USER MOD reduce.3.24.130724 H: found=0, std=0, add=543, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 546 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: C 98 SER OG : rot 91:sc= 2.24 USER MOD Set 1.2: C 150 TYR OH : rot -63:sc= 1.06 USER MOD Single : C 90 MET CE :methyl -114:sc= -0.13 (180deg=-2.72!) USER MOD Single : C 92 LYS NZ :NH3+ -147:sc= 0.958 (180deg=0.52) USER MOD Single : C 93 SER OG : rot 180:sc= 0 USER MOD Single : C 103 MET CE :methyl -155:sc= -0.194 (180deg=-1.33) USER MOD Single : C 106 LYS NZ :NH3+ 135:sc= 0.834 (180deg=-3.23!) USER MOD Single : C 107 ASN : amide:sc= -0.536 X(o=-0.54,f=-0.44) USER MOD Single : C 111 TYR OH : rot 180:sc= 0 USER MOD Single : C 118 LYS NZ :NH3+ 164:sc= 2.21 (180deg=1.38) USER MOD Single : C 120 MET CE :methyl 145:sc= -6.06! (180deg=-10.4!) USER MOD Single : C 122 GLN : amide:sc= -0.651 X(o=-0.65,f=-1.1) USER MOD Single : C 124 THR OG1 : rot -55:sc= 0.463 USER MOD Single : C 127 THR OG1 : rot 180:sc= 0.092 USER MOD Single : C 129 THR OG1 : rot 104:sc= 1.14 USER MOD Single : C 137 MET CE :methyl -162:sc= -4.11! (180deg=-4.81!) USER MOD Single : C 138 LYS NZ :NH3+ -147:sc= 1.11 (180deg=-2.61!) USER MOD Single : C 142 LYS NZ :NH3+ -172:sc= 0.551 (180deg=0.363) USER MOD Single : C 143 ASN : amide:sc= -0.168 X(o=-0.17,f=-0.016) USER MOD Single : C 144 ASN : amide:sc= 0.775 K(o=0.77,f=-0.29) USER MOD Single : C 157 MET CE :methyl 167:sc= -6.81! (180deg=-7.02!) USER MOD Single : C 158 LYS NZ :NH3+ -163:sc= 0.696 (180deg=-1.15!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 90 17.651 -0.480 -2.161 1.00 0.00 N ATOM 2 CA MET C 90 16.336 -0.902 -2.721 1.00 0.00 C ATOM 3 C MET C 90 16.443 -0.958 -4.261 1.00 0.00 C ATOM 4 O MET C 90 17.537 -1.038 -4.800 1.00 0.00 O ATOM 5 CB MET C 90 15.289 0.155 -2.260 1.00 0.00 C ATOM 6 CG MET C 90 15.023 0.025 -0.746 1.00 0.00 C ATOM 7 SD MET C 90 13.621 1.082 -0.294 1.00 0.00 S ATOM 8 CE MET C 90 12.314 0.089 -1.071 1.00 0.00 C ATOM 0 HA MET C 90 16.037 -1.891 -2.374 1.00 0.00 H new ATOM 0 HB2 MET C 90 15.651 1.158 -2.487 1.00 0.00 H new ATOM 0 HB3 MET C 90 14.359 0.019 -2.812 1.00 0.00 H new ATOM 0 HG2 MET C 90 14.809 -1.013 -0.490 1.00 0.00 H new ATOM 0 HG3 MET C 90 15.910 0.316 -0.183 1.00 0.00 H new ATOM 0 HE1 MET C 90 11.873 0.649 -1.896 1.00 0.00 H new ATOM 0 HE2 MET C 90 12.740 -0.840 -1.450 1.00 0.00 H new ATOM 0 HE3 MET C 90 11.544 -0.139 -0.334 1.00 0.00 H new ATOM 20 N GLY C 91 15.341 -0.920 -4.964 1.00 0.00 N ATOM 21 CA GLY C 91 15.379 -1.032 -6.460 1.00 0.00 C ATOM 22 C GLY C 91 15.359 -2.519 -6.850 1.00 0.00 C ATOM 23 O GLY C 91 15.976 -2.911 -7.822 1.00 0.00 O ATOM 0 H GLY C 91 14.408 -0.815 -4.566 1.00 0.00 H new ATOM 0 HA2 GLY C 91 14.525 -0.516 -6.898 1.00 0.00 H new ATOM 0 HA3 GLY C 91 16.276 -0.552 -6.851 1.00 0.00 H new ATOM 27 N LYS C 92 14.649 -3.349 -6.090 1.00 0.00 N ATOM 28 CA LYS C 92 14.581 -4.820 -6.393 1.00 0.00 C ATOM 29 C LYS C 92 13.186 -5.179 -6.964 1.00 0.00 C ATOM 30 O LYS C 92 13.079 -5.992 -7.871 1.00 0.00 O ATOM 31 CB LYS C 92 14.773 -5.515 -5.030 1.00 0.00 C ATOM 32 CG LYS C 92 15.254 -6.960 -5.237 1.00 0.00 C ATOM 33 CD LYS C 92 15.216 -7.716 -3.901 1.00 0.00 C ATOM 34 CE LYS C 92 16.301 -8.812 -3.896 1.00 0.00 C ATOM 35 NZ LYS C 92 17.473 -8.179 -3.211 1.00 0.00 N1+ ATOM 0 H LYS C 92 14.115 -3.059 -5.271 1.00 0.00 H new ATOM 0 HA LYS C 92 15.328 -5.123 -7.126 1.00 0.00 H new ATOM 0 HB2 LYS C 92 15.498 -4.964 -4.431 1.00 0.00 H new ATOM 0 HB3 LYS C 92 13.834 -5.512 -4.476 1.00 0.00 H new ATOM 0 HG2 LYS C 92 14.621 -7.463 -5.968 1.00 0.00 H new ATOM 0 HG3 LYS C 92 16.268 -6.962 -5.638 1.00 0.00 H new ATOM 0 HD2 LYS C 92 15.380 -7.024 -3.075 1.00 0.00 H new ATOM 0 HD3 LYS C 92 14.233 -8.163 -3.752 1.00 0.00 H new ATOM 0 HE2 LYS C 92 15.964 -9.702 -3.364 1.00 0.00 H new ATOM 0 HE3 LYS C 92 16.555 -9.124 -4.909 1.00 0.00 H new ATOM 0 HZ1 LYS C 92 18.355 -8.550 -3.618 1.00 0.00 H new ATOM 0 HZ2 LYS C 92 17.437 -7.148 -3.344 1.00 0.00 H new ATOM 0 HZ3 LYS C 92 17.441 -8.399 -2.195 1.00 0.00 H new ATOM 49 N SER C 93 12.112 -4.642 -6.384 1.00 0.00 N ATOM 50 CA SER C 93 10.720 -5.006 -6.846 1.00 0.00 C ATOM 51 C SER C 93 10.516 -4.577 -8.299 1.00 0.00 C ATOM 52 O SER C 93 11.083 -3.590 -8.749 1.00 0.00 O ATOM 53 CB SER C 93 9.759 -4.230 -5.929 1.00 0.00 C ATOM 54 OG SER C 93 9.837 -4.740 -4.587 1.00 0.00 O ATOM 0 H SER C 93 12.147 -3.972 -5.616 1.00 0.00 H new ATOM 0 HA SER C 93 10.549 -6.081 -6.795 1.00 0.00 H new ATOM 0 HB2 SER C 93 10.011 -3.170 -5.939 1.00 0.00 H new ATOM 0 HB3 SER C 93 8.738 -4.318 -6.301 1.00 0.00 H new ATOM 0 HG SER C 93 9.223 -4.239 -4.010 1.00 0.00 H new ATOM 60 N GLU C 94 9.674 -5.277 -9.024 1.00 0.00 N ATOM 61 CA GLU C 94 9.432 -4.925 -10.470 1.00 0.00 C ATOM 62 C GLU C 94 8.943 -3.461 -10.572 1.00 0.00 C ATOM 63 O GLU C 94 9.314 -2.731 -11.495 1.00 0.00 O ATOM 64 CB GLU C 94 8.320 -5.885 -10.951 1.00 0.00 C ATOM 65 CG GLU C 94 8.744 -7.379 -10.786 1.00 0.00 C ATOM 66 CD GLU C 94 10.083 -7.669 -11.449 1.00 0.00 C ATOM 67 OE1 GLU C 94 10.248 -7.368 -12.609 1.00 0.00 O1- ATOM 68 OE2 GLU C 94 10.941 -8.217 -10.782 1.00 0.00 O ATOM 0 H GLU C 94 9.142 -6.077 -8.681 1.00 0.00 H new ATOM 0 HA GLU C 94 10.336 -5.020 -11.071 1.00 0.00 H new ATOM 0 HB2 GLU C 94 7.408 -5.700 -10.384 1.00 0.00 H new ATOM 0 HB3 GLU C 94 8.092 -5.684 -11.998 1.00 0.00 H new ATOM 0 HG2 GLU C 94 8.804 -7.624 -9.726 1.00 0.00 H new ATOM 0 HG3 GLU C 94 7.978 -8.023 -11.219 1.00 0.00 H new ATOM 75 N GLU C 95 8.164 -2.999 -9.612 1.00 0.00 N ATOM 76 CA GLU C 95 7.722 -1.560 -9.632 1.00 0.00 C ATOM 77 C GLU C 95 8.957 -0.651 -9.472 1.00 0.00 C ATOM 78 O GLU C 95 9.107 0.326 -10.194 1.00 0.00 O ATOM 79 CB GLU C 95 6.784 -1.383 -8.410 1.00 0.00 C ATOM 80 CG GLU C 95 5.497 -2.246 -8.565 1.00 0.00 C ATOM 81 CD GLU C 95 5.670 -3.668 -8.003 1.00 0.00 C ATOM 82 OE1 GLU C 95 6.728 -3.990 -7.485 1.00 0.00 O ATOM 83 OE2 GLU C 95 4.744 -4.424 -8.114 1.00 0.00 O1- ATOM 0 H GLU C 95 7.819 -3.549 -8.825 1.00 0.00 H new ATOM 0 HA GLU C 95 7.218 -1.301 -10.563 1.00 0.00 H new ATOM 0 HB2 GLU C 95 7.310 -1.668 -7.499 1.00 0.00 H new ATOM 0 HB3 GLU C 95 6.512 -0.333 -8.305 1.00 0.00 H new ATOM 0 HG2 GLU C 95 4.670 -1.754 -8.053 1.00 0.00 H new ATOM 0 HG3 GLU C 95 5.228 -2.306 -9.620 1.00 0.00 H new ATOM 90 N GLU C 96 9.890 -1.017 -8.594 1.00 0.00 N ATOM 91 CA GLU C 96 11.155 -0.204 -8.458 1.00 0.00 C ATOM 92 C GLU C 96 11.952 -0.296 -9.767 1.00 0.00 C ATOM 93 O GLU C 96 12.469 0.694 -10.267 1.00 0.00 O ATOM 94 CB GLU C 96 11.971 -0.863 -7.333 1.00 0.00 C ATOM 95 CG GLU C 96 11.225 -0.802 -5.988 1.00 0.00 C ATOM 96 CD GLU C 96 12.147 -1.312 -4.898 1.00 0.00 C ATOM 97 OE1 GLU C 96 12.317 -2.500 -4.789 1.00 0.00 O ATOM 98 OE2 GLU C 96 12.704 -0.513 -4.206 1.00 0.00 O1- ATOM 0 H GLU C 96 9.826 -1.829 -7.980 1.00 0.00 H new ATOM 0 HA GLU C 96 10.939 0.842 -8.243 1.00 0.00 H new ATOM 0 HB2 GLU C 96 12.175 -1.902 -7.591 1.00 0.00 H new ATOM 0 HB3 GLU C 96 12.935 -0.362 -7.239 1.00 0.00 H new ATOM 0 HG2 GLU C 96 10.916 0.221 -5.773 1.00 0.00 H new ATOM 0 HG3 GLU C 96 10.319 -1.407 -6.030 1.00 0.00 H new ATOM 105 N LEU C 97 12.005 -1.478 -10.357 1.00 0.00 N ATOM 106 CA LEU C 97 12.733 -1.649 -11.666 1.00 0.00 C ATOM 107 C LEU C 97 12.099 -0.727 -12.712 1.00 0.00 C ATOM 108 O LEU C 97 12.789 -0.098 -13.509 1.00 0.00 O ATOM 109 CB LEU C 97 12.505 -3.127 -12.079 1.00 0.00 C ATOM 110 CG LEU C 97 13.069 -4.095 -11.017 1.00 0.00 C ATOM 111 CD1 LEU C 97 12.715 -5.528 -11.382 1.00 0.00 C ATOM 112 CD2 LEU C 97 14.577 -3.972 -10.955 1.00 0.00 C ATOM 0 H LEU C 97 11.577 -2.327 -9.989 1.00 0.00 H new ATOM 0 HA LEU C 97 13.793 -1.408 -11.584 1.00 0.00 H new ATOM 0 HB2 LEU C 97 11.439 -3.310 -12.212 1.00 0.00 H new ATOM 0 HB3 LEU C 97 12.984 -3.317 -13.040 1.00 0.00 H new ATOM 0 HG LEU C 97 12.635 -3.840 -10.050 1.00 0.00 H new ATOM 0 HD11 LEU C 97 13.116 -6.205 -10.628 1.00 0.00 H new ATOM 0 HD12 LEU C 97 11.631 -5.635 -11.426 1.00 0.00 H new ATOM 0 HD13 LEU C 97 13.143 -5.772 -12.354 1.00 0.00 H new ATOM 0 HD21 LEU C 97 14.967 -4.658 -10.203 1.00 0.00 H new ATOM 0 HD22 LEU C 97 15.002 -4.219 -11.928 1.00 0.00 H new ATOM 0 HD23 LEU C 97 14.848 -2.950 -10.689 1.00 0.00 H new ATOM 124 N SER C 98 10.798 -0.631 -12.705 1.00 0.00 N ATOM 125 CA SER C 98 10.092 0.248 -13.685 1.00 0.00 C