USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 777 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 0 THR OG1 : rot -147:sc= 0.235 USER MOD Single : A 1 MET CE :methyl -172:sc= -0.0983 (180deg=-0.188) USER MOD Single : A -2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -7 LYS NZ :NH3+ 168:sc= 0.403 (180deg=0.188) USER MOD Single : A -8 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -1.64 K(o=-1.6,f=-3!) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 180:sc= -0.295 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 102:sc= 0.812 USER MOD Single : A 36 SER OG : rot -112:sc= 0.538 USER MOD Single : A 41 TYR OH : rot 180:sc= -0.352 USER MOD Single : A 55 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.0243) USER MOD Single : A 57 HIS : no HD1:sc= -0.218 K(o=-0.22,f=-1.3) USER MOD Single : A 59 ASN : amide:sc= 0.0778 X(o=0.078,f=0) USER MOD Single : A 62 LYS NZ :NH3+ -121:sc= 1.14 (180deg=-0.09) USER MOD Single : A 63 ASN : amide:sc=-0.00926 X(o=-0.0093,f=-0.49) USER MOD Single : A 69 HIS :FLIP no HE2:sc= 0.123 F(o=-0.88,f=0.12) USER MOD Single : A 73 MET CE :methyl 140:sc= -0.154 (180deg=-2.46!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A -13 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -13 -1.454 -2.982 1.145 1.00 0.00 N ATOM 2 CA GLY A -13 -0.433 -3.955 0.695 1.00 0.00 C ATOM 3 C GLY A -13 0.845 -3.267 0.236 1.00 0.00 C ATOM 4 O GLY A -13 1.529 -2.627 1.046 1.00 0.00 O ATOM 0 H1 GLY A -13 -2.308 -3.491 1.449 1.00 0.00 H new ATOM 0 H2 GLY A -13 -1.079 -2.428 1.941 1.00 0.00 H new ATOM 0 H3 GLY A -13 -1.693 -2.342 0.361 1.00 0.00 H new ATOM 0 HA2 GLY A -13 -0.203 -4.642 1.509 1.00 0.00 H new ATOM 0 HA3 GLY A -13 -0.837 -4.553 -0.122 1.00 0.00 H new ATOM 10 N GLY A -12 1.158 -3.382 -1.069 1.00 0.00 N ATOM 11 CA GLY A -12 2.358 -2.768 -1.647 1.00 0.00 C ATOM 12 C GLY A -12 2.576 -3.172 -3.098 1.00 0.00 C ATOM 13 O GLY A -12 3.696 -3.529 -3.490 1.00 0.00 O ATOM 0 H GLY A -12 0.590 -3.898 -1.741 1.00 0.00 H new ATOM 0 HA2 GLY A -12 2.274 -1.683 -1.584 1.00 0.00 H new ATOM 0 HA3 GLY A -12 3.229 -3.055 -1.058 1.00 0.00 H new ATOM 17 N GLY A -11 1.497 -3.115 -3.895 1.00 0.00 N ATOM 18 CA GLY A -11 1.549 -3.485 -5.312 1.00 0.00 C ATOM 19 C GLY A -11 0.270 -3.117 -6.059 1.00 0.00 C ATOM 20 O GLY A -11 -0.822 -3.154 -5.476 1.00 0.00 O ATOM 0 H GLY A -11 0.576 -2.814 -3.577 1.00 0.00 H new ATOM 0 HA2 GLY A -11 2.397 -2.988 -5.783 1.00 0.00 H new ATOM 0 HA3 GLY A -11 1.720 -4.558 -5.398 1.00 0.00 H new ATOM 24 N ARG A -10 0.412 -2.754 -7.348 1.00 0.00 N ATOM 25 CA ARG A -10 -0.717 -2.398 -8.227 1.00 0.00 C ATOM 26 C ARG A -10 -1.244 -3.707 -8.864 1.00 0.00 C ATOM 27 O ARG A -10 -2.192 -4.314 -8.355 1.00 0.00 O ATOM 28 CB ARG A -10 -0.235 -1.357 -9.287 1.00 0.00 C ATOM 29 CG ARG A -10 0.440 -0.096 -8.689 1.00 0.00 C ATOM 30 CD ARG A -10 -0.537 0.763 -7.858 1.00 0.00 C ATOM 31 NE ARG A -10 -1.573 1.397 -8.695 1.00 0.00 N ATOM 32 CZ ARG A -10 -2.663 2.033 -8.241 1.00 0.00 C ATOM 33 NH1 ARG A -10 -2.900 2.152 -6.938 1.00 0.00 N ATOM 34 NH2 ARG A -10 -3.525 2.545 -9.105 1.00 0.00 N ATOM 0 H ARG A -10 1.319 -2.699 -7.811 1.00 0.00 H new ATOM 0 HA ARG A -10 -1.534 -1.930 -7.677 1.00 0.00 H new ATOM 0 HB2 ARG A -10 0.468 -1.844 -9.963 1.00 0.00 H new ATOM 0 HB3 ARG A -10 -1.090 -1.046 -9.887 1.00 0.00 H new ATOM 0 HG2 ARG A -10 1.276 -0.400 -8.059 1.00 0.00 H new ATOM 0 HG3 ARG A -10 0.852 0.508 -9.497 1.00 0.00 H new ATOM 0 HD2 ARG A -10 -1.015 0.139 -7.103 1.00 0.00 H new ATOM 0 HD3 ARG A -10 0.021 1.534 -7.328 1.00 0.00 H new ATOM 0 HE ARG A -10 -1.450 1.347 -9.706 1.00 0.00 H new ATOM 0 HH11 ARG A -10 -2.247 1.756 -6.262 1.00 0.00 H new ATOM 0 HH12 ARG A -10 -3.735 2.640 -6.614 1.00 0.00 H new ATOM 0 HH21 ARG A -10 -3.358 2.454 -10.107 1.00 0.00 H new ATOM 0 HH22 ARG A -10 -4.357 3.030 -8.769 1.00 0.00 H new ATOM 48 N ASP A -9 -0.627 -4.106 -9.997 1.00 0.00 N ATOM 49 CA ASP A -9 -0.517 -5.516 -10.459 1.00 0.00 C ATOM 50 C ASP A -9 -1.830 -6.171 -10.947 1.00 0.00 C ATOM 51 O ASP A -9 -1.823 -7.354 -11.310 1.00 0.00 O ATOM 52 CB ASP A -9 0.208 -6.361 -9.376 1.00 0.00 C ATOM 53 CG ASP A -9 1.557 -5.741 -8.944 1.00 0.00 C ATOM 54 OD1 ASP A -9 2.267 -5.156 -9.801 1.00 0.00 O ATOM 55 OD2 ASP A -9 1.922 -5.842 -7.759 1.00 0.00 O ATOM 0 H ASP A -9 -0.180 -3.446 -10.633 1.00 0.00 H new ATOM 0 HA ASP A -9 0.083 -5.490 -11.369 1.00 0.00 H new ATOM 0 HB2 ASP A -9 -0.438 -6.459 -8.504 1.00 0.00 H new ATOM 0 HB3 ASP A -9 0.381 -7.366 -9.760 1.00 0.00 H new ATOM 60 N TYR A -8 -2.929 -5.391 -10.946 1.00 0.00 N ATOM 61 CA TYR A -8 -4.162 -5.647 -11.733 1.00 0.00 C ATOM 62 C TYR A -8 -4.843 -7.007 -11.461 1.00 0.00 C ATOM 63 O TYR A -8 -5.792 -7.098 -10.677 1.00 0.00 O ATOM 64 CB TYR A -8 -3.866 -5.448 -13.255 1.00 0.00 C ATOM 65 CG TYR A -8 -3.362 -4.037 -13.593 1.00 0.00 C ATOM 66 CD1 TYR A -8 -4.259 -3.012 -13.895 1.00 0.00 C ATOM 67 CD2 TYR A -8 -1.993 -3.720 -13.563 1.00 0.00 C ATOM 68 CE1 TYR A -8 -3.826 -1.731 -14.150 1.00 0.00 C ATOM 69 CE2 TYR A -8 -1.555 -2.432 -13.827 1.00 0.00 C ATOM 70 CZ TYR A -8 -2.480 -1.443 -14.117 1.00 0.00 C ATOM 71 OH TYR A -8 -2.060 -0.154 -14.363 1.00 0.00 O ATOM 0 H TYR A -8 -2.990 -4.542 -10.384 1.00 0.00 H new ATOM 0 HA TYR A -8 -4.894 -4.913 -11.395 1.00 0.00 H new ATOM 0 HB2 TYR A -8 -3.122 -6.179 -13.573 1.00 0.00 H new ATOM 0 HB3 TYR A -8 -4.773 -5.649 -13.825 1.00 0.00 H new ATOM 0 HD1 TYR A -8 -5.316 -3.229 -13.929 1.00 0.00 H new ATOM 0 HD2 TYR A -8 -1.273 -4.491 -13.331 1.00 0.00 H new ATOM 0 HE1 TYR A -8 -4.540 -0.953 -14.376 1.00 0.00 H new ATOM 0 HE2 TYR A -8 -0.500 -2.201 -13.807 1.00 0.00 H new ATOM 0 HH TYR A -8 -1.083 -0.111 -14.302 1.00 0.00 H new ATOM 81 N LYS A -7 -4.310 -8.040 -12.103 1.00 0.00 N ATOM 82 CA LYS A -7 -4.927 -9.368 -12.233 1.00 0.00 C ATOM 83 C LYS A -7 -5.163 -10.092 -10.893 1.00 0.00 C ATOM 84 O LYS A -7 -6.146 -10.835 -10.765 1.00 0.00 O ATOM 85 CB LYS A -7 -4.012 -10.210 -13.151 1.00 0.00 C ATOM 86 CG LYS A -7 -2.563 -10.415 -12.616 1.00 0.00 C ATOM 87 CD LYS A -7 -1.516 -10.569 -13.747 1.00 0.00 C ATOM 88 CE LYS A -7 -0.186 -11.173 -13.263 1.00 0.00 C ATOM 89 NZ LYS A -7 -0.340 -12.532 -12.685 1.00 0.00 N ATOM 0 H LYS A -7 -3.403 -7.980 -12.567 1.00 0.00 H new ATOM 0 HA LYS A -7 -5.924 -9.239 -12.655 1.00 0.00 H new ATOM 0 HB2 LYS A -7 -4.471 -11.187 -13.301 1.00 0.00 H new ATOM 0 HB3 LYS A -7 -3.959 -9.729 -14.128 1.00 0.00 H new ATOM 0 HG2 LYS A -7 -2.290 -9.566 -11.989 1.00 0.00 H new ATOM 0 HG3 LYS A -7 -2.538 -11.301 -11.982 1.00 0.00 H new ATOM 0 HD2 LYS A -7 -1.930 -11.201 -14.533 1.00 0.00 H new ATOM 0 HD3 LYS A -7 -1.324 -9.592 -14.191 1.00 0.00 H new ATOM 0 HE2 LYS A -7 0.512 -11.217 -14.099 1.00 0.00 H new ATOM 0 HE3 LYS A -7 0.255 -10.514 -12.515 1.00 0.00 H new ATOM 0 HZ1 LYS A -7 0.597 -12.967 -12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A -7 -0.811 -12.465 -11.760 1.00 0.00 H new ATOM 0 HZ3 LYS A -7 -0.914 -13.118 -13.324 1.00 0.00 H new ATOM 103 N ASP A -6 -4.286 -9.856 -9.899 1.00 0.00 N ATOM 104 CA ASP A -6 -4.280 -10.660 -8.659 1.00 0.00 C ATOM 105 C ASP A -6 -3.581 -9.920 -7.496 1.00 0.00 C ATOM 106 O ASP A -6 -3.074 -8.805 -7.670 1.00 0.00 O ATOM 107 CB ASP A -6 -3.584 -12.029 -8.950 1.00 0.00 C ATOM 108 CG ASP A -6 -3.989 -13.156 -7.983 1.00 0.00 C ATOM 109 OD1 ASP A -6 -5.000 -13.841 -8.245 1.00 0.00 O ATOM 110 OD2 ASP A -6 -3.306 -13.363 -6.959 1.00 0.00 O ATOM 0 H ASP A -6 -3.578 -9.122 -9.928 1.00 0.00 H new ATOM 0 HA ASP A -6 -5.310 -10.829 -8.345 1.00 0.00 H new ATOM 0 HB2 ASP A -6 -3.821 -12.336 -9.969 1.00 0.00 H new ATOM 0 HB3 ASP A -6 -2.504 -11.893 -8.901 1.00 0.00 H new ATOM 115 N ASP A -5 -3.603 -10.553 -6.311 1.00 0.00 N ATOM 116 CA ASP A -5 -2.855 -10.124 -5.116 1.00 0.00 C ATOM 117 C ASP A -5 -1.376 -10.560 -5.211 1.00 0.00 C ATOM 118 O ASP A -5 -0.457 -9.751 -5.025 1.00 0.00 O ATOM 119 CB ASP A -5 -3.527 -10.740 -3.856 1.00 0.00 C ATOM 120 CG ASP A -5 -2.787 -10.420 -2.541 1.00 0.00 C ATOM 121 OD1 ASP A -5 -2.661 -9.226 -2.198 1.00 0.00 O ATOM 122 OD2 ASP A -5 -2.347 -11.354 -1.837 1.00 0.00 O ATOM 0 H ASP A -5 -4.154 -11.397 -6.153 1.00 0.00 H new ATOM 0 HA ASP A -5 -2.875 -9.036 -5.046 1.00 0.00 H new ATOM 0 HB2 ASP A -5 -4.551 -10.373 -3.785 1.00 0.00 H new ATOM 0 HB3 ASP A -5 -3.583 -11.822 -3.977 1.00 0.00 H new ATOM 127 N ASP A -4 -1.171 -11.855 -5.492 1.00 0.00 N ATOM 128 CA ASP A -4 0.166 -12.462 -5.649 1.00 0.00 C ATOM 129 C ASP A -4 0.534 -12.565 -7.138 1.00 0.00 C ATOM 130 O ASP A -4 -0.360 -12.637 -7.989 1.00 0.00 O ATOM 131 CB ASP A -4 0.201 -13.859 -4.992 1.00 0.00 C ATOM 132 CG ASP A -4 -0.068 -13.813 -3.478 1.00 0.00 C ATOM 133 OD1 ASP A -4 0.853 -13.447 -2.706 1.00 0.00 O ATOM 134 OD2 ASP A -4 -1.191 -14.148 -3.052 1.00 0.00 O ATOM 0 H ASP A -4 -1.934 -12.520 -5.619 1.00 0.00 H new ATOM 0 HA ASP A -4 0.897 -11.825 -5.152 1.00 0.00 H new ATOM 0 HB2 ASP A -4 -0.542 -14.498 -5.469 1.00 0.00 H new ATOM 0 HB3 ASP A -4 1.175 -14.315 -5.170 1.00 0.00 H new ATOM 139 N ASP A -3 1.860 -12.575 -7.416 1.00 0.00 N ATOM 140 CA ASP A -3 2.453 -12.634 -8.778 1.00 0.00 C ATOM 141 C ASP A -3 2.027 -11.418 -9.627 1.00 0.00 C ATOM 142 O ASP A -3 0.919 -11.385 -10.182 1.00 0.00 O ATOM 143 CB ASP A -3 2.138 -13.974 -9.502 1.00 0.00 C ATOM 144 CG ASP A -3 2.875 -14.135 -10.852 1.00 0.00 C ATOM 145 OD1 ASP A -3 4.029 -14.614 -10.850 1.00 0.00 O ATOM 146 OD2 ASP A -3 2.316 -13.770 -11.912 1.00 0.00 O ATOM 0 H ASP A -3 2.567 -12.541 -6.681 1.00 0.00 H new ATOM 0 HA ASP A -3 3.535 -12.592 -8.655 1.00 0.00 H new ATOM 0 HB2 ASP A -3 2.409 -14.803 -8.848 1.00 0.00 H new ATOM 0 HB3 ASP A -3 1.064 -14.041 -9.674 1.00 0.00 H new ATOM 151 N LYS A -2 2.940 -10.439 -9.724 1.00 0.00 N ATOM 152 CA LYS A -2 2.686 -9.114 -10.322 1.00 0.00 C ATOM 153 C LYS A -2 2.377 -9.179 -11.832 1.00 0.00 C ATOM 154 O LYS A -2 1.416 -8.546 -12.291 1.00 0.00 O ATOM 155 CB LYS A -2 3.907 -8.187 -10.053 1.00 0.00 C ATOM 156 CG LYS A -2 5.256 -8.700 -10.616 1.00 0.00 C ATOM 157 CD LYS A -2 6.392 -7.664 -10.540 1.00 0.00 C ATOM 158 CE LYS A -2 7.687 -8.179 -11.197 1.00 0.00 C ATOM 159 NZ LYS A -2 8.742 -7.145 -11.222 1.00 0.00 N ATOM 0 H LYS A -2 3.895 -10.546 -9.383 1.00 0.00 H new ATOM 0 HA LYS A -2 1.792 -8.707 -9.849 1.00 0.00 H new ATOM 0 HB2 LYS A -2 3.701 -7.206 -10.482 1.00 0.00 H new ATOM 0 HB3 LYS A -2 4.009 -8.049 -8.977 1.00 0.00 H new ATOM 0 HG2 LYS A -2 5.553 -9.593 -10.066 1.00 0.00 H new ATOM 0 HG3 LYS A -2 5.116 -8.997 -11.655 1.00 0.00 H new ATOM 0 HD2 LYS A -2 6.077 -6.744 -11.032 1.00 0.00 H new ATOM 0 HD3 LYS A -2 6.588 -7.417 -9.497 1.00 0.00 H new ATOM 0 HE2 LYS A -2 8.047 -9.052 -10.653 1.00 0.00 H new ATOM 0 HE3 LYS A -2 7.473 -8.504 -12.215 1.00 0.00 H new ATOM 0 HZ1 LYS A -2 9.596 -7.532 -11.672 1.00 0.00 H new ATOM 0 HZ2 LYS A -2 8.408 -6.322 -11.763 1.00 0.00 H new ATOM 0 HZ3 LYS A -2 8.965 -6.853 -10.249 1.00 0.00 H new ATOM 173 N GLY A -1 3.185 -9.959 -12.588 1.00 0.00 N ATOM 174 CA GLY A -1 3.133 -9.961 -14.061 1.00 0.00 C ATOM 175 C GLY A -1 3.248 -8.561 -14.671 1.00 0.00 C ATOM 176 O GLY A -1 2.648 -8.273 -15.705 1.00 0.00 O ATOM 0 H GLY A -1 3.880 -10.595 -12.197 1.00 0.00 H new ATOM 0 HA2 GLY A -1 3.940 -10.585 -14.446 1.00 0.00 H new ATOM 0 HA3 GLY A -1 2.196 -10.415 -14.384 1.00 0.00 H new ATOM 180 N THR A 0 4.009 -7.692 -13.991 1.00 0.00 N ATOM 181 CA THR A 0 4.209 -6.290 -14.380 1.00 0.00 C ATOM 182 C THR A 0 5.705 -5.981 -14.516 1.00 0.00 C ATOM 183 O THR A 0 6.561 -6.746 -14.054 1.00 0.00 O ATOM 184 CB THR A 0 3.558 -5.312 -13.344 1.00 0.00 C ATOM 185 OG1 THR A 0 4.029 -5.621 -12.031 1.00 0.00 O ATOM 186 CG2 THR A 0 2.017 -5.360 -13.368 1.00 0.00 C ATOM 0 H THR A 0 4.511 -7.949 -13.141 1.00 0.00 H new ATOM 0 HA THR A 