 0 H VAL A 92 -3.988 -6.249 3.598 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.154 -4.331 2.971 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.065 -6.166 1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.431 -6.135 -0.177 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.689 -4.524 0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.212 -5.440 0.918 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -5.667 -8.136 1.103 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.461 -7.629 2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.094 -8.109 2.830 1.00 0.00 H new ATOM 1367 N ARG A 93 -8.005 -5.767 4.278 1.00 0.00 N ATOM 1368 CA ARG A 93 -8.941 -6.355 5.231 1.00 0.00 C ATOM 1369 C ARG A 93 -10.262 -6.646 4.574 1.00 0.00 C ATOM 1370 O ARG A 93 -10.546 -6.169 3.476 1.00 0.00 O ATOM 1371 CB ARG A 93 -9.112 -5.436 6.455 1.00 0.00 C ATOM 1372 CG ARG A 93 -9.925 -4.151 6.239 1.00 0.00 C ATOM 1373 CD ARG A 93 -9.857 -3.272 7.499 1.00 0.00 C ATOM 1374 NE ARG A 93 -9.990 -1.824 7.261 1.00 0.00 N ATOM 1375 CZ ARG A 93 -9.669 -0.876 8.161 1.00 0.00 C ATOM 1376 NH1 ARG A 93 -9.017 -1.166 9.291 1.00 0.00 N ATOM 1377 NH2 ARG A 93 -9.987 0.396 7.931 1.00 0.00 N ATOM 0 H ARG A 93 -8.469 -5.265 3.521 1.00 0.00 H new ATOM 0 HA ARG A 93 -8.531 -7.304 5.578 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -9.588 -6.011 7.250 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.121 -5.157 6.813 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -9.535 -3.603 5.381 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -10.962 -4.400 6.014 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.645 -3.585 8.184 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -8.907 -3.456 8.000 1.00 0.00 H new ATOM 0 HE ARG A 93 -10.349 -1.520 6.356 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.748 -2.129 9.492 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.789 -0.424 9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.474 0.653 7.072 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.744 1.114 8.613 1.00 0.00 H new ATOM 1391 N ARG A 94 -11.081 -7.405 5.293 1.00 0.00 N ATOM 1392 CA ARG A 94 -12.513 -7.503 5.081 1.00 0.00 C ATOM 1393 C ARG A 94 -13.169 -7.800 6.415 1.00 0.00 C ATOM 1394 O ARG A 94 -12.601 -8.504 7.259 1.00 0.00 O ATOM 1395 CB ARG A 94 -12.839 -8.648 4.119 1.00 0.00 C ATOM 1396 CG ARG A 94 -12.595 -8.320 2.634 1.00 0.00 C ATOM 1397 CD ARG A 94 -11.305 -8.982 2.128 1.00 0.00 C ATOM 1398 NE ARG A 94 -11.524 -10.188 1.306 1.00 0.00 N ATOM 1399 CZ ARG A 94 -12.249 -11.290 1.546 1.00 0.00 C ATOM 1400 NH1 ARG A 94 -13.005 -11.414 2.629 1.00 0.00 N ATOM 1401 NH2 ARG A 94 -12.231 -12.296 0.687 1.00 0.00 N ATOM 0 H ARG A 94 -10.752 -7.986 6.064 1.00 0.00 H new ATOM 0 HA ARG A 94 -12.877 -6.567 4.657 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -12.239 -9.516 4.390 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.884 -8.930 4.249 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -13.441 -8.663 2.039 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.529 -7.240 2.503 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.743 -8.255 1.543 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -10.686 -9.248 2.985 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.044 -10.182 0.406 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -13.047 -10.657 3.311 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.544 -12.267 2.780 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -11.665 -12.234 -0.159 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -12.783 -13.134 0.871 1.00 0.00 H new ATOM 1415 N LYS A 95 -14.396 -7.318 6.575 