ATOM 126 C SER C 98 10.517 1.724 -13.514 1.00 0.00 C ATOM 127 O SER C 98 10.759 2.416 -14.500 1.00 0.00 O ATOM 128 CB SER C 98 8.605 0.062 -13.371 1.00 0.00 C ATOM 129 OG SER C 98 8.268 -1.337 -13.486 1.00 0.00 O ATOM 0 H SER C 98 10.187 -1.128 -12.057 1.00 0.00 H new ATOM 0 HA SER C 98 10.329 -0.012 -14.717 1.00 0.00 H new ATOM 0 HB2 SER C 98 8.386 0.420 -12.365 1.00 0.00 H new ATOM 0 HB3 SER C 98 7.999 0.652 -14.058 1.00 0.00 H new ATOM 0 HG SER C 98 8.377 -1.772 -12.615 1.00 0.00 H new ATOM 135 N ASP C 99 10.655 2.212 -12.280 1.00 0.00 N ATOM 136 CA ASP C 99 11.112 3.650 -12.100 1.00 0.00 C ATOM 137 C ASP C 99 12.518 3.801 -12.679 1.00 0.00 C ATOM 138 O ASP C 99 12.817 4.764 -13.388 1.00 0.00 O ATOM 139 CB ASP C 99 11.148 3.917 -10.586 1.00 0.00 C ATOM 140 CG ASP C 99 11.311 5.401 -10.360 1.00 0.00 C ATOM 141 OD1 ASP C 99 12.412 5.895 -10.480 1.00 0.00 O ATOM 142 OD2 ASP C 99 10.327 6.056 -10.109 1.00 0.00 O1- ATOM 0 H ASP C 99 10.477 1.695 -11.419 1.00 0.00 H new ATOM 0 HA ASP C 99 10.445 4.349 -12.605 1.00 0.00 H new ATOM 0 HB2 ASP C 99 10.230 3.562 -10.118 1.00 0.00 H new ATOM 0 HB3 ASP C 99 11.972 3.372 -10.126 1.00 0.00 H new ATOM 147 N LEU C 100 13.382 2.836 -12.416 1.00 0.00 N ATOM 148 CA LEU C 100 14.769 2.898 -12.988 1.00 0.00 C ATOM 149 C LEU C 100 14.688 2.871 -14.519 1.00 0.00 C ATOM 150 O LEU C 100 15.386 3.610 -15.192 1.00 0.00 O ATOM 151 CB LEU C 100 15.520 1.658 -12.459 1.00 0.00 C ATOM 152 CG LEU C 100 15.559 1.629 -10.909 1.00 0.00 C ATOM 153 CD1 LEU C 100 16.413 0.448 -10.446 1.00 0.00 C ATOM 154 CD2 LEU C 100 16.171 2.924 -10.349 1.00 0.00 C ATOM 0 H LEU C 100 13.186 2.020 -11.837 1.00 0.00 H new ATOM 0 HA LEU C 100 15.288 3.811 -12.697 1.00 0.00 H new ATOM 0 HB2 LEU C 100 15.035 0.754 -12.828 1.00 0.00 H new ATOM 0 HB3 LEU C 100 16.538 1.655 -12.849 1.00 0.00 H new ATOM 0 HG LEU C 100 14.537 1.532 -10.544 1.00 0.00 H new ATOM 0 HD11 LEU C 100 16.442 0.425 -9.357 1.00 0.00 H new ATOM 0 HD12 LEU C 100 15.981 -0.481 -10.817 1.00 0.00 H new ATOM 0 HD13 LEU C 100 17.426 0.557 -10.834 1.00 0.00 H new ATOM 0 HD21 LEU C 100 16.187 2.878 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU C 100 17.189 3.036 -10.722 1.00 0.00 H new ATOM 0 HD23 LEU C 100 15.572 3.777 -10.667 1.00 0.00 H new ATOM 166 N PHE C 101 13.788 2.081 -15.074 1.00 0.00 N ATOM 167 CA PHE C 101 13.605 2.062 -16.569 1.00 0.00 C ATOM 168 C PHE C 101 13.260 3.478 -17.049 1.00 0.00 C ATOM 169 O PHE C 101 13.809 3.960 -18.037 1.00 0.00 O ATOM 170 CB PHE C 101 12.430 1.099 -16.817 1.00 0.00 C ATOM 171 CG PHE C 101 12.215 0.909 -18.301 1.00 0.00 C ATOM 172 CD1 PHE C 101 13.135 0.182 -19.049 1.00 0.00 C ATOM 173 CD2 PHE C 101 11.102 1.472 -18.927 1.00 0.00 C ATOM 174 CE1 PHE C 101 12.949 0.006 -20.415 1.00 0.00 C ATOM 175 CE2 PHE C 101 10.914 1.294 -20.298 1.00 0.00 C ATOM 176 CZ PHE C 101 11.839 0.561 -21.038 1.00 0.00 C ATOM 0 H PHE C 101 13.175 1.451 -14.557 1.00 0.00 H new ATOM 0 HA PHE C 101 14.499 1.742 -17.104 1.00 0.00 H new ATOM 0 HB2 PHE C 101 12.633 0.137 -16.345 1.00 0.00 H new ATOM 0 HB3 PHE C 101 11.523 1.494 -16.358 1.00 0.00 H new ATOM 0 HD1 PHE C 101 13.999 -0.248 -18.565 1.00 0.00 H new ATOM 0 HD2 PHE C 101 10.389 2.044 -18.352 1.00 0.00 H new ATOM 0 HE1 PHE C 101 13.666 -0.561 -20.990 1.00 0.00 H new ATOM 0 HE2 PHE C 101 10.052 1.724 -20.785 1.00 0.00 H new ATOM 0 HZ PHE C 101 11.692 0.424 -22.099 1.00 0.00 H new ATOM 186 N ARG C 102 12.402 4.180 -16.320 1.00 0.00 N ATOM 187 CA ARG C 102 12.090 5.601 -16.688 1.00 0.00 C ATOM 188 C ARG C 102 13.410 6.416 -16.671 1.00 0.00 C ATOM 189 O ARG C 102 13.645 7.238 -17.529 1.00 0.00 O ATOM 190 CB ARG C 102 11.124 6.105 -15.589 1.00 0.00 C ATOM 191 CG ARG C 102 10.584 7.500 -15.957 1.00 0.00 C ATOM 192 CD ARG C 102 11.419 8.585 -15.245 1.00 0.00 C ATOM 193 NE ARG C 102 10.710 8.844 -13.941 1.00 0.00 N ATOM 194 CZ ARG C 102 10.881 8.051 -12.900 1.00 0.00 C ATOM 195 NH1 ARG C 102 12.099 7.756 -12.490 1.00 0.00 N1+ ATOM 196 NH2 ARG C 102 9.836 7.573 -12.277 1.00 0.00 N ATOM 0 H ARG C 102 11.914 3.828 -15.497 1.00 0.00 H new ATOM 0 HA ARG C 102 11.645 5.699 -17.678 1.00 0.00 H new ATOM 0 HB2 ARG C 102 10.296 5.405 -15.473 1.00 0.00 H new ATOM 0 HB3 ARG C 102 11.642 6.148 -14.631 1.00 0.00 H new ATOM 0 HG2 ARG C 102 10.627 7.644 -17.037 1.00 0.00 H new ATOM 0 HG3 ARG C 102 9.537 7.584 -15.666 1.00 0.00 H new ATOM 0 HD2 ARG C 102 12.441 8.246 -15.076 1.00 0.00 H new ATOM 0 HD3 ARG C 102 11.479 9.492 -15.846 1.00 0.00 H new ATOM 0 HE ARG C 102 10.086 9.647 -13.861 1.00 0.00 H new ATOM 0 HH11 ARG C 102 12.908 8.141 -12.977 1.00 0.00 H new ATOM 0 HH12 ARG C 102 12.232 7.143 -11.686 1.00 0.00 H new ATOM 0 HH21 ARG C 102 8.898 7.814 -12.596 1.00 0.00 H new ATOM 0 HH22 ARG C 102 9.959 6.959 -11.472 1.00 0.00 H new ATOM 210 N MET C 103 14.276 6.177 -15.694 1.00 0.00 N ATOM 211 CA MET C 103 15.600 6.917 -15.653 1.00 0.00 C ATOM 212 C MET C 103 16.461 6.552 -16.872 1.00 0.00 C ATOM 213 O MET C 103 17.145 7.403 -17.430 1.00 0.00 O ATOM 214 CB MET C 103 16.309 6.451 -14.369 1.00 0.00 C ATOM 215 CG MET C 103 15.574 6.965 -13.122 1.00 0.00 C ATOM 216 SD MET C 103 15.466 8.778 -13.170 1.00 0.00 S ATOM 217 CE MET C 103 17.251 9.132 -13.164 1.00 0.00 C ATOM 0 H MET C 103 14.127 5.512 -14.935 1.00 0.00 H new ATOM 0 HA MET C 103 15.444 7.996 -15.668 1.00 0.00 H new ATOM 0 HB2 MET C 103 16.353 5.362 -14.347 1.00 0.00 H new ATOM 0 HB3 MET C 103 17.338 6.812 -14.365 1.00 0.00 H new ATOM 0 HG2 MET C 103 14.574 6.534 -13.075 1.00 0.00 H new ATOM 0 HG3 MET C 103 16.101 6.647 -12.222 1.00 0.00 H new ATOM 0 HE1 MET C 103 17.423 10.127 -12.754 1.00 0.00 H new ATOM 0 HE2 MET C 103 17.766 8.393 -12.551 1.00 0.00 H new ATOM 0 HE3 MET C 103 17.634 9.089 -14.184 1.00 0.00 H new ATOM 227 N PHE C 104 16.469 5.301 -17.269 1.00 0.00 N ATOM 228 CA PHE C 104 17.324 4.868 -18.436 1.00 0.00 C ATOM 229 C PHE C 104 16.848 5.442 -19.772 1.00 0.00 C ATOM 230 O PHE C 104 17.655 5.688 -20.658 1.00 0.00 O ATOM 231 CB PHE C 104 17.332 3.335 -18.443 1.00 0.00 C ATOM 232 CG PHE C 104 18.453 2.834 -17.543 1.00 0.00 C ATOM 233 CD1 PHE C 104 18.283 2.791 -16.156 1.00 0.00 C ATOM 234 CD2 PHE C 104 19.671 2.420 -18.107 1.00 0.00 C ATOM 235 CE1 PHE C 104 19.320 2.336 -15.335 1.00 0.00 C ATOM 236 CE2 PHE C 104 20.707 1.964 -17.279 1.00 0.00 C ATOM 237 CZ PHE C 104 20.529 1.921 -15.896 1.00 0.00 C ATOM 0 H PHE C 104 15.922 4.556 -16.839 1.00 0.00 H new ATOM 0 HA PHE C 104 18.334 5.260 -18.314 1.00 0.00 H new ATOM 0 HB2 PHE C 104 16.372 2.953 -18.095 1.00 0.00 H new ATOM 0 HB3 PHE C 104 17.473 2.965 -19.459 1.00 0.00 H new ATOM 0 HD1 PHE C 104 17.349 3.110 -15.717 1.00 0.00 H new ATOM 0 HD2 PHE C 104 19.810 2.453 -19.178 1.00 0.00 H new ATOM 0 HE1 PHE C 104 19.185 2.306 -14.264 1.00 0.00 H new ATOM 0 HE2 PHE C 104 21.644 1.646 -17.712 1.00 0.00 H new ATOM 0 HZ PHE C 104 21.326 1.567 -15.260 1.00 0.00 H new ATOM 247 N ASP C 105 15.565 5.659 -19.955 1.00 0.00 N ATOM 248 CA ASP C 105 15.089 6.239 -21.267 1.00 0.00 C ATOM 249 C ASP C 105 15.126 7.764 -21.181 1.00 0.00 C ATOM 250 O ASP C 105 14.631 8.344 -20.226 1.00 0.00 O ATOM 251 CB ASP C 105 13.643 5.779 -21.437 1.00 0.00 C ATOM 252 CG ASP C 105 13.202 6.094 -22.833 1.00 0.00 C ATOM 253 OD1 ASP C 105 12.835 7.186 -23.087 1.00 0.00 O ATOM 254 OD2 ASP C 105 13.273 5.225 -23.652 1.00 0.00 O1- ATOM 0 H ASP C 105 14.834 5.466 -19.270 1.00 0.00 H new ATOM 0 HA ASP C 105 15.713 5.918 -22.101 1.00 0.00 H new ATOM 0 HB2 ASP C 105 13.562 4.709 -21.247 1.00 0.00 H new ATOM 0 HB3 ASP C 105 12.999 6.281 -20.715 1.00 0.00 H new ATOM 259 N LYS C 106 15.759 8.433 -22.108 1.00 0.00 N ATOM 260 CA LYS C 106 15.789 9.940 -22.020 1.00 0.00 C ATOM 261 C LYS C 106 14.863 10.598 -23.061 1.00 0.00 C ATOM 262 O LYS C 106 14.504 11.742 -22.911 1.00 0.00 O ATOM 263 CB LYS C 106 17.256 10.365 -22.222 1.00 0.00 C ATOM 264 CG LYS C 106 17.634 11.401 -21.135 1.00 0.00 C ATOM 265 CD LYS C 106 18.630 10.800 -20.125 1.00 0.00 C ATOM 266 CE LYS C 106 17.910 10.399 -18.807 1.00 0.00 C ATOM 267 NZ LYS C 106 17.035 9.223 -19.140 1.00 0.00 N1+ ATOM 0 H LYS C 106 16.247 8.024 -22.905 1.00 0.00 H new ATOM 0 HA LYS C 106 15.417 10.271 -21.050 1.00 0.00 H new ATOM 0 HB2 LYS C 106 17.912 9.497 -22.159 1.00 0.00 H new ATOM 0 HB3 LYS C 106 17.390 10.795 -23.215 1.00 0.00 H