USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1063 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 LYS NZ :NH3+ 158:sc= -0.0113 (180deg=0) USER MOD Set 1.2: A 84 MET CE :methyl -149:sc= -1.4 (180deg=-1.15) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= -0.0677 (180deg=-0.0677) USER MOD Single : A 7 TYR OH : rot -90:sc= -0.829 USER MOD Single : A 13 LYS NZ :NH3+ 171:sc= -2.12 (180deg=-2.37) USER MOD Single : A 24 LYS NZ :NH3+ -147:sc= -0.332 (180deg=-1.34!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -123:sc= -0.555 (180deg=-2.06!) USER MOD Single : A 34 TYR OH : rot -116:sc= 0.38 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 129:sc= -1.81 USER MOD Single : A 47 THR OG1 : rot 180:sc= -2 USER MOD Single : A 49 GLN : amide:sc= -0.116 X(o=-0.12,f=0.0037) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -126:sc= -0.118 (180deg=-2.08!) USER MOD Single : A 58 HIS : no HE2:sc= -1.59 K(o=-1.6,f=-5.4!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -112:sc= 0.359 (180deg=-0.381) USER MOD Single : A 62 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.7!) USER MOD Single : A 68 CYS SG : rot -167:sc= -0.197 USER MOD Single : A 69 THR OG1 : rot -150:sc= -0.294 USER MOD Single : A 80 TYR OH : rot 30:sc= -0.049 USER MOD Single : A 93 GLN : amide:sc= -4.06 K(o=-4.1,f=-7.2!) USER MOD Single : A 94 SER OG : rot 89:sc= -0.735 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 153:sc= -0.0632 (180deg=-0.489) USER MOD Single : A 101 SER OG : rot -50:sc= 0.873 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 105 ASN : amide:sc= -0.144 X(o=-0.14,f=-0.022) USER MOD Single : A 108 SER OG : rot -10:sc= 0.961 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 120:sc= -0.27 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 143:sc= 0.563! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.167 K(o=-0.17,f=-1.1) USER MOD Single : A 143 LYS NZ :NH3+ 158:sc= -0.28 (180deg=-1.08!) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -2.616 12.892 3.629 1.00 0.00 N ATOM 22 CA LEU A 4 -3.199 11.983 2.647 1.00 0.00 C ATOM 23 C LEU A 4 -3.917 12.766 1.550 1.00 0.00 C ATOM 24 O LEU A 4 -4.034 12.303 0.417 1.00 0.00 O ATOM 25 CB LEU A 4 -4.169 11.014 3.328 1.00 0.00 C ATOM 26 CG LEU A 4 -3.592 9.629 3.627 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.472 8.885 4.619 1.00 0.00 C ATOM 28 CD2 LEU A 4 -3.439 8.829 2.341 1.00 0.00 C ATOM 0 HA LEU A 4 -2.393 11.408 2.190 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.508 11.460 4.263 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.047 10.896 2.694 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.606 9.755 4.074 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.045 7.902 4.819 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.531 9.451 5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.472 8.768 4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.027 7.846 2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.414 8.712 1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.766 9.355 1.663 1.00 0.00 H new ATOM 40 N ASP A 5 -4.395 13.956 1.899 1.00 0.00 N ATOM 41 CA ASP A 5 -5.099 14.813 0.959 1.00 0.00 C ATOM 42 C ASP A 5 -4.297 15.035 -0.316 1.00 0.00 C ATOM 43 O ASP A 5 -4.819 14.915 -1.424 1.00 0.00 O ATOM 44 CB ASP A 5 -5.368 16.160 1.617 1.00 0.00 C ATOM 45 CG ASP A 5 -4.176 16.697 2.391 1.00 0.00 C ATOM 46 OD1 ASP A 5 -3.075 16.122 2.269 1.00 0.00 O ATOM 47 OD2 ASP A 5 -4.346 17.696 3.120 1.00 0.00 O ATOM 0 H ASP A 5 -4.305 14.349 2.836 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.033 14.320 0.689 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -5.650 16.882 0.850 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -6.218 16.064 2.292 1.00 0.00 H new ATOM 52 N LYS A 6 -3.031 15.374 -0.143 1.00 0.00 N ATOM 53 CA LYS A 6 -2.142 15.636 -1.277 1.00 0.00 C ATOM 54 C LYS A 6 -2.179 14.491 -2.287 1.00 0.00 C ATOM 55 O LYS A 6 -1.946 14.700 -3.479 1.00 0.00 O ATOM 56 CB LYS A 6 -0.702 15.860 -0.802 1.00 0.00 C ATOM 57 CG LYS A 6 -0.093 14.651 -0.110 1.00 0.00 C ATOM 58 CD LYS A 6 1.157 14.165 -0.829 1.00 0.00 C ATOM 59 CE LYS A 6 1.492 12.731 -0.453 1.00 0.00 C ATOM 60 NZ LYS A 6 1.887 12.607 0.977 1.00 0.00 N ATOM 0 H LYS A 6 -2.589 15.476 0.771 1.00 0.00 H new ATOM 0 HA LYS A 6 -2.499 16.542 -1.767 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.083 16.127 -1.659 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -0.682 16.708 -0.117 1.00 0.00 H new ATOM 0 HG2 LYS A 6 0.155 14.907 0.920 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -0.827 13.846 -0.070 1.00 0.00 H new ATOM 0 HD2 LYS A 6 1.009 14.235 -1.907 1.00 0.00 H new ATOM 0 HD3 LYS A 6 1.997 14.814 -0.580 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.629 12.094 -0.647 1.00 0.00 H new ATOM 0 HE3 LYS A 6 2.303 12.370 -1.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 2.107 11.613 1.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 2.726 13.194 1.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 1.104 12.927 1.582 1.00 0.00 H new ATOM 74 N TYR A 7 -2.479 13.285 -1.814 1.00 0.00 N ATOM 75 CA TYR A 7 -2.550 12.122 -2.694 1.00 0.00 C ATOM 76 C TYR A 7 -3.622 12.327 -3.760 1.00 0.00 C ATOM 77 O TYR A 7 -3.315 12.499 -4.939 1.00 0.00 O ATOM 78 CB TYR A 7 -2.842 10.852 -1.886 1.00 0.00 C ATOM 79 CG TYR A 7 -3.082 9.617 -2.732 1.00 0.00 C ATOM 80 CD1 TYR A 7 -2.551 9.509 -4.012 1.00 0.00 C ATOM 81 CD2 TYR A 7 -3.837 8.557 -2.244 1.00 0.00 C ATOM 82 CE1 TYR A 7 -2.766 8.381 -4.780 1.00 0.00 C ATOM 83 CE2 TYR A 7 -4.056 7.427 -3.007 1.00 0.00 C ATOM 84 CZ TYR A 7 -3.520 7.344 -4.274 1.00 0.00 C ATOM 85 OH TYR A 7 -3.735 6.219 -5.038 1.00 0.00 O ATOM 0 H TYR A 7 -2.676 13.088 -0.833 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.585 12.005 -3.187 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.004 10.662 -1.215 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -3.718 11.026 -1.261 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -1.961 10.320 -4.413 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.259 8.618 -1.252 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -2.345 8.312 -5.772 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -4.645 6.612 -2.613 1.00 0.00 H new ATOM 0 HH TYR A 7 -4.550 6.335 -5.569 1.00 0.00 H new ATOM 135 N ILE A 11 -10.579 10.076 -4.586 1.00 0.00 N ATOM 136 CA ILE A 11 -10.808 8.695 -4.183 1.00 0.00 C ATOM 137 C ILE A 11 -11.639 8.630 -2.905 1.00 0.00 C ATOM 138 O ILE A 11 -11.134 8.878 -1.810 1.00 0.00 O ATOM 139 CB ILE A 11 -9.475 7.945 -3.967 1.00 0.00 C ATOM 140 CG1 ILE A 11 -8.629 8.006 -5.241 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.732 6.499 -3.566 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.143 7.894 -4.995 1.00 0.00 C ATOM 0 HA ILE A 11 -11.356 8.211 -4.991 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.928 8.429 -3.158 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.938 7.203 -5.910 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.832 8.945 -5.756 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.781 5.988 -3.419 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.305 6.475 -2.639 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -10.295 5.998 -4.353 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.612 7.946 -5.945 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.818 8.712 -4.353 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.925 6.943 -4.509 1.00 0.00 H new ATOM 154 N GLU A 12 -12.919 8.301 -3.056 1.00 0.00 N ATOM 155 CA GLU A 12 -13.826 8.209 -1.917 1.00 0.00 C ATOM 156 C GLU A 12 -14.068 6.754 -1.523 1.00 0.00 C ATOM 157 O GLU A 12 -14.342 6.455 -0.362 1.00 0.00 O ATOM 158 CB GLU A 12 -15.156 8.887 -2.244 1.00 0.00 C ATOM 159 CG GLU A 12 -15.703 8.528 -3.616 1.00 0.00 C ATOM 160 CD GLU A 12 -17.161 8.910 -3.782 1.00 0.00 C ATOM 161 OE1 GLU A 12 -17.430 10.055 -4.204 1.00 0.00 O ATOM 162 OE2 GLU A 12 -18.033 8.064 -3.492 1.00 0.00 O ATOM 0 H GLU A 12 -13.351 8.094 -3.956 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.360 8.720 -1.074 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.890 8.612 -1.487 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.027 9.968 -2.185 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.111 9.029 -4.381 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.592 7.456 -3.778 1.00 0.00 H new ATOM 169 N LYS A 13 -13.969 5.854 -2.497 1.00 0.00 N ATOM 170 CA LYS A 13 -14.184 4.431 -2.243 1.00 0.00 C ATOM 171 C LYS A 13 -13.077 3.588 -2.870 1.00 0.00 C ATOM 172 O LYS A 13 -12.532 3.938 -3.917 1.00 0.00 O ATOM 173 CB LYS A 13 -15.542 3.995 -2.795 1.00 0.00 C ATOM 174 CG LYS A 13 -16.716 4.739 -2.178 1.00 0.00 C ATOM 175 CD LYS A 13 -17.945 3.850 -2.073 1.00 0.00 C ATOM 176 CE LYS A 13 -19.220 4.626 -2.360 1.00 0.00 C ATOM 177 NZ LYS A 13 -19.379 5.791 -1.447 1.00 0.00 N ATOM 0 H LYS A 13 -13.743 6.082 -3.465 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.166 4.276 -1.164 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.552 4.148 -3.874 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.669 2.926 -2.623 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.440 5.099 -1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -16.950 5.616 -2.782 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.857 3.021 -2.775 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.998 3.417 -1.074 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -19.209 4.973 -3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -20.079 3.963 -2.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -20.174 6.379 -1.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.568 5.453 -0.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.506 6.357 -1.451 1.00 0.00 H new ATOM 191 N LEU A 14 -12.752 2.473 -2.222 1.00 0.00 N ATOM 192 CA LEU A 14 -11.714 1.575 -2.714 1.00 0.00 C ATOM 193 C LEU A 14 -12.328 0.306 -3.297 1.00 0.00 C ATOM 194 O LEU A 14 -13.504 0.016 -3.076 1.00 0.00 O ATOM 195 CB LEU A 14 -10.742 1.215 -1.588 1.00 0.00 C ATOM 196 CG LEU A 14 -10.095 2.407 -0.878 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.482 3.365 -1.888 1.00 0.00 C ATOM 198 CD2 LEU A 14 -11.114 3.128 -0.009 1.00 0.00 C ATOM 0 H LEU A 14 -13.194 2.170 -1.354 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.167 2.090 -3.503 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.274 0.617 -0.848 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.953 0.585 -1.999 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.299 2.031 -0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.027 4.205 -1.363 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.720 2.844 -2.468 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.259 3.733 -2.558 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -10.636 3.972 0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -11.932 3.489 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.505 2.440 0.741 1.00 0.00 H new ATOM 210 N ARG A 15 -11.527 -0.447 -4.047 1.00 0.00 N ATOM 211 CA ARG A 15 -11.996 -1.683 -4.668 1.00 0.00 C ATOM 212 C ARG A 15 -12.040 -2.842 -3.673 1.00 0.00 C ATOM 213 O ARG A 15 -12.417 -3.956 -4.032 1.00 0.00 O ATOM 214 CB ARG A 15 -11.100 -2.056 -5.849 1.00 0.00 C ATOM 215 CG ARG A 15 -11.357 -1.227 -7.097 1.00 0.00 C ATOM 216 CD ARG A 15 -10.943 -1.972 -8.356 1.00 0.00 C ATOM 217 NE ARG A 15 -12.092 -2.540 -9.058 1.00 0.00 N ATOM 218 CZ ARG A 15 -12.897 -1.836 -9.852 1.00 0.00 C ATOM 219 NH1 ARG A 15 -12.683 -0.541 -10.047 1.00 0.00 N ATOM 220 NH2 ARG A 15 -13.920 -2.430 -10.452 1.00 0.00 N ATOM 0 H ARG A 15 -10.551 -0.223 -4.239 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.012 -1.502 -5.019 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.057 -1.938 -5.554 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.247 -3.110 -6.087 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.415 -0.973 -7.155 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.807 -0.288 -7.031 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.411 -1.292 -9.022 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.248 -2.769 -8.093 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.289 -3.533 -8.933 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.898 -0.079 -9.588 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.303 -0.008 -10.656 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.090 -3.425 -10.305 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.537 -1.892 -11.060 1.00 0.00 H new ATOM 234 N ARG A 16 -11.654 -2.570 -2.426 1.00 0.00 N ATOM 235 CA ARG A 16 -11.643 -3.581 -1.362 1.00 0.00 C ATOM 236 C ARG A 16 -11.355 -4.981 -1.908 1.00 0.00 C ATOM 237 O ARG A 16 -10.198 -5.367 -2.082 