0 3.722 -6.142 -15.344 1.00 0.00 H new ATOM 0 HB THR A 0 3.853 -4.301 -13.625 1.00 0.00 H new ATOM 0 HG1 THR A 0 3.320 -5.443 -11.379 1.00 0.00 H new ATOM 0 HG21 THR A 0 1.620 -4.663 -12.630 1.00 0.00 H new ATOM 0 HG22 THR A 0 1.660 -5.082 -14.360 1.00 0.00 H new ATOM 0 HG23 THR A 0 1.681 -6.369 -13.131 1.00 0.00 H new ATOM 194 N MET A 1 5.999 -4.838 -15.140 1.00 0.00 N ATOM 195 CA MET A 1 7.356 -4.378 -15.421 1.00 0.00 C ATOM 196 C MET A 1 7.432 -2.857 -15.211 1.00 0.00 C ATOM 197 O MET A 1 6.583 -2.103 -15.711 1.00 0.00 O ATOM 198 CB MET A 1 7.780 -4.782 -16.863 1.00 0.00 C ATOM 199 CG MET A 1 6.910 -4.231 -17.997 1.00 0.00 C ATOM 200 SD MET A 1 7.555 -4.663 -19.626 1.00 0.00 S ATOM 201 CE MET A 1 6.491 -3.690 -20.686 1.00 0.00 C ATOM 0 H MET A 1 5.281 -4.193 -15.471 1.00 0.00 H new ATOM 0 HA MET A 1 8.055 -4.855 -14.734 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.806 -4.451 -17.025 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.782 -5.870 -16.929 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.896 -4.619 -17.895 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.847 -3.146 -17.909 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.671 -3.958 -21.727 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.449 -3.888 -20.436 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.704 -2.631 -20.542 1.00 0.00 H new ATOM 211 N GLU A 2 8.426 -2.425 -14.422 1.00 0.00 N ATOM 212 CA GLU A 2 8.684 -1.007 -14.147 1.00 0.00 C ATOM 213 C GLU A 2 9.496 -0.412 -15.304 1.00 0.00 C ATOM 214 O GLU A 2 10.429 -1.039 -15.779 1.00 0.00 O ATOM 215 CB GLU A 2 9.432 -0.843 -12.800 1.00 0.00 C ATOM 216 CG GLU A 2 9.663 0.618 -12.366 1.00 0.00 C ATOM 217 CD GLU A 2 10.349 0.743 -10.997 1.00 0.00 C ATOM 218 OE1 GLU A 2 9.687 0.484 -9.972 1.00 0.00 O ATOM 219 OE2 GLU A 2 11.549 1.088 -10.937 1.00 0.00 O ATOM 0 H GLU A 2 9.077 -3.055 -13.954 1.00 0.00 H new ATOM 0 HA GLU A 2 7.738 -0.472 -14.065 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.866 -1.354 -12.021 1.00 0.00 H new ATOM 0 HB3 GLU A 2 10.398 -1.343 -12.873 1.00 0.00 H new ATOM 0 HG2 GLU A 2 10.272 1.121 -13.117 1.00 0.00 H new ATOM 0 HG3 GLU A 2 8.705 1.136 -12.333 1.00 0.00 H new ATOM 226 N LEU A 3 9.127 0.786 -15.773 1.00 0.00 N ATOM 227 CA LEU A 3 9.729 1.406 -16.967 1.00 0.00 C ATOM 228 C LEU A 3 10.191 2.834 -16.644 1.00 0.00 C ATOM 229 O LEU A 3 9.423 3.609 -16.079 1.00 0.00 O ATOM 230 CB LEU A 3 8.678 1.436 -18.103 1.00 0.00 C ATOM 231 CG LEU A 3 7.952 0.090 -18.407 1.00 0.00 C ATOM 232 CD1 LEU A 3 6.791 0.307 -19.382 1.00 0.00 C ATOM 233 CD2 LEU A 3 8.939 -0.971 -18.940 1.00 0.00 C ATOM 0 H LEU A 3 8.402 1.356 -15.337 1.00 0.00 H new ATOM 0 HA LEU A 3 10.595 0.824 -17.282 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.924 2.182 -17.852 1.00 0.00 H new ATOM 0 HB3 LEU A 3 9.170 1.773 -19.015 1.00 0.00 H new ATOM 0 HG LEU A 3 7.540 -0.288 -17.471 1.00 0.00 H new ATOM 0 HD11 LEU A 3 6.299 -0.645 -19.580 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.074 1.002 -18.945 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.173 0.719 -20.316 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.402 -1.898 -19.142 1.00 0.00 H new ATOM 0 HD22 LEU A 3 9.400 -0.610 -19.860 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.713 -1.155 -18.195 1.00 0.00 H new ATOM 245 N GLU A 4 11.426 3.190 -17.035 1.00 0.00 N ATOM 246 CA GLU A 4 11.940 4.556 -16.866 1.00 0.00 C ATOM 247 C GLU A 4 11.565 5.374 -18.111 1.00 0.00 C ATOM 248 O GLU A 4 12.268 5.357 -19.121 1.00 0.00 O ATOM 249 CB GLU A 4 13.482 4.547 -16.658 1.00 0.00 C ATOM 250 CG GLU A 4 14.103 5.950 -16.447 1.00 0.00 C ATOM 251 CD GLU A 4 15.641 5.969 -16.340 1.00 0.00 C ATOM 252 OE1 GLU A 4 16.319 5.052 -16.867 1.00 0.00 O ATOM 253 OE2 GLU A 4 16.190 6.944 -15.780 1.00 0.00 O ATOM 0 H GLU A 4 12.087 2.547 -17.471 1.00 0.00 H new ATOM 0 HA GLU A 4 11.495 5.007 -15.979 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.717 3.925 -15.795 1.00 0.00 H new ATOM 0 HB3 GLU A 4 13.951 4.081 -17.524 1.00 0.00 H new ATOM 0 HG2 GLU A 4 13.803 6.593 -17.275 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.685 6.384 -15.539 1.00 0.00 H new ATOM 260 N LEU A 5 10.457 6.114 -18.042 1.00 0.00 N ATOM 261 CA LEU A 5 9.948 6.839 -19.210 1.00 0.00 C ATOM 262 C LEU A 5 10.515 8.252 -19.186 1.00 0.00 C ATOM 263 O LEU A 5 10.092 9.096 -18.400 1.00 0.00 O ATOM 264 CB LEU A 5 8.405 6.850 -19.220 1.00 0.00 C ATOM 265 CG LEU A 5 7.713 5.466 -19.049 1.00 0.00 C ATOM 266 CD1 LEU A 5 6.189 5.610 -19.087 1.00 0.00 C ATOM 267 CD2 LEU A 5 8.203 4.445 -20.099 1.00 0.00 C ATOM 0 H LEU A 5 9.898 6.227 -17.197 1.00 0.00 H new ATOM 0 HA LEU A 5 10.266 6.339 -20.125 1.00 0.00 H new ATOM 0 HB2 LEU A 5 8.061 7.508 -18.422 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.070 7.288 -20.160 1.00 0.00 H new ATOM 0 HG LEU A 5 7.994 5.079 -18.070 1.00 0.00 H new ATOM 0 HD11 LEU A 5 5.728 4.630 -18.966 1.00 0.00 H new ATOM 0 HD12 LEU A 5 5.865 6.266 -18.279 1.00 0.00 H new ATOM 0 HD13 LEU A 5 5.888 6.037 -20.044 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.696 3.493 -19.945 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.981 4.817 -21.099 1.00 0.00 H new ATOM 0 HD23 LEU A 5 9.279 4.304 -19.995 1.00 0.00 H new ATOM 279 N ARG A 6 11.503 8.469 -20.045 1.00 0.00 N ATOM 280 CA ARG A 6 12.230 9.726 -20.152 1.00 0.00 C ATOM 281 C ARG A 6 11.555 10.623 -21.188 1.00 0.00 C ATOM 282 O ARG A 6 11.463 10.263 -22.339 1.00 0.00 O ATOM 283 CB ARG A 6 13.697 9.429 -20.545 1.00 0.00 C ATOM 284 CG ARG A 6 14.471 8.592 -19.509 1.00 0.00 C ATOM 285 CD ARG A 6 15.894 8.249 -19.969 1.00 0.00 C ATOM 286 NE ARG A 6 16.712 7.710 -18.873 1.00 0.00 N ATOM 287 CZ ARG A 6 18.023 7.445 -18.936 1.00 0.00 C ATOM 288 NH1 ARG A 6 18.720 7.658 -20.051 1.00 0.00 N ATOM 289 NH2 ARG A 6 18.617 6.937 -17.871 1.00 0.00 N ATOM 0 H ARG A 6 11.828 7.759 -20.701 1.00 0.00 H new ATOM 0 HA ARG A 6 12.222 10.248 -19.195 1.00 0.00 H new ATOM 0 HB2 ARG A 6 13.706 8.904 -21.500 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.219 10.374 -20.696 1.00 0.00 H new ATOM 0 HG2 ARG A 6 14.520 9.140 -18.568 1.00 0.00 H new ATOM 0 HG3 ARG A 6 13.925 7.669 -19.312 1.00 0.00 H new ATOM 0 HD2 ARG A 6 15.848 7.521 -20.779 1.00 0.00 H new ATOM 0 HD3 ARG A 6 16.370 9.143 -20.371 1.00 0.00 H new ATOM 0 HE ARG A 6 16.240 7.522 -17.988 1.00 0.00 H new ATOM 0 HH11 ARG A 6 18.256 8.030 -20.879 1.00 0.00 H new ATOM 0 HH12 ARG A 6 19.718 7.449 -20.076 1.00 0.00 H new ATOM 0 HH21 ARG A 6 18.078 6.755 -17.025 1.00 0.00 H new ATOM 0 HH22 ARG A 6 19.615 6.727 -17.895 1.00 0.00 H new ATOM 303 N PHE A 7 11.068 11.784 -20.752 1.00 0.00 N ATOM 304 CA PHE A 7 10.391 12.758 -21.630 1.00 0.00 C ATOM 305 C PHE A 7 11.314 13.942 -21.869 1.00 0.00 C ATOM 306 O PHE A 7 12.039 14.360 -20.963 1.00 0.00 O ATOM 307 CB PHE A 7 9.070 13.234 -20.989 1.00 0.00 C ATOM 308 CG PHE A 7 8.090 12.111 -20.737 1.00 0.00 C ATOM 309 CD1 PHE A 7 8.144 11.385 -19.561 1.00 0.00 C ATOM 310 CD2 PHE A 7 7.134 11.762 -21.687 1.00 0.00 C ATOM 311 CE1 PHE A 7 7.272 10.347 -19.339 1.00 0.00 C ATOM 312 CE2 PHE A 7 6.263 10.716 -21.464 1.00 0.00 C ATOM 313 CZ PHE A 7 6.336 10.007 -20.288 1.00 0.00 C ATOM 0 H PHE A 7 11.128 12.083 -19.779 1.00 0.00 H new ATOM 0 HA PHE A 7 10.157 12.281 -22.582 1.00 0.00 H new ATOM 0 HB2 PHE A 7 9.291 13.733 -20.045 1.00 0.00 H new ATOM 0 HB3 PHE A 7 8.604 13.974 -21.640 1.00 0.00 H new ATOM 0 HD1 PHE A 7 8.879 11.636 -18.810 1.00 0.00 H new ATOM 0 HD2 PHE A 7 7.074 12.318 -22.611 1.00 0.00 H new ATOM 0 HE1 PHE A 7 7.322 9.794 -18.413 1.00 0.00 H new ATOM 0 HE2 PHE A 7 5.527 10.455 -22.210 1.00 0.00 H new ATOM 0 HZ PHE A 7 5.659 9.184 -20.110 1.00 0.00 H new ATOM 323 N PHE A 8 11.302 14.471 -23.098 1.00 0.00 N ATOM 324 CA PHE A 8 12.128 15.630 -23.488 1.00 0.00 C ATOM 325 C PHE A 8 11.268 16.636 -24.263 1.00 0.00 C ATOM 326 O PHE A 8 10.177 16.286 -24.732 1.00 0.00 O ATOM 327 CB PHE A 8 13.366 15.165 -24.297 1.00 0.00 C ATOM 328 CG PHE A 8 14.216 14.141 -23.541 1.00 0.00 C ATOM 329 CD1 PHE A 8 15.105 14.536 -22.538 1.00 0.00 C ATOM 330 CD2 PHE A 8 14.075 12.777 -23.788 1.00 0.00 C ATOM 331 CE1 PHE A 8 15.818 13.600 -21.809 1.00 0.00 C ATOM 332 CE2 PHE A 8 14.794 11.849 -23.072 1.00 0.00 C ATOM 333 CZ PHE A 8 15.663 12.255 -22.077 1.00 0.00 C ATOM 0 H PHE A 8 10.720 14.110 -23.854 1.00 0.00 H new ATOM 0 HA PHE A 8 12.504 16.132 -22.597 1.00 0.00 H new ATOM 0 HB2 PHE A 8 13.036 14.731 -25.241 1.00 0.00 H new ATOM 0 HB3 PHE A 8 13.981 16.031 -24.542 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.238 15.587 -22.328 1.00 0.00 H new ATOM 0 HD2 PHE A 8 13.390 12.443 -24.554 1.00 0.00 H new ATOM 0 HE1 PHE A 8 16.495 13.922 -21.031 1.00 0.00 H new ATOM 0 HE2 PHE A 8 14.679 10.797 -23.288 1.00 0.00 H new ATOM 0 HZ PHE A 8 16.219 11.522 -21.511 1.00 0.00 H new ATOM 343 N ALA A 9 11.745 17.900 -24.314 1.00 0.00 N ATOM 344 CA ALA A 9 11.084 19.014 -25.023 1.00 0.00 C ATOM 345 C ALA A 9 9.633 19.267 -24.498 1.00 0.00 C ATOM 346 O ALA A 9 9.445 19.371 -23.277 1.00 0.00 O ATOM 347 CB ALA A 9 11.160 18.773 -26.531 1.00 0.00 C ATOM 0 H ALA A 9 12.613 18.177 -23.856 1.00 0.00 H new ATOM 0 HA ALA A 9 11.616 19.942 -24.812 1.00 0.00 H new ATOM 0 HB1 ALA A 9 10.672 19.595 -27.056 1.00 0.00 H new ATOM 0 HB2 ALA A 9 12.204 18.715 -26.838 1.00 0.00 H new ATOM 0 HB3 ALA A 9 10.658 17.837 -26.776 1.00 0.00 H new ATOM 353 N THR A 10 8.624 19.372 -25.415 1.00 0.00 N ATOM 354 CA THR A 10 7.195 19.543 -25.057 1.00 0.00 C ATOM 355 C THR A 10 6.717 18.417 -24.121 1.00 0.00 C ATOM 356 O THR A 10 6.168 18.688 -23.059 1.00 0.00 O ATOM 357 CB THR A 10 6.293 19.580 -26.339 1.00 0.00 C ATOM 358 OG1 THR A 10 6.729 20.635 -27.212 1.00 0.00 O ATOM 359 CG2 THR A 10 4.791 19.759 -26.022 1.00 0.00 C ATOM 0 H THR A 10 8.787 19.339 -26.421 1.00 0.00 H new ATOM 0 HA THR A 10 7.105 20.495 -24.535 1.00 0.00 H new ATOM 0 HB THR A 10 6.402 18.611 -26.826 1.00 0.00 H new ATOM 0 HG1 THR A 10 6.163 20.652 -28.012 1.00 0.00 H new ATOM 0 HG21 THR A 10 4.222 19.777 -26.952 1.00 0.00 H new ATOM 0 HG22 THR A 10 4.448 18.930 -25.403 1.00 0.00 H new ATOM 0 HG23 THR A 10 4.641 20.697 -25.487 1.00 0.00 H new ATOM 367 N PHE A 11 7.010 17.158 -24.501 1.00 0.00 N ATOM 368 CA PHE A 11 6.564 15.966 -23.742 1.00 0.00 C ATOM 369 C PHE A 11 7.113 15.984 -22.293 1.00 0.00 C ATOM 370 O PHE A 11 6.473 15.447 -21.389 1.00 0.00 O ATOM 371 CB PHE A 11 6.963 14.648 -24.479 1.00 0.00 C ATOM 372 CG PHE A 11 6.179 14.319 -25.772 1.00 0.00 C ATOM 373 CD1 PHE A 11 5.170 15.153 -26.269 1.00 0.00 C ATOM 374 CD2 PHE A 11 6.448 13.142 -26.481 1.00 0.00 C ATOM 375 CE1 PHE A 11 4.467 14.817 -27.416 1.00 0.00 C ATOM 376 CE2 PHE A 11 5.745 12.816 -27.630 1.00 0.00 C ATOM 377 CZ PHE A 11 4.755 13.652 -28.094 1.00 0.00 C ATOM 0 H PHE A 11 7.556 16.936 -25.333 1.00 0.00 H new ATOM 0 HA PHE A 11 5.476 15.999 -23.683 1.00 0.00 H new ATOM 0 HB2 PHE A 11 8.023 14.702 -24.727 1.00 0.00 H new ATOM 0 HB3 PHE A 11 6.840 13.817 -23.784 1.00 0.00 H new ATOM 0 HD1 PHE A 11 4.936 16.071 -25.751 1.00 0.00 H new ATOM 0 HD2 PHE A 11 7.219 12.475 -26.125 1.00 0.00 H new ATOM 0 HE1 PHE A 11 3.689 15.472 -27.780 1.00 0.00 H new ATOM 0 HE2 PHE A 11 5.974 11.905 -28.162 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.205 13.396 -28.987 1.00 0.00 H new ATOM 387 N ARG A 12 8.282 16.644 -22.086 1.00 0.00 N ATOM 388 CA ARG A 12 8.891 16.784 -20.747 1.00 0.00 C ATOM 389 C ARG A 12 8.055 17.707 -19.858 1.00 0.00 C ATOM 390 O ARG A 12 7.692 17.330 -18.744 1.00 0.00 O ATOM 391 CB ARG A 12 10.364 17.282 -20.831 1.00 0.00 C ATOM 392 CG ARG A 12 11.089 17.507 -19.461 1.00 0.00 C ATOM 393 CD ARG A 12 11.084 18.980 -18.996 1.00 0.00 C ATOM 394 NE ARG