new ATOM 0 HG2 LYS C 106 18.072 12.282 -21.604 1.00 0.00 H new ATOM 0 HG3 LYS C 106 16.736 11.731 -20.613 1.00 0.00 H new ATOM 0 HD2 LYS C 106 19.113 9.925 -20.561 1.00 0.00 H new ATOM 0 HD3 LYS C 106 19.416 11.524 -19.909 1.00 0.00 H new ATOM 0 HE2 LYS C 106 18.633 10.138 -18.034 1.00 0.00 H new ATOM 0 HE3 LYS C 106 17.316 11.228 -18.422 1.00 0.00 H new ATOM 0 HZ1 LYS C 106 17.138 8.494 -18.405 1.00 0.00 H new ATOM 0 HZ2 LYS C 106 16.043 9.531 -19.186 1.00 0.00 H new ATOM 0 HZ3 LYS C 106 17.318 8.829 -20.060 1.00 0.00 H new ATOM 281 N ASN C 107 14.501 9.909 -24.123 1.00 0.00 N ATOM 282 CA ASN C 107 13.615 10.555 -25.177 1.00 0.00 C ATOM 283 C ASN C 107 12.118 10.294 -24.911 1.00 0.00 C ATOM 284 O ASN C 107 11.289 10.631 -25.744 1.00 0.00 O ATOM 285 CB ASN C 107 14.036 9.928 -26.532 1.00 0.00 C ATOM 286 CG ASN C 107 15.500 10.256 -26.826 1.00 0.00 C ATOM 287 OD1 ASN C 107 15.933 11.368 -26.612 1.00 0.00 O ATOM 288 ND2 ASN C 107 16.289 9.347 -27.323 1.00 0.00 N ATOM 0 H ASN C 107 14.770 8.944 -24.312 1.00 0.00 H new ATOM 0 HA ASN C 107 13.741 11.638 -25.168 1.00 0.00 H new ATOM 0 HB2 ASN C 107 13.896 8.848 -26.502 1.00 0.00 H new ATOM 0 HB3 ASN C 107 13.401 10.310 -27.332 1.00 0.00 H new ATOM 0 HD21 ASN C 107 17.262 9.573 -27.529 1.00 0.00 H new ATOM 0 HD22 ASN C 107 15.934 8.409 -27.507 1.00 0.00 H new ATOM 295 N ALA C 108 11.768 9.623 -23.808 1.00 0.00 N ATOM 296 CA ALA C 108 10.319 9.235 -23.512 1.00 0.00 C ATOM 297 C ALA C 108 9.774 8.288 -24.616 1.00 0.00 C ATOM 298 O ALA C 108 8.580 8.084 -24.730 1.00 0.00 O ATOM 299 CB ALA C 108 9.513 10.547 -23.461 1.00 0.00 C ATOM 0 H ALA C 108 12.433 9.325 -23.094 1.00 0.00 H new ATOM 0 HA ALA C 108 10.239 8.697 -22.567 1.00 0.00 H new ATOM 0 HB1 ALA C 108 8.467 10.323 -23.252 1.00 0.00 H new ATOM 0 HB2 ALA C 108 9.911 11.188 -22.675 1.00 0.00 H new ATOM 0 HB3 ALA C 108 9.590 11.059 -24.420 1.00 0.00 H new ATOM 305 N ASP C 109 10.659 7.685 -25.391 1.00 0.00 N ATOM 306 CA ASP C 109 10.254 6.697 -26.461 1.00 0.00 C ATOM 307 C ASP C 109 9.764 5.365 -25.841 1.00 0.00 C ATOM 308 O ASP C 109 8.992 4.653 -26.442 1.00 0.00 O ATOM 309 CB ASP C 109 11.512 6.492 -27.354 1.00 0.00 C ATOM 310 CG ASP C 109 12.672 6.007 -26.539 1.00 0.00 C ATOM 311 OD1 ASP C 109 13.352 6.786 -25.958 1.00 0.00 O1- ATOM 312 OD2 ASP C 109 12.893 4.861 -26.453 1.00 0.00 O ATOM 0 H ASP C 109 11.665 7.839 -25.326 1.00 0.00 H new ATOM 0 HA ASP C 109 9.416 7.070 -27.050 1.00 0.00 H new ATOM 0 HB2 ASP C 109 11.290 5.773 -28.142 1.00 0.00 H new ATOM 0 HB3 ASP C 109 11.773 7.431 -27.843 1.00 0.00 H new ATOM 317 N GLY C 110 10.228 5.018 -24.657 1.00 0.00 N ATOM 318 CA GLY C 110 9.788 3.730 -24.000 1.00 0.00 C ATOM 319 C GLY C 110 10.844 2.627 -24.164 1.00 0.00 C ATOM 320 O GLY C 110 10.733 1.582 -23.563 1.00 0.00 O ATOM 0 H GLY C 110 10.893 5.570 -24.115 1.00 0.00 H new ATOM 0 HA2 GLY C 110 9.604 3.905 -22.940 1.00 0.00 H new ATOM 0 HA3 GLY C 110 8.845 3.401 -24.437 1.00 0.00 H new ATOM 324 N TYR C 111 11.876 2.844 -24.949 1.00 0.00 N ATOM 325 CA TYR C 111 12.940 1.797 -25.108 1.00 0.00 C ATOM 326 C TYR C 111 14.268 2.376 -24.640 1.00 0.00 C ATOM 327 O TYR C 111 14.620 3.521 -25.003 1.00 0.00 O ATOM 328 CB TYR C 111 13.036 1.529 -26.623 1.00 0.00 C ATOM 329 CG TYR C 111 11.712 1.048 -27.179 1.00 0.00 C ATOM 330 CD1 TYR C 111 11.015 0.014 -26.549 1.00 0.00 C ATOM 331 CD2 TYR C 111 11.197 1.630 -28.339 1.00 0.00 C ATOM 332 CE1 TYR C 111 9.807 -0.434 -27.071 1.00 0.00 C ATOM 333 CE2 TYR C 111 9.985 1.178 -28.870 1.00 0.00 C ATOM 334 CZ TYR C 111 9.288 0.143 -28.240 1.00 0.00 C ATOM 335 OH TYR C 111 8.095 -0.309 -28.781 1.00 0.00 O ATOM 0 H TYR C 111 12.027 3.698 -25.485 1.00 0.00 H new ATOM 0 HA TYR C 111 12.715 0.895 -24.540 1.00 0.00 H new ATOM 0 HB2 TYR C 111 13.340 2.441 -27.138 1.00 0.00 H new ATOM 0 HB3 TYR C 111 13.807 0.782 -26.815 1.00 0.00 H new ATOM 0 HD1 TYR C 111 11.416 -0.438 -25.654 1.00 0.00 H new ATOM 0 HD2 TYR C 111 11.735 2.430 -28.826 1.00 0.00 H new ATOM 0 HE1 TYR C 111 9.267 -1.228 -26.576 1.00 0.00 H new ATOM 0 HE2 TYR C 111 9.587 1.629 -29.767 1.00 0.00 H new ATOM 0 HH TYR C 111 7.887 0.205 -29.589 1.00 0.00 H new ATOM 345 N ILE C 112 15.059 1.631 -23.929 1.00 0.00 N ATOM 346 CA ILE C 112 16.387 2.176 -23.560 1.00 0.00 C ATOM 347 C ILE C 112 17.325 1.818 -24.696 1.00 0.00 C ATOM 348 O ILE C 112 17.551 0.636 -24.987 1.00 0.00 O ATOM 349 CB ILE C 112 16.805 1.459 -22.268 1.00 0.00 C ATOM 350 CG1 ILE C 112 15.765 1.693 -21.167 1.00 0.00 C ATOM 351 CG2 ILE C 112 18.168 1.992 -21.787 1.00 0.00 C ATOM 352 CD1 ILE C 112 16.124 0.843 -19.957 1.00 0.00 C ATOM 0 H ILE C 112 14.851 0.690 -23.594 1.00 0.00 H new ATOM 0 HA ILE C 112 16.392 3.254 -23.402 1.00 0.00 H new ATOM 0 HB ILE C 112 16.878 0.392 -22.477 1.00 0.00 H new ATOM 0 HG12 ILE C 112 15.739 2.747 -20.892 1.00 0.00 H new ATOM 0 HG13 ILE C 112 14.770 1.433 -21.528 1.00 0.00 H new ATOM 0 HG21 ILE C 112 18.457 1.478 -20.870 1.00 0.00 H new ATOM 0 HG22 ILE C 112 18.920 1.813 -22.555 1.00 0.00 H new ATOM 0 HG23 ILE C 112 18.093 3.062 -21.595 1.00 0.00 H new ATOM 0 HD11 ILE C 112 15.389 1.004 -19.169 1.00 0.00 H new ATOM 0 HD12 ILE C 112 16.128 -0.210 -20.240 1.00 0.00 H new ATOM 0 HD13 ILE C 112 17.112 1.125 -19.594 1.00 0.00 H new ATOM 364 N ASP C 113 17.848 2.802 -25.346 1.00 0.00 N ATOM 365 CA ASP C 113 18.770 2.565 -26.481 1.00 0.00 C ATOM 366 C ASP C 113 20.181 2.834 -26.017 1.00 0.00 C ATOM 367 O ASP C 113 20.400 3.639 -25.103 1.00 0.00 O ATOM 368 CB ASP C 113 18.378 3.592 -27.546 1.00 0.00 C ATOM 369 CG ASP C 113 19.122 3.283 -28.823 1.00 0.00 C ATOM 370 OD1 ASP C 113 20.220 3.770 -28.974 1.00 0.00 O1- ATOM 371 OD2 ASP C 113 18.593 2.543 -29.625 1.00 0.00 O ATOM 0 H ASP C 113 17.674 3.785 -25.137 1.00 0.00 H new ATOM 0 HA ASP C 113 18.713 1.546 -26.863 1.00 0.00 H new ATOM 0 HB2 ASP C 113 17.302 3.562 -27.720 1.00 0.00 H new ATOM 0 HB3 ASP C 113 18.618 4.599 -27.205 1.00 0.00 H new ATOM 376 N LEU C 114 21.145 2.225 -26.641 1.00 0.00 N ATOM 377 CA LEU C 114 22.572 2.494 -26.270 1.00 0.00 C ATOM 378 C LEU C 114 22.881 4.008 -26.413 1.00 0.00 C ATOM 379 O LEU C 114 23.589 4.583 -25.584 1.00 0.00 O ATOM 380 CB LEU C 114 23.451 1.648 -27.237 1.00 0.00 C ATOM 381 CG LEU C 114 23.088 1.916 -28.724 1.00 0.00 C ATOM 382 CD1 LEU C 114 24.130 2.835 -29.357 1.00 0.00 C ATOM 383 CD2 LEU C 114 23.072 0.595 -29.491 1.00 0.00 C ATOM 0 H LEU C 114 21.014 1.550 -27.394 1.00 0.00 H new ATOM 0 HA LEU C 114 22.775 2.222 -25.234 1.00 0.00 H new ATOM 0 HB2 LEU C 114 24.503 1.881 -27.071 1.00 0.00 H new ATOM 0 HB3 LEU C 114 23.320 0.589 -27.015 1.00 0.00 H new ATOM 0 HG LEU C 114 22.106 2.388 -28.768 1.00 0.00 H new ATOM 0 HD11 LEU C 114 23.869 3.018 -30.399 1.00 0.00 H new ATOM 0 HD12 LEU C 114 24.156 3.782 -28.818 1.00 0.00 H new ATOM 0 HD13 LEU C 114 25.111 2.362 -29.307 1.00 0.00 H new ATOM 0 HD21 LEU C 114 22.817 0.783 -30.534 1.00 0.00 H new ATOM 0 HD22 LEU C 114 24.056 0.130 -29.436 1.00 0.00 H new ATOM 0 HD23 LEU C 114 22.331 -0.072 -29.051 1.00 0.00 H new ATOM 395 N ASP C 115 22.332 4.668 -27.424 1.00 0.00 N ATOM 396 CA ASP C 115 22.544 6.149 -27.570 1.00 0.00 C ATOM 397 C ASP C 115 21.850 6.891 -26.410 1.00 0.00 C ATOM 398 O ASP C 115 22.431 7.767 -25.796 1.00 0.00 O ATOM 399 CB ASP C 115 21.940 6.533 -28.927 1.00 0.00 C ATOM 400 CG ASP C 115 22.545 7.829 -29.401 1.00 0.00 C ATOM 401 OD1 ASP C 115 23.730 7.836 -29.675 1.00 0.00 O1- ATOM 402 OD2 ASP C 115 21.831 8.784 -29.519 1.00 0.00 O ATOM 0 H ASP C 115 21.751 4.242 -28.146 1.00 0.00 H new ATOM 0 HA ASP C 115 23.599 6.421 -27.532 1.00 0.00 H new ATOM 0 HB2 ASP C 115 22.127 5.745 -29.656 1.00 0.00 H new ATOM 0 HB3 ASP C 115 20.858 6.636 -28.839 1.00 0.00 H new ATOM 407 N GLU C 116 20.650 6.469 -26.020 1.00 0.00 N ATOM 408 CA GLU C 116 20.014 7.106 -24.799 1.00 0.00 C ATOM 409 C GLU C 116 20.913 6.795 -23.585 1.00 0.00 C ATOM 410 O GLU C 116 21.108 7.627 -22.702 1.00 0.00 O ATOM 411 CB GLU C 116 18.640 6.411 -24.590 1.00 0.00 C ATOM 412 CG GLU C 116 17.681 6.684 -25.770 1.00 0.00 C ATOM 413 CD GLU C 116 16.321 6.069 -25.502 1.00 0.00 C ATOM 414 OE1 GLU C 116 15.825 6.125 -24.422 1.00 0.00 O ATOM 415 OE2 GLU C 116 15.757 5.522 -26.364 1.00 0.00 O1- ATOM 0 H GLU C 116 20.103 5.739 -26.476 1.00 0.00 H new ATOM 0 HA GLU C 116 19.895 8.183 -24.917 1.00 