1.00 0.00 O ATOM 238 CB ARG A 16 -12.975 -3.553 -0.595 1.00 0.00 C ATOM 239 CG ARG A 16 -13.112 -4.649 0.455 1.00 0.00 C ATOM 240 CD ARG A 16 -11.869 -4.756 1.328 1.00 0.00 C ATOM 241 NE ARG A 16 -12.205 -4.855 2.746 1.00 0.00 N ATOM 242 CZ ARG A 16 -12.609 -5.978 3.335 1.00 0.00 C ATOM 243 NH1 ARG A 16 -12.732 -7.098 2.632 1.00 0.00 N ATOM 244 NH2 ARG A 16 -12.893 -5.983 4.631 1.00 0.00 N ATOM 0 H ARG A 16 -11.341 -1.648 -2.123 1.00 0.00 H new ATOM 0 HA ARG A 16 -10.834 -3.336 -0.674 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.081 -2.583 -0.109 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.794 -3.643 -1.308 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.980 -4.445 1.082 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -13.293 -5.604 -0.038 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.291 -5.631 1.030 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -11.235 -3.884 1.165 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.125 -4.014 3.318 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -12.516 -7.101 1.635 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -13.042 -7.956 3.089 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.802 -5.126 5.176 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -13.203 -6.844 5.082 1.00 0.00 H new ATOM 258 N GLY A 17 -12.413 -5.725 -2.177 1.00 0.00 N ATOM 259 CA GLY A 17 -12.278 -7.069 -2.705 1.00 0.00 C ATOM 260 C GLY A 17 -13.505 -7.486 -3.489 1.00 0.00 C ATOM 261 O GLY A 17 -13.680 -7.085 -4.638 1.00 0.00 O ATOM 0 H GLY A 17 -13.376 -5.420 -2.038 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -11.399 -7.121 -3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.115 -7.768 -1.885 1.00 0.00 H new ATOM 265 N ASP A 18 -14.363 -8.286 -2.862 1.00 0.00 N ATOM 266 CA ASP A 18 -15.583 -8.747 -3.501 1.00 0.00 C ATOM 267 C ASP A 18 -16.335 -7.580 -4.136 1.00 0.00 C ATOM 268 O ASP A 18 -17.025 -7.742 -5.143 1.00 0.00 O ATOM 269 CB ASP A 18 -16.480 -9.455 -2.485 1.00 0.00 C ATOM 270 CG ASP A 18 -16.642 -8.663 -1.203 1.00 0.00 C ATOM 271 OD1 ASP A 18 -17.053 -7.486 -1.280 1.00 0.00 O ATOM 272 OD2 ASP A 18 -16.357 -9.218 -0.122 1.00 0.00 O ATOM 0 H ASP A 18 -14.232 -8.627 -1.910 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.310 -9.452 -4.286 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.461 -9.627 -2.929 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -16.059 -10.433 -2.253 1.00 0.00 H new ATOM 277 N GLY A 19 -16.193 -6.402 -3.534 1.00 0.00 N ATOM 278 CA GLY A 19 -16.857 -5.216 -4.045 1.00 0.00 C ATOM 279 C GLY A 19 -16.053 -3.953 -3.798 1.00 0.00 C ATOM 280 O GLY A 19 -14.888 -3.865 -4.184 1.00 0.00 O ATOM 0 H GLY A 19 -15.628 -6.248 -2.699 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.028 -5.331 -5.115 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.835 -5.119 -3.574 1.00 0.00 H new ATOM 284 N GLU A 20 -16.679 -2.970 -3.158 1.00 0.00 N ATOM 285 CA GLU A 20 -16.021 -1.703 -2.864 1.00 0.00 C ATOM 286 C GLU A 20 -16.474 -1.154 -1.514 1.00 0.00 C ATOM 287 O GLU A 20 -17.542 -1.510 -1.017 1.00 0.00 O ATOM 288 CB GLU A 20 -16.334 -0.688 -3.962 1.00 0.00 C ATOM 289 CG GLU A 20 -15.371 -0.744 -5.135 1.00 0.00 C ATOM 290 CD GLU A 20 -16.049 -0.460 -6.461 1.00 0.00 C ATOM 291 OE1 GLU A 20 -16.632 -1.399 -7.042 1.00 0.00 O ATOM 292 OE2 GLU A 20 -15.998 0.701 -6.917 1.00 0.00 O ATOM 0 H GLU A 20 -17.644 -3.028 -2.833 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.946 -1.878 -2.824 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -17.347 -0.860 -4.326 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.315 0.315 -3.535 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.571 -0.021 -4.978 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.907 -1.730 -5.172 1.00 0.00 H new ATOM 299 N VAL A 21 -15.658 -0.284 -0.928 1.00 0.00 N ATOM 300 CA VAL A 21 -15.983 0.315 0.362 1.00 0.00 C ATOM 301 C VAL A 21 -15.556 1.780 0.417 1.00 0.00 C ATOM 302 O VAL A 21 -14.757 2.235 -0.402 1.00 0.00 O ATOM 303 CB VAL A 21 -15.329 -0.454 1.528 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.675 -1.932 1.453 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.821 -0.254 1.531 1.00 0.00 C ATOM 0 H VAL A 21 -14.769 0.022 -1.324 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.066 0.256 0.470 1.00 0.00 H new ATOM 0 HB VAL A 21 -15.724 -0.056 2.463 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -15.205 -2.458 2.284 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.756 -2.056 1.510 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.312 -2.343 0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.382 -0.806 2.362 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.404 -0.619 0.593 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.595 0.807 1.640 1.00 0.00 H new ATOM 315 N GLU A 22 -16.099 2.513 1.384 1.00 0.00 N ATOM 316 CA GLU A 22 -15.781 3.928 1.544 1.00 0.00 C ATOM 317 C GLU A 22 -14.407 4.120 2.177 1.00 0.00 C ATOM 318 O GLU A 22 -13.924 3.264 2.918 1.00 0.00 O ATOM 319 CB GLU A 22 -16.848 4.616 2.398 1.00 0.00 C ATOM 320 CG GLU A 22 -18.074 5.046 1.609 1.00 0.00 C ATOM 321 CD GLU A 22 -17.951 6.457 1.066 1.00 0.00 C ATOM 322 OE1 GLU A 22 -16.808 6.939 0.919 1.00 0.00 O ATOM 323 OE2 GLU A 22 -18.998 7.079 0.787 1.00 0.00 O ATOM 0 H GLU A 22 -16.762 2.150 2.069 1.00 0.00 H new ATOM 0 HA GLU A 22 -15.765 4.381 0.553 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.157 3.938 3.194 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.409 5.491 2.877 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.230 4.354 0.781 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -18.954 4.982 2.249 1.00 0.00 H new ATOM 330 N VAL A 23 -13.785 5.258 1.878 1.00 0.00 N ATOM 331 CA VAL A 23 -12.467 5.584 2.411 1.00 0.00 C ATOM 332 C VAL A 23 -12.509 5.750 3.930 1.00 0.00 C ATOM 333 O VAL A 23 -11.506 5.545 4.615 1.00 0.00 O ATOM 334 CB VAL A 23 -11.909 6.873 1.770 1.00 0.00 C ATOM 335 CG1 VAL A 23 -10.621 7.310 2.454 1.00 0.00 C ATOM 336 CG2 VAL A 23 -11.682 6.669 0.279 1.00 0.00 C ATOM 0 H VAL A 23 -14.177 5.973 1.265 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.808 4.751 2.165 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.645 7.665 1.904 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.250 8.220 1.983 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.816 7.501 3.509 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.874 6.522 2.360 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.289 7.587 -0.158 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -10.968 5.860 0.127 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -12.627 6.414 -0.201 1.00 0.00 H new ATOM 346 N LYS A 24 -13.672 6.133 4.448 1.00 0.00 N ATOM 347 CA LYS A 24 -13.848 6.340 5.884 1.00 0.00 C ATOM 348 C LYS A 24 -13.354 5.136 6.686 1.00 0.00 C ATOM 349 O LYS A 24 -12.952 5.274 7.841 1.00 0.00 O ATOM 350 CB LYS A 24 -15.320 6.608 6.203 1.00 0.00 C ATOM 351 CG LYS A 24 -15.827 7.936 5.660 1.00 0.00 C ATOM 352 CD LYS A 24 -16.304 8.852 6.777 1.00 0.00 C ATOM 353 CE LYS A 24 -15.148 9.315 7.649 1.00 0.00 C ATOM 354 NZ LYS A 24 -15.028 8.502 8.891 1.00 0.00 N ATOM 0 H LYS A 24 -14.510 6.307 3.893 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.252 7.206 6.171 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.926 5.801 5.791 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.458 6.590 7.284 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.032 8.428 5.100 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -16.645 7.756 4.962 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.808 9.718 6.348 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.037 8.328 7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.219 9.252 7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -15.290 10.363 7.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -14.679 9.101 9.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.960 8.116 9.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.361 7.720 8.731 1.00 0.00 H new ATOM 368 N SER A 25 -13.387 3.959 6.069 1.00 0.00 N ATOM 369 CA SER A 25 -12.940 2.737 6.731 1.00 0.00 C ATOM 370 C SER A 25 -11.467 2.827 7.136 1.00 0.00 C ATOM 371 O SER A 25 -10.989 2.027 7.940 1.00 0.00 O ATOM 372 CB SER A 25 -13.153 1.531 5.814 1.00 0.00 C ATOM 373 OG SER A 25 -14.526 1.360 5.507 1.00 0.00 O ATOM 0 H SER A 25 -13.718 3.825 5.113 1.00 0.00 H new ATOM 0 HA SER A 25 -13.534 2.613 7.636 1.00 0.00 H new ATOM 0 HB2 SER A 25 -12.585 1.665 4.893 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.770 0.631 6.296 1.00 0.00 H new ATOM 0 HG SER A 25 -14.635 0.584 4.918 1.00 0.00 H new ATOM 379 N LEU A 26 -10.753 3.807 6.585 1.00 0.00 N ATOM 380 CA LEU A 26 -9.342 4.001 6.903 1.00 0.00 C ATOM 381 C LEU A 26 -9.155 5.295 7.686 1.00 0.00 C ATOM 382 O LEU A 26 -8.310 6.127 7.354 1.00 0.00 O ATOM 383 CB LEU A 26 -8.494 4.033 5.624 1.00 0.00 C ATOM 384 CG LEU A 26 -8.946 3.092 4.500 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.824 2.900 3.491 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.394 1.749 5.060 1.00 0.00 C ATOM 0 H LEU A 26 -11.130 4.479 5.916 1.00 0.00 H new ATOM 0 HA LEU A 26 -9.010 3.162 7.515 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.490 5.053 5.239 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.465 3.787 5.886 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.798 3.548 3.995 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.158 2.230 2.699 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.553 3.864 3.061 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.956 2.468 3.990 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.709 1.101 4.242 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.566 1.283 5.594 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.228 1.900 5.745 1.00 0.00 H new ATOM 398 N ALA A 27 -9.962 5.453 8.727 1.00 0.00 N ATOM 399 CA ALA A 27 -9.922 6.622 9.570 1.00 0.00 C ATOM 400 C ALA A 27 -9.252 6.309 10.890 1.00 0.00 C ATOM 401 O ALA A 27 -9.887 5.897 11.862 1.00 0.00 O ATOM 402 CB ALA A 27 -11.314 7.133 9.802 1.00 0.00 C ATOM 0 H ALA A 27 -10.663 4.766 9.005 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.339 7.393 9.066 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.276 8.016 10.440 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.770 7.394 8.847 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.909 6.360 10.288 1.00 0.00 H new ATOM 408 N GLY A 28 -7.967 6.515 10.889 1.00 0.00 N ATOM 409 CA GLY A 28 -7.149 6.272 12.065 1.00 0.00 C ATOM 410 C GLY A 28 -6.446 4.931 12.027 1.00 0.00 C ATOM 411 O GLY A 28 -6.589 4.117 12.939 1.00 0.00 O ATOM 0 H GLY A 28 -7.448 6.855 10.080 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.405 7.064 12.154 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.777 6.322 12.955 1.00 0.00 H new ATOM 415 N LYS A 29 -5.679 4.706 10.966 1.00 0.00 N ATOM 416 CA LYS A 29 -4.938 3.466 10.797 1.00 0.00 C ATOM 417 C LYS A 29 -3.799 3.654 9.797 1.00 0.00 C ATOM 418 O LYS A 29 -3.892 4.477 8.887 1.00 0.00 O ATOM 419 CB LYS A 29 -5.885 2.357 10.337 1.00 0.00 C ATOM 420 CG LYS A 29 -6.172 2.364 8.843 1.00 0.00 C ATOM 421 CD LYS A 29 -7.085 1.214 8.447 1.00 0.00 C ATOM 422 CE LYS A 29 -8.423 1.293 9.163 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.400 0.573 10.467 1.00 0.00 N ATOM 0 H LYS A 29 -5.555 5.374 10.205 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.501 3.180 11.754 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.457 1.392 10.609 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.827 2.451 10.877 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.635 3.311 8.565 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.235 2.293 8.291 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.246 1.231 7.369 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.601 0.266 8.682 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.684 2.338 9.330 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -9.200 0.868 8.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.147 -0.151 10.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.474 0.117 10.