1.00 0.00 N ATOM 1416 CA LYS A 95 -15.339 -7.792 7.571 1.00 0.00 C ATOM 1417 C LYS A 95 -15.526 -9.301 7.493 1.00 0.00 C ATOM 1418 O LYS A 95 -15.327 -9.942 6.458 1.00 0.00 O ATOM 1419 CB LYS A 95 -16.661 -7.032 7.435 1.00 0.00 C ATOM 1420 CG LYS A 95 -17.001 -6.311 8.749 1.00 0.00 C ATOM 1421 CD LYS A 95 -18.455 -6.570 9.093 1.00 0.00 C ATOM 1422 CE LYS A 95 -19.012 -5.610 10.143 1.00 0.00 C ATOM 1423 NZ LYS A 95 -18.212 -5.582 11.384 1.00 0.00 N ATOM 0 H LYS A 95 -14.769 -6.565 5.997 1.00 0.00 H new ATOM 0 HA LYS A 95 -14.935 -7.590 8.563 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -16.590 -6.308 6.623 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -17.461 -7.725 7.175 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -16.355 -6.667 9.552 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.823 -5.240 8.648 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -19.054 -6.492 8.186 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -18.558 -7.593 9.456 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -19.054 -4.605 9.722 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -20.035 -5.898 10.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -18.684 -4.979 12.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -18.121 -6.547 11.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -17.267 -5.199 11.179 1.00 0.00 H new ATOM 1437 N VAL A 96 -15.944 -9.858 8.625 1.00 0.00 N ATOM 1438 CA VAL A 96 -16.213 -11.269 8.804 1.00 0.00 C ATOM 1439 C VAL A 96 -17.350 -11.363 9.811 1.00 0.00 C ATOM 1440 O VAL A 96 -17.468 -10.504 10.699 1.00 0.00 O ATOM 1441 CB VAL A 96 -14.890 -11.965 9.230 1.00 0.00 C ATOM 1442 CG1 VAL A 96 -14.682 -12.048 10.742 1.00 0.00 C ATOM 1443 CG2 VAL A 96 -14.735 -13.368 8.639 1.00 0.00 C ATOM 0 H VAL A 96 -16.109 -9.313 9.471 1.00 0.00 H new ATOM 0 HA VAL A 96 -16.535 -11.787 7.901 1.00 0.00 H new ATOM 0 HB VAL A 96 -14.122 -11.310 8.818 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -13.736 -12.547 10.952 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -14.663 -11.043 11.162 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -15.498 -12.613 11.191 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -13.792 -13.801 8.973 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -15.561 -13.996 8.972 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -14.741 -13.307 7.551 1.00 0.00 H new ATOM 1453 N LEU A 97 -18.211 -12.367 9.663 1.00 0.00 N ATOM 1454 CA LEU A 97 -19.343 -12.572 10.564 1.00 0.00 C ATOM 1455 C LEU A 97 -19.843 -14.006 10.465 1.00 0.00 C ATOM 1456 O LEU A 97 -20.080 -14.644 11.487 1.00 0.00 O ATOM 1457 CB LEU A 97 -20.454 -11.561 10.235 1.00 0.00 C ATOM 1458 CG LEU A 97 -21.279 -11.233 11.502 1.00 0.00 C ATOM 1459 CD1 LEU A 97 -21.664 -9.756 11.525 1.00 0.00 C ATOM 1460 CD2 LEU A 97 -22.539 -12.087 11.615 1.00 0.00 C ATOM 0 H LEU A 97 -18.144 -13.060 8.917 1.00 0.00 H new ATOM 0 HA LEU A 97 -19.025 -12.406 11.593 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -20.016 -10.648 9.833 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -21.107 -11.968 9.463 1.00 0.00 H new ATOM 0 HG LEU A 97 -20.642 -11.462 12.356 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -22.244 -9.545 12.424 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -20.762 -9.145 11.524 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -22.262 -9.522 10.644 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -23.081 -11.817 12.521 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -23.175 -11.914 10.747 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -22.262 -13.140 11.658 1.00 0.00 H new ATOM 1472 N SER A 98 -19.883 -14.544 