0.00 H new ATOM 0 HB2 GLU C 116 18.788 5.337 -24.481 1.00 0.00 H new ATOM 0 HB3 GLU C 116 18.189 6.766 -23.664 1.00 0.00 H new ATOM 0 HG2 GLU C 116 17.577 7.758 -25.921 1.00 0.00 H new ATOM 0 HG3 GLU C 116 18.099 6.272 -26.689 1.00 0.00 H new ATOM 422 N LEU C 117 21.427 5.584 -23.518 1.00 0.00 N ATOM 423 CA LEU C 117 22.283 5.172 -22.357 1.00 0.00 C ATOM 424 C LEU C 117 23.573 6.026 -22.306 1.00 0.00 C ATOM 425 O LEU C 117 24.002 6.437 -21.230 1.00 0.00 O ATOM 426 CB LEU C 117 22.629 3.690 -22.636 1.00 0.00 C ATOM 427 CG LEU C 117 23.255 3.033 -21.396 1.00 0.00 C ATOM 428 CD1 LEU C 117 22.166 2.740 -20.361 1.00 0.00 C ATOM 429 CD2 LEU C 117 23.929 1.718 -21.807 1.00 0.00 C ATOM 0 H LEU C 117 21.288 4.861 -24.224 1.00 0.00 H new ATOM 0 HA LEU C 117 21.778 5.308 -21.401 1.00 0.00 H new ATOM 0 HB2 LEU C 117 21.727 3.149 -22.923 1.00 0.00 H new ATOM 0 HB3 LEU C 117 23.321 3.625 -23.476 1.00 0.00 H new ATOM 0 HG LEU C 117 23.993 3.708 -20.963 1.00 0.00 H new ATOM 0 HD11 LEU C 117 22.614 2.274 -19.483 1.00 0.00 H new ATOM 0 HD12 LEU C 117 21.681 3.672 -20.070 1.00 0.00 H new ATOM 0 HD13 LEU C 117 21.426 2.065 -20.792 1.00 0.00 H new ATOM 0 HD21 LEU C 117 24.375 1.248 -20.930 1.00 0.00 H new ATOM 0 HD22 LEU C 117 23.186 1.048 -22.240 1.00 0.00 H new ATOM 0 HD23 LEU C 117 24.706 1.922 -22.544 1.00 0.00 H new ATOM 441 N LYS C 118 24.202 6.302 -23.448 1.00 0.00 N ATOM 442 CA LYS C 118 25.472 7.113 -23.406 1.00 0.00 C ATOM 443 C LYS C 118 25.230 8.533 -22.886 1.00 0.00 C ATOM 444 O LYS C 118 26.049 9.057 -22.149 1.00 0.00 O ATOM 445 CB LYS C 118 26.127 7.117 -24.821 1.00 0.00 C ATOM 446 CG LYS C 118 25.242 7.801 -25.879 1.00 0.00 C ATOM 447 CD LYS C 118 26.032 8.019 -27.191 1.00 0.00 C ATOM 448 CE LYS C 118 26.348 6.669 -27.867 1.00 0.00 C ATOM 449 NZ LYS C 118 26.060 6.868 -29.314 1.00 0.00 N1+ ATOM 0 H LYS C 118 23.896 6.008 -24.376 1.00 0.00 H new ATOM 0 HA LYS C 118 26.160 6.649 -22.700 1.00 0.00 H new ATOM 0 HB2 LYS C 118 27.089 7.628 -24.771 1.00 0.00 H new ATOM 0 HB3 LYS C 118 26.327 6.090 -25.128 1.00 0.00 H new ATOM 0 HG2 LYS C 118 24.362 7.189 -26.076 1.00 0.00 H new ATOM 0 HG3 LYS C 118 24.886 8.759 -25.499 1.00 0.00 H new ATOM 0 HD2 LYS C 118 25.453 8.645 -27.870 1.00 0.00 H new ATOM 0 HD3 LYS C 118 26.959 8.551 -26.979 1.00 0.00 H new ATOM 0 HE2 LYS C 118 27.389 6.386 -27.710 1.00 0.00 H new ATOM 0 HE3 LYS C 118 25.734 5.870 -27.452 1.00 0.00 H new ATOM 0 HZ1 LYS C 118 26.499 6.102 -29.864 1.00 0.00 H new ATOM 0 HZ2 LYS C 118 25.031 6.858 -29.468 1.00 0.00 H new ATOM 0 HZ3 LYS C 118 26.448 7.782 -29.623 1.00 0.00 H new ATOM 463 N ILE C 119 24.112 9.150 -23.232 1.00 0.00 N ATOM 464 CA ILE C 119 23.841 10.553 -22.738 1.00 0.00 C ATOM 465 C ILE C 119 23.897 10.585 -21.196 1.00 0.00 C ATOM 466 O ILE C 119 24.535 11.451 -20.605 1.00 0.00 O ATOM 467 CB ILE C 119 22.408 10.918 -23.245 1.00 0.00 C ATOM 468 CG1 ILE C 119 22.370 10.903 -24.783 1.00 0.00 C ATOM 469 CG2 ILE C 119 21.995 12.318 -22.757 1.00 0.00 C ATOM 470 CD1 ILE C 119 20.957 11.232 -25.271 1.00 0.00 C ATOM 0 H ILE C 119 23.386 8.750 -23.826 1.00 0.00 H new ATOM 0 HA ILE C 119 24.581 11.264 -23.105 1.00 0.00 H new ATOM 0 HB ILE C 119 21.715 10.177 -22.847 1.00 0.00 H new ATOM 0 HG12 ILE C 119 23.080 11.629 -25.180 1.00 0.00 H new ATOM 0 HG13 ILE C 119 22.674 9.924 -25.154 1.00 0.00 H new ATOM 0 HG21 ILE C 119 20.995 12.550 -23.122 1.00 0.00 H new ATOM 0 HG22 ILE C 119 21.997 12.339 -21.667 1.00 0.00 H new ATOM 0 HG23 ILE C 119 22.700 13.058 -23.136 1.00 0.00 H new ATOM 0 HD11 ILE C 119 20.936 11.220 -26.361 1.00 0.00 H new ATOM 0 HD12 ILE C 119 20.257 10.490 -24.887 1.00 0.00 H new ATOM 0 HD13 ILE C 119 20.670 12.221 -24.914 1.00 0.00 H new ATOM 482 N MET C 120 23.279 9.623 -20.536 1.00 0.00 N ATOM 483 CA MET C 120 23.350 9.599 -19.045 1.00 0.00 C ATOM 484 C MET C 120 24.798 9.301 -18.592 1.00 0.00 C ATOM 485 O MET C 120 25.248 9.803 -17.574 1.00 0.00 O ATOM 486 CB MET C 120 22.318 8.532 -18.558 1.00 0.00 C ATOM 487 CG MET C 120 22.993 7.204 -18.157 1.00 0.00 C ATOM 488 SD MET C 120 21.739 6.070 -17.514 1.00 0.00 S ATOM 489 CE MET C 120 20.833 5.823 -19.057 1.00 0.00 C ATOM 0 H MET C 120 22.740 8.870 -20.963 1.00 0.00 H new ATOM 0 HA MET C 120 23.094 10.562 -18.604 1.00 0.00 H new ATOM 0 HB2 MET C 120 21.765 8.927 -17.706 1.00 0.00 H new ATOM 0 HB3 MET C 120 21.593 8.344 -19.350 1.00 0.00 H new ATOM 0 HG2 MET C 120 23.493 6.762 -19.019 1.00 0.00 H new ATOM 0 HG3 MET C 120 23.758 7.385 -17.402 1.00 0.00 H new ATOM 0 HE1 MET C 120 20.464 4.798 -19.102 1.00 0.00 H new ATOM 0 HE2 MET C 120 19.991 6.514 -19.099 1.00 0.00 H new ATOM 0 HE3 MET C 120 21.496 6.008 -19.902 1.00 0.00 H new ATOM 499 N LEU C 121 25.509 8.448 -19.314 1.00 0.00 N ATOM 500 CA LEU C 121 26.914 8.096 -18.909 1.00 0.00 C ATOM 501 C LEU C 121 27.857 9.287 -19.178 1.00 0.00 C ATOM 502 O LEU C 121 28.606 9.686 -18.310 1.00 0.00 O ATOM 503 CB LEU C 121 27.294 6.889 -19.819 1.00 0.00 C ATOM 504 CG LEU C 121 28.382 5.995 -19.161 1.00 0.00 C ATOM 505 CD1 LEU C 121 29.567 6.833 -18.669 1.00 0.00 C ATOM 506 CD2 LEU C 121 27.775 5.227 -17.979 1.00 0.00 C ATOM 0 H LEU C 121 25.175 7.986 -20.160 1.00 0.00 H new ATOM 0 HA LEU C 121 26.996 7.857 -17.849 1.00 0.00 H new ATOM 0 HB2 LEU C 121 26.405 6.291 -20.021 1.00 0.00 H new ATOM 0 HB3 LEU C 121 27.656 7.257 -20.779 1.00 0.00 H new ATOM 0 HG LEU C 121 28.745 5.295 -19.913 1.00 0.00 H new ATOM 0 HD11 LEU C 121 30.311 6.179 -18.214 1.00 0.00 H new ATOM 0 HD12 LEU C 121 30.014 7.360 -19.511 1.00 0.00 H new ATOM 0 HD13 LEU C 121 29.220 7.556 -17.931 1.00 0.00 H new ATOM 0 HD21 LEU C 121 28.540 4.601 -17.520 1.00 0.00 H new ATOM 0 HD22 LEU C 121 27.395 5.935 -17.242 1.00 0.00 H new ATOM 0 HD23 LEU C 121 26.958 4.599 -18.334 1.00 0.00 H new ATOM 518 N GLN C 122 27.810 9.873 -20.365 1.00 0.00 N ATOM 519 CA GLN C 122 28.738 11.030 -20.682 1.00 0.00 C ATOM 520 C GLN C 122 28.502 12.205 -19.729 1.00 0.00 C ATOM 521 O GLN C 122 29.427 12.920 -19.381 1.00 0.00 O ATOM 522 CB GLN C 122 28.482 11.428 -22.161 1.00 0.00 C ATOM 523 CG GLN C 122 27.078 12.021 -22.344 1.00 0.00 C ATOM 524 CD GLN C 122 26.860 12.331 -23.819 1.00 0.00 C ATOM 525 OE1 GLN C 122 26.507 11.465 -24.581 1.00 0.00 O ATOM 526 NE2 GLN C 122 27.077 13.528 -24.265 1.00 0.00 N ATOM 0 H GLN C 122 27.178 9.606 -21.120 1.00 0.00 H new ATOM 0 HA GLN C 122 29.779 10.738 -20.547 1.00 0.00 H new ATOM 0 HB2 GLN C 122 29.230 12.154 -22.479 1.00 0.00 H new ATOM 0 HB3 GLN C 122 28.595 10.553 -22.800 1.00 0.00 H new ATOM 0 HG2 GLN C 122 26.323 11.318 -21.991 1.00 0.00 H new ATOM 0 HG3 GLN C 122 26.972 12.928 -21.749 1.00 0.00 H new ATOM 0 HE21 GLN C 122 27.376 14.264 -23.625 1.00 0.00 H new ATOM 0 HE22 GLN C 122 26.949 13.734 -25.256 1.00 0.00 H new ATOM 535 N ALA C 123 27.272 12.424 -19.310 1.00 0.00 N ATOM 536 CA ALA C 123 26.985 13.559 -18.366 1.00 0.00 C ATOM 537 C ALA C 123 27.656 13.311 -16.996 1.00 0.00 C ATOM 538 O ALA C 123 27.821 14.233 -16.216 1.00 0.00 O ATOM 539 CB ALA C 123 25.455 13.586 -18.205 1.00 0.00 C ATOM 0 H ALA C 123 26.460 11.869 -19.579 1.00 0.00 H new ATOM 0 HA ALA C 123 27.373 14.503 -18.748 1.00 0.00 H new ATOM 0 HB1 ALA C 123 25.175 14.392 -17.527 1.00 0.00 H new ATOM 0 HB2 ALA C 123 24.990 13.750 -19.177 1.00 0.00 H new ATOM 0 HB3 ALA C 123 25.115 12.634 -17.797 1.00 0.00 H new ATOM 545 N THR C 124 27.965 12.072 -16.654 1.00 0.00 N ATOM 546 CA THR C 124 28.534 11.792 -15.293 1.00 0.00 C ATOM 547 C THR C 124 29.291 10.428 -15.297 1.00 0.00 C ATOM 548 O THR C 124 28.959 9.524 -14.533 1.00 0.00 O ATOM 549 CB THR C 124 27.257 11.767 -14.372 1.00 0.00 C ATOM 550 OG1 THR C 124 27.570 11.381 -13.026 1.00 0.00 O ATOM 551 CG2 THR C 124 26.208 10.808 -14.941 1.00 0.00 C ATOM 0 H THR C 124 27.848 11.255 -17.253 1.00 0.00 H new ATOM 0 HA THR C 124 29.267 12.524 -14.956 1.00 0.00 H new ATOM 0 HB THR C 124 26.860 12.782 -14.351 1.00 0.00 H new ATOM 0 HG1 THR C 124 28.040 10.521 -13.033 1.00 0.00 H new ATOM 0 HG21 THR C 124 25.331 10.802 -14.293 1.00 0.00 H new ATOM 0 HG22 THR C 124 25.919 11.136 -15.940 1.00 0.00 H new ATOM 0 HG23 THR C 124 26.626 9.803 -14.996 1.00 0.00 H new ATOM 559 N GLY C 125 30.284 10.269 -16.146 1.00 0.00 N ATOM 560 CA GLY C 125 31.027 8.962 -16.195 1.00 0.00 C ATOM 561 C GLY C 125 32.316 9.118 -17.005 1.00 0.00 