A 12 11.433 19.152 -17.568 1.00 0.00 N ATOM 395 CZ ARG A 12 10.859 20.052 -16.742 1.00 0.00 C ATOM 396 NH1 ARG A 12 9.913 20.876 -17.182 1.00 0.00 N ATOM 397 NH2 ARG A 12 11.254 20.139 -15.481 1.00 0.00 N ATOM 0 H ARG A 12 8.818 17.086 -22.833 1.00 0.00 H new ATOM 0 HA ARG A 12 8.906 15.793 -20.293 1.00 0.00 H new ATOM 0 HB2 ARG A 12 10.939 16.559 -21.410 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.379 18.220 -21.386 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.609 16.892 -18.700 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.120 17.164 -19.544 1.00 0.00 H new ATOM 0 HD2 ARG A 12 11.789 19.547 -19.604 1.00 0.00 H new ATOM 0 HD3 ARG A 12 10.096 19.405 -19.174 1.00 0.00 H new ATOM 0 HE ARG A 12 12.158 18.548 -17.181 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.612 20.833 -18.156 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.488 21.551 -16.546 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.992 19.526 -15.134 1.00 0.00 H new ATOM 0 HH22 ARG A 12 10.820 20.819 -14.857 1.00 0.00 H new ATOM 411 N GLU A 13 7.755 18.918 -20.366 1.00 0.00 N ATOM 412 CA GLU A 13 7.076 19.971 -19.577 1.00 0.00 C ATOM 413 C GLU A 13 5.585 19.646 -19.359 1.00 0.00 C ATOM 414 O GLU A 13 4.957 20.165 -18.428 1.00 0.00 O ATOM 415 CB GLU A 13 7.315 21.375 -20.214 1.00 0.00 C ATOM 416 CG GLU A 13 6.845 21.583 -21.681 1.00 0.00 C ATOM 417 CD GLU A 13 5.329 21.828 -21.848 1.00 0.00 C ATOM 418 OE1 GLU A 13 4.770 22.666 -21.106 1.00 0.00 O ATOM 419 OE2 GLU A 13 4.698 21.221 -22.740 1.00 0.00 O ATOM 0 H GLU A 13 7.972 19.195 -21.323 1.00 0.00 H new ATOM 0 HA GLU A 13 7.519 19.999 -18.581 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.815 22.117 -19.591 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.383 21.588 -20.169 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.384 22.431 -22.104 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.123 20.705 -22.265 1.00 0.00 H new ATOM 426 N VAL A 14 5.043 18.777 -20.225 1.00 0.00 N ATOM 427 CA VAL A 14 3.711 18.176 -20.045 1.00 0.00 C ATOM 428 C VAL A 14 3.676 17.318 -18.769 1.00 0.00 C ATOM 429 O VAL A 14 2.830 17.508 -17.884 1.00 0.00 O ATOM 430 CB VAL A 14 3.322 17.304 -21.292 1.00 0.00 C ATOM 431 CG1 VAL A 14 2.082 16.439 -20.996 1.00 0.00 C ATOM 432 CG2 VAL A 14 3.095 18.184 -22.549 1.00 0.00 C ATOM 0 H VAL A 14 5.517 18.469 -21.074 1.00 0.00 H new ATOM 0 HA VAL A 14 2.985 18.983 -19.946 1.00 0.00 H new ATOM 0 HB VAL A 14 4.158 16.637 -21.501 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.834 15.845 -21.876 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.293 15.775 -20.158 1.00 0.00 H new ATOM 0 HG13 VAL A 14 1.240 17.084 -20.745 1.00 0.00 H new ATOM 0 HG21 VAL A 14 2.827 17.549 -23.394 1.00 0.00 H new ATOM 0 HG22 VAL A 14 2.289 18.892 -22.357 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.009 18.730 -22.781 1.00 0.00 H new ATOM 442 N VAL A 15 4.627 16.388 -18.693 1.00 0.00 N ATOM 443 CA VAL A 15 4.772 15.470 -17.558 1.00 0.00 C ATOM 444 C VAL A 15 5.346 16.212 -16.329 1.00 0.00 C ATOM 445 O VAL A 15 5.136 15.801 -15.181 1.00 0.00 O ATOM 446 CB VAL A 15 5.659 14.239 -17.994 1.00 0.00 C ATOM 447 CG1 VAL A 15 5.930 13.251 -16.833 1.00 0.00 C ATOM 448 CG2 VAL A 15 4.989 13.507 -19.189 1.00 0.00 C ATOM 0 H VAL A 15 5.326 16.247 -19.423 1.00 0.00 H new ATOM 0 HA VAL A 15 3.796 15.089 -17.260 1.00 0.00 H new ATOM 0 HB VAL A 15 6.630 14.630 -18.299 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.544 12.426 -17.193 1.00 0.00 H new ATOM 0 HG12 VAL A 15 6.453 13.769 -16.029 1.00 0.00 H new ATOM 0 HG13 VAL A 15 4.983 12.862 -16.458 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.604 12.658 -19.487 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.002 13.153 -18.892 1.00 0.00 H new ATOM 0 HG23 VAL A 15 4.890 14.196 -20.028 1.00 0.00 H new ATOM 458 N GLY A 16 6.017 17.351 -16.603 1.00 0.00 N ATOM 459 CA GLY A 16 6.750 18.122 -15.596 1.00 0.00 C ATOM 460 C GLY A 16 7.995 17.397 -15.090 1.00 0.00 C ATOM 461 O GLY A 16 8.620 17.827 -14.114 1.00 0.00 O ATOM 0 H GLY A 16 6.061 17.758 -17.537 1.00 0.00 H new ATOM 0 HA2 GLY A 16 7.041 19.083 -16.021 1.00 0.00 H new ATOM 0 HA3 GLY A 16 6.090 18.333 -14.754 1.00 0.00 H new ATOM 465 N GLN A 17 8.362 16.304 -15.787 1.00 0.00 N ATOM 466 CA GLN A 17 9.466 15.410 -15.406 1.00 0.00 C ATOM 467 C GLN A 17 10.174 14.958 -16.690 1.00 0.00 C ATOM 468 O GLN A 17 9.511 14.717 -17.711 1.00 0.00 O ATOM 469 CB GLN A 17 8.966 14.145 -14.621 1.00 0.00 C ATOM 470 CG GLN A 17 7.802 14.379 -13.617 1.00 0.00 C ATOM 471 CD GLN A 17 7.559 13.222 -12.651 1.00 0.00 C ATOM 472 OE1 GLN A 17 8.490 12.518 -12.256 1.00 0.00 O ATOM 473 NE2 GLN A 17 6.306 13.007 -12.266 1.00 0.00 N ATOM 0 H GLN A 17 7.890 16.015 -16.644 1.00 0.00 H new ATOM 0 HA GLN A 17 10.140 15.956 -14.745 1.00 0.00 H new ATOM 0 HB2 GLN A 17 8.649 13.395 -15.345 1.00 0.00 H new ATOM 0 HB3 GLN A 17 9.810 13.724 -14.075 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.012 15.280 -13.040 1.00 0.00 H new ATOM 0 HG3 GLN A 17 6.887 14.566 -14.178 1.00 0.00 H new ATOM 0 HE21 GLN A 17 5.557 13.607 -12.610 1.00 0.00 H new ATOM 0 HE22 GLN A 17 6.093 12.242 -11.626 1.00 0.00 H new ATOM 482 N LYS A 18 11.512 14.834 -16.637 1.00 0.00 N ATOM 483 CA LYS A 18 12.314 14.390 -17.796 1.00 0.00 C ATOM 484 C LYS A 18 12.600 12.876 -17.746 1.00 0.00 C ATOM 485 O LYS A 18 13.146 12.327 -18.700 1.00 0.00 O ATOM 486 CB LYS A 18 13.617 15.219 -17.912 1.00 0.00 C ATOM 487 CG LYS A 18 14.577 15.128 -16.709 1.00 0.00 C ATOM 488 CD LYS A 18 15.769 16.102 -16.847 1.00 0.00 C ATOM 489 CE LYS A 18 16.676 15.786 -18.056 1.00 0.00 C ATOM 490 NZ LYS A 18 17.802 16.748 -18.171 1.00 0.00 N ATOM 0 H LYS A 18 12.064 15.035 -15.803 1.00 0.00 H new ATOM 0 HA LYS A 18 11.726 14.568 -18.697 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.152 14.897 -18.805 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.348 16.265 -18.061 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.031 15.350 -15.792 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.950 14.108 -16.619 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.389 17.119 -16.942 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.365 16.068 -15.935 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.071 14.775 -17.959 1.00 0.00 H new ATOM 0 HE3 LYS A 18 16.083 15.810 -18.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.387 16.501 -18.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.426 17.710 -18.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.383 16.707 -17.309 1.00 0.00 H new ATOM 504 N SER A 19 12.247 12.227 -16.616 1.00 0.00 N ATOM 505 CA SER A 19 12.258 10.753 -16.456 1.00 0.00 C ATOM 506 C SER A 19 11.310 10.378 -15.288 1.00 0.00 C ATOM 507 O SER A 19 11.426 10.939 -14.193 1.00 0.00 O ATOM 508 CB SER A 19 13.685 10.195 -16.140 1.00 0.00 C ATOM 509 OG SER A 19 14.708 10.835 -16.890 1.00 0.00 O ATOM 0 H SER A 19 11.941 12.718 -15.776 1.00 0.00 H new ATOM 0 HA SER A 19 11.932 10.313 -17.398 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.890 10.318 -15.077 1.00 0.00 H new ATOM 0 HB3 SER A 19 13.705 9.125 -16.347 1.00 0.00 H new ATOM 0 HG SER A 19 15.577 10.450 -16.653 1.00 0.00 H new ATOM 515 N ILE A 20 10.376 9.448 -15.524 1.00 0.00 N ATOM 516 CA ILE A 20 9.497 8.881 -14.471 1.00 0.00 C ATOM 517 C ILE A 20 9.741 7.373 -14.377 1.00 0.00 C ATOM 518 O ILE A 20 10.445 6.806 -15.214 1.00 0.00 O ATOM 519 CB ILE A 20 7.969 9.150 -14.775 1.00 0.00 C ATOM 520 CG1 ILE A 20 7.489 8.377 -16.037 1.00 0.00 C ATOM 521 CG2 ILE A 20 7.706 10.652 -14.951 1.00 0.00 C ATOM 522 CD1 ILE A 20 6.080 8.728 -16.499 1.00 0.00 C ATOM 0 H ILE A 20 10.201 9.060 -16.451 1.00 0.00 H new ATOM 0 HA ILE A 20 9.739 9.368 -13.526 1.00 0.00 H new ATOM 0 HB ILE A 20 7.401 8.786 -13.919 1.00 0.00 H new ATOM 0 HG12 ILE A 20 8.184 8.573 -16.853 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.534 7.308 -15.831 1.00 0.00 H new ATOM 0 HG21 ILE A 20 6.648 10.814 -15.159 1.00 0.00 H new ATOM 0 HG22 ILE A 20 7.981 11.179 -14.037 1.00 0.00 H new ATOM 0 HG23 ILE A 20 8.302 11.031 -15.781 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.830 8.142 -17.383 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.370 8.504 -15.703 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.030 9.790 -16.742 1.00 0.00 H new ATOM 534 N TYR A 21 9.168 6.732 -13.355 1.00 0.00 N ATOM 535 CA TYR A 21 9.079 5.264 -13.296 1.00 0.00 C ATOM 536 C TYR A 21 7.597 4.858 -13.280 1.00 0.00 C ATOM 537 O TYR A 21 6.870 5.139 -12.327 1.00 0.00 O ATOM 538 CB TYR A 21 9.824 4.691 -12.062 1.00 0.00 C ATOM 539 CG TYR A 21 11.354 4.860 -12.113 1.00 0.00 C ATOM 540 CD1 TYR A 21 12.148 4.073 -12.966 1.00 0.00 C ATOM 541 CD2 TYR A 21 12.008 5.790 -11.301 1.00 0.00 C ATOM 542 CE1 TYR A 21 13.522 4.214 -12.995 1.00 0.00 C ATOM 543 CE2 TYR A 21 13.384 5.926 -11.330 1.00 0.00 C ATOM 544 CZ TYR A 21 14.134 5.136 -12.175 1.00 0.00 C ATOM 545 OH TYR A 21 15.506 5.273 -12.205 1.00 0.00 O ATOM 0 H TYR A 21 8.756 7.206 -12.552 1.00 0.00 H new ATOM 0 HA TYR A 21 9.566 4.846 -14.177 1.00 0.00 H new ATOM 0 HB2 TYR A 21 9.446 5.180 -11.164 1.00 0.00 H new ATOM 0 HB3 TYR A 21 9.590 3.630 -11.971 1.00 0.00 H new ATOM 0 HD1 TYR A 21 11.676 3.346 -13.610 1.00 0.00 H new ATOM 0 HD2 TYR A 21 11.428 6.415 -10.638 1.00 0.00 H new ATOM 0 HE1 TYR A 21 14.115 3.603 -13.659 1.00 0.00 H new ATOM 0 HE2 TYR A 21 13.870 6.649 -10.692 1.00 0.00 H new ATOM 0 HH TYR A 21 15.780 5.966 -11.568 1.00 0.00 H new ATOM 555 N TRP A 22 7.166 4.221 -14.367 1.00 0.00 N ATOM 556 CA TRP A 22 5.841 3.590 -14.498 1.00 0.00 C ATOM 557 C TRP A 22 5.931 2.120 -14.116 1.00 0.00 C ATOM 558 O TRP A 22 7.011 1.620 -13.819 1.00 0.00 O ATOM 559 CB TRP A 22 5.330 3.736 -15.965 1.00 0.00 C ATOM 560 CG TRP A 22 4.342 4.844 -16.178 1.00 0.00 C ATOM 561 CD1 TRP A 22 4.289 6.048 -15.543 1.00 0.00 C ATOM 562 CD2 TRP A 22 3.258 4.833 -17.102 1.00 0.00 C ATOM 563 NE1 TRP A 22 3.268 6.799 -16.051 1.00 0.00 N ATOM 564 CE2 TRP A 22 2.613 6.069 -16.999 1.00 0.00 C ATOM 565 CE3 TRP A 22 2.778 3.894 -18.011 1.00 0.00 C ATOM 566 CZ2 TRP A 22 1.520 6.397 -17.776 1.00 0.00 C ATOM 567 CZ3 TRP A 22 1.680 4.217 -18.775 1.00 0.00 C ATOM 568 CH2 TRP A 22 1.065 5.465 -18.651 1.00 0.00 C ATOM 0 H TRP A 22 7.738 4.123 -15.206 1.00 0.00 H new ATOM 0 HA TRP A 22 5.138 4.085 -13.829 1.00 0.00 H new ATOM 0 HB2 TRP A 22 6.186 3.901 -16.619 1.00 0.00 H new ATOM 0 HB3 TRP A 22 4.872 2.795 -16.271 1.00 0.00 H new ATOM 0 HD1 TRP A 22 4.956 6.362 -14.754 1.00 0.00 H new ATOM 0 HE1 TRP A 22 3.033 7.750 -15.768 1.00 0.00 H new ATOM 0 HE3 TRP A 22 3.258 2.932 -18.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 1.043 7.362 -17.