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.563 1.249 11.240 1.00 0.00 H new ATOM 437 N LEU A 30 -2.725 2.888 9.968 1.00 0.00 N ATOM 438 CA LEU A 30 -1.579 2.982 9.071 1.00 0.00 C ATOM 439 C LEU A 30 -1.902 2.342 7.726 1.00 0.00 C ATOM 440 O LEU A 30 -1.867 1.119 7.583 1.00 0.00 O ATOM 441 CB LEU A 30 -0.352 2.314 9.695 1.00 0.00 C ATOM 442 CG LEU A 30 0.938 2.439 8.882 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.478 3.860 8.953 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.979 1.447 9.381 1.00 0.00 C ATOM 0 H LEU A 30 -2.625 2.200 10.714 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.355 4.036 8.910 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.185 2.746 10.682 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.569 1.256 9.843 1.00 0.00 H new ATOM 0 HG LEU A 30 0.713 2.209 7.841 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.396 3.930 8.369 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.738 4.551 8.550 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.688 4.118 9.991 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.890 1.549 8.792 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.200 1.648 10.429 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.593 0.433 9.279 1.00 0.00 H new ATOM 456 N VAL A 31 -2.225 3.177 6.745 1.00 0.00 N ATOM 457 CA VAL A 31 -2.566 2.697 5.412 1.00 0.00 C ATOM 458 C VAL A 31 -1.318 2.502 4.554 1.00 0.00 C ATOM 459 O VAL A 31 -0.637 3.466 4.202 1.00 0.00 O ATOM 460 CB VAL A 31 -3.526 3.667 4.691 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.159 2.987 3.486 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.598 4.180 5.646 1.00 0.00 C ATOM 0 H VAL A 31 -2.258 4.191 6.848 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.063 1.736 5.544 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.950 4.524 4.341 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.833 3.683 2.988 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.378 2.678 2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.719 2.112 3.815 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.262 4.862 5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.174 3.339 6.032 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.125 4.707 6.475 1.00 0.00 H new ATOM 472 N PHE A 32 -1.026 1.249 4.216 1.00 0.00 N ATOM 473 CA PHE A 32 0.135 0.926 3.394 1.00 0.00 C ATOM 474 C PHE A 32 -0.221 1.001 1.909 1.00 0.00 C ATOM 475 O PHE A 32 -1.392 0.908 1.541 1.00 0.00 O ATOM 476 CB PHE A 32 0.663 -0.468 3.751 1.00 0.00 C ATOM 477 CG PHE A 32 1.467 -0.498 5.019 1.00 0.00 C ATOM 478 CD1 PHE A 32 2.749 0.027 5.055 1.00 0.00 C ATOM 479 CD2 PHE A 32 0.941 -1.054 6.174 1.00 0.00 C ATOM 480 CE1 PHE A 32 3.491 0.000 6.221 1.00 0.00 C ATOM 481 CE2 PHE A 32 1.679 -1.084 7.343 1.00 0.00 C ATOM 482 CZ PHE A 32 2.955 -0.556 7.366 1.00 0.00 C ATOM 0 H PHE A 32 -1.579 0.440 4.500 1.00 0.00 H new ATOM 0 HA PHE A 32 0.918 1.657 3.594 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.179 -1.153 3.848 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.280 -0.835 2.931 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.173 0.462 4.162 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -0.056 -1.468 6.161 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.489 0.413 6.237 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.258 -1.520 8.237 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.533 -0.578 8.278 1.00 0.00 H new ATOM 492 N PHE A 33 0.789 1.180 1.060 1.00 0.00 N ATOM 493 CA PHE A 33 0.566 1.278 -0.380 1.00 0.00 C ATOM 494 C PHE A 33 1.677 0.582 -1.161 1.00 0.00 C ATOM 495 O PHE A 33 2.800 1.079 -1.245 1.00 0.00 O ATOM 496 CB PHE A 33 0.471 2.747 -0.802 1.00 0.00 C ATOM 497 CG PHE A 33 -0.709 3.463 -0.211 1.00 0.00 C ATOM 498 CD1 PHE A 33 -0.706 3.851 1.119 1.00 0.00 C ATOM 499 CD2 PHE A 33 -1.821 3.750 -0.986 1.00 0.00 C ATOM 500 CE1 PHE A 33 -1.791 4.510 1.666 1.00 0.00 C ATOM 501 CE2 PHE A 33 -2.909 4.408 -0.445 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.894 4.788 0.883 1.00 0.00 C ATOM 0 H PHE A 33 1.766 1.260 1.343 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.375 0.777 -0.608 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.385 3.262 -0.506 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.413 2.802 -1.889 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.154 3.636 1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -1.838 3.456 -2.025 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.776 4.807 2.704 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.770 4.625 -1.060 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.744 5.302 1.308 1.00 0.00 H new ATOM 512 N TYR A 34 1.349 -0.572 -1.732 1.00 0.00 N ATOM 513 CA TYR A 34 2.307 -1.349 -2.515 1.00 0.00 C ATOM 514 C TYR A 34 2.212 -0.994 -3.998 1.00 0.00 C ATOM 515 O TYR A 34 1.150 -1.122 -4.607 1.00 0.00 O ATOM 516 CB TYR A 34 2.053 -2.844 -2.317 1.00 0.00 C ATOM 517 CG TYR A 34 3.148 -3.728 -2.869 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.106 -4.180 -4.183 1.00 0.00 C ATOM 519 CD2 TYR A 34 4.221 -4.113 -2.076 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.104 -4.991 -4.689 1.00 0.00 C ATOM 521 CE2 TYR A 34 5.223 -4.923 -2.576 1.00 0.00 C ATOM 522 CZ TYR A 34 5.160 -5.359 -3.883 1.00 0.00 C ATOM 523 OH TYR A 34 6.155 -6.168 -4.385 1.00 0.00 O ATOM 0 H TYR A 34 0.422 -0.993 -1.667 1.00 0.00 H new ATOM 0 HA TYR A 34 3.311 -1.107 -2.168 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.939 -3.046 -1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 34 1.110 -3.109 -2.795 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.281 -3.893 -4.818 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.273 -3.774 -1.052 1.00 0.00 H new ATOM 0 HE1 TYR A 34 4.057 -5.335 -5.712 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.051 -5.213 -1.946 1.00 0.00 H new ATOM 0 HH TYR A 34 6.156 -7.022 -3.904 1.00 0.00 H new ATOM 533 N PHE A 35 3.326 -0.547 -4.572 1.00 0.00 N ATOM 534 CA PHE A 35 3.362 -0.170 -5.984 1.00 0.00 C ATOM 535 C PHE A 35 3.947 -1.288 -6.845 1.00 0.00 C ATOM 536 O PHE A 35 5.079 -1.723 -6.628 1.00 0.00 O ATOM 537 CB PHE A 35 4.179 1.111 -6.168 1.00 0.00 C ATOM 538 CG PHE A 35 3.586 2.305 -5.475 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.804 2.516 -4.123 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.810 3.214 -6.176 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.259 3.613 -3.483 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.263 4.313 -5.541 1.00 0.00 C ATOM 543 CZ PHE A 35 2.488 4.512 -4.193 1.00 0.00 C ATOM 0 H PHE A 35 4.214 -0.437 -4.083 1.00 0.00 H new ATOM 0 HA PHE A 35 2.336 0.006 -6.308 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.188 0.946 -5.791 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.268 1.326 -7.233 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.406 1.816 -3.563 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.631 3.062 -7.230 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.436 3.767 -2.429 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.660 5.015 -6.098 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.061 5.370 -3.695 1.00 0.00 H new ATOM 553 N SER A 36 3.172 -1.749 -7.828 1.00 0.00 N ATOM 554 CA SER A 36 3.619 -2.813 -8.722 1.00 0.00 C ATOM 555 C SER A 36 2.602 -3.056 -9.833 1.00 0.00 C ATOM 556 O SER A 36 1.470 -2.576 -9.765 1.00 0.00 O ATOM 557 CB SER A 36 3.851 -4.103 -7.935 1.00 0.00 C ATOM 558 OG SER A 36 4.613 -5.031 -8.689 1.00 0.00 O ATOM 0 H SER A 36 2.233 -1.401 -8.023 1.00 0.00 H new ATOM 0 HA SER A 36 4.558 -2.499 -9.178 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.368 -3.876 -7.003 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.892 -4.547 -7.668 1.00 0.00 H new ATOM 0 HG SER A 36 4.749 -5.847 -8.163 1.00 0.00 H new ATOM 564 N ALA A 37 3.005 -3.812 -10.853 1.00 0.00 N ATOM 565 CA ALA A 37 2.121 -4.123 -11.969 1.00 0.00 C ATOM 566 C ALA A 37 1.918 -5.629 -12.097 1.00 0.00 C ATOM 567 O ALA A 37 2.782 -6.416 -11.710 1.00 0.00 O ATOM 568 CB ALA A 37 2.668 -3.539 -13.264 1.00 0.00 C ATOM 0 H ALA A 37 3.937 -4.219 -10.927 1.00 0.00 H new ATOM 0 HA ALA A 37 1.150 -3.668 -11.772 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.994 -3.782 -14.086 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.749 -2.456 -13.169 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.653 -3.960 -13.466 1.00 0.00 H new ATOM 574 N SER A 38 0.769 -6.023 -12.632 1.00 0.00 N ATOM 575 CA SER A 38 0.445 -7.435 -12.800 1.00 0.00 C ATOM 576 C SER A 38 1.400 -8.118 -13.776 1.00 0.00 C ATOM 577 O SER A 38 1.726 -9.294 -13.615 1.00 0.00 O ATOM 578 CB SER A 38 -0.994 -7.590 -13.294 1.00 0.00 C ATOM 579 OG SER A 38 -1.158 -7.001 -14.573 1.00 0.00 O ATOM 0 H SER A 38 0.044 -5.383 -12.958 1.00 0.00 H new ATOM 0 HA SER A 38 0.552 -7.916 -11.828 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.254 -8.647 -13.340 1.00 0.00 H new ATOM 0 HB3 SER A 38 -1.678 -7.124 -12.585 1.00 0.00 H new ATOM 0 HG SER A 38 -1.581 -7.645 -15.178 1.00 0.00 H new ATOM 585 N TRP A 39 1.835 -7.382 -14.794 1.00 0.00 N ATOM 586 CA TRP A 39 2.740 -7.933 -15.796 1.00 0.00 C ATOM 587 C TRP A 39 4.198 -7.586 -15.496 1.00 0.00 C ATOM 588 O TRP A 39 5.058 -7.699 -16.371 1.00 0.00 O ATOM 589 CB TRP A 39 2.358 -7.426 -17.188 1.00 0.00 C ATOM 590 CG TRP A 39 2.627 -5.965 -17.384 1.00 0.00 C ATOM 591 CD1 TRP A 39 1.926 -4.924 -16.848 1.00 0.00 C ATOM 592 CD2 TRP A 39 3.675 -5.383 -18.168 1.00 0.00 C ATOM 593 NE1 TRP A 39 2.473 -3.731 -17.252 1.00 0.00 N ATOM 594 CE2 TRP A 39 3.547 -3.986 -18.064 1.00 0.00 C ATOM 595 CE3 TRP A 39 4.709 -5.908 -18.950 1.00 0.00 C ATOM 596 CZ2 TRP A 39 4.413 -3.107 -18.710 1.00 0.00 C ATOM 597 CZ3 TRP A 39 5.568 -5.035 -19.591 1.00 0.00 C ATOM 598 CH2 TRP A 39 5.415 -3.649 -19.467 1.00 0.00 C ATOM 0 H TRP A 39 1.577 -6.407 -14.946 1.00 0.00 H new ATOM 0 HA TRP A 39 2.643 -9.018 -15.765 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.910 -7.993 -17.937 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.299 -7.619 -17.359 1.00 0.00 H new ATOM 0 HD1 TRP A 39 1.067 -5.024 -16.201 1.00 0.00 H new ATOM 0 HE1 TRP A 39 2.135 -2.805 -16.990 1.00 0.00 H new ATOM 0 HE3 TRP A 39 4.834 -6.976 -19.051 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 4.298 -2.037 -18.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 6.370 -5.429 -20.197 1.00 0.00 H new ATOM 0 HH2 TRP A 39 6.103 -2.994 -19.980 1.00 0.00 H new ATOM 609 N CYS A 40 4.478 -7.166 -14.266 1.00 0.00 N ATOM 610 CA CYS A 40 5.842 -6.815 -13.886 1.00 0.00 C ATOM 611 C CYS A 40 6.706 -8.074 -13.784 1.00 0.00 C ATOM 612 O CYS A 40 6.182 -9.186 -13.717 1.00 0.00 O ATOM 613 CB CYS A 40 5.842 -6.012 -12.572 1.00 0.00 C ATOM 614 SG CYS A 40 6.177 -6.968 -11.051 1.00 0.00 S ATOM 0 H CYS A 40 3.787 -7.061 -13.523 1.00 0.00 H new ATOM 0 HA CYS A 40 6.276 -6.180 -14.659 1.00 0.00 H new ATOM 0 HB2 CYS A 40 6.588 -5.221 -12.652 1.00 0.00 H new ATOM 0 HB3 CYS A 40 4.872 -5.526 -12.466 1.00 0.00 H new ATOM 619 N PRO A 41 8.041 -7.925 -13.801 1.00 0.00 N ATOM 620 CA PRO A 41 8.951 -9.070 -13.733 1.00 0.00 C ATOM 621 C PRO A 41 8.915 -9.788 -12.380 1.00 0.00 C ATOM 622 O PRO A 41 8.636 -10.986 -12.327 1.00 0.00 O ATOM 623 CB PRO A 41 10.340 -8.473 -14.007 1.00 0.00 C ATOM 624 CG PRO A 41 10.100 -7.067 -14.463 1.00 0.00 C ATOM 625 CD PRO A 41 8.763 -6.652 -13.915 1.00 0.00 C ATOM 0 HA PRO A 41 8.668 -9.838 -14.453 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.957 -8.492 -13.109 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.868 -9.046 -14.769 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.887 -6.405 -14.103 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.106 -7.008 -15.551 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.859 -6.155 -12.950 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.252 -5.957 -14.581 1.00 0.00 H new ATOM 633 N PRO A 42 9.203 -9.089 -11.260 1.00 0.00 N ATOM 634 CA PRO A 42 9.201 -9.713 -9.931 1.00 0.00 C ATOM 635 C PRO A 42 7.815 -10.203 -9.496 1.00 0.00 C ATOM 636 O PRO A 42 7.551 -11.404 -9.526 1.00 0.00 O ATOM 637 CB PRO A 42 9.708 -8.604 -8.994 1.00 0.00 C ATOM 638 CG PRO A 42 10.318 -7.581 -9.891 1.00 0.00 C ATOM 639 CD PRO A 42 9.566 -7.663 -11.186 1.00 0.00 C ATOM 0 HA PRO A 42 9.822 -10.609 -9.918 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.892 -8.179 -8.410 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.439 -8.992 -8.285 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.239 -6.584 -9.457 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.379 -7.779 -10.043 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.685 -7.021 -11.184 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.182 -7.357 -12.032 1.00 0.00 H new ATOM 647 N CYS A 43 6.946 -9.269 -9.076 1.00 0.00 N ATOM 648 CA CYS A 43 5.581 -9.594 -8.606 1.00 0.00 C ATOM 649 C CYS A 43 5.338 -11.095 -8.537 1.00 0.00 C ATOM 650 O CYS A 43 4.638 -11.671 -9.370 1.00 0.00 O ATOM 651 CB CYS A 43 4.506 -8.939 -9.479 1.00 0.00 C ATOM 652 SG CYS A 43 4.999 -8.612 -11.201 1.00 0.00 S ATOM 0 H CYS A 43 7.164 -8.273 -9.051 1.00 0.00 H new ATOM 0 HA CYS A 43 5.508 -9.188 -7.597 1.00 0.00 H new ATOM 0 HB2 CYS A 43 3.625 -9.581 -9.486 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.210 -7.997 -9.017 1.00 0.00 H new ATOM 657 N ARG A 44 5.929 -11.712 -7.529 1.00 0.00 N ATOM 658 CA ARG A 44 5.799 -13.148 -7.315 1.00 0.00 C ATOM 659 C ARG A 44 6.321 -13.534 -5.934 1.00 0.00 C ATOM 660 O ARG A 44 5.710 -14.338 -5.231 1.00 0.00 O ATOM 661 CB ARG A 44 6.561 -13.917 -8.397 1.00 0.00 C ATOM 662 CG ARG A 44 6.077 -15.346 -8.580 1.00 0.00 C ATOM 663 CD ARG A 44 6.899 -16.087 -9.625 1.00 0.00 C ATOM 664 NE ARG A 44 8.334 -15.876 -9.445 1.00 0.00 N ATOM 665 CZ ARG A 44 9.015 -14.871 -9.993 1.00 0.00 C ATOM 666 NH1 ARG A 44 8.398 -13.976 -10.755 1.00 0.00 N ATOM 667 NH2 ARG A 44 10.318 -14.759 -9.776 1.00 0.00 N ATOM 0 H ARG A 44 6.510 -11.238 -6.838 1.00 0.00 H new ATOM 0 HA ARG A 44 4.742 -13.409 -7.373 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.466 -13.386 -9.344 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.621 -13.930 -8.144 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.135 -15.875 -7.629 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.029 -15.340 -8.878 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.680 -17.153 -9.569 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.606 -15.753 -10.620 1.00 0.00 H new ATOM 0 HE ARG A 44 8.846 -16.540 -8.864 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.395 -14.055 -10.924 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.927 -13.209 -11.171 1.00 0.00 H new ATOM 0 HH21 ARG A 44 10.798 -15.442 -9.190 1.00 0.00 H new ATOM 0 HH22 ARG A 44 10.841 -13.990 -10.195 1.00 0.00 H new ATOM 681 N GLY A 45 7.454 -12.953 -5.553 1.00 0.00 N ATOM 682 CA GLY A 45 8.039 -13.243 -4.257 1.00 0.00 C ATOM 683 C GLY A 45 7.545 -12.299 -3.179 1.00 0.00 C ATOM 684 O GLY A 45 7.094 -12.736 -2.120 1.00 0.00 O ATOM 0 H GLY A 45 7.978 -12.286 -6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.802 -14.269 -3.975 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.125 -13.175 -4.327 1.00 0.00 H new ATOM 688 N PHE A 46 7.630 -11.000 -3.449 1.00 0.00 N ATOM 689 CA PHE A 46 7.186 -9.990 -2.495 1.00 0.00 C ATOM 690 C PHE A 46 5.788 -9.491 -2.849 1.00 0.00 C ATOM 691 O PHE A 46 5.614 -8.711 -3.784 1.00 0.00 O ATOM 692 CB PHE A 46 8.169 -8.818 -2.464 1.00 0.00 C ATOM 693 CG PHE A 46 8.015 -7.934 -1.259 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.835 -8.483 0.002 1.00 0.00 C ATOM 695 CD2 PHE A 46 8.050 -6.555 -1.386 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.693 -7.671 1.112 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.908 -5.739 -0.280 1.00 0.00 C ATOM 698 CZ PHE A 46 7.729 -6.298 0.971 1.00 0.00 C ATOM 0 H PHE A 46 8.002 -10.622 -4.320 1.00 0.00 H new ATOM 0 HA PHE A 46 7.151 -10.447 -1.506 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.187 -9.208 -2.490 1.00 0.00 H new ATOM 0 HB3 PHE A 46 8.034 -8.218 -3.364 1.00 0.00 H new ATOM 0 HD1 PHE A 46 7.805 -9.556 0.118 1.00 0.00 H new ATOM 0 HD2 PHE A 46 8.190 -6.112 -2.361 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.554 -8.110 2.089 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.937 -4.665 -0.393 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.617 -5.662 1.837 1.00 0.00 H new ATOM 708 N THR A 47 4.795 -9.952 -2.094 1.00 0.00 N ATOM 709 CA THR A 47 3.409 -9.557 -2.326 1.00 0.00 C ATOM 710 C THR A 47 2.480 -10.209 -1.302 1.00 0.00 C ATOM 711 O THR A 47 1.769 -9.520 -0.570 1.00 0.00 O ATOM 712 CB THR A 47 2.969 -9.935 -3.745 1.00 0.00 C ATOM 713 OG1 THR A 47 3.919 -10.793 -4.359 1.00 0.00 O ATOM 714 CG2 THR A 47 2.772 -8.735 -4.648 1.00 0.00 C ATOM 0 H THR A 47 4.924 -10.599 -1.316 1.00 0.00 H new ATOM 0 HA THR A 47 3.346 -8.474 -2.215 1.00 0.00 H new ATOM 0 HB THR A 47 2.010 -10.439 -3.625 1.00 0.00 H new ATOM 0 HG1 THR A 47 3.617 -11.022 -5.263 1.00 0.00 H new ATOM 0 HG21 THR A 47 2.461 -9.071 -5.637 1.00 0.00 H new ATOM 0 HG22 THR A 47 2.004 -8.085 -4.228 1.00 0.00 H new ATOM 0 HG23 THR A 47 3.709 -8.184 -4.730 1.00 0.00 H new ATOM 722 N PRO A 48 2.474 -11.553 -1.238 1.00 0.00 N ATOM 723 CA PRO A 48 1.626 -12.301 -0.302 1.00 0.00 C ATOM 724 C PRO A 48 2.178 -12.318 1.124 1.00 0.00 C ATOM 725 O PRO A 48 1.674 -13.046 1.980 1.00 0.00 O ATOM 726 CB PRO A 48 1.636 -13.709 -0.889 1.00 0.00 C ATOM 727 CG PRO A 48 2.971 -13.824 -1.533 1.00 0.00 C ATOM 728 CD PRO A 48 3.286 -12.457 -2.080 1.00 0.00 C ATOM 0 HA PRO A 48 0.635 -11.856 -0.208 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.500 -14.464 -0.115 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.832 -13.845 -1.612 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.726 -14.140 -0.813 1.00 0.00 H new ATOM 0 HG3 PRO A 48 2.958 -14.569 -2.328 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.349 -12.229 -2.004 1.00 0.00 H new ATOM 0 HD3 PRO A 48 3.017 -12.374 -3.133 1.00 0.00 H new ATOM 736 N GLN A 49 3.205 -11.514 1.381 1.00 0.00 N ATOM 737 CA GLN A 49 3.803 -11.444 2.707 1.00 0.00 C ATOM 738 C GLN A 49 2.919 -10.616 3.630 1.00 0.00 C ATOM 739 O GLN A 49 2.781 -10.922 4.814 1.00 0.00 O ATOM 740 CB GLN A 49 5.218 -10.854 2.642 1.00 0.00 C ATOM 741 CG GLN A 49 5.869 -10.679 4.005 1.00 0.00 C ATOM 742 CD GLN A 49 6.266 -12.002 4.633 1.00 0.00 C ATOM 743 OE1 GLN A 49 5.853 -12.321 5.748 1.00 0.00 O ATOM 744 NE2 GLN A 49 7.072 -12.778 3.918 1.00 0.00 N ATOM 0 H GLN A 49 3.639 -10.903 0.689 1.00 0.00 H new ATOM 0 HA GLN A 49 3.882 -12.455 3.106 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.845 -11.502 2.030 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.176 -9.886 2.142 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.753 -10.049 3.904 1.00 0.00 H new ATOM 0 HG3 GLN A 49 5.180 -10.157 4.669 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.390 -12.473 2.998 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.373 -13.679 4.289 1.00 0.00 H new ATOM 753 N LEU A 50 2.306 -9.575 3.072 1.00 0.00 N ATOM 754 CA LEU A 50 1.417 -8.712 3.831 1.00 0.00 C ATOM 755 C LEU A 50 0.342 -9.533 4.524 1.00 0.00 C ATOM 756 O LEU A 50 0.071 -9.359 5.711 1.00 0.00 O ATOM 757 CB LEU A 50 0.753 -7.705 2.893 1.00 0.00 C ATOM 758 CG LEU A 50 0.616 -6.278 3.428 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.529 -6.262 4.951 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.778 -5.428 2.944 1.00 0.00 C ATOM 0 H LEU A 50 2.412 -9.311 2.092 1.00 0.00 H new ATOM 0 HA LEU A 50 2.004 -8.186 4.584 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.325 -7.671 1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.241 -8.074 2.641 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.313 -5.856 3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.432 -5.234 5.299 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.340 -6.837 5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.432 -6.704 5.372 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.672 -4.414 3.329 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.715 -5.856 3.300 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.782 -5.403 1.854 1.00 0.00 H new ATOM 772 N ILE A 51 -0.273 -10.423 3.757 1.00 0.00 N ATOM 773 CA ILE A 51 -1.334 -11.280 4.273 1.00 0.00 C ATOM 774 C ILE A 51 -0.874 -12.070 5.499 1.00 0.00 C ATOM 775 O ILE A 51 -1.599 -12.171 6.487 1.00 0.00 O ATOM 776 CB ILE A 51 -1.838 -12.261 3.192 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.474 -11.490 2.034 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.831 -13.251 3.787 1.00 0.00 C ATOM 779 CD1 ILE A 51 -3.622 -10.600 2.460 1.00 0.00 C ATOM 0 H ILE A 51 -0.055 -10.571 2.772 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.152 -10.623 4.567 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.986 -12.823 2.809 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -1.711 -10.879 1.552 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.832 -12.200 1.288 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.174 -13.934 3.010 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.347 -13.819 4.581 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.684 -12.709 4.197 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.025 -10.084 1.589 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.404 -11.208 2.916 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.265 -9.867 3.183 1.00 0.00 H new ATOM 791 N GLU A 52 0.326 -12.633 5.425 1.00 0.00 N ATOM 792 CA GLU A 52 0.866 -13.417 6.530 1.00 0.00 C ATOM 793 C GLU A 52 1.111 -12.544 7.757 1.00 0.00 C ATOM 794 O GLU A 52 0.669 -12.868 8.859 1.00 0.00 O ATOM 795 CB GLU A 52 2.168 -14.102 6.109 1.00 0.00 C ATOM 796 CG GLU A 52 2.422 -15.418 6.825 1.00 0.00 C ATOM 797 CD GLU A 52 3.895 -15.664 7.087 1.00 0.00 C ATOM 798 OE1 GLU A 52 4.731 -15.111 6.342 1.00 0.00 O ATOM 799 OE2 GLU A 52 4.212 -16.410 8.037 1.00 0.00 O ATOM 0 H GLU A 52 0.942 -12.562 4.615 1.00 0.00 H new ATOM 0 HA GLU A 52 0.130 -14.177 6.792 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.143 -14.282 5.034 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.002 -13.427 6.300 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.883 -15.422 7.772 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.022 -16.236 6.227 1.00 0.00 H new ATOM 806 N PHE A 53 1.814 -11.434 7.559 1.00 0.00 N ATOM 807 CA PHE A 53 2.115 -10.514 8.649 1.00 0.00 C ATOM 808 C PHE A 53 0.848 -9.813 9.135 1.00 0.00 C ATOM 809 O PHE A 53 0.755 -9.412 10.295 1.00 0.00 O ATOM 810 CB PHE A 53 3.147 -9.478 8.199 1.00 0.00 C ATOM 811 CG PHE A 53 3.669 -8.616 9.316 1.00 0.00 C ATOM 812 CD1 PHE A 53 3.937 -9.158 10.564 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.893 -7.263 9.115 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.418 -8.366 11.589 1.00 0.00 C ATOM 815 CE2 PHE A 53 4.374 -6.466 10.137 1.00 0.00 C ATOM 816 CZ PHE A 53 4.636 -7.018 11.376 1.00 0.00 C ATOM 0 H PHE A 53 2.186 -11.150 6.653 1.00 0.00 H new ATOM 0 HA PHE A 53 2.528 -11.091 9.476 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.984 -9.994 7.729 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.699 -8.839 7.438 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.768 -10.211 10.737 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.689 -6.826 8.148 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.624 -8.800 12.556 1.00 0.00 H new ATOM 0 HE2 PHE A 53 4.545 -5.413 9.967 1.00 0.00 H new ATOM 0 HZ PHE A 53 5.010 -6.397 12.177 1.00 0.00 H new ATOM 826 N TYR A 54 -0.118 -9.664 8.236 1.00 0.00 N ATOM 827 CA TYR A 54 -1.377 -9.005 8.562 1.00 0.00 C ATOM 828 C TYR A 54 -2.351 -9.969 9.236 1.00 0.00 C ATOM 829 O TYR A 54 -2.874 -9.684 10.308 1.00 0.00 O ATOM 830 CB TYR A 54 -2.005 -8.422 7.290 1.00 0.00 C ATOM 831 CG TYR A 54 -3.431 -7.947 7.466 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.706 -6.685 7.977 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.501 -8.761 7.118 1.00 0.00 C ATOM 834 CE1 TYR A 54 -5.007 -6.249 8.138 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.805 -8.332 7.275 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.053 -7.075 7.785 1.00 0.00 C ATOM 837 OH TYR A 54 -7.350 -6.644 7.943 1.00 0.00 O ATOM 0 H TYR A 54 -0.053 -9.992 7.272 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.166 -8.198 9.264 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.395 -7.586 6.947 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.980 -9.179 6.506 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.890 -6.034 8.253 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.311 -9.746 6.718 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.204 -5.266 8.539 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.626 -8.978 7.000 1.00 0.00 H new ATOM 0 HH TYR A 54 -7.966 -7.346 7.646 1.00 0.00 H new ATOM 847 N ASP A 55 -2.600 -11.103 8.600 1.00 0.00 N ATOM 848 CA ASP A 55 -3.526 -12.092 9.141 1.00 0.00 C ATOM 849 C ASP A 55 -3.140 -12.521 10.557 1.00 0.00 C ATOM 850 O ASP A 55 -3.988 -12.967 11.328 1.00 0.00 O ATOM 851 CB ASP A 55 -3.581 -13.316 8.227 1.00 0.00 C ATOM 852 CG ASP A 55 -4.738 -14.236 8.563 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.899 -13.781 8.489 1.00 0.00 O ATOM 854 OD2 ASP A 55 -4.484 -15.412 8.898 1.00 0.00 O ATOM 0 H ASP A 55 -2.176 -11.363 7.710 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.510 -11.626 9.190 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.669 -12.989 7.191 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.645 -13.869 8.308 1.00 0.00 H new ATOM 859 N LYS A 56 -1.855 -12.420 10.883 1.00 0.00 N ATOM 860 CA LYS A 56 -1.370 -12.837 12.191 1.00 0.00 C ATOM 861 C LYS A 56 -1.298 -11.693 13.210 1.00 0.00 C ATOM 862 O LYS A 56 -1.178 -11.950 14.408 1.00 0.00 O ATOM 863 CB LYS A 56 0.009 -13.482 12.054 1.00 0.00 C ATOM 864 CG LYS A 56 0.014 -14.732 11.190 1.00 0.00 C ATOM 865 CD LYS A 56 1.397 -15.357 11.122 1.00 0.00 C ATOM 866 CE LYS A 56 1.323 -16.838 10.790 1.00 0.00 C ATOM 867 NZ LYS A 56 0.708 -17.078 9.455 1.00 0.00 N ATOM 0 H LYS A 56 -1.134 -12.054 10.261 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.095 -13.556 12.572 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.700 -12.754 11.629 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.383 -13.735 13.046 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.694 -15.456 11.592 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.323 -14.482 10.184 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.993 -14.843 10.368 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.906 -15.222 12.076 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.326 -17.265 10.810 1.00 0.00 H new ATOM 0 HE3 LYS A 56 0.742 -17.353 11.