9.244 1.00 0.00 N ATOM 1473 CA SER A 98 -19.828 -15.973 8.958 1.00 0.00 C ATOM 1474 C SER A 98 -21.046 -16.801 9.395 1.00 0.00 C ATOM 1475 O SER A 98 -21.064 -18.006 9.140 1.00 0.00 O ATOM 1476 CB SER A 98 -18.531 -16.557 9.524 1.00 0.00 C ATOM 1477 OG SER A 98 -17.370 -15.844 9.133 1.00 0.00 O ATOM 0 H SER A 98 -19.957 -13.975 8.401 1.00 0.00 H new ATOM 0 HA SER A 98 -19.849 -16.049 7.871 1.00 0.00 H new ATOM 0 HB2 SER A 98 -18.592 -16.568 10.612 1.00 0.00 H new ATOM 0 HB3 SER A 98 -18.437 -17.593 9.200 1.00 0.00 H new ATOM 0 HG SER A 98 -16.579 -16.266 9.528 1.00 0.00 H new ATOM 1483 N GLY A 99 -22.082 -16.186 9.963 1.00 0.00 N ATOM 1484 CA GLY A 99 -23.354 -16.824 10.260 1.00 0.00 C ATOM 1485 C GLY A 99 -24.440 -15.814 9.932 1.00 0.00 C ATOM 1486 O GLY A 99 -24.382 -14.721 10.498 1.00 0.00 O ATOM 0 H GLY A 99 -22.054 -15.203 10.235 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -23.479 -17.731 9.669 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -23.403 -17.118 11.309 1.00 0.00 H new ATOM 1490 N PRO A 100 -25.364 -16.076 8.992 1.00 0.00 N ATOM 1491 CA PRO A 100 -26.433 -15.132 8.693 1.00 0.00 C ATOM 1492 C PRO A 100 -27.391 -15.046 9.885 1.00 0.00 C ATOM 1493 O PRO A 100 -27.425 -15.934 10.743 1.00 0.00 O ATOM 1494 CB PRO A 100 -27.119 -15.675 7.434 1.00 0.00 C ATOM 1495 CG PRO A 100 -26.855 -17.177 7.503 1.00 0.00 C ATOM 1496 CD PRO A 100 -25.488 -17.271 8.173 1.00 0.00 C ATOM 0 HA PRO A 100 -26.070 -14.119 8.519 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -28.187 -15.455 7.432 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -26.701 -15.235 6.528 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -27.621 -17.692 8.082 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -26.847 -17.629 6.511 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -25.412 -18.172 8.782 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -24.691 -17.320 7.431 1.00 0.00 H new ATOM 1504 N SER A 101 -28.205 -13.997 9.910 1.00 0.00 N ATOM 1505 CA SER A 101 -29.389 -13.892 10.739 1.00 0.00 C ATOM 1506 C SER A 101 -30.455 -13.182 9.906 1.00 0.00 C ATOM 1507 O SER A 101 -30.158 -12.639 8.837 1.00 0.00 O ATOM 1508 CB SER A 101 -29.066 -13.168 12.050 1.00 0.00 C ATOM 1509 OG SER A 101 -29.953 -13.580 13.075 1.00 0.00 O ATOM 0 H SER A 101 -28.049 -13.171 9.332 1.00 0.00 H new ATOM 0 HA SER A 101 -29.763 -14.872 11.035 1.00 0.00 H new ATOM 0 HB2 SER A 101 -28.038 -13.378 12.345 1.00 0.00 H new ATOM 0 HB3 SER A 101 -29.143 -12.090 11.906 1.00 0.00 H new ATOM 0 HG SER A 101 -29.733 -13.110 13.906 1.00 0.00 H new ATOM 1515 N SER A 102 -31.700 -13.228 10.357 1.00 0.00 N ATOM 1516 CA SER A 102 -32.856 -12.704 9.647 1.00 0.00 C ATOM 1517 C SER A 102 -33.829 -12.263 10.730 1.00 0.00 C ATOM 1518 O SER A 102 -34.346 -13.108 11.460 1.00 0.00 O ATOM 1519 CB SER A 102 -33.437 -13.761 8.692 1.00 0.00 C ATOM 1520 OG SER A 102 -33.184 -15.094 9.124 1.00 0.00 O ATOM 0 H SER A 102 -31.940 -13.645 11.256 1.00 0.00 H new ATOM 0 HA SER A 102 -32.608 -11.861 9.002 1.00 0.00 H new ATOM 0 HB2 SER A 102 -34.513 -13.611 8.603 1.00 0.00 H new ATOM 0 HB3 SER A 102 -33.012 -13.619 7.698 1.00 0.00 H new ATOM 0 HG SER A 102 -33.575 -15.725 8.484 1.00 0.00 H new ATOM 1526 N GLY A 103 -33.995 -10.953 10.877 1.00 0.00 N ATOM 1527 CA GLY A 103 -34.202 -10.316 12.160 1.00 0.00 C ATOM 1528 C GLY A 103 -32.979 -9.443 12.282 1.00 0.00 C ATOM 1529 O GLY A 103 -33.031 -8.309 11.761 1.00 0.00 O ATOM 0 H GLY A 103 -33.988 -10.300 10.093 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -35.123 -9.733 12.181 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -34.266 -11.043 12.970 1.00 0.00 H new TER 1533 GLY A 103