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 1.289 3.497 -19.479 1.00 0.00 H new ATOM 0 HH2 TRP A 22 0.207 5.694 -19.266 1.00 0.00 H new ATOM 579 N ARG A 23 4.781 1.442 -14.138 1.00 0.00 N ATOM 580 CA ARG A 23 4.710 -0.009 -13.979 1.00 0.00 C ATOM 581 C ARG A 23 3.407 -0.506 -14.613 1.00 0.00 C ATOM 582 O ARG A 23 2.319 -0.318 -14.059 1.00 0.00 O ATOM 583 CB ARG A 23 4.825 -0.376 -12.474 1.00 0.00 C ATOM 584 CG ARG A 23 4.816 -1.890 -12.137 1.00 0.00 C ATOM 585 CD ARG A 23 5.270 -2.137 -10.684 1.00 0.00 C ATOM 586 NE ARG A 23 4.965 -3.484 -10.177 1.00 0.00 N ATOM 587 CZ ARG A 23 5.247 -3.918 -8.934 1.00 0.00 C ATOM 588 NH1 ARG A 23 5.908 -3.149 -8.069 1.00 0.00 N ATOM 589 NH2 ARG A 23 4.866 -5.128 -8.564 1.00 0.00 N ATOM 0 H ARG A 23 3.872 1.886 -14.267 1.00 0.00 H new ATOM 0 HA ARG A 23 5.539 -0.501 -14.487 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.747 0.056 -12.085 1.00 0.00 H new ATOM 0 HB3 ARG A 23 4.001 0.099 -11.941 1.00 0.00 H new ATOM 0 HG2 ARG A 23 3.813 -2.292 -12.281 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.475 -2.423 -12.823 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.345 -1.971 -10.618 1.00 0.00 H new ATOM 0 HD3 ARG A 23 4.794 -1.401 -10.036 1.00 0.00 H new ATOM 0 HE ARG A 23 4.507 -4.136 -10.813 1.00 0.00 H new ATOM 0 HH11 ARG A 23 6.209 -2.214 -8.344 1.00 0.00 H new ATOM 0 HH12 ARG A 23 6.112 -3.495 -7.132 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.362 -5.726 -9.218 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.076 -5.464 -7.624 1.00 0.00 H new ATOM 603 N VAL A 24 3.546 -1.131 -15.789 1.00 0.00 N ATOM 604 CA VAL A 24 2.426 -1.684 -16.580 1.00 0.00 C ATOM 605 C VAL A 24 2.562 -3.203 -16.621 1.00 0.00 C ATOM 606 O VAL A 24 3.582 -3.730 -16.197 1.00 0.00 O ATOM 607 CB VAL A 24 2.410 -1.122 -18.060 1.00 0.00 C ATOM 608 CG1 VAL A 24 2.153 0.404 -18.090 1.00 0.00 C ATOM 609 CG2 VAL A 24 3.718 -1.483 -18.818 1.00 0.00 C ATOM 0 H VAL A 24 4.455 -1.272 -16.230 1.00 0.00 H new ATOM 0 HA VAL A 24 1.492 -1.386 -16.104 1.00 0.00 H new ATOM 0 HB VAL A 24 1.581 -1.604 -18.577 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.149 0.752 -19.123 1.00 0.00 H new ATOM 0 HG12 VAL A 24 1.188 0.620 -17.631 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.940 0.917 -17.537 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.674 -1.082 -19.831 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.572 -1.054 -18.295 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.826 -2.567 -18.861 1.00 0.00 H new ATOM 619 N ASP A 25 1.561 -3.898 -17.169 1.00 0.00 N ATOM 620 CA ASP A 25 1.598 -5.367 -17.302 1.00 0.00 C ATOM 621 C ASP A 25 2.666 -5.789 -18.346 1.00 0.00 C ATOM 622 O ASP A 25 3.073 -4.976 -19.184 1.00 0.00 O ATOM 623 CB ASP A 25 0.195 -5.906 -17.667 1.00 0.00 C ATOM 624 CG ASP A 25 -0.301 -5.456 -19.053 1.00 0.00 C ATOM 625 OD1 ASP A 25 -0.878 -4.348 -19.158 1.00 0.00 O ATOM 626 OD2 ASP A 25 -0.127 -6.209 -20.034 1.00 0.00 O ATOM 0 H ASP A 25 0.709 -3.469 -17.531 1.00 0.00 H new ATOM 0 HA ASP A 25 1.883 -5.805 -16.346 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.214 -6.995 -17.634 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.518 -5.577 -16.911 1.00 0.00 H new ATOM 631 N ASP A 26 3.103 -7.061 -18.292 1.00 0.00 N ATOM 632 CA ASP A 26 4.239 -7.555 -19.107 1.00 0.00 C ATOM 633 C ASP A 26 3.835 -7.820 -20.572 1.00 0.00 C ATOM 634 O ASP A 26 4.705 -7.969 -21.437 1.00 0.00 O ATOM 635 CB ASP A 26 4.870 -8.830 -18.479 1.00 0.00 C ATOM 636 CG ASP A 26 4.026 -10.116 -18.632 1.00 0.00 C ATOM 637 OD1 ASP A 26 3.168 -10.393 -17.771 1.00 0.00 O ATOM 638 OD2 ASP A 26 4.243 -10.870 -19.610 1.00 0.00 O ATOM 0 H ASP A 26 2.687 -7.772 -17.690 1.00 0.00 H new ATOM 0 HA ASP A 26 4.988 -6.763 -19.112 1.00 0.00 H new ATOM 0 HB2 ASP A 26 5.846 -8.997 -18.935 1.00 0.00 H new ATOM 0 HB3 ASP A 26 5.040 -8.649 -17.418 1.00 0.00 H new ATOM 643 N ASP A 27 2.514 -7.881 -20.843 1.00 0.00 N ATOM 644 CA ASP A 27 1.994 -8.063 -22.217 1.00 0.00 C ATOM 645 C ASP A 27 1.983 -6.721 -22.960 1.00 0.00 C ATOM 646 O ASP A 27 1.866 -6.692 -24.187 1.00 0.00 O ATOM 647 CB ASP A 27 0.566 -8.681 -22.211 1.00 0.00 C ATOM 648 CG ASP A 27 0.553 -10.173 -21.835 1.00 0.00 C ATOM 649 OD1 ASP A 27 1.147 -10.981 -22.583 1.00 0.00 O ATOM 650 OD2 ASP A 27 -0.039 -10.550 -20.804 1.00 0.00 O ATOM 0 H ASP A 27 1.788 -7.807 -20.130 1.00 0.00 H new ATOM 0 HA ASP A 27 2.657 -8.757 -22.734 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.058 -8.130 -21.508 1.00 0.00 H new ATOM 0 HB3 ASP A 27 0.120 -8.558 -23.198 1.00 0.00 H new ATOM 655 N ALA A 28 2.100 -5.619 -22.197 1.00 0.00 N ATOM 656 CA ALA A 28 2.282 -4.268 -22.744 1.00 0.00 C ATOM 657 C ALA A 28 3.689 -4.111 -23.351 1.00 0.00 C ATOM 658 O ALA A 28 4.633 -4.802 -22.949 1.00 0.00 O ATOM 659 CB ALA A 28 2.035 -3.217 -21.648 1.00 0.00 C ATOM 0 H ALA A 28 2.070 -5.644 -21.178 1.00 0.00 H new ATOM 0 HA ALA A 28 1.556 -4.112 -23.542 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.172 -2.219 -22.064 1.00 0.00 H new ATOM 0 HB2 ALA A 28 1.017 -3.316 -21.271 1.00 0.00 H new ATOM 0 HB3 ALA A 28 2.740 -3.370 -20.831 1.00 0.00 H new ATOM 665 N THR A 29 3.798 -3.220 -24.342 1.00 0.00 N ATOM 666 CA THR A 29 5.070 -2.831 -24.994 1.00 0.00 C ATOM 667 C THR A 29 5.092 -1.287 -25.163 1.00 0.00 C ATOM 668 O THR A 29 4.180 -0.620 -24.672 1.00 0.00 O ATOM 669 CB THR A 29 5.263 -3.552 -26.375 1.00 0.00 C ATOM 670 OG1 THR A 29 4.116 -3.346 -27.209 1.00 0.00 O ATOM 671 CG2 THR A 29 5.509 -5.065 -26.227 1.00 0.00 C ATOM 0 H THR A 29 2.989 -2.733 -24.728 1.00 0.00 H new ATOM 0 HA THR A 29 5.901 -3.144 -24.362 1.00 0.00 H new ATOM 0 HB THR A 29 6.149 -3.112 -26.832 1.00 0.00 H new ATOM 0 HG1 THR A 29 4.313 -2.649 -27.870 1.00 0.00 H new ATOM 0 HG21 THR A 29 5.635 -5.511 -27.213 1.00 0.00 H new ATOM 0 HG22 THR A 29 6.409 -5.231 -25.636 1.00 0.00 H new ATOM 0 HG23 THR A 29 4.657 -5.525 -25.727 1.00 0.00 H new ATOM 679 N VAL A 30 6.132 -0.735 -25.849 1.00 0.00 N ATOM 680 CA VAL A 30 6.368 0.744 -25.979 1.00 0.00 C ATOM 681 C VAL A 30 5.097 1.503 -26.449 1.00 0.00 C ATOM 682 O VAL A 30 4.808 2.611 -25.980 1.00 0.00 O ATOM 683 CB VAL A 30 7.579 1.045 -26.953 1.00 0.00 C ATOM 684 CG1 VAL A 30 7.782 2.569 -27.200 1.00 0.00 C ATOM 685 CG2 VAL A 30 8.886 0.407 -26.419 1.00 0.00 C ATOM 0 H VAL A 30 6.834 -1.298 -26.330 1.00 0.00 H new ATOM 0 HA VAL A 30 6.620 1.109 -24.983 1.00 0.00 H new ATOM 0 HB VAL A 30 7.329 0.594 -27.913 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.625 2.719 -27.875 1.00 0.00 H new ATOM 0 HG12 VAL A 30 6.881 2.988 -27.647 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.983 3.068 -26.252 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.705 0.627 -27.104 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.116 0.817 -25.436 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.758 -0.673 -26.341 1.00 0.00 H new ATOM 695 N GLY A 31 4.339 0.851 -27.331 1.00 0.00 N ATOM 696 CA GLY A 31 3.100 1.389 -27.874 1.00 0.00 C ATOM 697 C GLY A 31 1.956 1.437 -26.868 1.00 0.00 C ATOM 698 O GLY A 31 1.178 2.386 -26.856 1.00 0.00 O ATOM 0 H GLY A 31 4.574 -0.075 -27.690 1.00 0.00 H new ATOM 0 HA2 GLY A 31 3.285 2.396 -28.247 1.00 0.00 H new ATOM 0 HA3 GLY A 31 2.795 0.783 -28.728 1.00 0.00 H new ATOM 702 N ASP A 32 1.840 0.385 -26.042 1.00 0.00 N ATOM 703 CA ASP A 32 0.815 0.295 -24.971 1.00 0.00 C ATOM 704 C ASP A 32 1.083 1.332 -23.872 1.00 0.00 C ATOM 705 O ASP A 32 0.156 1.820 -23.205 1.00 0.00 O ATOM 706 CB ASP A 32 0.796 -1.120 -24.356 1.00 0.00 C ATOM 707 CG ASP A 32 0.460 -2.206 -25.385 1.00 0.00 C ATOM 708 OD1 ASP A 32 1.369 -2.628 -26.124 1.00 0.00 O ATOM 709 OD2 ASP A 32 -0.715 -2.615 -25.482 1.00 0.00 O ATOM 0 H ASP A 32 2.450 -0.431 -26.092 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.157 0.501 -25.420 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.769 -1.333 -23.913 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.065 -1.151 -23.548 1.00 0.00 H new ATOM 714 N VAL A 33 2.373 1.643 -23.699 1.00 0.00 N ATOM 715 CA VAL A 33 2.859 2.676 -22.781 1.00 0.00 C ATOM 716 C VAL A 33 2.331 4.055 -23.201 1.00 0.00 C ATOM 717 O VAL A 33 1.548 4.651 -22.460 1.00 0.00 O ATOM 718 CB VAL A 33 4.435 2.631 -22.746 1.00 0.00 C ATOM 719 CG1 VAL A 33 5.050 3.786 -21.940 1.00 0.00 C ATOM 720 CG2 VAL A 33 4.918 1.267 -22.208 1.00 0.00 C ATOM 0 H VAL A 33 3.123 1.172 -24.205 1.00 0.00 H new ATOM 0 HA VAL A 33 2.488 2.487 -21.774 1.00 0.00 H new ATOM 0 HB VAL A 33 4.780 2.756 -23.772 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.137 3.700 -21.953 1.00 0.00 H new ATOM 0 HG12 VAL A 33 4.756 4.737 -22.384 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.695 3.741 -20.911 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.008 1.249 -22.189 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.535 1.118 -21.199 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.553 0.470 -22.856 1.00 0.00 H new ATOM 730 N LEU A 34 2.671 4.506 -24.426 1.00 0.00 N ATOM 731 CA LEU A 34 2.241 5.831 -24.937 1.00 0.00 C ATOM 732 C LEU A 34 0.704 5.894 -25.140 1.00 0.00 C ATOM 733 O LEU A 34 0.095 6.956 -24.980 1.00 0.00 O ATOM 734 CB LEU A 34 3.082 6.276 -26.182 1.00 0.00 C ATOM 735 CG LEU A 34 3.336 5.237 -27.330 1.00 0.00 C ATOM 736 CD1 LEU A 34 2.119 5.062 -28.253 1.00 0.00 C ATOM 737 CD2 LEU A 34 4.603 5.603 -28.144 1.00 0.00 C ATOM 0 H LEU A 34 3.242 3.974 -25.083 1.00 0.00 H new ATOM 0 HA LEU A 34 2.457 6.578 -24.173 1.00 0.00 H new ATOM 0 HB2 LEU A 34 2.587 7.141 -26.623 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.053 6.614 -25.821 1.00 0.00 H new ATOM 0 HG LEU A 34 3.503 4.274 -26.847 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.352 4.332 -29.028 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.267 4.712 -27.670 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.874 6.017 -28.717 1.00 0.00 H new ATOM 0 HD21 LEU A 34 4.754 4.866 -28.933 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.477 6.590 -28.589 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.470 5.611 -27.484 1.00 0.00 H new ATOM 749 N ARG A 35 0.089 4.736 -25.454 1.00 0.00 N ATOM 750 CA ARG A 35 -1.388 4.563 -25.452 1.00 0.00 C ATOM 751 C ARG A 35 -2.002 5.061 -24.128 1.00 0.00 C ATOM 752 O ARG A 35 -2.971 5.828 -24.117 1.00 0.00 O ATOM 753 CB ARG A 35 -1.739 3.055 -25.721 1.00 0.00 C ATOM 754 CG ARG A 35 -3.149 2.552 -25.300 1.00 0.00 C ATOM 755 CD ARG A 35 -4.305 3.332 -25.942 1.00 0.00 C ATOM 756 NE ARG A 35 -5.623 2.833 -25.487 1.00 0.00 N ATOM 757 CZ ARG A 35 -6.802 3.034 -26.104 1.00 0.00 C ATOM 758 NH1 ARG A 35 -6.882 3.715 -27.243 1.00 0.00 N ATOM 759 NH2 ARG A 35 -7.906 2.544 -25.561 1.00 0.00 N ATOM 0 H ARG A 35 0.597 3.891 -25.717 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.820 5.168 -26.249 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -1.622 2.869 -26.789 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -0.998 2.442 -25.208 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -3.243 1.499 -25.565 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -3.238 2.616 -24.216 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -4.212 4.390 -25.695 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -4.240 3.251 -27.027 1.00 0.00 H new ATOM 0 HE ARG A 35 -5.639 2.286 -24.626 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -6.038 4.098 -27.668 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.787 3.854 -27.692 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -7.856 2.022 -24.686 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.807 2.689 -26.018 1.00 0.00 H new ATOM 773 N SER A 36 -1.422 4.597 -23.030 1.00 0.00 N ATOM 774 CA SER A 36 -1.857 4.946 -21.682 1.00 0.00 C ATOM 775 C SER A 36 -1.407 6.376 -21.276 1.00 0.00 C ATOM 776 O SER A 36 -2.103 7.037 -20.507 1.00 0.00 O ATOM 777 CB SER A 36 -1.345 3.877 -20.709 1.00 0.00 C ATOM 778 OG SER A 36 -1.780 4.105 -19.377 1.00 0.00 O ATOM 0 H SER A 36 -0.626 3.959 -23.049 1.00 0.00 H new ATOM 0 HA SER A 36 -2.946 4.964 -21.649 1.00 0.00 H new ATOM 0 HB2 SER A 36 -1.688 2.896 -21.038 1.00 0.00 H new ATOM 0 HB3 SER A 36 -0.255 3.858 -20.734 1.00 0.00 H new ATOM 0 HG SER A 36 -1.012 4.348 -18.819 1.00 0.00 H new ATOM 784 N LEU A 37 -0.231 6.832 -21.772 1.00 0.00 N ATOM 785 CA LEU A 37 0.343 8.165 -21.420 1.00 0.00 C ATOM 786 C LEU A 37 -0.623 9.331 -21.738 1.00 0.00 C ATOM 787 O LEU A 37 -0.652 10.314 -20.998 1.00 0.00 O ATOM 788 CB LEU A 37 1.724 8.405 -22.121 1.00 0.00 C ATOM 789 CG LEU A 37 3.011 8.177 -21.265 1.00 0.00 C ATOM 790 CD1 LEU A 37 2.970 8.968 -19.942 1.00 0.00 C ATOM 791 CD2 LEU A 37 3.284 6.702 -21.021 1.00 0.00 C ATOM 0 H LEU A 37 0.345 6.297 -22.421 1.00 