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.087 -17.742 9.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.361 -16.178 9.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.419 -17.482 8.813 1.00 0.00 H new ATOM 881 N PHE A 57 -1.339 -10.442 12.756 1.00 0.00 N ATOM 882 CA PHE A 57 -1.241 -9.314 13.683 1.00 0.00 C ATOM 883 C PHE A 57 -2.212 -8.180 13.353 1.00 0.00 C ATOM 884 O PHE A 57 -2.191 -7.137 14.007 1.00 0.00 O ATOM 885 CB PHE A 57 0.197 -8.783 13.700 1.00 0.00 C ATOM 886 CG PHE A 57 0.802 -8.709 15.077 1.00 0.00 C ATOM 887 CD1 PHE A 57 0.574 -9.711 16.007 1.00 0.00 C ATOM 888 CD2 PHE A 57 1.604 -7.636 15.437 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.130 -9.644 17.270 1.00 0.00 C ATOM 890 CE2 PHE A 57 2.164 -7.565 16.698 1.00 0.00 C ATOM 891 CZ PHE A 57 1.927 -8.570 17.616 1.00 0.00 C ATOM 0 H PHE A 57 -1.437 -10.185 11.774 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.519 -9.687 14.669 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.818 -9.424 13.074 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.213 -7.789 13.253 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.046 -10.554 15.741 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.793 -6.847 14.724 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.942 -10.430 17.986 1.00 0.00 H new ATOM 0 HE2 PHE A 57 2.787 -6.724 16.966 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.364 -8.516 18.602 1.00 0.00 H new ATOM 901 N HIS A 58 -3.048 -8.363 12.337 1.00 0.00 N ATOM 902 CA HIS A 58 -3.995 -7.328 11.945 1.00 0.00 C ATOM 903 C HIS A 58 -4.879 -6.906 13.116 1.00 0.00 C ATOM 904 O HIS A 58 -5.285 -5.748 13.213 1.00 0.00 O ATOM 905 CB HIS A 58 -4.872 -7.800 10.783 1.00 0.00 C ATOM 906 CG HIS A 58 -5.767 -8.949 11.132 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.300 -10.224 11.376 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.113 -9.010 11.279 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.320 -11.018 11.658 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.429 -10.305 11.605 1.00 0.00 N ATOM 0 H HIS A 58 -3.089 -9.212 11.774 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.412 -6.465 11.623 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.484 -6.966 10.439 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.231 -8.090 9.950 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -4.321 -10.510 11.344 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.808 -8.192 11.161 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -6.256 -12.070 11.892 1.00 0.00 H new ATOM 919 N GLU A 59 -5.180 -7.853 13.998 1.00 0.00 N ATOM 920 CA GLU A 59 -6.025 -7.577 15.155 1.00 0.00 C ATOM 921 C GLU A 59 -5.293 -6.720 16.184 1.00 0.00 C ATOM 922 O GLU A 59 -5.913 -5.948 16.914 1.00 0.00 O ATOM 923 CB GLU A 59 -6.483 -8.887 15.799 1.00 0.00 C ATOM 924 CG GLU A 59 -7.199 -9.820 14.837 1.00 0.00 C ATOM 925 CD GLU A 59 -7.602 -11.130 15.485 1.00 0.00 C ATOM 926 OE1 GLU A 59 -8.572 -11.130 16.272 1.00 0.00 O ATOM 927 OE2 GLU A 59 -6.948 -12.157 15.205 1.00 0.00 O ATOM 0 H GLU A 59 -4.852 -8.817 13.934 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.896 -7.022 14.808 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.616 -9.401 16.213 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.147 -8.659 16.633 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.088 -9.323 14.449 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.550 -10.025 13.985 1.00 0.00 H new ATOM 934 N SER A 60 -3.974 -6.863 16.240 1.00 0.00 N ATOM 935 CA SER A 60 -3.165 -6.102 17.186 1.00 0.00 C ATOM 936 C SER A 60 -2.674 -4.795 16.567 1.00 0.00 C ATOM 937 O SER A 60 -2.681 -3.750 17.217 1.00 0.00 O ATOM 938 CB SER A 60 -1.970 -6.936 17.652 1.00 0.00 C ATOM 939 OG SER A 60 -1.060 -6.149 18.401 1.00 0.00 O ATOM 0 H SER A 60 -3.443 -7.497 15.643 1.00 0.00 H new ATOM 0 HA SER A 60 -3.793 -5.860 18.044 1.00 0.00 H new ATOM 0 HB2 SER A 60 -2.320 -7.770 18.260 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.461 -7.363 16.788 1.00 0.00 H new ATOM 0 HG SER A 60 -0.306 -6.705 18.688 1.00 0.00 H new ATOM 945 N LYS A 61 -2.245 -4.863 15.312 1.00 0.00 N ATOM 946 CA LYS A 61 -1.747 -3.686 14.610 1.00 0.00 C ATOM 947 C LYS A 61 -2.888 -2.878 14.002 1.00 0.00 C ATOM 948 O LYS A 61 -2.807 -1.654 13.899 1.00 0.00 O ATOM 949 CB LYS A 61 -0.764 -4.100 13.515 1.00 0.00 C ATOM 950 CG LYS A 61 0.436 -4.876 14.035 1.00 0.00 C ATOM 951 CD LYS A 61 1.720 -4.491 13.314 1.00 0.00 C ATOM 952 CE LYS A 61 1.557 -4.584 11.776 1.00 0.00 C ATOM 953 NZ LYS A 61 2.799 -4.171 11.066 1.00 0.00 N ATOM 0 H LYS A 61 -2.232 -5.720 14.760 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.234 -3.057 15.337 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.289 -4.709 12.779 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.412 -3.207 12.998 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.551 -4.693 15.103 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.258 -5.944 13.912 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.003 -3.475 13.590 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.530 -5.146 13.635 1.00 0.00 H new ATOM 0 HE2 LYS A 61 1.302 -5.607 11.498 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.728 -3.951 11.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.628 -3.280 10.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.564 -4.034 11.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.073 -4.910 10.387 1.00 0.00 H new ATOM 967 N ASN A 62 -3.953 -3.568 13.599 1.00 0.00 N ATOM 968 CA ASN A 62 -5.110 -2.912 13.000 1.00 0.00 C ATOM 969 C ASN A 62 -4.681 -1.912 11.927 1.00 0.00 C ATOM 970 O ASN A 62 -4.762 -0.700 12.124 1.00 0.00 O ATOM 971 CB ASN A 62 -5.927 -2.207 14.081 1.00 0.00 C ATOM 972 CG ASN A 62 -7.395 -2.094 13.721 1.00 0.00 C ATOM 973 OD1 ASN A 62 -7.929 -2.921 12.983 1.00 0.00 O ATOM 974 ND2 ASN A 62 -8.054 -1.066 14.241 1.00 0.00 N ATOM 0 H ASN A 62 -4.037 -4.582 13.677 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.727 -3.674 12.524 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.828 -2.752 15.020 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.520 -1.210 14.247 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -9.044 -0.937 14.033 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.570 -0.405 14.848 1.00 0.00 H new ATOM 981 N PHE A 63 -4.219 -2.433 10.795 1.00 0.00 N ATOM 982 CA PHE A 63 -3.771 -1.588 9.692 1.00 0.00 C ATOM 983 C PHE A 63 -4.411 -2.019 8.377 1.00 0.00 C ATOM 984 O PHE A 63 -5.060 -3.062 8.305 1.00 0.00 O ATOM 985 CB PHE A 63 -2.246 -1.623 9.574 1.00 0.00 C ATOM 986 CG PHE A 63 -1.676 -3.004 9.434 1.00 0.00 C ATOM 987 CD1 PHE A 63 -1.748 -3.909 10.481 1.00 0.00 C ATOM 988 CD2 PHE A 63 -1.059 -3.396 8.257 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.217 -5.179 10.355 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.526 -4.663 8.126 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.605 -5.555 9.176 1.00 0.00 C ATOM 0 H PHE A 63 -4.145 -3.435 10.617 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.083 -0.566 9.905 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -1.945 -1.028 8.712 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -1.813 -1.150 10.455 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.224 -3.619 11.406 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.994 -2.702 7.432 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.281 -5.876 11.178 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.048 -4.956 7.203 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.188 -6.546 9.076 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.227 -1.209 7.339 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.784 -1.502 6.037 1.00 0.00 C ATOM 1003 C GLU A 64 -3.734 -1.322 4.949 1.00 0.00 C ATOM 1004 O GLU A 64 -2.957 -0.368 4.961 1.00 0.00 O ATOM 1005 CB GLU A 64 -5.982 -0.601 5.749 1.00 0.00 C ATOM 1006 CG GLU A 64 -6.968 -1.196 4.759 1.00 0.00 C ATOM 1007 CD GLU A 64 -6.364 -1.400 3.383 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -5.515 -0.578 2.980 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -6.741 -2.381 2.709 1.00 0.00 O ATOM 0 H GLU A 64 -3.692 -0.341 7.382 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.114 -2.541 6.040 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.501 -0.391 6.684 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.624 0.353 5.363 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.326 -2.153 5.140 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.835 -0.540 4.677 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.729 -2.250 4.017 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.796 -2.236 2.897 1.00 0.00 C ATOM 1018 C VAL A 65 -3.543 -1.981 1.591 1.00 0.00 C ATOM 1019 O VAL A 65 -4.641 -2.494 1.391 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.036 -3.580 2.809 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.138 -3.646 1.577 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.232 -3.813 4.078 1.00 0.00 C ATOM 0 H VAL A 65 -4.372 -3.041 4.009 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.076 -1.434 3.060 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.775 -4.375 2.709 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.623 -4.606 1.553 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.745 -3.538 0.678 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.404 -2.841 1.618 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.702 -4.762 4.004 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.512 -3.004 4.206 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.905 -3.840 4.935 1.00 0.00 H new ATOM 1032 N VAL A 66 -2.957 -1.179 0.709 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.591 -0.871 -0.567 1.00 0.00 C ATOM 1034 C VAL A 66 -2.724 -1.338 -1.736 1.00 0.00 C ATOM 1035 O VAL A 66 -1.497 -1.247 -1.679 1.00 0.00 O ATOM 1036 CB VAL A 66 -3.857 0.643 -0.705 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.596 0.954 -1.999 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.634 1.156 0.498 1.00 0.00 C ATOM 0 H VAL A 66 -2.051 -0.733 0.852 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.542 -1.403 -0.591 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.896 1.156 -0.740 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.770 2.028 -2.070 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.996 0.627 -2.848 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.552 0.430 -2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.814 2.225 0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.588 0.633 0.565 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.058 0.978 1.406 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.360 -1.841 -2.796 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.625 -2.317 -3.963 1.00 0.00 C ATOM 1050 C PHE A 67 -2.495 -1.221 -5.017 1.00 0.00 C ATOM 1051 O PHE A 67 -3.408 -0.998 -5.811 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.303 -3.555 -4.560 1.00 0.00 C ATOM 1053 CG PHE A 67 -3.151 -3.696 -6.052 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.898 -3.641 -6.642 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -4.259 -3.886 -6.861 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -1.754 -3.771 -8.010 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -4.122 -4.017 -8.230 1.00 0.00 C ATOM 1058 CZ PHE A 67 -2.868 -3.959 -8.806 1.00 0.00 C ATOM 0 H PHE A 67 -4.374 -1.928 -2.868 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.622 -2.593 -3.637 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -2.893 -4.444 -4.081 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.365 -3.523 -4.318 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.024 -3.495 -6.025 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -5.242 -3.932 -6.417 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.772 -3.726 -8.457 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -4.995 -4.165 -8.849 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.758 -4.060 -9.876 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.346 -0.556 -5.034 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.095 0.493 -6.011 1.00 0.00 C ATOM 1070 C CYS A 68 -0.554 -0.125 -7.292 1.00 0.00 C ATOM 1071 O CYS A 68 0.576 -0.607 -7.330 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.105 1.520 -5.459 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.864 2.800 -4.432 1.00 0.00 S ATOM 0 H CYS A 68 -0.577 -0.724 -4.385 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.032 1.007 -6.226 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.652 1.000 -4.872 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.410 1.997 -6.293 1.00 0.00 H new ATOM 0 HG CYS A 68 -0.013 3.763 -4.240 1.00 0.00 H new ATOM 1079 N THR A 69 -1.369 -0.128 -8.337 1.00 0.00 N ATOM 1080 CA THR A 69 -0.960 -0.713 -9.609 1.00 0.00 C ATOM 1081 C THR A 69 0.117 0.131 -10.282 1.00 0.00 C ATOM 1082 O THR A 69 0.259 1.322 -10.003 1.00 0.00 O ATOM 1083 CB THR A 69 -2.157 -0.884 -10.553 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.845 -1.795 -11.591 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.600 0.407 -11.202 1.00 0.00 C ATOM 0 H THR A 69 -2.310 0.264 -8.332 1.00 0.00 H new ATOM 0 HA THR A 69 -0.546 -1.698 -9.393 1.00 0.00 H new ATOM 0 HB THR A 69 -2.968 -1.253 -9.926 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.352 -1.560 -12.396 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.450 0.212 -11.856 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.891 1.121 -10.431 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.779 0.820 -11.787 1.00 0.00 H new ATOM 1093 N TRP A 70 0.865 -0.500 -11.174 1.00 0.00 N ATOM 1094 CA TRP A 70 1.929 0.173 -11.906 1.00 0.00 C ATOM 1095 C TRP A 70 2.106 -0.473 -13.276 1.00 0.00 C ATOM 1096 O TRP A 70 3.214 -0.841 -13.667 1.00 0.00 O ATOM 1097 CB TRP A 70 3.237 0.119 -11.112 1.00 0.00 C ATOM 1098 CG TRP A 70 3.735 1.469 -10.695 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.516 2.089 -9.498 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.533 2.367 -11.474 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.131 3.317 -9.486 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.761 3.511 -10.687 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.077 2.314 -12.761 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.510 4.592 -11.145 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 5.820 3.389 -13.214 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.030 4.514 -12.407 1.00 0.00 C ATOM 0 H TRP A 70 0.754 -1.486 -11.410 1.00 0.00 H new ATOM 0 HA TRP A 70 1.657 1.219 -12.046 1.00 0.00 H new ATOM 0 HB2 TRP A 70 3.090 -0.496 -10.224 1.00 0.00 H new ATOM 0 HB3 TRP A 70 4.000 -0.371 -11.716 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.944 1.675 -8.681 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.120 3.978 -8.709 1.00 0.00 H new ATOM 0 HE3 TRP A 70 4.920 1.450 -13.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.674 5.461 -10.525 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 6.245 3.360 -14.206 1.00 0.00 H new ATOM 0 HH2 TRP A 70 6.615 5.337 -12.790 1.00 0.00 H new ATOM 1117 N ASP A 71 1.001 -0.607 -14.002 1.00 0.00 N ATOM 1118 CA ASP A 71 1.033 -1.214 -15.331 1.00 0.00 C ATOM 1119 C ASP A 71 0.882 -0.142 -16.419 1.00 0.00 C ATOM 1120 O ASP A 71 1.853 0.527 -16.772 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.042 -2.325 -15.462 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.239 -2.813 -16.889 1.00 0.00 C ATOM 1123 OD1 ASP A 71 0.452 -2.307 -17.798 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -1.091 -3.703 -17.097 1.00 0.00 O ATOM 0 H ASP A 71 0.076 -0.306 -13.696 1.00 0.00 H new ATOM 0 HA ASP A 71 2.004 -1.689 -15.470 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.241 -3.169 -14.833 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.991 -1.948 -15.081 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.329 0.017 -16.945 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.597 1.003 -17.989 1.00 0.00 C ATOM 1131 C GLU A 72 -1.987 0.784 -18.576 1.00 0.00 C ATOM 1132 O GLU A 72 -2.672 1.735 -18.949 1.00 0.00 O ATOM 1133 CB GLU A 72 0.458 0.920 -19.097 1.00 0.00 C ATOM 1134 CG GLU A 72 1.495 2.030 -19.035 1.00 0.00 C ATOM 1135 CD GLU A 72 1.767 2.652 -20.391 1.00 0.00 C ATOM 1136 OE1 GLU A 72 2.432 1.998 -21.222 1.00 0.00 O ATOM 1137 OE2 GLU A 72 1.314 3.792 -20.622 1.00 0.00 O ATOM 0 H GLU A 72 -1.145 -0.527 -16.664 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.552 1.996 -17.541 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.965 -0.043 -19.033 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.041 0.954 -20.065 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.153 2.803 -18.347 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.425 1.631 -18.630 1.00 0.00 H new ATOM 1144 N GLU A 73 -2.395 -0.480 -18.652 1.00 0.00 N ATOM 1145 CA GLU A 73 -3.701 -0.832 -19.188 1.00 0.00 C ATOM 1146 C GLU A 73 -4.511 -1.619 -18.164 1.00 0.00 C ATOM 1147 O GLU A 73 -3.985 -2.505 -17.490 1.00 0.00 O ATOM 1148 CB GLU A 73 -3.544 -1.651 -20.471 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.553 -1.292 -21.551 1.00 0.00 C ATOM 1150 CD GLU A 73 -4.017 -1.528 -22.949 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -4.167 -2.658 -23.459 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -3.449 -0.582 -23.535 1.00 0.00 O ATOM 0 H GLU A 73 -1.836 -1.277 -18.348 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.235 0.090 -19.418 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.537 -1.506 -20.863 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.643 -2.710 -20.231 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.458 -1.882 -21.408 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.835 -0.244 -21.446 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.793 -1.288 -18.049 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.677 -1.964 -17.105 1.00 0.00 C ATOM 1161 C GLU A 74 -6.628 -3.479 -17.289 1.00 0.00 C ATOM 1162 O GLU A 74 -6.900 -4.234 -16.357 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.114 -1.466 -17.279 1.00 0.00 C ATOM 1164 CG GLU A 74 -8.480 -0.324 -16.347 1.00 0.00 C ATOM 1165 CD GLU A 74 -9.956 -0.304 -16.001 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -10.768 0.046 -16.884 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -10.300 -0.639 -14.849 1.00 0.00 O ATOM 0 H GLU A 74 -6.243 -0.556 -18.598 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.333 -1.731 -16.097 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.255 -1.141 -18.310 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.800 -2.296 -17.110 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.897 -0.407 -15.430 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.207 0.623 -16.814 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.289 -3.914 -18.497 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.215 -5.338 -18.807 1.00 0.00 C ATOM 1176 C ASP A 75 -5.272 -6.075 -17.858 1.00 0.00 C ATOM 1177 O ASP A 75 -5.547 -7.205 -17.455 1.00 0.00 O ATOM 1178 CB ASP A 75 -5.757 -5.541 -20.253 1.00 0.00 C ATOM 1179 CG ASP A 75 -6.479 -6.688 -20.933 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -7.682 -6.879 -20.658 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -5.841 -7.395 -21.741 1.00 0.00 O ATOM 0 H ASP A 75 -6.061 -3.301 -19.279 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.214 -5.754 -18.679 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.926 -4.624 -20.817 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.684 -5.731 -20.268 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.157 -5.438 -17.510 1.00 0.00 N ATOM 1187 CA GLY A 76 -3.199 -6.069 -16.618 1.00 0.00 C ATOM 1188 C GLY A 76 -3.645 -6.062 -15.168 1.00 0.00 C ATOM 1189 O GLY A 76 -3.739 -7.114 -14.538 1.00 0.00 O ATOM 0 H GLY A 76 -3.901 -4.503 -17.827 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.037 -7.098 -16.937 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.241 -5.555 -16.700 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.916 -4.875 -14.634 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.348 -4.746 -13.245 1.00 0.00 C ATOM 1195 C PHE A 77 -5.670 -5.483 -13.009 1.00 0.00 C ATOM 1196 O PHE A 77 -5.919 -5.994 -11.917 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.475 -3.261 -12.869 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.873 -2.815 -12.532 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -6.838 -2.706 -13.521 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.220 -2.508 -11.226 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -8.122 -2.298 -13.213 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.502 -2.100 -10.912 1.00 0.00 C ATOM 1203 CZ PHE A 77 -8.455 -1.995 -11.907 1.00 0.00 C ATOM 0 H PHE A 77 -3.845 -3.992 -15.139 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.595 -5.206 -12.605 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.828 -3.060 -12.015 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.105 -2.657 -13.698 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -6.584 -2.943 -14.544 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.479 -2.589 -10.444 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -8.865 -2.216 -13.993 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -7.759 -1.863 -9.890 1.00 0.00 H new ATOM 0 HZ PHE A 77 -9.458 -1.677 -11.664 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.511 -5.525 -14.036 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.810 -6.190 -13.942 1.00 0.00 C ATOM 1215 C ALA A 78 -7.663 -7.663 -13.631 1.00 0.00 C ATOM 1216 O ALA A 78 -8.223 -8.165 -12.656 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.530 -6.059 -15.247 1.00 0.00 C ATOM 0 H ALA A 78 -6.318 -5.106 -14.946 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.367 -5.714 -13.135 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.499 -6.554 -15.179 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.677 -5.004 -15.477 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.939 -6.524 -16.037 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.870 -8.351 -14.448 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.625 -9.755 -14.218 1.00 0.00 C ATOM 1225 C GLY A 79 -6.014 -9.951 -12.855 1.00 0.00 C ATOM 1226 O GLY A 79 -5.962 -11.061 -12.327 1.00 0.00 O ATOM 0 H GLY A 79 -6.396 -7.958 -15.262 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.558 -10.313 -14.292 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.958 -10.147 -14.985 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.547 -8.840 -12.291 1.00 0.00 N ATOM 1231 CA TYR A 80 -4.923 -8.854 -10.970 1.00 0.00 C ATOM 1232 C TYR A 80 -5.936 -8.538 -9.868 1.00 0.00 C ATOM 1233 O TYR A 80 -5.626 -8.651 -8.682 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.764 -7.856 -10.922 1.00 0.00 C ATOM 1235 CG TYR A 80 -2.423 -8.502 -10.657 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -2.073 -9.698 -11.273 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.506 -7.918 -9.792 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -0.849 -10.293 -11.034 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.280 -8.507 -9.549 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.043 -9.694 -10.172 1.00 0.00 C ATOM 1241 OH TYR A 80 1.264 -10.283 -9.932 1.00 0.00 O ATOM 0 H TYR A 80 -5.589 -7.919 -12.727 1.00 0.00 H new ATOM 0 HA TYR A 80 -4.539 -9.859 -10.794 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.719 -7.318 -11.869 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.963 -7.118 -10.145 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.770 -10.170 -11.950 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -1.755 -6.989 -9.302 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -0.593 -11.223 -11.520 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.422 -8.040 -8.874 1.00 0.00 H new ATOM 0 HH TYR A 80 1.546 -10.786 -10.725 1.00 0.00 H new ATOM 1251 N PHE A 81 -7.144 -8.142 -10.262 1.00 0.00 N ATOM 1252 CA PHE A 81 -8.196 -7.813 -9.304 1.00 0.00 C ATOM 1253 C PHE A 81 -8.412 -8.953 -8.309 1.00 0.00 C ATOM 1254 O PHE A 81 -8.820 -8.726 -7.170 1.00 0.00 O ATOM 1255 CB PHE A 81 -9.504 -7.508 -10.038 1.00 0.00 C ATOM 1256 CG PHE A 81 -10.644 -7.164 -9.121 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -10.725 -5.913 -8.532 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -11.633 -8.095 -8.847 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -11.772 -5.595 -7.688 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -12.683 -7.783 -8.003 1.00 0.00 C ATOM 1261 CZ PHE A 81 -12.752 -6.531 -7.423 1.00 0.00 C ATOM 0 H PHE A 81 -7.419 -8.041 -11.239 1.00 0.00 H new ATOM 0 HA PHE A 81 -7.881 -6.929 -8.749 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -9.340 -6.679 -10.726 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.782 -8.372 -10.641 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.961 -5.177 -8.735 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -11.583 -9.075 -9.298 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.824 -4.615 -7.236 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -13.448 -8.517 -7.798 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.571 -6.285 -6.763 1.00 0.00 H new ATOM 1271 N ALA A 82 -8.134 -10.177 -8.748 1.00 0.00 N ATOM 1272 CA ALA A 82 -8.298 -11.351 -7.898 1.00 0.00 C ATOM 1273 C ALA A 82 -7.249 -11.389 -6.787 1.00 0.00 C ATOM 1274 O ALA A 82 -7.336 -12.208 -5.871 1.00 0.00 O ATOM 1275 CB ALA A 82 -8.226 -12.618 -8.737 1.00 0.00 C ATOM 0 H ALA A 82 -7.794 -10.381 -9.688 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.279 -11.290 -7.426 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.350 -13.489 -8.093 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.019 -12.605 -9.485 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.258 -12.670 -9.235 1.00 0.00 H new ATOM 1281 N LYS A 83 -6.256 -10.506 -6.872 1.00 0.00 N ATOM 1282 CA LYS A 83 -5.190 -10.444 -5.875 1.00 0.00 C ATOM 1283 C LYS A 83 -5.754 -10.337 -4.459 1.00 0.00 C ATOM 1284 O LYS A 83 -6.969 -10.378 -4.258 1.00 0.00 O ATOM 1285 CB LYS A 83 -4.274 -9.252 -6.162 1.00 0.00 C ATOM 1286 CG LYS A 83 -3.283 -9.502 -7.287 1.00 0.00 C ATOM 1287 CD LYS A 83 -1.886 -9.779 -6.754 1.00 0.00 C ATOM 1288 CE LYS A 83 -1.525 -11.251 -6.869 1.00 0.00 C ATOM 1289 NZ LYS A 83 -0.111 -11.510 -6.480 1.00 0.00 N ATOM 0 H LYS A 83 -6.168 -9.822 -7.623 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.616 -11.369 -5.940 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -4.887 -8.387 -6.415 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -3.725 -9.000 -5.255 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.618 -10.348 -7.886 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.255 -8.635 -7.947 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.160 -9.182 -7.306 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.826 -9.469 -5.711 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.189 -11.838 -6.234 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.686 -11.585 -7.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.002 -12.509 -6.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.515 -11.297 -7.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.144 -10.905 -5.673 1.00 0.00 H new ATOM 1303 N MET A 84 -4.855 -10.206 -3.484 1.00 0.00 N ATOM 1304 CA MET A 84 -5.232 -10.096 -2.075 1.00 0.00 C ATOM 1305 C MET A 84 -6.489 -9.247 -1.878 1.00 0.00 C ATOM 1306 O MET A 84 -6.836 -8.424 -2.724 1.00 0.00 O ATOM 1307 CB MET A 84 -4.067 -9.511 -1.281 1.00 0.00 C ATOM 1308 CG MET A 84 -2.879 -10.453 -1.187 1.00 0.00 C ATOM 1309 SD MET A 84 -1.597 -10.088 -2.399 1.00 0.00 S ATOM 1310 CE MET A 84 -1.712 -11.527 -3.460 1.00 0.00 C ATOM 0 H MET A 84 -3.849 -10.173 -3.647 1.00 0.00 H new ATOM 0 HA MET A 84 -5.463 -11.097 -1.710 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.748 -8.579 -1.748 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.408 -9.264 -0.276 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.453 -10.393 -0.186 1.00 0.00 H new ATOM 0 HG3 MET A 84 -3.223 -11.478 -1.327 1.00 0.00 H new ATOM 0 HE1 MET A 84 -0.730 -11.751 -3.877 1.00 0.00 H new ATOM 0 HE2 MET A 84 -2.063 -12.380 -2.879 1.00 0.00 H new ATOM 0 HE3 MET A 84 -2.413 -11.327 -4.270 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.196 -9.455 -0.751 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.432 -8.726 -0.438 1.00 0.00 C ATOM 1322 C PRO A 85 -8.203 -7.258 -0.087 1.00 0.00 C ATOM 1323 O PRO A 85 -9.150 -6.472 -0.055 1.00 0.00 O ATOM 1324 CB PRO A 85 -8.986 -9.473 0.776 1.00 0.00 C ATOM 1325 CG PRO A 85 -7.794 -10.092 1.418 1.00 0.00 C ATOM 1326 CD PRO A 85 -6.853 -10.435 0.298 1.00 0.00 C ATOM 0 HA PRO A 85 -9.100 -8.701 -1.299 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -9.496 -8.794 1.460 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.712 -10.229 0.478 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.328 -9.403 2.122 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.072 -10.983 1.981 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.812 -10.345 0.607 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.996 -11.459 -0.047 1.00 0.00 H new ATOM 1334 N TRP A 86 -6.951 -6.890 0.186 1.00 0.00 N ATOM 1335 CA TRP A 86 -6.619 -5.508 0.542 1.00 0.00 C ATOM 1336 C TRP A 86 -7.348 -4.518 -0.363 1.00 0.00 C ATOM 1337 O TRP A 86 -7.828 -4.897 -1.432 1.00 0.00 O ATOM 1338 CB TRP A 86 -5.104 -5.284 0.474 1.00 0.00 C ATOM 1339 CG TRP A 86 -4.458 -5.603 -0.838 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -4.977 -5.419 -2.086 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.141 -6.131 -1.025 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.065 -5.802 -3.034 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -2.930 -6.246 -2.409 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.119 -6.518 -0.154 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -1.739 -6.731 -2.945 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -0.938 -7.000 -0.685 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -0.756 -7.102 -2.069 1.00 0.00 C ATOM 0 H TRP A 86 -6.153 -7.525 0.168 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.950 -5.335 1.566 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -4.899 -4.241 0.715 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -4.631 -5.889 1.247 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -5.962 -5.029 -2.296 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -4.208 -5.763 -4.043 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.250 -6.442 0.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.597 -6.811 -4.013 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -0.142 -7.303 -0.021 1.00 0.00 H new ATOM 0 HH2 TRP A 86 0.179 -7.481 -2.453 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.464 -3.253 0.061 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.164 -2.285 -0.746 1.00 0.00 C ATOM 1360 C LEU A 87 -7.260 -1.685 -1.811 1.00 0.00 C ATOM 1361 O LEU A 87 -6.188 -1.170 -1.514 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.749 -1.174 0.123 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.712 -1.641 1.216 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.359 -1.001 2.553 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -11.145 -1.316 0.828 1.00 0.00 C ATOM 0 H LEU A 87 -7.087 -2.896 0.939 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.977 -2.811 -1.246 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.928 -0.631 0.592 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.272 -0.467 -0.522 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.618 -2.722 1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.056 -1.346 3.317 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.344 -1.282 2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.424 0.084 2.466 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.820 -1.654 1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.251 -0.239 0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.393 -1.822 -0.105 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.708 -1.758 -3.057 1.00 0.00 N ATOM 1378 CA ALA A 88 -6.945 -1.229 -4.177 1.00 0.00 C ATOM 1379 C ALA A 88 -7.673 -0.067 -4.839 1.00 0.00 C ATOM 1380 O ALA A 88 -8.882 -0.125 -5.061 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.687 -2.330 -5.193 1.00 0.00 C ATOM 0 H ALA A 88 -8.599 -2.180 -3.317 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.993 -0.858 -3.796 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.115 -1.927 -6.029 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.123 -3.135 -4.722 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.638 -2.719 -5.558 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.931 0.986 -5.160 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.518 2.153 -5.806 1.00 0.00 C ATOM 1389 C VAL A 89 -8.097 1.776 -7.169 1.00 0.00 C ATOM 1390 O VAL A 89 -7.386 1.252 -8.026 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.487 3.284 -5.995 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.148 4.519 -6.594 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.816 3.620 -4.671 1.00 0.00 C ATOM 0 H VAL A 89 -5.929 1.056 -4.985 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.312 2.513 -5.151 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.721 2.939 -6.689 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.404 5.305 -6.719 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.577 4.268 -7.564 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.937 4.869 -5.928 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.091 4.420 -4.823 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.569 3.944 -3.953 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.306 2.737 -4.287 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.398 2.035 -7.392 1.00 0.00 N ATOM 1404 CA PRO A 90 -10.053 1.713 -8.663 1.00 0.00 C ATOM 1405 C PRO A 90 -9.401 2.427 -9.841 1.00 0.00 C ATOM 1406 O PRO A 90 -8.789 3.482 -9.677 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.495 2.202 -8.470 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.436 3.151 -7.323 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.329 2.658 -6.438 1.00 0.00 C ATOM 0 HA PRO A 90 -9.985 0.650 -8.895 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.868 2.693 -9.369 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.168 1.371 -8.259 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.239 4.167 -7.666 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.384 3.174 -6.786 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.858 3.473 -5.888 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.690 1.942 -5.700 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.538 1.847 -11.030 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.962 2.432 -12.237 1.00 0.00 C ATOM 1419 C PHE A 91 -9.355 3.901 -12.373 1.00 0.00 C ATOM 1420 O PHE A 91 -8.646 4.691 -12.994 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.417 1.655 -13.473 1.00 0.00 C ATOM 1422 CG PHE A 91 -8.842 2.181 -14.758 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -7.473 2.177 -14.973 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -9.671 2.680 -15.750 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -6.942 2.661 -16.154 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -9.145 3.166 -16.932 1.00 0.00 C ATOM 1427 CZ PHE A 91 -7.779 3.156 -17.135 1.00 0.00 C ATOM 0 H PHE A 91 -10.042 0.974 -11.184 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.877 2.371 -12.156 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.134 0.609 -13.359 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.505 1.686 -13.532 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.814 1.791 -14.209 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -10.740 2.689 -15.598 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -5.873 2.652 -16.310 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -9.802 3.553 -17.697 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.366 3.534 -18.059 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.496 4.256 -11.791 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.992 5.625 -11.846 1.00 0.00 C ATOM 1439 C ALA A 92 -9.937 6.637 -11.398 1.00 0.00 C ATOM 1440 O ALA A 92 -9.858 7.737 -11.945 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.245 5.762 -10.995 1.00 0.00 C ATOM 0 H ALA A 92 -11.095 3.612 -11.275 1.00 0.00 H new ATOM 0 HA ALA A 92 -11.233 5.844 -12.886 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.607 6.789 -11.043 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -13.015 5.088 -11.370 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.012 5.508 -9.961 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.137 6.275 -10.396 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.109 7.178 -9.887 1.00 0.00 C ATOM 1449 C GLN A 93 -6.715 6.566 -9.986 1.00 0.00 C ATOM 1450 O GLN A 93 -5.925 6.650 -9.044 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.405 7.548 -8.431 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.883 7.746 -8.130 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.600 8.554 -9.195 