C ATOM 562 O GLY C 125 32.800 10.235 -17.210 1.00 0.00 O ATOM 0 H GLY C 125 30.610 10.980 -16.801 1.00 0.00 H new ATOM 0 HA2 GLY C 125 31.262 8.631 -15.184 1.00 0.00 H new ATOM 0 HA3 GLY C 125 30.397 8.194 -16.644 1.00 0.00 H new ATOM 566 N GLU C 126 32.878 8.024 -17.471 1.00 0.00 N ATOM 567 CA GLU C 126 34.136 8.100 -18.299 1.00 0.00 C ATOM 568 C GLU C 126 33.737 8.207 -19.784 1.00 0.00 C ATOM 569 O GLU C 126 32.640 7.810 -20.170 1.00 0.00 O ATOM 570 CB GLU C 126 34.866 6.758 -18.080 1.00 0.00 C ATOM 571 CG GLU C 126 35.205 6.533 -16.588 1.00 0.00 C ATOM 572 CD GLU C 126 36.017 5.236 -16.403 1.00 0.00 C ATOM 573 OE1 GLU C 126 36.437 4.641 -17.383 1.00 0.00 O ATOM 574 OE2 GLU C 126 36.155 4.823 -15.284 1.00 0.00 O1- ATOM 0 H GLU C 126 32.522 7.081 -17.315 1.00 0.00 H new ATOM 0 HA GLU C 126 34.758 8.953 -18.026 1.00 0.00 H new ATOM 0 HB2 GLU C 126 34.241 5.940 -18.439 1.00 0.00 H new ATOM 0 HB3 GLU C 126 35.783 6.741 -18.669 1.00 0.00 H new ATOM 0 HG2 GLU C 126 35.774 7.381 -16.207 1.00 0.00 H new ATOM 0 HG3 GLU C 126 34.285 6.478 -16.005 1.00 0.00 H new ATOM 581 N THR C 127 34.612 8.702 -20.624 1.00 0.00 N ATOM 582 CA THR C 127 34.280 8.791 -22.085 1.00 0.00 C ATOM 583 C THR C 127 34.375 7.364 -22.669 1.00 0.00 C ATOM 584 O THR C 127 35.350 6.657 -22.429 1.00 0.00 O ATOM 585 CB THR C 127 35.381 9.691 -22.714 1.00 0.00 C ATOM 586 OG1 THR C 127 35.969 10.545 -21.708 1.00 0.00 O ATOM 587 CG2 THR C 127 34.763 10.568 -23.814 1.00 0.00 C ATOM 0 H THR C 127 35.537 9.047 -20.366 1.00 0.00 H new ATOM 0 HA THR C 127 33.286 9.196 -22.276 1.00 0.00 H new ATOM 0 HB THR C 127 36.154 9.050 -23.137 1.00 0.00 H new ATOM 0 HG1 THR C 127 36.661 11.104 -22.118 1.00 0.00 H new ATOM 0 HG21 THR C 127 35.536 11.198 -24.254 1.00 0.00 H new ATOM 0 HG22 THR C 127 34.330 9.932 -24.586 1.00 0.00 H new ATOM 0 HG23 THR C 127 33.984 11.197 -23.383 1.00 0.00 H new ATOM 595 N ILE C 128 33.373 6.926 -23.395 1.00 0.00 N ATOM 596 CA ILE C 128 33.407 5.540 -23.957 1.00 0.00 C ATOM 597 C ILE C 128 33.197 5.541 -25.467 1.00 0.00 C ATOM 598 O ILE C 128 32.479 6.392 -26.019 1.00 0.00 O ATOM 599 CB ILE C 128 32.267 4.753 -23.251 1.00 0.00 C ATOM 600 CG1 ILE C 128 30.887 5.483 -23.395 1.00 0.00 C ATOM 601 CG2 ILE C 128 32.616 4.502 -21.777 1.00 0.00 C ATOM 602 CD1 ILE C 128 30.535 6.276 -22.117 1.00 0.00 C ATOM 0 H ILE C 128 32.538 7.466 -23.621 1.00 0.00 H new ATOM 0 HA ILE C 128 34.380 5.082 -23.782 1.00 0.00 H new ATOM 0 HB ILE C 128 32.171 3.787 -23.746 1.00 0.00 H new ATOM 0 HG12 ILE C 128 30.919 6.160 -24.248 1.00 0.00 H new ATOM 0 HG13 ILE C 128 30.105 4.751 -23.598 1.00 0.00 H new ATOM 0 HG21 ILE C 128 31.806 3.950 -21.300 1.00 0.00 H new ATOM 0 HG22 ILE C 128 33.536 3.922 -21.715 1.00 0.00 H new ATOM 0 HG23 ILE C 128 32.754 5.456 -21.268 1.00 0.00 H new ATOM 0 HD11 ILE C 128 29.573 6.770 -22.249 1.00 0.00 H new ATOM 0 HD12 ILE C 128 30.479 5.593 -21.269 1.00 0.00 H new ATOM 0 HD13 ILE C 128 31.305 7.025 -21.930 1.00 0.00 H new ATOM 614 N THR C 129 33.715 4.555 -26.116 1.00 0.00 N ATOM 615 CA THR C 129 33.488 4.379 -27.570 1.00 0.00 C ATOM 616 C THR C 129 32.236 3.473 -27.742 1.00 0.00 C ATOM 617 O THR C 129 31.542 3.165 -26.758 1.00 0.00 O ATOM 618 CB THR C 129 34.789 3.706 -28.111 1.00 0.00 C ATOM 619 OG1 THR C 129 35.540 3.122 -27.033 1.00 0.00 O ATOM 620 CG2 THR C 129 35.655 4.751 -28.829 1.00 0.00 C ATOM 0 H THR C 129 34.305 3.839 -25.691 1.00 0.00 H new ATOM 0 HA THR C 129 33.300 5.306 -28.113 1.00 0.00 H new ATOM 0 HB THR C 129 34.507 2.920 -28.811 1.00 0.00 H new ATOM 0 HG1 THR C 129 35.417 2.150 -27.038 1.00 0.00 H new ATOM 0 HG21 THR C 129 36.562 4.276 -29.205 1.00 0.00 H new ATOM 0 HG22 THR C 129 35.096 5.176 -29.663 1.00 0.00 H new ATOM 0 HG23 THR C 129 35.923 5.543 -28.130 1.00 0.00 H new ATOM 628 N GLU C 130 31.870 3.117 -28.947 1.00 0.00 N ATOM 629 CA GLU C 130 30.623 2.292 -29.141 1.00 0.00 C ATOM 630 C GLU C 130 30.891 0.822 -28.733 1.00 0.00 C ATOM 631 O GLU C 130 30.814 -0.088 -29.552 1.00 0.00 O ATOM 632 CB GLU C 130 30.285 2.415 -30.648 1.00 0.00 C ATOM 633 CG GLU C 130 28.906 3.090 -30.827 1.00 0.00 C ATOM 634 CD GLU C 130 28.916 4.541 -30.331 1.00 0.00 C ATOM 635 OE1 GLU C 130 29.962 5.158 -30.289 1.00 0.00 O1- ATOM 636 OE2 GLU C 130 27.870 5.024 -29.999 1.00 0.00 O ATOM 0 H GLU C 130 32.371 3.356 -29.803 1.00 0.00 H new ATOM 0 HA GLU C 130 29.792 2.635 -28.524 1.00 0.00 H new ATOM 0 HB2 GLU C 130 31.053 2.999 -31.155 1.00 0.00 H new ATOM 0 HB3 GLU C 130 30.278 1.428 -31.109 1.00 0.00 H new ATOM 0 HG2 GLU C 130 28.624 3.067 -31.880 1.00 0.00 H new ATOM 0 HG3 GLU C 130 28.150 2.524 -30.282 1.00 0.00 H new ATOM 643 N ASP C 131 31.209 0.592 -27.474 1.00 0.00 N ATOM 644 CA ASP C 131 31.487 -0.808 -26.973 1.00 0.00 C ATOM 645 C ASP C 131 31.006 -0.967 -25.519 1.00 0.00 C ATOM 646 O ASP C 131 30.151 -1.785 -25.233 1.00 0.00 O ATOM 647 CB ASP C 131 33.037 -1.036 -27.044 1.00 0.00 C ATOM 648 CG ASP C 131 33.833 0.235 -26.752 1.00 0.00 C ATOM 649 OD1 ASP C 131 33.837 0.679 -25.623 1.00 0.00 O1- ATOM 650 OD2 ASP C 131 34.421 0.750 -27.662 1.00 0.00 O ATOM 0 H ASP C 131 31.289 1.319 -26.763 1.00 0.00 H new ATOM 0 HA ASP C 131 30.957 -1.537 -27.585 1.00 0.00 H new ATOM 0 HB2 ASP C 131 33.320 -1.809 -26.330 1.00 0.00 H new ATOM 0 HB3 ASP C 131 33.301 -1.406 -28.035 1.00 0.00 H new ATOM 655 N ASP C 132 31.580 -0.207 -24.599 1.00 0.00 N ATOM 656 CA ASP C 132 31.227 -0.320 -23.123 1.00 0.00 C ATOM 657 C ASP C 132 29.715 -0.176 -22.951 1.00 0.00 C ATOM 658 O ASP C 132 29.079 -0.932 -22.226 1.00 0.00 O ATOM 659 CB ASP C 132 31.915 0.893 -22.448 1.00 0.00 C ATOM 660 CG ASP C 132 32.098 0.625 -20.954 1.00 0.00 C ATOM 661 OD1 ASP C 132 31.157 0.818 -20.217 1.00 0.00 O ATOM 662 OD2 ASP C 132 33.188 0.239 -20.570 1.00 0.00 O1- ATOM 0 H ASP C 132 32.288 0.497 -24.807 1.00 0.00 H new ATOM 0 HA ASP C 132 31.541 -1.274 -22.700 1.00 0.00 H new ATOM 0 HB2 ASP C 132 32.883 1.078 -22.914 1.00 0.00 H new ATOM 0 HB3 ASP C 132 31.314 1.790 -22.594 1.00 0.00 H new ATOM 667 N ILE C 133 29.120 0.763 -23.665 1.00 0.00 N ATOM 668 CA ILE C 133 27.625 0.949 -23.600 1.00 0.00 C ATOM 669 C ILE C 133 26.962 -0.356 -24.081 1.00 0.00 C ATOM 670 O ILE C 133 26.044 -0.860 -23.458 1.00 0.00 O ATOM 671 CB ILE C 133 27.308 2.115 -24.591 1.00 0.00 C ATOM 672 CG1 ILE C 133 28.072 3.385 -24.178 1.00 0.00 C ATOM 673 CG2 ILE C 133 25.801 2.430 -24.586 1.00 0.00 C ATOM 674 CD1 ILE C 133 27.940 4.425 -25.285 1.00 0.00 C ATOM 0 H ILE C 133 29.605 1.407 -24.289 1.00 0.00 H new ATOM 0 HA ILE C 133 27.262 1.176 -22.598 1.00 0.00 H new ATOM 0 HB ILE C 133 27.616 1.802 -25.589 1.00 0.00 H new ATOM 0 HG12 ILE C 133 27.672 3.778 -23.243 1.00 0.00 H new ATOM 0 HG13 ILE C 133 29.122 3.152 -24.003 1.00 0.00 H new ATOM 0 HG21 ILE C 133 25.597 3.244 -25.281 1.00 0.00 H new ATOM 0 HG22 ILE C 133 25.243 1.544 -24.891 1.00 0.00 H new ATOM 0 HG23 ILE C 133 25.494 2.725 -23.582 1.00 0.00 H new ATOM 0 HD11 ILE C 133 28.479 5.329 -25.001 1.00 0.00 H new ATOM 0 HD12 ILE C 133 28.360 4.028 -26.209 1.00 0.00 H new ATOM 0 HD13 ILE C 133 26.887 4.663 -25.437 1.00 0.00 H new ATOM 686 N GLU C 134 27.455 -0.923 -25.178 1.00 0.00 N ATOM 687 CA GLU C 134 26.870 -2.193 -25.684 1.00 0.00 C ATOM 688 C GLU C 134 27.053 -3.293 -24.636 1.00 0.00 C ATOM 689 O GLU C 134 26.160 -4.073 -24.410 1.00 0.00 O ATOM 690 CB GLU C 134 27.652 -2.562 -26.952 1.00 0.00 C ATOM 691 CG GLU C 134 26.971 -3.760 -27.633 1.00 0.00 C ATOM 692 CD GLU C 134 27.863 -4.288 -28.719 1.00 0.00 C ATOM 693 OE1 GLU C 134 28.029 -3.626 -29.698 1.00 0.00 O ATOM 694 OE2 GLU C 134 28.401 -5.347 -28.531 1.00 0.00 O1- ATOM 0 H GLU C 134 28.230 -0.552 -25.728 1.00 0.00 H new ATOM 0 HA GLU C 134 25.805 -2.084 -25.891 1.00 0.00 H new ATOM 0 HB2 GLU C 134 27.686 -1.712 -27.633 1.00 0.00 H new ATOM 0 HB3 GLU C 134 28.683 -2.809 -26.699 1.00 0.00 H new ATOM 0 HG2 GLU C 134 26.768 -4.542 -26.901 1.00 0.00 H new ATOM 0 HG3 GLU C 134 26.011 -3.458 -28.051 1.00 0.00 H new ATOM 701 N GLU C 135 28.197 -3.362 -23.983 1.00 0.00 N ATOM 702 CA GLU C 135 28.400 -4.439 -22.949 1.00 0.00 C ATOM 703 C GLU C 135 27.356 -4.301 -21.847 1.00 0.00 C ATOM 704 O GLU C 135 26.730 -5.280 -21.466 1.00 0.00 O ATOM 705 CB GLU C 135 29.810 -4.187 -22.396 1.00 0.00 C ATOM 706 CG GLU C 135 30.871 -4.473 -23.497 1.00 0.00 C ATOM 