0.00 H new ATOM 0 HA LEU A 37 0.498 8.148 -20.341 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.778 7.752 -22.992 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.741 9.431 -22.490 1.00 0.00 H new ATOM 0 HG LEU A 37 3.845 8.564 -21.850 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.884 8.781 -19.378 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.888 10.033 -20.157 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.109 8.650 -19.354 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.188 6.594 -20.422 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.441 6.259 -20.490 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.418 6.194 -21.976 1.00 0.00 H new ATOM 803 N GLU A 38 -1.380 9.227 -22.847 1.00 0.00 N ATOM 804 CA GLU A 38 -2.394 10.248 -23.205 1.00 0.00 C ATOM 805 C GLU A 38 -3.640 10.164 -22.302 1.00 0.00 C ATOM 806 O GLU A 38 -4.346 11.163 -22.113 1.00 0.00 O ATOM 807 CB GLU A 38 -2.803 10.160 -24.698 1.00 0.00 C ATOM 808 CG GLU A 38 -3.218 8.767 -25.214 1.00 0.00 C ATOM 809 CD GLU A 38 -4.011 8.813 -26.542 1.00 0.00 C ATOM 810 OE1 GLU A 38 -3.461 9.259 -27.573 1.00 0.00 O ATOM 811 OE2 GLU A 38 -5.193 8.413 -26.558 1.00 0.00 O ATOM 0 H GLU A 38 -1.313 8.454 -23.509 1.00 0.00 H new ATOM 0 HA GLU A 38 -1.923 11.217 -23.041 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.632 10.848 -24.866 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.968 10.513 -25.303 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.324 8.159 -25.354 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.824 8.273 -24.455 1.00 0.00 H new ATOM 818 N ALA A 39 -3.907 8.963 -21.764 1.00 0.00 N ATOM 819 CA ALA A 39 -5.029 8.722 -20.838 1.00 0.00 C ATOM 820 C ALA A 39 -4.762 9.374 -19.462 1.00 0.00 C ATOM 821 O ALA A 39 -5.695 9.694 -18.717 1.00 0.00 O ATOM 822 CB ALA A 39 -5.264 7.211 -20.695 1.00 0.00 C ATOM 0 H ALA A 39 -3.351 8.130 -21.958 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.929 9.181 -21.247 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -6.094 7.035 -20.010 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.502 6.786 -21.670 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.363 6.738 -20.303 1.00 0.00 H new ATOM 828 N GLU A 40 -3.472 9.564 -19.145 1.00 0.00 N ATOM 829 CA GLU A 40 -3.027 10.219 -17.907 1.00 0.00 C ATOM 830 C GLU A 40 -2.905 11.729 -18.132 1.00 0.00 C ATOM 831 O GLU A 40 -3.528 12.538 -17.439 1.00 0.00 O ATOM 832 CB GLU A 40 -1.637 9.678 -17.502 1.00 0.00 C ATOM 833 CG GLU A 40 -1.488 8.161 -17.519 1.00 0.00 C ATOM 834 CD GLU A 40 -2.367 7.423 -16.505 1.00 0.00 C ATOM 835 OE1 GLU A 40 -2.063 7.492 -15.293 1.00 0.00 O ATOM 836 OE2 GLU A 40 -3.369 6.787 -16.905 1.00 0.00 O ATOM 0 H GLU A 40 -2.704 9.265 -19.745 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.756 10.014 -17.123 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.892 10.106 -18.173 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.406 10.036 -16.499 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -1.725 7.797 -18.519 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.445 7.909 -17.327 1.00 0.00 H new ATOM 843 N TYR A 41 -2.062 12.080 -19.117 1.00 0.00 N ATOM 844 CA TYR A 41 -1.645 13.453 -19.389 1.00 0.00 C ATOM 845 C TYR A 41 -2.413 14.015 -20.597 1.00 0.00 C ATOM 846 O TYR A 41 -2.344 13.454 -21.698 1.00 0.00 O ATOM 847 CB TYR A 41 -0.118 13.520 -19.660 1.00 0.00 C ATOM 848 CG TYR A 41 0.764 13.085 -18.476 1.00 0.00 C ATOM 849 CD1 TYR A 41 1.195 14.007 -17.518 1.00 0.00 C ATOM 850 CD2 TYR A 41 1.177 11.758 -18.326 1.00 0.00 C ATOM 851 CE1 TYR A 41 1.996 13.623 -16.456 1.00 0.00 C ATOM 852 CE2 TYR A 41 1.978 11.371 -17.264 1.00 0.00 C ATOM 853 CZ TYR A 41 2.385 12.305 -16.333 1.00 0.00 C ATOM 854 OH TYR A 41 3.187 11.920 -15.274 1.00 0.00 O ATOM 0 H TYR A 41 -1.647 11.400 -19.755 1.00 0.00 H new ATOM 0 HA TYR A 41 -1.871 14.057 -18.510 1.00 0.00 H new ATOM 0 HB2 TYR A 41 0.113 12.890 -20.519 1.00 0.00 H new ATOM 0 HB3 TYR A 41 0.144 14.542 -19.935 1.00 0.00 H new ATOM 0 HD1 TYR A 41 0.897 15.041 -17.608 1.00 0.00 H new ATOM 0 HD2 TYR A 41 0.866 11.021 -19.051 1.00 0.00 H new ATOM 0 HE1 TYR A 41 2.315 14.353 -15.726 1.00 0.00 H new ATOM 0 HE2 TYR A 41 2.284 10.340 -17.165 1.00 0.00 H new ATOM 0 HH TYR A 41 3.369 10.959 -15.334 1.00 0.00 H new ATOM 864 N ASP A 42 -3.121 15.130 -20.378 1.00 0.00 N ATOM 865 CA ASP A 42 -3.892 15.827 -21.426 1.00 0.00 C ATOM 866 C ASP A 42 -2.978 16.487 -22.467 1.00 0.00 C ATOM 867 O ASP A 42 -3.358 16.625 -23.635 1.00 0.00 O ATOM 868 CB ASP A 42 -4.821 16.885 -20.786 1.00 0.00 C ATOM 869 CG ASP A 42 -5.993 16.244 -20.032 1.00 0.00 C ATOM 870 OD1 ASP A 42 -7.024 15.938 -20.675 1.00 0.00 O ATOM 871 OD2 ASP A 42 -5.884 16.019 -18.808 1.00 0.00 O ATOM 0 H ASP A 42 -3.178 15.580 -19.464 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.494 15.080 -21.944 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.245 17.505 -20.099 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -5.208 17.545 -21.563 1.00 0.00 H new ATOM 876 N GLY A 43 -1.771 16.878 -22.026 1.00 0.00 N ATOM 877 CA GLY A 43 -0.774 17.499 -22.898 1.00 0.00 C ATOM 878 C GLY A 43 -0.037 16.500 -23.787 1.00 0.00 C ATOM 879 O GLY A 43 0.808 16.899 -24.586 1.00 0.00 O ATOM 0 H GLY A 43 -1.465 16.771 -21.059 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.265 18.241 -23.528 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.048 18.032 -22.285 1.00 0.00 H new ATOM 883 N LEU A 44 -0.315 15.191 -23.605 1.00 0.00 N ATOM 884 CA LEU A 44 0.239 14.114 -24.453 1.00 0.00 C ATOM 885 C LEU A 44 -0.827 13.545 -25.401 1.00 0.00 C ATOM 886 O LEU A 44 -0.506 12.687 -26.209 1.00 0.00 O ATOM 887 CB LEU A 44 0.824 12.970 -23.577 1.00 0.00 C ATOM 888 CG LEU A 44 2.104 13.308 -22.758 1.00 0.00 C ATOM 889 CD1 LEU A 44 2.613 12.098 -21.957 1.00 0.00 C ATOM 890 CD2 LEU A 44 3.214 13.881 -23.658 1.00 0.00 C ATOM 0 H LEU A 44 -0.930 14.851 -22.866 1.00 0.00 H new ATOM 0 HA LEU A 44 1.038 14.550 -25.053 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.051 12.643 -22.882 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.048 12.124 -24.226 1.00 0.00 H new ATOM 0 HG LEU A 44 1.824 14.078 -22.039 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.507 12.380 -21.401 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.841 11.772 -21.261 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.853 11.284 -22.641 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.093 14.106 -23.054 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.477 13.150 -24.422 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.860 14.794 -24.136 1.00 0.00 H new ATOM 902 N ALA A 45 -2.067 14.053 -25.332 1.00 0.00 N ATOM 903 CA ALA A 45 -3.223 13.453 -26.041 1.00 0.00 C ATOM 904 C ALA A 45 -3.109 13.563 -27.587 1.00 0.00 C ATOM 905 O ALA A 45 -2.987 14.669 -28.124 1.00 0.00 O ATOM 906 CB ALA A 45 -4.516 14.112 -25.545 1.00 0.00 C ATOM 0 H ALA A 45 -2.302 14.884 -24.790 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.235 12.387 -25.813 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.369 13.674 -26.063 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.620 13.948 -24.472 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.479 15.183 -25.746 1.00 0.00 H new ATOM 912 N GLY A 46 -3.118 12.395 -28.278 1.00 0.00 N ATOM 913 CA GLY A 46 -3.231 12.322 -29.755 1.00 0.00 C ATOM 914 C GLY A 46 -1.959 12.683 -30.541 1.00 0.00 C ATOM 915 O GLY A 46 -1.940 12.594 -31.778 1.00 0.00 O ATOM 0 H GLY A 46 -3.047 11.482 -27.828 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.530 11.310 -30.028 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -4.033 12.988 -30.073 1.00 0.00 H new ATOM 919 N ARG A 47 -0.897 13.075 -29.826 1.00 0.00 N ATOM 920 CA ARG A 47 0.394 13.532 -30.421 1.00 0.00 C ATOM 921 C ARG A 47 1.501 12.480 -30.220 1.00 0.00 C ATOM 922 O ARG A 47 2.657 12.707 -30.594 1.00 0.00 O ATOM 923 CB ARG A 47 0.804 14.905 -29.803 1.00 0.00 C ATOM 924 CG ARG A 47 0.480 15.025 -28.299 1.00 0.00 C ATOM 925 CD ARG A 47 1.030 16.282 -27.616 1.00 0.00 C ATOM 926 NE ARG A 47 0.756 17.536 -28.344 1.00 0.00 N ATOM 927 CZ ARG A 47 0.904 18.773 -27.833 1.00 0.00 C ATOM 928 NH1 ARG A 47 1.272 18.950 -26.568 1.00 0.00 N ATOM 929 NH2 ARG A 47 0.669 19.828 -28.593 1.00 0.00 N ATOM 0 H ARG A 47 -0.896 13.089 -28.806 1.00 0.00 H new ATOM 0 HA ARG A 47 0.258 13.659 -31.495 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.874 15.055 -29.949 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.294 15.704 -30.341 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -0.603 15.006 -28.173 1.00 0.00 H new ATOM 0 HG3 ARG A 47 0.876 14.148 -27.786 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.602 16.355 -26.616 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.108 16.174 -27.495 1.00 0.00 H new ATOM 0 HE ARG A 47 0.430 17.460 -29.307 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.447 18.142 -25.970 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.380 19.893 -26.195 1.00 0.00 H new ATOM 0 HH21 ARG A 47 0.377 19.703 -29.562 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.780 20.767 -28.210 1.00 0.00 H new ATOM 943 N LEU A 48 1.123 11.330 -29.642 1.00 0.00 N ATOM 944 CA LEU A 48 2.038 10.202 -29.358 1.00 0.00 C ATOM 945 C LEU A 48 1.488 8.892 -29.963 1.00 0.00 C ATOM 946 O LEU A 48 2.119 7.845 -29.847 1.00 0.00 O ATOM 947 CB LEU A 48 2.284 10.080 -27.818 1.00 0.00 C ATOM 948 CG LEU A 48 1.165 9.458 -26.901 1.00 0.00 C ATOM 949 CD1 LEU A 48 1.454 9.752 -25.418 1.00 0.00 C ATOM 950 CD2 LEU A 48 -0.259 9.878 -27.282 1.00 0.00 C ATOM 0 H LEU A 48 0.162 11.150 -29.353 1.00 0.00 H new ATOM 0 HA LEU A 48 3.001 10.395 -29.830 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.188 9.488 -27.678 1.00 0.00 H new ATOM 0 HB3 LEU A 48 2.497 11.080 -27.441 1.00 0.00 H new ATOM 0 HG LEU A 48 1.203 8.381 -27.067 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.670 9.314 -24.801 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.416 9.320 -25.142 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.481 10.830 -25.259 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -0.971 9.408 -26.604 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.350 10.962 -27.210 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.470 9.563 -28.304 1.00 0.00 H new ATOM 962 N ILE A 49 0.284 8.978 -30.586 1.00 0.00 N ATOM 963 CA ILE A 49 -0.331 7.894 -31.392 1.00 0.00 C ATOM 964 C ILE A 49 -0.808 8.488 -32.728 1.00 0.00 C ATOM 965 O ILE A 49 -1.364 9.594 -32.755 1.00 0.00 O ATOM 966 CB ILE A 49 -1.539 7.181 -30.656 1.00 0.00 C ATOM 967 CG1 ILE A 49 -1.017 6.296 -29.485 1.00 0.00 C ATOM 968 CG2 ILE A 49 -2.416 6.334 -31.632 1.00 0.00 C ATOM 969 CD1 ILE A 49 -2.079 5.493 -28.764 1.00 0.00 C ATOM 0 H ILE A 49 -0.295 9.817 -30.541 1.00 0.00 H new ATOM 0 HA ILE A 49 0.427 7.127 -31.552 1.00 0.00 H new ATOM 0 HB ILE A 49 -2.178 7.967 -30.254 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -0.267 5.609 -29.876 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.515 6.938 -28.761 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -3.230 5.867 -31.077 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -2.829 6.982 -32.405 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -1.802 5.562 -32.095 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.616 4.911 -27.967 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.819 6.170 -28.336 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.567 4.820 -29.469 1.00 0.00 H new ATOM 981 N GLU A 50 -0.556 7.755 -33.828 1.00 0.00 N ATOM 982 CA GLU A 50 -1.117 8.068 -35.155 1.00 0.00 C ATOM 983 C GLU A 50 -1.314 6.746 -35.922 1.00 0.00 C ATOM 984 O GLU A 50 -0.347 6.055 -36.202 1.00 0.00 O ATOM 985 CB GLU A 50 -0.172 9.048 -35.914 1.00 0.00 C ATOM 986 CG GLU A 50 -0.778 9.818 -37.119 1.00 0.00 C ATOM 987 CD GLU A 50 -1.044 8.960 -38.369 1.00 0.00 C ATOM 988 OE1 GLU A 50 -0.068 8.463 -38.965 1.00 0.00 O ATOM 989 OE2 GLU A 50 -2.220 8.759 -38.743 1.00 0.00 O ATOM 0 H GLU A 50 0.042 6.929 -33.822 1.00 0.00 H new ATOM 0 HA GLU A 50 -2.083 8.564 -35.060 1.00 0.00 H new ATOM 0 HB2 GLU A 50 0.203 9.779 -35.198 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.688 8.481 -36.271 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -1.716 10.276 -36.804 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -0.102 10.629 -37.390 1.00 0.00 H new ATOM 996 N ASP A 51 -2.582 6.405 -36.207 1.00 0.00 N ATOM 997 CA ASP A 51 -2.988 5.216 -37.014 1.00 0.00 C ATOM 998 C ASP A 51 -2.484 3.887 -36.400 1.00 0.00 C ATOM 999 O ASP A 51 -2.235 2.903 -37.102 1.00 0.00 O ATOM 1000 CB ASP A 51 -2.517 5.385 -38.498 1.00 0.00 C ATOM 1001 CG ASP A 51 -3.210 4.421 -39.479 1.00 0.00 C ATOM 1002 OD1 ASP A 51 -4.427 4.589 -39.723 1.00 0.00 O ATOM 1003 OD2 ASP A 51 -2.553 3.501 -40.012 1.00 0.00 O ATOM 0 H ASP A 51 -3.379 6.952 -35.881 1.00 0.00 H new ATOM 0 HA ASP A 51 -4.077 5.160 -37.001 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.705 6.411 -38.816 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -1.439 5.229 -38.548 1.00 0.00 H new ATOM 1008 N GLY A 52 -2.376 3.856 -35.068 1.00 0.00 N ATOM 1009 CA GLY A 52 -1.975 2.649 -34.340 1.00 0.00 C ATOM 1010 C GLY A 52 -0.464 2.440 -34.241 1.00 0.00 C ATOM 1011 O GLY A 52 -0.026 1.538 -33.527 1.00 0.00 O ATOM 0 H GLY A 52 -2.562 4.660 -34.469 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.390 2.693 -33.333 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -2.418 1.781 -34.829 1.00 0.00 H new ATOM 1015 N GLU A 53 0.341 3.231 -34.983 1.00 0.00 N ATOM 1016 CA GLU A 53 1.803 3.314 -34.753 1.00 0.00 C ATOM 1017 C GLU A 53 2.098 4.506 -33.821 1.00 0.00 C ATOM 1018 O GLU A 53 1.159 5.144 -33.320 1.00 0.00 O ATOM 1019 CB GLU A 53 2.604 3.456 -36.073 1.00 0.00 C ATOM 1020 CG GLU A 53 2.269 4.718 -36.899 1.00 0.00 C ATOM 1021 CD GLU A 53 3.471 5.298 -37.660 1.00 0.00 C ATOM 1022 OE1 GLU A 53 4.294 6.002 -37.023 1.00 0.00 O ATOM 1023 OE2 GLU A 53 3.603 5.046 -38.881 1.00 0.00 O ATOM 0 H GLU A 53 0.006 3.820 -35.745 1.00 0.00 H new ATOM 0 HA GLU A 53 2.124 2.381 -34.289 1.00 0.00 H new ATOM 0 HB2 GLU A 53 3.668 3.465 -35.837 1.00 0.00 H new ATOM 0 HB3 GLU A 53 2.421 2.576 -36.689 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.482 4.475 -37.613 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.870 5.482 -36.232 1.00 0.00 H new ATOM 1030 N VAL A 54 3.402 4.801 -33.586 1.00 0.00 N ATOM 1031 CA VAL A 54 3.791 5.875 -32.658 1.00 0.00 C ATOM 1032 C VAL A 54 3.331 7.270 -33.181 1.00 0.00 C ATOM 1033 O VAL A 54 2.531 7.886 -32.523 1.00 0.00 O ATOM 1034 CB VAL A 54 5.346 5.863 -32.334 1.00 0.00 C ATOM 1035 CG1 VAL A 54 5.750 4.563 -31.589 1.00 0.00 C ATOM 1036 CG2 VAL A 54 6.219 6.044 -33.605 1.00 0.00 C ATOM 0 H VAL A 54 4.185 4.315 -34.022 1.00 0.00 H new ATOM 0 HA VAL A 54 3.274 5.681 -31.718 1.00 0.00 H new ATOM 0 HB VAL A 54 5.533 6.718 -31.684 1.00 0.00 H new ATOM 0 HG11 VAL A 54 6.820 4.581 -31.380 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.198 4.494 -30.652 1.00 0.00 H new ATOM 0 HG13 VAL A 54 5.517 3.699 -32.212 1.00 0.00 H new ATOM 0 HG21 VAL A 54 7.273 6.028 -33.328 1.00 0.00 H new ATOM 0 HG22 VAL A 54 6.016 5.233 -34.304 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.982 6.998 -34.076 1.00 0.00 H new ATOM 1046 N LYS A 55 3.732 7.659 -34.421 1.00 0.00 N ATOM 1047 CA LYS A 55 3.465 8.996 -35.043 1.00 0.00 C ATOM 1048 C LYS A 55 4.611 9.317 -36.023 1.00 0.00 C ATOM 1049 O LYS A 55 5.778 9.137 -35.674 1.00 0.00 O ATOM 1050 CB LYS A 55 3.310 10.164 -33.991 1.00 0.00 C ATOM 1051 CG LYS A 55 3.392 11.628 -34.503 1.00 0.00 C ATOM 1052 CD LYS A 55 2.107 12.113 -35.211 1.00 0.00 C ATOM 1053 CE LYS A 55 0.899 12.201 -34.260 1.00 0.00 C ATOM 1054 NZ LYS A 55 -0.314 12.703 -34.950 1.00 0.00 N ATOM 0 H LYS A 55 4.263 7.041 -35.035 1.00 0.00 H new ATOM 0 HA LYS A 55 2.508 8.932 -35.561 1.00 0.00 H new ATOM 0 HB2 LYS A 55 2.348 10.039 -33.493 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.081 10.033 -33.232 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.602 12.287 -33.660 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.231 11.715 -35.193 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.288 13.093 -35.652 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.870 11.434 -36.030 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.696 11.216 -33.839 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.141 12.860 -33.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.959 13.128 -34.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.042 13.420 -35.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.793 11.914 -35.429 1.00 0.00 H new ATOM 1068 N PRO A 56 4.295 9.768 -37.267 1.00 0.00 N ATOM 1069 CA PRO A 56 5.287 10.405 -38.172 1.00 0.00 C ATOM 1070 C PRO A 56 5.861 11.708 -37.559 1.00 0.00 C ATOM 1071 O PRO A 56 5.101 12.516 -37.011 1.00 0.00 O ATOM 1072 CB PRO A 56 4.455 10.701 -39.457 1.00 0.00 C ATOM 1073 CG PRO A 56 3.032 10.723 -38.978 1.00 0.00 C ATOM 1074 CD PRO A 56 2.966 9.659 -37.922 1.00 0.00 C ATOM 0 HA PRO A 56 6.156 9.775 -38.361 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.739 11.653 -39.905 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.608 9.934 -40.216 1.00 0.00 H new ATOM 0 HG2 PRO A 56 2.766 11.699 -38.573 1.00 0.00 H new ATOM 0 HG3 PRO A 56 2.337 10.516 -39.792 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.152 9.836 -37.219 1.00 0.00 H new ATOM 0 HD3 PRO A 56 2.806 8.670 -38.352 1.00 0.00 H new ATOM 1082 N HIS A 57 7.197 11.875 -37.645 1.00 0.00 N ATOM 1083 CA HIS A 57 7.948 13.082 -37.184 1.00 0.00 C ATOM 1084 C HIS A 57 8.264 13.073 -35.671 1.00 0.00 C ATOM 1085 O HIS A 57 9.137 13.838 -35.231 1.00 0.00 O ATOM 1086 CB HIS A 57 7.278 14.437 -37.594 1.00 0.00 C ATOM 1087 CG HIS A 57 7.252 14.728 -39.078 1.00 0.00 C ATOM 1088 ND1 HIS A 57 7.832 15.846 -39.635 1.00 0.00 N ATOM 1089 CD2 HIS A 57 6.672 14.064 -40.106 1.00 0.00 C ATOM 1090 CE1 HIS A 57 7.609 15.858 -40.933 1.00 0.00 C ATOM 1091 NE2 HIS A 57 6.906 14.788 -41.246 1.00 0.00 N ATOM 0 H HIS A 57 7.807 11.162 -38.045 1.00 0.00 H new ATOM 0 HA HIS A 57 8.896 13.015 -37.718 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.253 14.443 -37.222 1.00 0.00 H new ATOM 0 HB3 HIS A 57 7.804 15.249 -37.091 1.00 0.00 H new ATOM 0 HD2 HIS A 57 6.126 13.135 -40.040 1.00 0.00 H new ATOM 0 HE1 HIS A 57 7.945 16.617 -41.624 1.00 0.00 H new ATOM 0 HE2 HIS A 57 6.588 14.540 -42.183 1.00 0.00 H new ATOM 1100 N VAL A 58 7.568 12.234 -34.872 1.00 0.00 N ATOM 1101 CA VAL A 58 7.870 12.096 -33.427 1.00 0.00 C ATOM 1102 C VAL A 58 9.188 11.309 -33.279 1.00 0.00 C ATOM 1103 O VAL A 58 9.441 10.371 -34.050 1.00 0.00 O ATOM 1104 CB VAL A 58 6.687 11.400 -32.618 1.00 0.00 C ATOM 1105 CG1 VAL A 58 6.711 9.851 -32.685 1.00 0.00 C ATOM 1106 CG2 VAL A 58 6.649 11.876 -31.149 1.00 0.00 C ATOM 0 H VAL A 58 6.800 11.647 -35.198 1.00 0.00 H new ATOM 0 HA VAL A 58 7.977 13.091 -32.995 1.00 0.00 H new ATOM 0 HB VAL A 58 5.771 11.717 -33.117 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.876 9.449 -32.111 1.00 0.00 H new ATOM 0 HG12 VAL A 58 6.625 9.530 -33.723 1.00 0.00 H new ATOM 0 HG13 VAL A 58 7.648 9.483 -32.268 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.830 11.381 -30.627 1.00 0.00 H new ATOM 0 HG22 VAL A 58 7.592 11.628 -30.662 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.498 12.955 -31.120 1.00 0.00 H new ATOM 1116 N ASN A 59 10.057 11.716 -32.343 1.00 0.00 N ATOM 1117 CA ASN A 59 11.331 11.017 -32.111 1.00 0.00 C ATOM 1118 C ASN A 59 11.213 10.232 -30.813 1.00 0.00 C ATOM 1119 O ASN A 59 11.287 10.796 -29.736 1.00 0.00 O ATOM 1120 CB ASN A 59 12.502 12.033 -32.049 1.00 0.00 C ATOM 1121 CG ASN A 59 12.643 12.853 -33.330 1.00 0.00 C ATOM 1122 OD1 ASN A 59 12.062 13.936 -33.467 1.00 0.00 O ATOM 1123 ND2 ASN A 59 13.411 12.345 -34.278 1.00 0.00 N ATOM 0 H ASN A 59 9.903 12.522 -31.736 1.00 0.00 H new ATOM 0 HA ASN A 59 11.542 10.332 -32.932 1.00 0.00 H new ATOM 0 HB2 ASN A 59 12.348 12.707 -31.207 1.00 0.00 H new ATOM 0 HB3 ASN A 59 13.432 11.497 -31.862 1.00 0.00 H new ATOM 0 HD21 ASN A 59 13.539 12.849 -35.155 1.00 0.00 H new ATOM 0 HD22 ASN A 59 13.876 11.449 -34.132 1.00 0.00 H new ATOM 1130 N VAL A 60 11.037 8.919 -30.927 1.00 0.00 N ATOM 1131 CA VAL A 60 10.821 8.033 -29.773 1.00 0.00 C ATOM 1132 C VAL A 60 11.905 6.958 -29.742 1.00 0.00 C ATOM 1133 O VAL A 60 12.193 6.329 -30.757 1.00 0.00 O ATOM 1134 CB VAL A 60 9.383 7.390 -29.784 1.00 0.00 C ATOM 1135 CG1 VAL A 60 8.306 8.412 -29.312 1.00 0.00 C ATOM 1136 CG2 VAL A 60 9.016 6.835 -31.183 1.00 0.00 C ATOM 0 H VAL A 60 11.039 8.432 -31.823 1.00 0.00 H new ATOM 0 HA VAL A 60 10.887 8.633 -28.865 1.00 0.00 H new ATOM 0 HB VAL A 60 9.401 6.556 -29.083 1.00 0.00 H new ATOM 0 HG11 VAL A 60 7.324 7.940 -29.330 1.00 0.00 H new ATOM 0 HG12 VAL A 60 8.534 8.738 -28.297 1.00 0.00 H new ATOM 0 HG13 VAL A 60 8.306 9.275 -29.978 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.017 6.399 -31.151 1.00 0.00 H new ATOM 0 HG22 VAL A 60 9.036 7.645 -31.912 1.00 0.00 H new ATOM 0 HG23 VAL A 60 9.737 6.070 -31.471 1.00 0.00 H new ATOM 1146 N LEU A 61 12.509 6.787 -28.561 1.00 0.00 N ATOM 1147 CA LEU A 61 13.708 5.962 -28.351 1.00 0.00 C ATOM 1148 C LEU A 61 13.427 4.890 -27.296 1.00 0.00 C ATOM 1149 O LEU A 61 12.697 5.123 -26.333 1.00 0.00 O ATOM 1150 CB LEU A 61 14.939 6.822 -27.887 1.00 0.00 C ATOM 1151 CG LEU A 61 15.510 7.893 -28.882 1.00 0.00 C ATOM 1152 CD1 LEU A 61 14.579 9.095 -29.070 1.00 0.00 C ATOM 1153 CD2 LEU A 61 16.931 8.356 -28.472 1.00 0.00 C ATOM 0 H LEU A 61 12.172 7.227 -27.705 1.00 0.00 H new ATOM 0 HA LEU A 61 13.953 5.499 -29.307 1.00 0.00 H new ATOM 0 HB2 LEU A 61 14.659 7.337 -26.968 1.00 0.00 H new ATOM 0 HB3 LEU A 61 15.748 6.137 -27.634 1.00 0.00 H new ATOM 0 HG LEU A 61 15.578 7.394 -29.848 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.030 9.799 -29.769 1.00 0.00 H new ATOM 0 HD12 LEU A 61 13.621 8.755 -29.465 1.00 0.00 H new ATOM 0 HD13 LEU A 61 14.422 9.587 -28.110 1.00 0.00 H new ATOM 0 HD21 LEU A 61 17.292 9.097 -29.185 1.00 0.00 H new ATOM 0 HD22 LEU A 61 16.897 8.797 -27.476 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.605 7.500 -28.466 1.00 0.00 H new ATOM 1165 N LYS A 62 14.001 3.713 -27.513 1.00 0.00 N ATOM 1166 CA LYS A 62 14.131 2.656 -26.515 1.00 0.00 C ATOM 1167 C LYS A 62 15.631 2.496 -26.195 1.00 0.00 C ATOM 1168 O LYS A 62 16.396 1.976 -27.015 1.00 0.00 O ATOM 1169 CB LYS A 62 13.487 1.351 -27.072 1.00 0.00 C ATOM 1170 CG LYS A 62 13.814 0.050 -26.327 1.00 0.00 C ATOM 1171 CD LYS A 62 13.424 0.075 -24.832 1.00 0.00 C ATOM 1172 CE LYS A 62 14.481 -0.608 -23.967 1.00 0.00 C ATOM 1173 NZ LYS A 62 14.705 -2.035 -24.341 1.00 0.00 N ATOM 0 H LYS A 62 14.402 3.459 -28.416 1.00 0.00 H new ATOM 0 HA LYS A 62 13.609 2.897 -25.589 1.00 0.00 H new ATOM 0 HB2 LYS A 62 12.405 1.479 -27.074 1.00 0.00 H new ATOM 0 HB3 LYS A 62 13.796 1.235 -28.111 1.00 0.00 H new ATOM 0 HG2 LYS A 62 13.297 -0.777 -26.814 1.00 0.00 H new ATOM 0 HG3 LYS A 62 14.883 -0.148 -26.411 1.00 0.00 H new ATOM 0 HD2 LYS A 62 13.296 1.107 -24.505 1.00 0.00 H new ATOM 0 HD3 LYS A 62 12.464 -0.423 -24.697 1.00 0.00 H new ATOM 0 HE2 LYS A 62 15.421 -0.063 -24.053 1.00 0.00 H new ATOM 0 HE3 LYS A 62 14.177 -0.555 -22.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 14.508 -2.644 -23.