707 CD GLU C 135 30.924 -5.955 -23.858 1.00 0.00 C ATOM 708 OE1 GLU C 135 30.479 -6.769 -23.082 1.00 0.00 O ATOM 709 OE2 GLU C 135 31.388 -6.256 -24.925 1.00 0.00 O1- ATOM 0 H GLU C 135 28.987 -2.731 -24.118 1.00 0.00 H new ATOM 0 HA GLU C 135 28.298 -5.443 -23.360 1.00 0.00 H new ATOM 0 HB2 GLU C 135 29.897 -3.156 -22.055 1.00 0.00 H new ATOM 0 HB3 GLU C 135 29.990 -4.825 -21.531 1.00 0.00 H new ATOM 0 HG2 GLU C 135 30.638 -3.890 -24.388 1.00 0.00 H new ATOM 0 HG3 GLU C 135 31.852 -4.147 -23.151 1.00 0.00 H new ATOM 716 N LEU C 136 27.070 -3.086 -21.427 1.00 0.00 N ATOM 717 CA LEU C 136 25.963 -2.885 -20.430 1.00 0.00 C ATOM 718 C LEU C 136 24.630 -3.306 -21.068 1.00 0.00 C ATOM 719 O LEU C 136 23.799 -3.936 -20.430 1.00 0.00 O ATOM 720 CB LEU C 136 25.971 -1.377 -20.103 1.00 0.00 C ATOM 721 CG LEU C 136 24.908 -1.049 -19.035 1.00 0.00 C ATOM 722 CD1 LEU C 136 25.245 -1.750 -17.721 1.00 0.00 C ATOM 723 CD2 LEU C 136 24.873 0.458 -18.794 1.00 0.00 C ATOM 0 H LEU C 136 27.548 -2.236 -21.727 1.00 0.00 H new ATOM 0 HA LEU C 136 26.094 -3.479 -19.526 1.00 0.00 H new ATOM 0 HB2 LEU C 136 26.957 -1.082 -19.745 1.00 0.00 H new ATOM 0 HB3 LEU C 136 25.775 -0.802 -21.008 1.00 0.00 H new ATOM 0 HG LEU C 136 23.937 -1.394 -19.392 1.00 0.00 H new ATOM 0 HD11 LEU C 136 24.487 -1.510 -16.976 1.00 0.00 H new ATOM 0 HD12 LEU C 136 25.269 -2.828 -17.880 1.00 0.00 H new ATOM 0 HD13 LEU C 136 26.220 -1.413 -17.368 1.00 0.00 H new ATOM 0 HD21 LEU C 136 24.121 0.688 -18.039 1.00 0.00 H new ATOM 0 HD22 LEU C 136 25.850 0.794 -18.447 1.00 0.00 H new ATOM 0 HD23 LEU C 136 24.622 0.969 -19.723 1.00 0.00 H new ATOM 735 N MET C 137 24.421 -2.969 -22.329 1.00 0.00 N ATOM 736 CA MET C 137 23.141 -3.383 -23.004 1.00 0.00 C ATOM 737 C MET C 137 23.100 -4.915 -23.158 1.00 0.00 C ATOM 738 O MET C 137 22.096 -5.518 -22.888 1.00 0.00 O ATOM 739 CB MET C 137 23.154 -2.708 -24.394 1.00 0.00 C ATOM 740 CG MET C 137 23.114 -1.169 -24.252 1.00 0.00 C ATOM 741 SD MET C 137 21.546 -0.643 -23.518 1.00 0.00 S ATOM 742 CE MET C 137 20.487 -1.071 -24.924 1.00 0.00 C ATOM 0 H MET C 137 25.069 -2.435 -22.908 1.00 0.00 H new ATOM 0 HA MET C 137 22.267 -3.086 -22.425 1.00 0.00 H new ATOM 0 HB2 MET C 137 24.049 -3.005 -24.940 1.00 0.00 H new ATOM 0 HB3 MET C 137 22.298 -3.047 -24.977 1.00 0.00 H new ATOM 0 HG2 MET C 137 23.944 -0.833 -23.631 1.00 0.00 H new ATOM 0 HG3 MET C 137 23.239 -0.704 -25.230 1.00 0.00 H new ATOM 0 HE1 MET C 137 19.533 -0.551 -24.833 1.00 0.00 H new ATOM 0 HE2 MET C 137 20.976 -0.773 -25.852 1.00 0.00 H new ATOM 0 HE3 MET C 137 20.314 -2.147 -24.935 1.00 0.00 H new ATOM 752 N LYS C 138 24.208 -5.547 -23.563 1.00 0.00 N ATOM 753 CA LYS C 138 24.220 -7.060 -23.740 1.00 0.00 C ATOM 754 C LYS C 138 23.876 -7.762 -22.424 1.00 0.00 C ATOM 755 O LYS C 138 23.241 -8.789 -22.427 1.00 0.00 O ATOM 756 CB LYS C 138 25.649 -7.470 -24.193 1.00 0.00 C ATOM 757 CG LYS C 138 25.969 -6.911 -25.604 1.00 0.00 C ATOM 758 CD LYS C 138 27.221 -7.607 -26.191 1.00 0.00 C ATOM 759 CE LYS C 138 28.490 -7.224 -25.412 1.00 0.00 C ATOM 760 NZ LYS C 138 29.052 -6.035 -26.125 1.00 0.00 N1+ ATOM 0 H LYS C 138 25.092 -5.083 -23.775 1.00 0.00 H new ATOM 0 HA LYS C 138 23.476 -7.353 -24.481 1.00 0.00 H new ATOM 0 HB2 LYS C 138 26.382 -7.099 -23.476 1.00 0.00 H new ATOM 0 HB3 LYS C 138 25.734 -8.557 -24.201 1.00 0.00 H new ATOM 0 HG2 LYS C 138 25.116 -7.065 -26.265 1.00 0.00 H new ATOM 0 HG3 LYS C 138 26.137 -5.836 -25.546 1.00 0.00 H new ATOM 0 HD2 LYS C 138 27.086 -8.688 -26.161 1.00 0.00 H new ATOM 0 HD3 LYS C 138 27.337 -7.329 -27.238 1.00 0.00 H new ATOM 0 HE2 LYS C 138 28.257 -6.985 -24.374 1.00 0.00 H new ATOM 0 HE3 LYS C 138 29.205 -8.047 -25.397 1.00 0.00 H new ATOM 0 HZ1 LYS C 138 30.090 -6.051 -26.062 1.00 0.00 H new ATOM 0 HZ2 LYS C 138 28.766 -6.062 -27.124 1.00 0.00 H new ATOM 0 HZ3 LYS C 138 28.691 -5.164 -25.685 1.00 0.00 H new ATOM 774 N ASP C 139 24.303 -7.213 -21.305 1.00 0.00 N ATOM 775 CA ASP C 139 23.996 -7.851 -19.971 1.00 0.00 C ATOM 776 C ASP C 139 22.474 -8.016 -19.819 1.00 0.00 C ATOM 777 O ASP C 139 22.007 -8.980 -19.249 1.00 0.00 O ATOM 778 CB ASP C 139 24.524 -6.852 -18.921 1.00 0.00 C ATOM 779 CG ASP C 139 24.410 -7.441 -17.532 1.00 0.00 C ATOM 780 OD1 ASP C 139 25.320 -8.137 -17.129 1.00 0.00 O1- ATOM 781 OD2 ASP C 139 23.428 -7.177 -16.873 1.00 0.00 O ATOM 0 H ASP C 139 24.849 -6.353 -21.255 1.00 0.00 H new ATOM 0 HA ASP C 139 24.450 -8.836 -19.865 1.00 0.00 H new ATOM 0 HB2 ASP C 139 25.564 -6.605 -19.135 1.00 0.00 H new ATOM 0 HB3 ASP C 139 23.958 -5.922 -18.977 1.00 0.00 H new ATOM 786 N GLY C 140 21.701 -7.070 -20.304 1.00 0.00 N ATOM 787 CA GLY C 140 20.217 -7.168 -20.163 1.00 0.00 C ATOM 788 C GLY C 140 19.522 -7.464 -21.507 1.00 0.00 C ATOM 789 O GLY C 140 18.358 -7.892 -21.507 1.00 0.00 O ATOM 0 H GLY C 140 22.036 -6.238 -20.790 1.00 0.00 H new ATOM 0 HA2 GLY C 140 19.973 -7.954 -19.449 1.00 0.00 H new ATOM 0 HA3 GLY C 140 19.830 -6.235 -19.754 1.00 0.00 H new ATOM 793 N ASP C 141 20.155 -7.175 -22.647 1.00 0.00 N ATOM 794 CA ASP C 141 19.451 -7.345 -23.977 1.00 0.00 C ATOM 795 C ASP C 141 19.126 -8.805 -24.260 1.00 0.00 C ATOM 796 O ASP C 141 19.882 -9.704 -23.933 1.00 0.00 O ATOM 797 CB ASP C 141 20.369 -6.787 -25.085 1.00 0.00 C ATOM 798 CG ASP C 141 19.551 -6.577 -26.359 1.00 0.00 C ATOM 799 OD1 ASP C 141 18.562 -5.861 -26.294 1.00 0.00 O ATOM 800 OD2 ASP C 141 19.890 -7.119 -27.366 1.00 0.00 O1- ATOM 0 H ASP C 141 21.114 -6.834 -22.707 1.00 0.00 H new ATOM 0 HA ASP C 141 18.506 -6.803 -23.948 1.00 0.00 H new ATOM 0 HB2 ASP C 141 20.814 -5.845 -24.765 1.00 0.00 H new ATOM 0 HB3 ASP C 141 21.190 -7.478 -25.276 1.00 0.00 H new ATOM 805 N LYS C 142 17.980 -9.042 -24.828 1.00 0.00 N ATOM 806 CA LYS C 142 17.527 -10.415 -25.125 1.00 0.00 C ATOM 807 C LYS C 142 17.125 -10.458 -26.591 1.00 0.00 C ATOM 808 O LYS C 142 16.640 -9.492 -27.125 1.00 0.00 O ATOM 809 CB LYS C 142 16.301 -10.611 -24.222 1.00 0.00 C ATOM 810 CG LYS C 142 16.722 -10.351 -22.764 1.00 0.00 C ATOM 811 CD LYS C 142 15.561 -10.623 -21.796 1.00 0.00 C ATOM 812 CE LYS C 142 15.895 -10.151 -20.338 1.00 0.00 C ATOM 813 NZ LYS C 142 17.388 -9.947 -20.228 1.00 0.00 N1+ ATOM 0 H LYS C 142 17.322 -8.314 -25.105 1.00 0.00 H new ATOM 0 HA LYS C 142 18.279 -11.185 -24.951 1.00 0.00 H new ATOM 0 HB2 LYS C 142 15.503 -9.928 -24.513 1.00 0.00 H new ATOM 0 HB3 LYS C 142 15.910 -11.623 -24.329 1.00 0.00 H new ATOM 0 HG2 LYS C 142 17.569 -10.987 -22.508 1.00 0.00 H new ATOM 0 HG3 LYS C 142 17.055 -9.318 -22.657 1.00 0.00 H new ATOM 0 HD2 LYS C 142 14.666 -10.110 -22.148 1.00 0.00 H new ATOM 0 HD3 LYS C 142 15.335 -11.689 -21.790 1.00 0.00 H new ATOM 0 HE2 LYS C 142 15.369 -9.224 -20.110 1.00 0.00 H new ATOM 0 HE3 LYS C 142 15.560 -10.894 -19.614 1.00 0.00 H new ATOM 0 HZ1 LYS C 142 17.641 -9.766 -19.236 1.00 0.00 H new ATOM 0 HZ2 LYS C 142 17.880 -10.800 -20.561 1.00 0.00 H new ATOM 0 HZ3 LYS C 142 17.671 -9.134 -20.811 1.00 0.00 H new ATOM 827 N ASN C 143 17.342 -11.560 -27.237 1.00 0.00 N ATOM 828 CA ASN C 143 17.015 -11.722 -28.711 1.00 0.00 C ATOM 829 C ASN C 143 17.789 -10.691 -29.567 1.00 0.00 C ATOM 830 O ASN C 143 17.398 -10.396 -30.690 1.00 0.00 O ATOM 831 CB ASN C 143 15.497 -11.488 -28.831 1.00 0.00 C ATOM 832 CG ASN C 143 14.972 -12.215 -30.064 1.00 0.00 C ATOM 833 OD1 ASN C 143 14.577 -13.363 -29.977 1.00 0.00 O ATOM 834 ND2 ASN C 143 14.982 -11.631 -31.218 1.00 0.00 N ATOM 0 H ASN C 143 17.745 -12.393 -26.808 1.00 0.00 H new ATOM 0 HA ASN C 143 17.303 -12.709 -29.073 1.00 0.00 H new ATOM 0 HB2 ASN C 143 14.990 -11.851 -27.937 1.00 0.00 H new ATOM 0 HB3 ASN C 143 15.287 -10.421 -28.906 1.00 0.00 H new ATOM 0 HD21 ASN C 143 14.660 -12.132 -32.046 1.00 0.00 H new ATOM 0 HD22 ASN C 143 15.311 -10.669 -31.300 1.00 0.00 H new ATOM 841 N ASN C 144 18.930 -10.214 -29.081 1.00 0.00 N ATOM 842 CA ASN C 144 19.815 -9.278 -29.863 1.00 0.00 C ATOM 843 C ASN C 144 19.010 -8.098 -30.461 1.00 0.00 C ATOM 844 O ASN C 144 19.248 -7.692 -31.603 1.00 0.00 O ATOM 845 CB ASN C 144 20.441 -10.147 -30.975 1.00 0.00 C ATOM 846 CG ASN C 144 21.740 -9.500 -31.476 1.00 0.00 C ATOM 847 OD1 ASN C 144 22.819 -9.962 -31.164 1.00 0.00 O ATOM 848 ND2 ASN C 144 21.696 -8.439 -32.221 1.00 0.00 N ATOM 0 H ASN C 144 19.287 -10.444 -28.153 1.00 0.00 