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.071 -2.292 -25.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 15.693 -2.165 -24.639 1.00 0.00 H new ATOM 1187 N ASN A 63 16.023 3.002 -25.007 1.00 0.00 N ATOM 1188 CA ASN A 63 17.401 2.948 -24.467 1.00 0.00 C ATOM 1189 C ASN A 63 18.443 3.498 -25.477 1.00 0.00 C ATOM 1190 O ASN A 63 19.379 2.802 -25.897 1.00 0.00 O ATOM 1191 CB ASN A 63 17.753 1.507 -23.977 1.00 0.00 C ATOM 1192 CG ASN A 63 19.082 1.418 -23.204 1.00 0.00 C ATOM 1193 OD1 ASN A 63 19.464 2.355 -22.495 1.00 0.00 O ATOM 1194 ND2 ASN A 63 19.803 0.310 -23.352 1.00 0.00 N ATOM 0 H ASN A 63 15.373 3.473 -24.378 1.00 0.00 H new ATOM 0 HA ASN A 63 17.443 3.606 -23.599 1.00 0.00 H new ATOM 0 HB2 ASN A 63 16.948 1.144 -23.338 1.00 0.00 H new ATOM 0 HB3 ASN A 63 17.800 0.842 -24.839 1.00 0.00 H new ATOM 0 HD21 ASN A 63 20.699 0.217 -22.873 1.00 0.00 H new ATOM 0 HD22 ASN A 63 19.460 -0.446 -23.944 1.00 0.00 H new ATOM 1201 N GLY A 64 18.216 4.748 -25.914 1.00 0.00 N ATOM 1202 CA GLY A 64 19.137 5.454 -26.819 1.00 0.00 C ATOM 1203 C GLY A 64 18.982 5.096 -28.302 1.00 0.00 C ATOM 1204 O GLY A 64 19.503 5.814 -29.162 1.00 0.00 O ATOM 0 H GLY A 64 17.395 5.294 -25.652 1.00 0.00 H new ATOM 0 HA2 GLY A 64 18.988 6.527 -26.701 1.00 0.00 H new ATOM 0 HA3 GLY A 64 20.161 5.239 -26.513 1.00 0.00 H new ATOM 1208 N ARG A 65 18.266 3.998 -28.606 1.00 0.00 N ATOM 1209 CA ARG A 65 17.990 3.575 -29.995 1.00 0.00 C ATOM 1210 C ARG A 65 16.604 4.065 -30.403 1.00 0.00 C ATOM 1211 O ARG A 65 15.612 3.606 -29.850 1.00 0.00 O ATOM 1212 CB ARG A 65 18.067 2.028 -30.137 1.00 0.00 C ATOM 1213 CG ARG A 65 17.791 1.496 -31.573 1.00 0.00 C ATOM 1214 CD ARG A 65 18.761 2.077 -32.620 1.00 0.00 C ATOM 1215 NE ARG A 65 20.182 1.914 -32.228 1.00 0.00 N ATOM 1216 CZ ARG A 65 21.180 2.746 -32.565 1.00 0.00 C ATOM 1217 NH1 ARG A 65 20.957 3.796 -33.341 1.00 0.00 N ATOM 1218 NH2 ARG A 65 22.402 2.521 -32.117 1.00 0.00 N ATOM 0 H ARG A 65 17.863 3.380 -27.901 1.00 0.00 H new ATOM 0 HA ARG A 65 18.746 4.010 -30.648 1.00 0.00 H new ATOM 0 HB2 ARG A 65 19.057 1.696 -29.825 1.00 0.00 H new ATOM 0 HB3 ARG A 65 17.349 1.577 -29.452 1.00 0.00 H new ATOM 0 HG2 ARG A 65 17.870 0.409 -31.575 1.00 0.00 H new ATOM 0 HG3 ARG A 65 16.768 1.742 -31.856 1.00 0.00 H new ATOM 0 HD2 ARG A 65 18.593 1.586 -33.579 1.00 0.00 H new ATOM 0 HD3 ARG A 65 18.546 3.136 -32.762 1.00 0.00 H new ATOM 0 HE ARG A 65 20.420 1.104 -31.656 1.00 0.00 H new ATOM 0 HH11 ARG A 65 20.017 3.981 -33.691 1.00 0.00 H new ATOM 0 HH12 ARG A 65 21.725 4.419 -33.589 1.00 0.00 H new ATOM 0 HH21 ARG A 65 22.585 1.717 -31.517 1.00 0.00 H new ATOM 0 HH22 ARG A 65 23.163 3.151 -32.371 1.00 0.00 H new ATOM 1232 N GLU A 66 16.543 4.987 -31.375 1.00 0.00 N ATOM 1233 CA GLU A 66 15.274 5.566 -31.830 1.00 0.00 C ATOM 1234 C GLU A 66 14.463 4.502 -32.602 1.00 0.00 C ATOM 1235 O GLU A 66 14.863 4.054 -33.679 1.00 0.00 O ATOM 1236 CB GLU A 66 15.519 6.860 -32.666 1.00 0.00 C ATOM 1237 CG GLU A 66 14.400 7.919 -32.536 1.00 0.00 C ATOM 1238 CD GLU A 66 14.734 9.255 -33.214 1.00 0.00 C ATOM 1239 OE1 GLU A 66 15.333 10.138 -32.559 1.00 0.00 O ATOM 1240 OE2 GLU A 66 14.408 9.429 -34.401 1.00 0.00 O ATOM 0 H GLU A 66 17.363 5.348 -31.862 1.00 0.00 H new ATOM 0 HA GLU A 66 14.682 5.868 -30.966 1.00 0.00 H new ATOM 0 HB2 GLU A 66 16.464 7.306 -32.356 1.00 0.00 H new ATOM 0 HB3 GLU A 66 15.625 6.586 -33.716 1.00 0.00 H new ATOM 0 HG2 GLU A 66 13.483 7.521 -32.970 1.00 0.00 H new ATOM 0 HG3 GLU A 66 14.202 8.097 -31.479 1.00 0.00 H new ATOM 1247 N VAL A 67 13.333 4.089 -32.006 1.00 0.00 N ATOM 1248 CA VAL A 67 12.480 3.004 -32.521 1.00 0.00 C ATOM 1249 C VAL A 67 11.684 3.397 -33.785 1.00 0.00 C ATOM 1250 O VAL A 67 10.959 2.568 -34.332 1.00 0.00 O ATOM 1251 CB VAL A 67 11.515 2.454 -31.411 1.00 0.00 C ATOM 1252 CG1 VAL A 67 12.308 1.849 -30.237 1.00 0.00 C ATOM 1253 CG2 VAL A 67 10.532 3.535 -30.905 1.00 0.00 C ATOM 0 H VAL A 67 12.981 4.503 -31.143 1.00 0.00 H new ATOM 0 HA VAL A 67 13.164 2.208 -32.817 1.00 0.00 H new ATOM 0 HB VAL A 67 10.921 1.664 -31.871 1.00 0.00 H new ATOM 0 HG11 VAL A 67 11.614 1.476 -29.483 1.00 0.00 H new ATOM 0 HG12 VAL A 67 12.926 1.027 -30.600 1.00 0.00 H new ATOM 0 HG13 VAL A 67 12.946 2.615 -29.796 1.00 0.00 H new ATOM 0 HG21 VAL A 67 9.885 3.108 -30.139 1.00 0.00 H new ATOM 0 HG22 VAL A 67 11.094 4.368 -30.483 1.00 0.00 H new ATOM 0 HG23 VAL A 67 9.924 3.891 -31.736 1.00 0.00 H new ATOM 1263 N VAL A 68 11.830 4.654 -34.248 1.00 0.00 N ATOM 1264 CA VAL A 68 11.195 5.127 -35.498 1.00 0.00 C ATOM 1265 C VAL A 68 11.851 4.479 -36.748 1.00 0.00 C ATOM 1266 O VAL A 68 11.315 4.587 -37.855 1.00 0.00 O ATOM 1267 CB VAL A 68 11.249 6.702 -35.623 1.00 0.00 C ATOM 1268 CG1 VAL A 68 10.751 7.385 -34.327 1.00 0.00 C ATOM 1269 CG2 VAL A 68 12.661 7.215 -36.015 1.00 0.00 C ATOM 0 H VAL A 68 12.385 5.365 -33.773 1.00 0.00 H new ATOM 0 HA VAL A 68 10.150 4.821 -35.452 1.00 0.00 H new ATOM 0 HB VAL A 68 10.574 6.976 -36.434 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.800 8.468 -34.444 1.00 0.00 H new ATOM 0 HG12 VAL A 68 9.721 7.088 -34.132 1.00 0.00 H new ATOM 0 HG13 VAL A 68 11.381 7.082 -33.491 1.00 0.00 H new ATOM 0 HG21 VAL A 68 12.646 8.302 -36.088 1.00 0.00 H new ATOM 0 HG22 VAL A 68 13.382 6.912 -35.255 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.948 6.791 -36.977 1.00 0.00 H new ATOM 1279 N HIS A 69 13.030 3.838 -36.556 1.00 0.00 N ATOM 1280 CA HIS A 69 13.777 3.154 -37.636 1.00 0.00 C ATOM 1281 C HIS A 69 13.413 1.652 -37.693 1.00 0.00 C ATOM 1282 O HIS A 69 13.656 0.982 -38.704 1.00 0.00 O ATOM 1283 CB HIS A 69 15.303 3.317 -37.413 1.00 0.00 C ATOM 1284 CG HIS A 69 15.752 4.748 -37.268 1.00 0.00 C ATOM 1285 ND1 HIS A 69 16.013 5.478 -36.164 1.00 0.00 N flip ATOM 1286 CD2 HIS A 69 15.965 5.592 -38.336 1.00 0.00 C flip ATOM 1287 CE1 HIS A 69 16.358 6.737 -36.575 1.00 0.00 C flip ATOM 1288 NE2 HIS A 69 16.321 6.781 -37.891 1.00 0.00 N flip ATOM 0 H HIS A 69 13.489 3.782 -35.647 1.00 0.00 H new ATOM 0 HA HIS A 69 13.500 3.613 -38.585 1.00 0.00 H new ATOM 0 HB2 HIS A 69 15.590 2.765 -36.518 1.00 0.00 H new ATOM 0 HB3 HIS A 69 15.833 2.864 -38.251 1.00 0.00 H new ATOM 0 HD1 HIS A 69 15.962 5.151 -35.199 1.00 0.00 H new ATOM 0 HD2 HIS A 69 15.857 5.322 -39.376 1.00 0.00 H new ATOM 0 HE1 HIS A 69 16.618 7.560 -35.926 1.00 0.00 H new ATOM 1297 N LEU A 70 12.842 1.144 -36.588 1.00 0.00 N ATOM 1298 CA LEU A 70 12.411 -0.261 -36.450 1.00 0.00 C ATOM 1299 C LEU A 70 10.979 -0.295 -35.882 1.00 0.00 C ATOM 1300 O LEU A 70 10.193 0.624 -36.146 1.00 0.00 O ATOM 1301 CB LEU A 70 13.422 -1.079 -35.574 1.00 0.00 C ATOM 1302 CG LEU A 70 13.714 -0.555 -34.115 1.00 0.00 C ATOM 1303 CD1 LEU A 70 14.189 -1.698 -33.194 1.00 0.00 C ATOM 1304 CD2 LEU A 70 14.755 0.592 -34.119 1.00 0.00 C ATOM 0 H LEU A 70 12.664 1.703 -35.754 1.00 0.00 H new ATOM 0 HA LEU A 70 12.402 -0.740 -37.429 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.049 -2.100 -35.496 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.370 -1.126 -36.110 1.00 0.00 H new ATOM 0 HG LEU A 70 12.775 -0.162 -33.725 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.382 -1.305 -32.196 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.417 -2.465 -33.139 1.00 0.00 H new ATOM 0 HD13 LEU A 70 15.104 -2.133 -33.596 1.00 0.00 H new ATOM 0 HD21 LEU A 70 14.931 0.927 -33.097 1.00 0.00 H new ATOM 0 HD22 LEU A 70 15.690 0.233 -34.549 1.00 0.00 H new ATOM 0 HD23 LEU A 70 14.378 1.424 -34.714 1.00 0.00 H new ATOM 1316 N ASP A 71 10.620 -1.388 -35.177 1.00 0.00 N ATOM 1317 CA ASP A 71 9.349 -1.488 -34.443 1.00 0.00 C ATOM 1318 C ASP A 71 9.224 -0.361 -33.403 1.00 0.00 C ATOM 1319 O ASP A 71 10.001 -0.312 -32.449 1.00 0.00 O ATOM 1320 CB ASP A 71 9.240 -2.858 -33.734 1.00 0.00 C ATOM 1321 CG ASP A 71 9.177 -4.045 -34.702 1.00 0.00 C ATOM 1322 OD1 ASP A 71 10.241 -4.587 -35.063 1.00 0.00 O ATOM 1323 OD2 ASP A 71 8.059 -4.434 -35.116 1.00 0.00 O ATOM 0 H ASP A 71 11.203 -2.221 -35.103 1.00 0.00 H new ATOM 0 HA ASP A 71 8.539 -1.391 -35.166 1.00 0.00 H new ATOM 0 HB2 ASP A 71 10.097 -2.985 -33.072 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.349 -2.863 -33.107 1.00 0.00 H new ATOM 1328 N GLY A 72 8.272 0.557 -33.625 1.00 0.00 N ATOM 1329 CA GLY A 72 7.995 1.633 -32.678 1.00 0.00 C ATOM 1330 C GLY A 72 7.171 1.145 -31.502 1.00 0.00 C ATOM 1331 O GLY A 72 7.483 1.437 -30.342 1.00 0.00 O ATOM 0 H GLY A 72 7.682 0.571 -34.457 1.00 0.00 H new ATOM 0 HA2 GLY A 72 8.935 2.050 -32.316 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.464 2.438 -33.186 1.00 0.00 H new ATOM 1335 N MET A 73 6.111 0.393 -31.818 1.00 0.00 N ATOM 1336 CA MET A 73 5.102 -0.052 -30.843 1.00 0.00 C ATOM 1337 C MET A 73 5.572 -1.282 -30.031 1.00 0.00 C ATOM 1338 O MET A 73 5.324 -1.360 -28.835 1.00 0.00 O ATOM 1339 CB MET A 73 3.754 -0.310 -31.562 1.00 0.00 C ATOM 1340 CG MET A 73 3.253 0.884 -32.399 1.00 0.00 C ATOM 1341 SD MET A 73 2.985 2.381 -31.410 1.00 0.00 S ATOM 1342 CE MET A 73 1.326 2.154 -30.751 1.00 0.00 C ATOM 0 H MET A 73 5.925 0.071 -32.768 1.00 0.00 H new ATOM 0 HA MET A 73 4.958 0.746 -30.115 1.00 0.00 H new ATOM 0 HB2 MET A 73 3.861 -1.178 -32.213 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.999 -0.561 -30.817 1.00 0.00 H new ATOM 0 HG2 MET A 73 3.977 1.099 -33.185 1.00 0.00 H new ATOM 0 HG3 MET A 73 2.320 0.609 -32.892 1.00 0.00 H new ATOM 0 HE1 MET A 73 1.296 2.495 -29.716 1.00 0.00 H new ATOM 0 HE2 MET A 73 0.617 2.731 -31.344 1.00 0.00 H new ATOM 0 HE3 MET A 73 1.059 1.098 -30.793 1.00 0.00 H new ATOM 1352 N ALA A 74 6.271 -2.241 -30.681 1.00 0.00 N ATOM 1353 CA ALA A 74 6.732 -3.484 -30.006 1.00 0.00 C ATOM 1354 C ALA A 74 8.155 -3.877 -30.456 1.00 0.00 C ATOM 1355 O ALA A 74 8.349 -4.813 -31.248 1.00 0.00 O ATOM 1356 CB ALA A 74 5.715 -4.624 -30.216 1.00 0.00 C ATOM 0 H ALA A 74 6.529 -2.182 -31.666 1.00 0.00 H new ATOM 0 HA ALA A 74 6.790 -3.292 -28.935 1.00 0.00 H new ATOM 0 HB1 ALA A 74 6.070 -5.525 -29.715 1.00 0.00 H new ATOM 0 HB2 ALA A 74 4.751 -4.333 -29.799 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.605 -4.821 -31.282 1.00 0.00 H new ATOM 1362 N THR A 75 9.143 -3.118 -29.949 1.00 0.00 N ATOM 1363 CA THR A 75 10.577 -3.327 -30.240 1.00 0.00 C ATOM 1364 C THR A 75 11.201 -4.450 -29.372 1.00 0.00 C ATOM 1365 O THR A 75 11.495 -5.538 -29.881 1.00 0.00 O ATOM 1366 CB THR A 75 11.398 -1.985 -30.098 1.00 0.00 C ATOM 1367 OG1 THR A 75 12.811 -2.244 -30.118 1.00 0.00 O ATOM 1368 CG2 THR A 75 11.042 -1.190 -28.828 1.00 0.00 C ATOM 0 H THR A 75 8.969 -2.334 -29.320 1.00 0.00 H new ATOM 0 HA THR A 75 10.636 -3.654 -31.278 1.00 0.00 H new ATOM 0 HB THR A 75 11.121 -1.373 -30.957 1.00 0.00 H new ATOM 0 HG1 THR A 75 13.300 -1.399 -30.030 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.640 -0.279 -28.789 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.984 -0.929 -28.847 1.00 0.00 H new ATOM 0 HG23 THR A 75 11.250 -1.798 -27.948 1.00 0.00 H new ATOM 1376 N ALA A 76 11.353 -4.189 -28.054 1.00 0.00 N ATOM 1377 CA ALA A 76 12.218 -4.980 -27.152 1.00 0.00 C ATOM 1378 C ALA A 76 12.106 -4.461 -25.705 1.00 0.00 C ATOM 1379 O ALA A 76 13.082 -4.474 -24.937 1.00 0.00 O ATOM 1380 CB ALA A 76 13.685 -4.961 -27.645 1.00 0.00 C ATOM 0 H ALA A 76 10.876 -3.419 -27.585 1.00 0.00 H new ATOM 0 HA ALA A 76 11.878 -6.015 -27.164 1.00 0.00 H new ATOM 0 HB1 ALA A 76 14.304 -5.549 -26.967 1.00 0.00 H new ATOM 0 HB2 ALA A 76 13.738 -5.387 -28.647 1.00 0.00 H new ATOM 0 HB3 ALA A 76 14.048 -3.933 -27.669 1.00 0.00 H new ATOM 1386 N LEU A 77 10.906 -3.985 -25.350 1.00 0.00 N ATOM 1387 CA LEU A 77 10.625 -3.419 -24.024 1.00 0.00 C ATOM 1388 C LEU A 77 10.493 -4.540 -22.968 1.00 0.00 C ATOM 1389 O LEU A 77 9.868 -5.575 -23.217 1.00 0.00 O ATOM 1390 CB LEU A 77 9.345 -2.540 -24.051 1.00 0.00 C ATOM 1391 CG LEU A 77 9.134 -1.641 -22.793 1.00 0.00 C ATOM 1392 CD1 LEU A 77 10.295 -0.638 -22.630 1.00 0.00 C ATOM 1393 CD2 LEU A 77 7.782 -0.911 -22.839 1.00 0.00 C ATOM 0 H LEU A 77 10.100 -3.981 -25.976 1.00 0.00 H new ATOM 0 HA LEU A 77 11.465 -2.782 -23.747 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.380 -1.901 -24.933 1.00 0.00 H new ATOM 0 HB3 LEU A 77 8.478 -3.191 -24.163 1.00 0.00 H new ATOM 0 HG LEU A 77 9.124 -2.296 -21.922 1.00 0.00 H new ATOM 0 HD11 LEU A 77 10.124 -0.024 -21.746 1.00 0.00 H new ATOM 0 HD12 LEU A 77 11.233 -1.182 -22.517 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.350 0.001 -23.511 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.671 -0.295 -21.947 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.741 -0.277 -23.725 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.975 -1.642 -22.878 1.00 0.00 H new ATOM 1405 N ASP A 78 11.072 -4.288 -21.789 1.00 0.00 N ATOM 1406 CA ASP A 78 11.191 -5.261 -20.685 1.00 0.00 C ATOM 1407 C ASP A 78 11.210 -4.470 -19.349 1.00 0.00 C ATOM 1408 O ASP A 78 11.034 -3.251 -19.362 1.00 0.00 O ATOM 1409 CB ASP A 78 12.493 -6.098 -20.912 1.00 0.00 C ATOM 1410 CG ASP A 78 12.669 -7.297 -19.963 1.00 0.00 C ATOM 1411 OD1 ASP A 78 12.046 -8.350 -20.203 1.00 0.00 O ATOM 1412 OD2 ASP A 78 13.422 -7.194 -18.970 1.00 0.00 O ATOM 0 H ASP A 78 11.482 -3.381 -21.565 1.00 0.00 H new ATOM 0 HA ASP A 78 10.352 -5.956 -20.649 1.00 0.00 H new ATOM 0 HB2 ASP A 78 12.498 -6.463 -21.939 1.00 0.00 H new ATOM 0 HB3 ASP A 78 13.354 -5.439 -20.804 1.00 0.00 H new ATOM 1417 N ASP A 79 11.392 -5.149 -18.208 1.00 0.00 N ATOM 1418 CA ASP A 79 11.468 -4.492 -16.885 1.00 0.00 C ATOM 1419 C ASP A 79 12.788 -3.695 -16.730 1.00 0.00 C ATOM 1420 O ASP A 79 13.845 -4.123 -17.197 1.00 0.00 O ATOM 1421 CB ASP A 79 11.335 -5.567 -15.774 1.00 0.00 C ATOM 1422 CG ASP A 79 11.395 -5.009 -14.334 1.00 0.00 C ATOM 1423 OD1 ASP A 79 10.337 -4.668 -13.762 1.00 0.00 O ATOM 1424 OD2 ASP A 79 12.500 -4.929 -13.757 1.00 0.00 O ATOM 0 H ASP A 79 11.491 -6.163 -18.170 1.00 0.00 H new ATOM 0 HA ASP A 79 10.649 -3.778 -16.795 1.00 0.00 H new ATOM 0 HB2 ASP A 79 10.390 -6.094 -15.907 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.130 -6.302 -15.899 1.00 0.00 H new ATOM 1429 N GLY A 80 12.696 -2.554 -16.032 1.00 0.00 N ATOM 1430 CA GLY A 80 13.816 -1.628 -15.825 1.00 0.00 C ATOM 1431 C GLY A 80 14.213 -0.824 -17.063 1.00 0.00 C ATOM 1432 O GLY A 80 15.183 -0.062 -17.018 1.00 0.00 O ATOM 0 H GLY A 80 11.830 -2.245 -15.590 1.00 0.00 H new ATOM 0 HA2 GLY A 80 13.554 -0.934 -15.026 1.00 0.00 H new ATOM 0 HA3 GLY A 80 14.682 -2.196 -15.483 1.00 0.00 H new ATOM 1436 N ASP A 81 13.448 -0.962 -18.156 1.00 0.00 N ATOM 1437 CA ASP A 81 13.816 -0.396 -19.469 1.00 0.00 C ATOM 1438 C ASP A 81 13.398 1.071 -19.602 1.00 0.00 C ATOM 1439 O ASP A 81 12.277 1.445 -19.245 1.00 0.00 O ATOM 1440 CB ASP A 81 13.199 -1.248 -20.605 1.00 0.00 C ATOM 1441 CG ASP A 81 13.941 -2.563 -20.903 1.00 0.00 C ATOM 1442 OD1 ASP A 81 14.763 -3.017 -20.082 1.00 0.00 O ATOM 1443 OD2 ASP A 81 13.707 -3.138 -21.984 1.00 0.00 O ATOM 0 H ASP A 81 12.561 -1.466 -18.159 1.00 0.00 H new ATOM 0 HA ASP A 81 14.903 -0.425 -19.550 1.00 0.00 H new ATOM 0 HB2 ASP A 81 12.166 -1.481 -20.345 1.00 0.00 H new ATOM 0 HB3 ASP A 81 13.171 -0.649 -21.515 1.00 0.00 H new ATOM 1448 N ALA A 82 14.321 1.889 -20.141 1.00 0.00 N ATOM 1449 CA ALA A 82 14.108 3.322 -20.345 1.00 0.00 C ATOM 1450 C ALA A 82 13.558 3.599 -21.760 1.00 0.00 C ATOM 1451 O ALA A 82 14.153 3.170 -22.756 1.00 0.00 O ATOM 1452 CB ALA A 82 15.413 4.104 -20.104 1.00 0.00 C ATOM 0 H ALA A 82 15.239 1.566 -20.447 1.00 0.00 H new ATOM 0 HA ALA A 82 13.367 3.662 -19.622 1.00 0.00 H new ATOM 0 HB1 ALA A 82 15.234 5.168 -20.261 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.752 3.940 -19.081 1.00 0.00 H new ATOM 0 HB3 ALA A 82 16.178 3.759 -20.799 1.00 0.00 H new ATOM 1458 N VAL A 83 12.399 4.291 -21.833 1.00 0.00 N ATOM 1459 CA VAL A 83 11.819 4.772 -23.106 1.00 0.00 C ATOM 1460 C VAL A 83 11.983 6.304 -23.167 1.00 0.00 C ATOM 1461 O VAL A 83 11.278 7.033 -22.468 1.00 0.00 O ATOM 1462 CB VAL A 83 10.287 4.401 -23.227 1.00 0.00 C ATOM 1463 CG1 VAL A 83 9.728 4.775 -24.625 1.00 0.00 C ATOM 1464 CG2 VAL A 83 10.032 2.910 -22.894 1.00 0.00 C ATOM 0 H VAL A 83 11.841 4.531 -21.013 1.00 0.00 H new ATOM 0 HA VAL A 83 12.342 4.290 -23.933 1.00 0.00 H new ATOM 0 HB VAL A 83 9.748 4.992 -22.487 1.00 0.00 H new ATOM 0 HG11 VAL A 83 8.673 4.508 -24.678 1.00 0.00 H new ATOM 0 HG12 VAL A 83 9.840 5.847 -24.787 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.279 4.233 -25.394 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.968 2.693 -22.988 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.593 2.282 -23.586 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.355 2.705 -21.874 1.00 0.00 H new ATOM 1474 N SER A 84 12.910 6.774 -24.011 1.00 0.00 N ATOM 1475 CA SER A 84 13.209 8.209 -24.162 1.00 0.00 C ATOM 1476 C SER A 84 12.399 8.800 -25.328 1.00 0.00 C ATOM 1477 O SER A 84 12.724 8.571 -26.477 1.00 0.00 O ATOM 1478 CB SER A 84 14.730 8.367 -24.411 1.00 0.00 C ATOM 1479 OG SER A 84 15.478 7.930 -23.284 1.00 0.00 O ATOM 0 H SER A 84 13.476 6.172 -24.610 1.00 0.00 H new ATOM 0 HA SER A 84 12.930 8.749 -23.257 1.00 0.00 H new ATOM 0 HB2 SER A 84 15.020 7.791 -25.290 1.00 0.00 H new ATOM 0 HB3 SER A 84 14.961 9.411 -24.623 1.00 0.00 H new ATOM 0 HG SER A 84 16.435 8.038 -23.465 1.00 0.00 H new ATOM 1485 N VAL A 85 11.358 9.583 -25.034 1.00 0.00 N ATOM 1486 CA VAL A 85 10.501 10.181 -26.060 1.00 0.00 C ATOM 1487 C VAL A 85 10.773 11.696 -26.196 1.00 0.00 C ATOM 1488 O VAL A 85 11.089 12.397 -25.223 1.00 0.00 O ATOM 1489 CB VAL A 85 8.973 9.920 -25.768 1.00 0.00 C ATOM 1490 CG1 VAL A 85 8.679 8.407 -25.577 1.00 0.00 C ATOM 1491 CG2 VAL A 85 8.473 10.737 -24.560 1.00 0.00 C ATOM 0 H VAL A 85 11.086 9.820 -24.080 1.00 0.00 H new ATOM 0 HA VAL A 85 10.747 9.699 -27.006 1.00 0.00 H new ATOM 0 HB VAL A 85 8.420 10.259 -26.644 1.00 0.00 H new ATOM 0 HG11 VAL A 85 7.617 8.265 -25.378 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.954 7.866 -26.482 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.260 8.027 -24.737 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.416 10.529 -24.392 1.00 0.00 H new ATOM 0 HG22 VAL A 85 9.043 10.460 -23.673 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.606 11.800 -24.760 1.00 0.00 H new ATOM 1501 N PHE A 86 10.655 12.161 -27.432 1.00 0.00 N ATOM 1502 CA PHE A 86 10.758 13.567 -27.835 1.00 0.00 C ATOM 1503 C PHE A 86 9.523 13.831 -28.733 1.00 0.00 C ATOM 1504 O PHE A 86 9.170 12.960 -29.538 1.00 0.00 O ATOM 1505 CB PHE A 86 12.044 13.861 -28.680 1.00 0.00 C ATOM 1506 CG PHE A 86 13.401 13.535 -28.043 1.00 0.00 C ATOM 1507 CD1 PHE A 86 13.780 12.217 -27.804 1.00 0.00 C ATOM 1508 CD2 PHE A 86 14.323 14.542 -27.727 1.00 0.00 C ATOM 1509 CE1 PHE A 86 15.009 11.914 -27.259 1.00 0.00 C ATOM 1510 CE2 PHE A 86 15.564 14.228 -27.187 1.00 0.00 C ATOM 1511 CZ PHE A 86 15.900 12.908 -26.959 1.00 0.00 C ATOM 0 H PHE A 86 10.476 11.543 -28.223 1.00 0.00 H new ATOM 0 HA PHE A 86 10.807 14.199 -26.948 1.00 0.00 H new ATOM 0 HB2 PHE A 86 11.968 13.303 -29.613 1.00 0.00 H new ATOM 0 HB3 PHE A 86 12.040 14.919 -28.940 1.00 0.00 H new ATOM 0 HD1 PHE A 86 13.098 11.417 -28.050 1.00 0.00 H new ATOM 0 HD2 PHE A 86 14.066 15.576 -27.906 1.00 0.00 H new ATOM 0 HE1 PHE A 86 15.271 10.884 -27.067 1.00 0.00 H new ATOM 0 HE2 PHE A 86 16.264 15.014 -26.946 1.00 0.00 H new ATOM 0 HZ PHE A 86 16.866 12.660 -26.544 1.00 0.00 H new ATOM 1521 N PRO A 87 8.851 15.007 -28.616 1.00 0.00 N ATOM 1522 CA PRO A 87 7.708 15.390 -29.489 1.00 0.00 C ATOM 1523 C PRO A 87 8.127 15.594 -30.961 1.00 0.00 C ATOM 1524 O PRO A 87 9.331 15.643 -31.269 1.00 0.00 O ATOM 1525 CB PRO A 87 7.214 16.728 -28.862 1.00 0.00 C ATOM 1526 CG PRO A 87 8.410 17.256 -28.165 1.00 0.00 C ATOM 1527 CD PRO A 87 9.120 16.048 -27.616 1.00 0.00 C ATOM 0 HA PRO A 87 6.944 14.614 -29.527 1.00 0.00 H new ATOM 0 HB2 PRO A 87 6.858 17.420 -29.625 1.00 0.00 H new ATOM 0 HB3 PRO A 87 6.388 16.564 -28.170 1.00 0.00 H new ATOM 0 HG2 PRO A 87 9.051 17.810 -28.850 1.00 0.00 H new ATOM 0 HG3 PRO A 87 8.128 17.942 -27.367 1.00 0.00 H new ATOM 0 HD2 PRO A 87 10.189 16.228 -27.502 1.00 0.00 H new ATOM 0 HD3 PRO A 87 8.737 15.770 -26.634 1.00 0.00 H new ATOM 1535 N PRO A 88 7.139 15.711 -31.900 1.00 0.00 N ATOM 1536 CA PRO A 88 7.448 16.108 -33.281 1.00 0.00 C ATOM 1537 C PRO A 88 7.850 17.605 -33.308 1.00 0.00 C ATOM 1538 O PRO A 88 7.152 18.460 -32.740 1.00 0.00 O ATOM 1539 CB PRO A 88 6.119 15.815 -34.026 1.00 0.00 C ATOM 1540 CG PRO A 88 5.052 15.980 -32.983 1.00 0.00 C ATOM 1541 CD PRO A 88 5.673 15.487 -31.692 1.00 0.00 C ATOM 0 HA PRO A 88 8.286 15.582 -33.739 1.00 0.00 H new ATOM 0 HB2 PRO A 88 5.971 16.505 -34.857 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.113 14.808 -34.443 1.00 0.00 H new ATOM 0 HG2 PRO A 88 4.743 17.022 -32.898 1.00 0.00 H new ATOM 0 HG3 PRO A 88 4.162 15.404 -33.236 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.301 16.041 -30.830 1.00 0.00 H new ATOM 0 HD3 PRO A 88 5.449 14.435 -31.515 1.00 0.00 H new ATOM 1549 N VAL A 89 8.990 17.904 -33.955 1.00 0.00 N ATOM 1550 CA VAL A 89 9.551 19.278 -34.017 1.00 0.00 C ATOM 1551 C VAL A 89 9.104 19.991 -35.306 1.00 0.00 C ATOM 1552 O VAL A 89 9.298 21.201 -35.467 1.00 0.00 O ATOM 1553 CB VAL A 89 11.126 19.262 -33.906 1.00 0.00 C ATOM 1554 CG1 VAL A 89 11.575 18.604 -32.579 1.00 0.00 C ATOM 1555 CG2 VAL A 89 11.790 18.569 -35.123 1.00 0.00 C ATOM 0 H VAL A 89 9.550 17.209 -34.449 1.00 0.00 H new ATOM 0 HA VAL A 89 9.163 19.834 -33.163 1.00 0.00 H new ATOM 0 HB VAL A 89 11.462 20.299 -33.908 1.00 0.00 H new ATOM 0 HG11 VAL A 89 12.664 18.603 -32.523 1.00 0.00 H new ATOM 0 HG12 VAL A 89 11.169 19.166 -31.738 1.00 0.00 H new ATOM 0 HG13 VAL A 89 11.209 17.578 -32.540 1.00 0.00 H new ATOM 0 HG21 VAL A 89 12.873 18.582 -35.003 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.444 17.537 -35.187 1.00 0.00 H new ATOM 0 HG23 VAL A 89 11.520 19.100 -36.036 1.00 0.00 H new ATOM 1565 N ALA A 90 8.501 19.207 -36.209 1.00 0.00 N ATOM 1566 CA ALA A 90 7.941 19.687 -37.469 1.00 0.00 C ATOM 1567 C ALA A 90 6.580 19.007 -37.676 1.00 0.00 C ATOM 1568 O ALA A 90 6.521 17.819 -38.016 1.00 0.00 O ATOM 1569 CB ALA A 90 8.912 19.392 -38.627 1.00 0.00 C ATOM 0 H ALA A 90 8.389 18.202 -36.077 1.00 0.00 H new ATOM 0 HA ALA A 90 7.798 20.767 -37.442 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.484 19.754 -39.562 1.00 0.00 H new ATOM 0 HB2 ALA A 90 9.861 19.895 -38.443 1.00 0.00 H new ATOM 0 HB3 ALA A 90 9.079 18.317 -38.697 1.00 0.00 H new ATOM 1575 N GLY A 91 5.499 19.756 -37.391 1.00 0.00 N ATOM 1576 CA GLY A 91 4.133 19.265 -37.574 1.00 0.00 C ATOM 1577 C GLY A 91 3.762 19.158 -39.049 1.00 0.00 C ATOM 1578 O GLY A 91 3.321 20.140 -39.659 1.00 0.00 O ATOM 0 H GLY A 91 5.553 20.709 -37.031 1.00 0.00 H new ATOM 0 HA2 GLY A 91 4.032 18.288 -37.102 1.00 0.00 H new ATOM 0 HA3 GLY A 91 3.436 19.935 -37.072 1.00 0.00 H new ATOM 1582 N GLY A 92 3.981 17.969 -39.623 1.00 0.00 N ATOM 1583 CA GLY A 92 3.699 17.710 -41.034 1.00 0.00 C ATOM 1584 C GLY A 92 3.945 16.250 -41.408 1.00 0.00 C ATOM 1585 O GLY A 92 3.730 15.366 -40.548 1.00 0.00 O ATOM 1586 OXT GLY A 92 4.384 15.976 -42.544 1.00 0.00 O ATOM 0 H GLY A 92 4.357 17.164 -39.122 1.00 0.00 H new ATOM 0 HA2 GLY A 92 2.663 17.970 -41.250 1.00 0.00 H new ATOM 0 HA3 GLY A 92 4.325 18.353 -41.653 1.00 0.00 H new TER 1590 GLY A 92