H new ATOM 0 HA ASN C 144 20.574 -8.822 -29.228 1.00 0.00 H new ATOM 0 HB2 ASN C 144 20.646 -11.147 -30.594 1.00 0.00 H new ATOM 0 HB3 ASN C 144 19.738 -10.258 -31.801 1.00 0.00 H new ATOM 0 HD21 ASN C 144 22.562 -8.002 -32.538 1.00 0.00 H new ATOM 0 HD22 ASN C 144 20.796 -8.042 -32.490 1.00 0.00 H new ATOM 855 N ASP C 145 18.101 -7.500 -29.709 1.00 0.00 N ATOM 856 CA ASP C 145 17.362 -6.300 -30.269 1.00 0.00 C ATOM 857 C ASP C 145 18.175 -5.000 -30.031 1.00 0.00 C ATOM 858 O ASP C 145 17.778 -3.934 -30.477 1.00 0.00 O ATOM 859 CB ASP C 145 15.961 -6.250 -29.577 1.00 0.00 C ATOM 860 CG ASP C 145 16.079 -5.928 -28.123 1.00 0.00 C ATOM 861 OD1 ASP C 145 16.075 -4.804 -27.757 1.00 0.00 O ATOM 862 OD2 ASP C 145 16.180 -6.785 -27.361 1.00 0.00 O1- ATOM 0 H ASP C 145 17.843 -7.777 -28.762 1.00 0.00 H new ATOM 0 HA ASP C 145 17.233 -6.388 -31.348 1.00 0.00 H new ATOM 0 HB2 ASP C 145 15.339 -5.501 -30.067 1.00 0.00 H new ATOM 0 HB3 ASP C 145 15.460 -7.210 -29.698 1.00 0.00 H new ATOM 867 N GLY C 146 19.321 -5.079 -29.354 1.00 0.00 N ATOM 868 CA GLY C 146 20.217 -3.869 -29.156 1.00 0.00 C ATOM 869 C GLY C 146 19.639 -2.829 -28.171 1.00 0.00 C ATOM 870 O GLY C 146 20.328 -1.907 -27.782 1.00 0.00 O ATOM 0 H GLY C 146 19.673 -5.937 -28.929 1.00 0.00 H new ATOM 0 HA2 GLY C 146 21.189 -4.202 -28.791 1.00 0.00 H new ATOM 0 HA3 GLY C 146 20.386 -3.390 -30.120 1.00 0.00 H new ATOM 874 N ARG C 147 18.401 -2.949 -27.776 1.00 0.00 N ATOM 875 CA ARG C 147 17.781 -1.943 -26.854 1.00 0.00 C ATOM 876 C ARG C 147 17.433 -2.656 -25.566 1.00 0.00 C ATOM 877 O ARG C 147 17.140 -3.864 -25.582 1.00 0.00 O ATOM 878 CB ARG C 147 16.442 -1.600 -27.524 1.00 0.00 C ATOM 879 CG ARG C 147 16.629 -0.973 -28.915 1.00 0.00 C ATOM 880 CD ARG C 147 15.240 -0.678 -29.530 1.00 0.00 C ATOM 881 NE ARG C 147 14.540 -2.036 -29.591 1.00 0.00 N ATOM 882 CZ ARG C 147 13.562 -2.335 -28.730 1.00 0.00 C ATOM 883 NH1 ARG C 147 12.465 -1.627 -28.710 1.00 0.00 N ATOM 884 NH2 ARG C 147 13.702 -3.345 -27.905 1.00 0.00 N1+ ATOM 0 H ARG C 147 17.781 -3.710 -28.054 1.00 0.00 H new ATOM 0 HA ARG C 147 18.425 -1.083 -26.667 1.00 0.00 H new ATOM 0 HB2 ARG C 147 15.841 -2.505 -27.614 1.00 0.00 H new ATOM 0 HB3 ARG C 147 15.887 -0.910 -26.889 1.00 0.00 H new ATOM 0 HG2 ARG C 147 17.209 -0.053 -28.838 1.00 0.00 H new ATOM 0 HG3 ARG C 147 17.189 -1.650 -29.560 1.00 0.00 H new ATOM 0 HD2 ARG C 147 14.679 0.028 -28.918 1.00 0.00 H new ATOM 0 HD3 ARG C 147 15.333 -0.237 -30.522 1.00 0.00 H new ATOM 0 HE ARG C 147 14.821 -2.719 -30.294 1.00 0.00 H new ATOM 0 HH11 ARG C 147 12.352 -0.843 -29.353 1.00 0.00 H new ATOM 0 HH12 ARG C 147 11.721 -1.858 -28.052 1.00 0.00 H new ATOM 0 HH21 ARG C 147 14.557 -3.902 -27.921 1.00 0.00 H new ATOM 0 HH22 ARG C 147 12.956 -3.574 -27.248 1.00 0.00 H new ATOM 898 N ILE C 148 17.245 -1.946 -24.505 1.00 0.00 N ATOM 899 CA ILE C 148 16.661 -2.613 -23.327 1.00 0.00 C ATOM 900 C ILE C 148 15.217 -2.151 -23.271 1.00 0.00 C ATOM 901 O ILE C 148 14.925 -0.970 -23.067 1.00 0.00 O ATOM 902 CB ILE C 148 17.462 -2.153 -22.080 1.00 0.00 C ATOM 903 CG1 ILE C 148 18.963 -2.471 -22.242 1.00 0.00 C ATOM 904 CG2 ILE C 148 16.941 -2.886 -20.844 1.00 0.00 C ATOM 905 CD1 ILE C 148 19.163 -3.953 -22.612 1.00 0.00 C ATOM 0 H ILE C 148 17.464 -0.955 -24.401 1.00 0.00 H new ATOM 0 HA ILE C 148 16.702 -3.701 -23.370 1.00 0.00 H new ATOM 0 HB ILE C 148 17.335 -1.076 -21.970 1.00 0.00 H new ATOM 0 HG12 ILE C 148 19.394 -1.835 -23.016 1.00 0.00 H new ATOM 0 HG13 ILE C 148 19.490 -2.247 -21.315 1.00 0.00 H new ATOM 0 HG21 ILE C 148 17.502 -2.564 -19.967 1.00 0.00 H new ATOM 0 HG22 ILE C 148 15.885 -2.657 -20.703 1.00 0.00 H new ATOM 0 HG23 ILE C 148 17.064 -3.961 -20.979 1.00 0.00 H new ATOM 0 HD11 ILE C 148 20.227 -4.160 -22.722 1.00 0.00 H new ATOM 0 HD12 ILE C 148 18.751 -4.584 -21.824 1.00 0.00 H new ATOM 0 HD13 ILE C 148 18.653 -4.166 -23.551 1.00 0.00 H new ATOM 917 N ASP C 149 14.319 -3.060 -23.487 1.00 0.00 N ATOM 918 CA ASP C 149 12.876 -2.728 -23.447 1.00 0.00 C ATOM 919 C ASP C 149 12.446 -2.848 -22.005 1.00 0.00 C ATOM 920 O ASP C 149 13.225 -3.312 -21.158 1.00 0.00 O ATOM 921 CB ASP C 149 12.173 -3.788 -24.308 1.00 0.00 C ATOM 922 CG ASP C 149 11.182 -3.118 -25.218 1.00 0.00 C ATOM 923 OD1 ASP C 149 10.181 -2.656 -24.731 1.00 0.00 O1- ATOM 924 OD2 ASP C 149 11.451 -3.065 -26.412 1.00 0.00 O ATOM 0 H ASP C 149 14.527 -4.037 -23.693 1.00 0.00 H new ATOM 0 HA ASP C 149 12.643 -1.729 -23.817 1.00 0.00 H new ATOM 0 HB2 ASP C 149 12.907 -4.340 -24.895 1.00 0.00 H new ATOM 0 HB3 ASP C 149 11.666 -4.512 -23.670 1.00 0.00 H new ATOM 929 N TYR C 150 11.265 -2.430 -21.688 1.00 0.00 N ATOM 930 CA TYR C 150 10.814 -2.502 -20.252 1.00 0.00 C ATOM 931 C TYR C 150 11.019 -3.929 -19.708 1.00 0.00 C ATOM 932 O TYR C 150 11.613 -4.116 -18.656 1.00 0.00 O ATOM 933 CB TYR C 150 9.310 -2.173 -20.321 1.00 0.00 C ATOM 934 CG TYR C 150 8.691 -2.230 -18.947 1.00 0.00 C ATOM 935 CD1 TYR C 150 8.733 -1.119 -18.103 1.00 0.00 C ATOM 936 CD2 TYR C 150 8.050 -3.402 -18.529 1.00 0.00 C ATOM 937 CE1 TYR C 150 8.146 -1.188 -16.836 1.00 0.00 C ATOM 938 CE2 TYR C 150 7.461 -3.465 -17.272 1.00 0.00 C ATOM 939 CZ TYR C 150 7.502 -2.364 -16.425 1.00 0.00 C ATOM 940 OH TYR C 150 6.899 -2.435 -15.190 1.00 0.00 O ATOM 0 H TYR C 150 10.585 -2.042 -22.342 1.00 0.00 H new ATOM 0 HA TYR C 150 11.366 -1.827 -19.598 1.00 0.00 H new ATOM 0 HB2 TYR C 150 9.169 -1.180 -20.749 1.00 0.00 H new ATOM 0 HB3 TYR C 150 8.808 -2.879 -20.982 1.00 0.00 H new ATOM 0 HD1 TYR C 150 9.217 -0.210 -18.427 1.00 0.00 H new ATOM 0 HD2 TYR C 150 8.013 -4.259 -19.185 1.00 0.00 H new ATOM 0 HE1 TYR C 150 8.189 -0.336 -16.174 1.00 0.00 H new ATOM 0 HE2 TYR C 150 6.970 -4.372 -16.952 1.00 0.00 H new ATOM 0 HH TYR C 150 7.575 -2.323 -14.489 1.00 0.00 H new ATOM 950 N ASP C 151 10.589 -4.928 -20.450 1.00 0.00 N ATOM 951 CA ASP C 151 10.762 -6.358 -20.001 1.00 0.00 C ATOM 952 C ASP C 151 12.250 -6.705 -19.830 1.00 0.00 C ATOM 953 O ASP C 151 12.639 -7.364 -18.874 1.00 0.00 O ATOM 954 CB ASP C 151 10.167 -7.206 -21.138 1.00 0.00 C ATOM 955 CG ASP C 151 9.905 -8.604 -20.633 1.00 0.00 C ATOM 956 OD1 ASP C 151 8.867 -8.803 -20.041 1.00 0.00 O ATOM 957 OD2 ASP C 151 10.729 -9.455 -20.846 1.00 0.00 O1- ATOM 0 H ASP C 151 10.124 -4.817 -21.351 1.00 0.00 H new ATOM 0 HA ASP C 151 10.278 -6.535 -19.041 1.00 0.00 H new ATOM 0 HB2 ASP C 151 9.241 -6.757 -21.496 1.00 0.00 H new ATOM 0 HB3 ASP C 151 10.854 -7.235 -21.983 1.00 0.00 H new ATOM 962 N GLU C 152 13.098 -6.250 -20.740 1.00 0.00 N ATOM 963 CA GLU C 152 14.569 -6.559 -20.620 1.00 0.00 C ATOM 964 C GLU C 152 15.136 -5.836 -19.403 1.00 0.00 C ATOM 965 O GLU C 152 15.992 -6.354 -18.698 1.00 0.00 O ATOM 966 CB GLU C 152 15.233 -5.996 -21.896 1.00 0.00 C ATOM 967 CG GLU C 152 14.695 -6.701 -23.159 1.00 0.00 C ATOM 968 CD GLU C 152 15.492 -6.241 -24.354 1.00 0.00 C ATOM 969 OE1 GLU C 152 16.505 -6.759 -24.603 1.00 0.00 O ATOM 970 OE2 GLU C 152 15.112 -5.347 -25.017 1.00 0.00 O1- ATOM 0 H GLU C 152 12.837 -5.686 -21.549 1.00 0.00 H new ATOM 0 HA GLU C 152 14.747 -7.629 -20.510 1.00 0.00 H new ATOM 0 HB2 GLU C 152 15.044 -4.925 -21.965 1.00 0.00 H new ATOM 0 HB3 GLU C 152 16.313 -6.126 -21.835 1.00 0.00 H new ATOM 0 HG2 GLU C 152 14.772 -7.783 -23.048 1.00 0.00 H new ATOM 0 HG3 GLU C 152 13.639 -6.470 -23.299 1.00 0.00 H new ATOM 977 N PHE C 153 14.705 -4.617 -19.184 1.00 0.00 N ATOM 978 CA PHE C 153 15.253 -3.817 -18.059 1.00 0.00 C ATOM 979 C PHE C 153 14.929 -4.442 -16.699 1.00 0.00 C ATOM 980 O PHE C 153 15.759 -4.422 -15.806 1.00 0.00 O ATOM 981 CB PHE C 153 14.649 -2.434 -18.179 1.00 0.00 C ATOM 982 CG PHE C 153 15.337 -1.563 -17.172 1.00 0.00 C ATOM 983 CD1 PHE C 153 16.559 -0.970 -17.486 1.00 0.00 C ATOM 984 CD2 PHE C 153 14.768 -1.378 -15.924 1.00 0.00 C ATOM 985 CE1 PHE C 153 17.213 -0.189 -16.538 1.00 0.00 C ATOM 986 CE2 PHE C 153 15.415 -0.599 -14.976 1.00 0.00 C ATOM 987 CZ PHE C 153 16.640 -0.001 -15.279 1.00 0.00 C ATOM 0 H PHE C 153 13.994 -4.145 -19.742 1.00 0.00 H new ATOM 0 HA PHE C 153 16.341 -3.780 -18.116 1.00 0.00 H new ATOM 0 HB2 PHE C 153 14.786 -2.040 -19.186 1.00 0.00 H new ATOM 0 HB3 PHE C 153 13.576 -2.465 -17.992 1.00 0.00 H new ATOM 0 HD1 PHE C 153 16.997 -1.116 -18.462 1.00 0.00 H new ATOM 0 HD2 PHE C 153 13.821 -1.840 -15.688 1.00 0.00 H new ATOM 0 HE1 PHE C 153 18.161 0.270 -16.776 1.00 0.00 H new ATOM 0 HE2 PHE C 153 14.971 -0.455 -14.002 1.00 0.00 H new ATOM 0 HZ PHE C 153 17.143 0.606 -14.541 1.00 0.00 H new ATOM 997 N LEU C 154 13.724 -4.959 -16.514 1.00 0.00 N ATOM 998 CA LEU C 154 13.341 -5.539 -15.162 1.00 0.00 C ATOM 999 C LEU C 154 14.394 -6.556 -14.698 1.00 0.00 C ATOM 1000 O LEU C 154 14.576 -6.754 -13.510 1.00 0.00 O ATOM 1001 CB LEU C 154 11.991 -6.264 -15.364 1.00 0.00 C ATOM 1002 CG LEU C 154 10.873 -5.285 -15.777 1.00 0.00 C ATOM 1003 CD1 LEU C 154 9.570 -6.060 -15.928 1.00 0.00 C ATOM 1004 CD2 LEU C 154 10.679 -4.221 -14.692 1.00 0.00 C ATOM 0 H LEU C 154 12.996 -5.006 -17.227 1.00 0.00 H new ATOM 0 HA LEU C 154 13.274 -4.753 -14.410 1.00 0.00 H new ATOM 0 HB2 LEU C 154 12.102 -7.033 -16.129 1.00 0.00 H new ATOM 0 HB3 LEU C 154 11.708 -6.770 -14.441 1.00 0.00 H new ATOM 0 HG LEU C 154 11.148 -4.804 -16.716 1.00 0.00 H new ATOM 0 HD11 LEU C 154 8.772 -5.377 -16.220 1.00 0.00 H new ATOM 0 HD12 LEU C 154 9.689 -6.827 -16.693 1.00 0.00 H new ATOM 0 HD13 LEU C 154 9.315 -6.531 -14.979 1.00 0.00 H new ATOM 0 HD21 LEU C 154 9.888 -3.535 -14.993 1.00 0.00 H new ATOM 0 HD22 LEU C 154 10.404 -4.704 -13.754 1.00 0.00 H new ATOM 0 HD23 LEU C 154 11.608 -3.667 -14.556 1.00 0.00 H new ATOM 1016 N GLU C 155 15.021 -7.256 -15.614 1.00 0.00 N ATOM 1017 CA GLU C 155 16.045 -8.297 -15.239 1.00 0.00 C ATOM 1018 C GLU C 155 17.301 -7.663 -14.568 1.00 0.00 C ATOM 1019 O GLU C 155 17.919 -8.276 -13.721 1.00 0.00 O ATOM 1020 CB GLU C 155 16.458 -8.927 -16.575 1.00 0.00 C ATOM 1021 CG GLU C 155 15.258 -9.653 -17.221 1.00 0.00 C ATOM 1022 CD GLU C 155 14.718 -10.724 -16.300 1.00 0.00 C ATOM 1023 OE1 GLU C 155 15.467 -11.600 -15.946 1.00 0.00 O1- ATOM 1024 OE2 GLU C 155 13.566 -10.680 -15.998 1.00 0.00 O ATOM 0 H GLU C 155 14.869 -7.153 -16.617 1.00 0.00 H new ATOM 0 HA GLU C 155 15.634 -9.009 -14.524 1.00 0.00 H new ATOM 0 HB2 GLU C 155 16.830 -8.155 -17.249 1.00 0.00 H new ATOM 0 HB3 GLU C 155 17.274 -9.631 -16.415 1.00 0.00 H new ATOM 0 HG2 GLU C 155 14.472 -8.933 -17.449 1.00 0.00 H new ATOM 0 HG3 GLU C 155 15.564 -10.101 -18.166 1.00 0.00 H new ATOM 1031 N PHE C 156 17.724 -6.486 -15.014 1.00 0.00 N ATOM 1032 CA PHE C 156 19.036 -5.870 -14.509 1.00 0.00 C ATOM 1033 C PHE C 156 19.103 -5.743 -12.976 1.00 0.00 C ATOM 1034 O PHE C 156 20.116 -6.039 -12.377 1.00 0.00 O ATOM 1035 CB PHE C 156 19.080 -4.434 -15.091 1.00 0.00 C ATOM 1036 CG PHE C 156 19.669 -4.380 -16.490 1.00 0.00 C ATOM 1037 CD1 PHE C 156 20.938 -4.921 -16.746 1.00 0.00 C ATOM 1038 CD2 PHE C 156 18.964 -3.740 -17.516 1.00 0.00 C ATOM 1039 CE1 PHE C 156 21.488 -4.827 -18.024 1.00 0.00 C ATOM 1040 CE2 PHE C 156 19.524 -3.640 -18.792 1.00 0.00 C ATOM 1041 CZ PHE C 156 20.785 -4.184 -19.045 1.00 0.00 C ATOM 0 H PHE C 156 17.226 -5.921 -15.702 1.00 0.00 H new ATOM 0 HA PHE C 156 19.862 -6.511 -14.816 1.00 0.00 H new ATOM 0 HB2 PHE C 156 18.070 -4.025 -15.112 1.00 0.00 H new ATOM 0 HB3 PHE C 156 19.668 -3.798 -14.430 1.00 0.00 H new ATOM 0 HD1 PHE C 156 21.488 -5.409 -15.955 1.00 0.00 H new ATOM 0 HD2 PHE C 156 17.987 -3.323 -17.321 1.00 0.00 H new ATOM 0 HE1 PHE C 156 22.460 -5.253 -18.225 1.00 0.00 H new ATOM 0 HE2 PHE C 156 18.982 -3.142 -19.582 1.00 0.00 H new ATOM 0 HZ PHE C 156 21.217 -4.107 -20.032 1.00 0.00 H new ATOM 1051 N MET C 157 18.098 -5.171 -12.361 1.00 0.00 N ATOM 1052 CA MET C 157 18.203 -4.865 -10.884 1.00 0.00 C ATOM 1053 C MET C 157 17.458 -5.889 -9.990 1.00 0.00 C ATOM 1054 O MET C 157 17.165 -5.605 -8.849 1.00 0.00 O ATOM 1055 CB MET C 157 17.653 -3.429 -10.721 1.00 0.00 C ATOM 1056 CG MET C 157 18.611 -2.410 -11.385 1.00 0.00 C ATOM 1057 SD MET C 157 20.190 -2.351 -10.493 1.00 0.00 S ATOM 1058 CE MET C 157 19.571 -1.588 -8.969 1.00 0.00 C ATOM 0 H MET C 157 17.218 -4.903 -12.802 1.00 0.00 H new ATOM 0 HA MET C 157 19.237 -4.940 -10.548 1.00 0.00 H new ATOM 0 HB2 MET C 157 16.664 -3.357 -11.173 1.00 0.00 H new ATOM 0 HB3 MET C 157 17.537 -3.194 -9.663 1.00 0.00 H new ATOM 0 HG2 MET C 157 18.784 -2.688 -12.425 1.00 0.00 H new ATOM 0 HG3 MET C 157 18.153 -1.421 -11.391 1.00 0.00 H new ATOM 0 HE1 MET C 157 20.328 -1.667 -8.189 1.00 0.00 H new ATOM 0 HE2 MET C 157 19.348 -0.537 -9.153 1.00 0.00 H new ATOM 0 HE3 MET C 157 18.664 -2.101 -8.648 1.00 0.00 H new ATOM 1068 N LYS C 158 17.141 -7.074 -10.485 1.00 0.00 N ATOM 1069 CA LYS C 158 16.441 -8.077 -9.586 1.00 0.00 C ATOM 1070 C LYS C 158 17.322 -8.472 -8.375 1.00 0.00 C ATOM 1071 O LYS C 158 16.811 -8.651 -7.272 1.00 0.00 O ATOM 1072 CB LYS C 158 16.078 -9.304 -10.445 1.00 0.00 C ATOM 1073 CG LYS C 158 15.011 -8.887 -11.461 1.00 0.00 C ATOM 1074 CD LYS C 158 14.452 -10.119 -12.210 1.00 0.00 C ATOM 1075 CE LYS C 158 13.411 -9.694 -13.300 1.00 0.00 C ATOM 1076 NZ LYS C 158 12.679 -8.510 -12.750 1.00 0.00 N1+ ATOM 0 H LYS C 158 17.327 -7.386 -11.438 1.00 0.00 H new ATOM 0 HA LYS C 158 15.538 -7.633 -9.168 1.00 0.00 H new ATOM 0 HB2 LYS C 158 16.962 -9.682 -10.958 1.00 0.00 H new ATOM 0 HB3 LYS C 158 15.706 -10.111 -9.814 1.00 0.00 H new ATOM 0 HG2 LYS C 158 14.200 -8.368 -10.950 1.00 0.00 H new ATOM 0 HG3 LYS C 158 15.439 -8.185 -12.176 1.00 0.00 H new ATOM 0 HD2 LYS C 158 15.271 -10.665 -12.678 1.00 0.00 H new ATOM 0 HD3 LYS C 158 13.981 -10.798 -11.499 1.00 0.00 H new ATOM 0 HE2 LYS C 158 13.910 -9.441 -14.235 1.00 0.00 H new ATOM 0 HE3 LYS C 158 12.722 -10.510 -13.517 1.00 0.00 H new ATOM 0 HZ1 LYS C 158 11.801 -8.365 -13.287 1.00 0.00 H new ATOM 0 HZ2 LYS C 158 12.449 -8.678 -11.750 1.00 0.00 H new ATOM 0 HZ3 LYS C 158 13.278 -7.664 -12.830 1.00 0.00 H new ATOM 1090 N ASP C 159 18.632 -8.590 -8.548 1.00 0.00 N ATOM 1091 CA ASP C 159 19.498 -8.949 -7.366 1.00 0.00 C ATOM 1092 C ASP C 159 20.069 -7.667 -6.733 1.00 0.00 C ATOM 1093 O ASP C 159 21.274 -7.457 -6.679 1.00 0.00 O ATOM 1094 CB ASP C 159 20.627 -9.849 -7.902 1.00 0.00 C ATOM 1095 CG ASP C 159 21.224 -10.608 -6.732 1.00 0.00 C ATOM 1096 OD1 ASP C 159 22.135 -10.107 -6.123 1.00 0.00 O ATOM 1097 OD2 ASP C 159 20.738 -11.672 -6.432 1.00 0.00 O1- ATOM 0 H ASP C 159 19.124 -8.457 -9.432 1.00 0.00 H new ATOM 0 HA ASP C 159 18.931 -9.470 -6.595 1.00 0.00 H new ATOM 0 HB2 ASP C 159 20.238 -10.543 -8.647 1.00 0.00 H new ATOM 0 HB3 ASP C 159 21.391 -9.248 -8.395 1.00 0.00 H new ATOM 1102 N VAL C 160 19.213 -6.811 -6.261 1.00 0.00 N ATOM 1103 CA VAL C 160 19.670 -5.547 -5.609 1.00 0.00 C ATOM 1104 C VAL C 160 19.062 -5.490 -4.214 1.00 0.00 C ATOM 1105 O VAL C 160 17.906 -5.877 -4.020 1.00 0.00 O ATOM 1106 CB VAL C 160 19.135 -4.410 -6.501 1.00 0.00 C ATOM 1107 CG1 VAL C 160 19.585 -3.058 -5.938 1.00 0.00 C ATOM 1108 CG2 VAL C 160 19.701 -4.560 -7.920 1.00 0.00 C ATOM 0 H VAL C 160 18.201 -6.931 -6.297 1.00 0.00 H new ATOM 0 HA VAL C 160 20.753 -5.474 -5.507 1.00 0.00 H new ATOM 0 HB VAL C 160 18.046 -4.461 -6.525 1.00 0.00 H new ATOM 0 HG11 VAL C 160 19.205 -2.256 -6.571 1.00 0.00 H new ATOM 0 HG12 VAL C 160 19.196 -2.937 -4.927 1.00 0.00 H new ATOM 0 HG13 VAL C 160 20.674 -3.018 -5.915 1.00 0.00 H new ATOM 0 HG21 VAL C 160 19.322 -3.755 -8.550 1.00 0.00 H new ATOM 0 HG22 VAL C 160 20.789 -4.511 -7.885 1.00 0.00 H new ATOM 0 HG23 VAL C 160 19.394 -5.520 -8.334 1.00 0.00 H new ATOM 1118 N GLU C 161 19.808 -5.072 -3.234 1.00 0.00 N ATOM 1119 CA GLU C 161 19.256 -5.027 -1.853 1.00 0.00 C ATOM 1120 C GLU C 161 18.500 -3.694 -1.674 1.00 0.00 C ATOM 1121 O GLU C 161 19.062 -2.667 -1.987 1.00 0.00 O ATOM 1122 CB GLU C 161 20.481 -5.093 -0.927 1.00 0.00 C ATOM 1123 CG GLU C 161 20.021 -5.357 0.512 1.00 0.00 C ATOM 1124 CD GLU C 161 21.201 -5.257 1.446 1.00 0.00 C ATOM 1125 OE1 GLU C 161 21.582 -4.155 1.775 1.00 0.00 O1- ATOM 1126 OE2 GLU C 161 21.728 -6.279 1.809 1.00 0.00 O ATOM 1127 OXT GLU C 161 17.372 -3.717 -1.250 1.00 0.00 O ATOM 0 H GLU C 161 20.775 -4.760 -3.328 1.00 0.00 H new ATOM 0 HA GLU C 161 18.560 -5.838 -1.638 1.00 0.00 H new ATOM 0 HB2 GLU C 161 21.156 -5.884 -1.255 1.00 0.00 H new ATOM 0 HB3 GLU C 161 21.038 -4.157 -0.976 1.00 0.00 H new ATOM 0 HG2 GLU C 161 19.256 -4.636 0.798 1.00 0.00 H new ATOM 0 HG3 GLU C 161 19.570 -6.346 0.585 1.00 0.00 H new TER 1134 GLU C 161 HETATM 1135 CA CA C 201 16.759 -5.600 -26.067 1.00 0.00 CA HETATM 1136 CA CA C 202 14.265 5.290 -25.204 1.00 0.00 CA