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.974 9.279 -9.968 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.922 8.431 -9.241 1.00 0.00 N ATOM 0 H GLN A 93 -9.181 5.371 -9.925 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.128 8.075 -10.506 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -8.014 6.765 -7.781 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.869 8.464 -8.184 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.363 6.772 -8.036 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -9.989 8.248 -7.168 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.400 7.818 -8.581 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.458 8.949 -9.937 1.00 0.00 H new ATOM 1464 N SER A 94 -6.404 5.962 -11.128 1.00 0.00 N ATOM 1465 CA SER A 94 -5.091 5.361 -11.324 1.00 0.00 C ATOM 1466 C SER A 94 -4.034 6.442 -11.511 1.00 0.00 C ATOM 1467 O SER A 94 -2.868 6.252 -11.168 1.00 0.00 O ATOM 1468 CB SER A 94 -5.095 4.423 -12.530 1.00 0.00 C ATOM 1469 OG SER A 94 -6.367 3.832 -12.715 1.00 0.00 O ATOM 0 H SER A 94 -7.036 5.876 -11.924 1.00 0.00 H new ATOM 0 HA SER A 94 -4.851 4.779 -10.434 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.815 4.977 -13.426 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.346 3.644 -12.390 1.00 0.00 H new ATOM 0 HG SER A 94 -6.914 4.406 -13.292 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.452 7.586 -12.051 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.542 8.703 -12.274 1.00 0.00 C ATOM 1477 C GLU A 95 -2.820 9.067 -10.982 1.00 0.00 C ATOM 1478 O GLU A 95 -1.639 9.414 -10.991 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.309 9.916 -12.805 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.409 11.042 -13.286 1.00 0.00 C ATOM 1481 CD GLU A 95 -3.919 11.692 -14.557 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -3.647 11.153 -15.651 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.589 12.742 -14.459 1.00 0.00 O ATOM 0 H GLU A 95 -5.414 7.761 -12.341 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.802 8.402 -13.016 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.950 9.598 -13.627 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.962 10.295 -12.019 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.327 11.797 -12.504 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.406 10.652 -13.459 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.541 8.970 -9.868 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.976 9.272 -8.559 1.00 0.00 C ATOM 1492 C ALA A 96 -1.741 8.427 -8.298 1.00 0.00 C ATOM 1493 O ALA A 96 -0.776 8.883 -7.696 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.001 9.016 -7.470 1.00 0.00 C ATOM 0 H ALA A 96 -4.520 8.684 -9.847 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.693 10.325 -8.549 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.564 9.246 -6.498 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.873 9.649 -7.635 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.303 7.969 -7.493 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.794 7.186 -8.752 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.699 6.249 -8.573 1.00 0.00 C ATOM 1502 C VAL A 97 0.559 6.715 -9.289 1.00 0.00 C ATOM 1503 O VAL A 97 1.677 6.481 -8.829 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.109 4.862 -9.076 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.052 3.889 -8.988 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.309 4.380 -8.279 1.00 0.00 C ATOM 0 H VAL A 97 -2.595 6.801 -9.253 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.474 6.196 -7.508 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.389 4.923 -10.128 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.264 2.911 -9.351 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.879 4.253 -9.599 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.377 3.803 -7.951 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.607 3.393 -8.631 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.046 4.324 -7.223 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.137 5.077 -8.410 1.00 0.00 H new ATOM 1516 N GLN A 98 0.362 7.378 -10.412 1.00 0.00 N ATOM 1517 CA GLN A 98 1.470 7.892 -11.206 1.00 0.00 C ATOM 1518 C GLN A 98 2.112 9.100 -10.529 1.00 0.00 C ATOM 1519 O GLN A 98 3.337 9.208 -10.463 1.00 0.00 O ATOM 1520 CB GLN A 98 0.986 8.276 -12.606 1.00 0.00 C ATOM 1521 CG GLN A 98 0.286 7.143 -13.341 1.00 0.00 C ATOM 1522 CD GLN A 98 0.286 7.336 -14.845 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.876 6.546 -15.583 1.00 0.00 O ATOM 1524 NE2 GLN A 98 -0.378 8.389 -15.307 1.00 0.00 N ATOM 0 H GLN A 98 -0.560 7.576 -10.800 1.00 0.00 H new ATOM 0 HA GLN A 98 2.219 7.105 -11.290 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.304 9.122 -12.526 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.839 8.609 -13.197 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.777 6.200 -13.099 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.742 7.067 -12.988 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.853 9.017 -14.659 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.414 8.569 -16.310 1.00 0.00 H new ATOM 1533 N LYS A 99 1.277 10.004 -10.026 1.00 0.00 N ATOM 1534 CA LYS A 99 1.760 11.203 -9.353 1.00 0.00 C ATOM 1535 C LYS A 99 2.138 10.902 -7.904 1.00 0.00 C ATOM 1536 O LYS A 99 3.125 11.429 -7.390 1.00 0.00 O ATOM 1537 CB LYS A 99 0.690 12.302 -9.392 1.00 0.00 C ATOM 1538 CG LYS A 99 0.083 12.566 -10.772 1.00 0.00 C ATOM 1539 CD LYS A 99 -1.373 12.128 -10.831 1.00 0.00 C ATOM 1540 CE LYS A 99 -2.315 13.320 -10.830 1.00 0.00 C ATOM 1541 NZ LYS A 99 -2.141 14.167 -12.042 1.00 0.00 N ATOM 0 H LYS A 99 0.261 9.928 -10.072 1.00 0.00 H new ATOM 0 HA LYS A 99 2.650 11.549 -9.879 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.112 12.032 -8.705 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.129 13.228 -9.022 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.155 13.628 -11.006 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.656 12.033 -11.531 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.539 11.533 -11.729 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -1.596 11.487 -9.978 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.345 12.968 -10.778 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.138 13.922 -9.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.032 14.661 -12.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.389 14.865 -11.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -1.880 13.567 -12.850 1.00 0.00 H new ATOM 1555 N LEU A 100 1.348 10.059 -7.247 1.00 0.00 N ATOM 1556 CA LEU A 100 1.608 9.700 -5.854 1.00 0.00 C ATOM 1557 C LEU A 100 2.916 8.925 -5.729 1.00 0.00 C ATOM 1558 O LEU A 100 3.577 8.969 -4.691 1.00 0.00 O ATOM 1559 CB LEU A 100 0.450 8.873 -5.292 1.00 0.00 C ATOM 1560 CG LEU A 100 0.633 8.360 -3.869 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.377 9.480 -2.877 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.300 7.179 -3.614 1.00 0.00 C ATOM 0 H LEU A 100 0.526 9.612 -7.653 1.00 0.00 H new ATOM 0 HA LEU A 100 1.697 10.620 -5.277 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.455 9.479 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.286 8.018 -5.948 1.00 0.00 H new ATOM 0 HG LEU A 100 1.659 8.017 -3.740 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.510 9.105 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.079 10.294 -3.058 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.642 9.847 -2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.162 6.820 -2.594 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.334 7.496 -3.750 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.072 6.377 -4.316 1.00 0.00 H new ATOM 1574 N SER A 101 3.286 8.218 -6.792 1.00 0.00 N ATOM 1575 CA SER A 101 4.518 7.438 -6.800 1.00 0.00 C ATOM 1576 C SER A 101 5.728 8.338 -6.575 1.00 0.00 C ATOM 1577 O SER A 101 6.596 8.035 -5.754 1.00 0.00 O ATOM 1578 CB SER A 101 4.664 6.687 -8.124 1.00 0.00 C ATOM 1579 OG SER A 101 4.756 7.588 -9.214 1.00 0.00 O ATOM 0 H SER A 101 2.750 8.169 -7.659 1.00 0.00 H new ATOM 0 HA SER A 101 4.468 6.714 -5.986 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.553 6.057 -8.092 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.810 6.025 -8.266 1.00 0.00 H new ATOM 0 HG SER A 101 4.025 8.238 -9.163 1.00 0.00 H new ATOM 1585 N LYS A 102 5.779 9.447 -7.306 1.00 0.00 N ATOM 1586 CA LYS A 102 6.882 10.393 -7.183 1.00 0.00 C ATOM 1587 C LYS A 102 6.913 11.009 -5.788 1.00 0.00 C ATOM 1588 O LYS A 102 7.960 11.063 -5.145 1.00 0.00 O ATOM 1589 CB LYS A 102 6.758 11.493 -8.240 1.00 0.00 C ATOM 1590 CG LYS A 102 8.086 11.885 -8.868 1.00 0.00 C ATOM 1591 CD LYS A 102 7.932 12.198 -10.348 1.00 0.00 C ATOM 1592 CE LYS A 102 8.898 13.284 -10.791 1.00 0.00 C ATOM 1593 NZ LYS A 102 8.307 14.645 -10.653 1.00 0.00 N ATOM 0 H LYS A 102 5.070 9.712 -7.989 1.00 0.00 H new ATOM 0 HA LYS A 102 7.815 9.852 -7.342 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.080 11.157 -9.024 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.307 12.374 -7.784 1.00 0.00 H new ATOM 0 HG2 LYS A 102 8.491 12.755 -8.351 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.804 11.075 -8.739 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.106 11.294 -10.932 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.909 12.515 -10.549 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.810 13.223 -10.197 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.182 13.115 -11.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.998 15.357 -10.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.451 14.713 -11.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.059 14.817 -9.658 1.00 0.00 H new ATOM 1607 N HIS A 103 5.753 11.468 -5.326 1.00 0.00 N ATOM 1608 CA HIS A 103 5.645 12.075 -4.005 1.00 0.00 C ATOM 1609 C HIS A 103 6.008 11.070 -2.917 1.00 0.00 C ATOM 1610 O HIS A 103 6.460 11.446 -1.835 1.00 0.00 O ATOM 1611 CB HIS A 103 4.225 12.601 -3.779 1.00 0.00 C ATOM 1612 CG HIS A 103 4.087 14.071 -4.020 1.00 0.00 C ATOM 1613 ND1 HIS A 103 4.437 15.024 -3.086 1.00 0.00 N ATOM 1614 CD2 HIS A 103 3.633 14.754 -5.098 1.00 0.00 C ATOM 1615 CE1 HIS A 103 4.203 16.228 -3.578 1.00 0.00 C ATOM 1616 NE2 HIS A 103 3.716 16.092 -4.798 1.00 0.00 N ATOM 0 H HIS A 103 4.877 11.431 -5.847 1.00 0.00 H new ATOM 0 HA HIS A 103 6.346 12.908 -3.954 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.539 12.067 -4.437 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.922 12.379 -2.756 1.00 0.00 H new ATOM 0 HD2 HIS A 103 3.273 14.326 -6.022 1.00 0.00 H new ATOM 0 HE1 HIS A 103 4.380 17.164 -3.069 1.00 0.00 H new ATOM 0 HE2 HIS A 103 3.445 16.856 -5.417 1.00 0.00 H new ATOM 1625 N PHE A 104 5.807 9.790 -3.213 1.00 0.00 N ATOM 1626 CA PHE A 104 6.112 8.726 -2.263 1.00 0.00 C ATOM 1627 C PHE A 104 7.535 8.201 -2.456 1.00 0.00 C ATOM 1628 O PHE A 104 7.868 7.106 -2.002 1.00 0.00 O ATOM 1629 CB PHE A 104 5.109 7.581 -2.416 1.00 0.00 C ATOM 1630 CG PHE A 104 3.907 7.707 -1.522 1.00 0.00 C ATOM 1631 CD1 PHE A 104 3.332 8.944 -1.279 1.00 0.00 C ATOM 1632 CD2 PHE A 104 3.352 6.586 -0.925 1.00 0.00 C ATOM 1633 CE1 PHE A 104 2.227 9.062 -0.458 1.00 0.00 C ATOM 1634 CE2 PHE A 104 2.246 6.698 -0.104 1.00 0.00 C ATOM 1635 CZ PHE A 104 1.683 7.938 0.130 1.00 0.00 C ATOM 0 H PHE A 104 5.434 9.464 -4.104 1.00 0.00 H new ATOM 0 HA PHE A 104 6.036 9.141 -1.258 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.776 7.537 -3.453 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.612 6.638 -2.203 1.00 0.00 H new ATOM 0 HD1 PHE A 104 3.753 9.827 -1.737 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.789 5.614 -1.103 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.789 10.033 -0.277 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.822 5.817 0.354 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.819 8.028 0.772 1.00 0.00 H new ATOM 1645 N ASN A 105 8.372 8.988 -3.125 1.00 0.00 N ATOM 1646 CA ASN A 105 9.756 8.604 -3.368 1.00 0.00 C ATOM 1647 C ASN A 105 9.843 7.271 -4.108 1.00 0.00 C ATOM 1648 O ASN A 105 10.814 6.529 -3.953 1.00 0.00 O ATOM 1649 CB ASN A 105 10.514 8.519 -2.045 1.00 0.00 C ATOM 1650 CG ASN A 105 12.008 8.714 -2.218 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.806 7.855 -1.843 1.00 0.00 O ATOM 1652 ND2 ASN A 105 12.396 9.849 -2.788 1.00 0.00 N ATOM 0 H ASN A 105 8.114 9.897 -3.509 1.00 0.00 H new ATOM 0 HA ASN A 105 10.212 9.368 -3.998 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.129 9.275 -1.360 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.328 7.548 -1.585 1.00 0.00 H new ATOM 0 HD21 ASN A 105 13.389 10.035 -2.930 1.00 0.00 H new ATOM 0 HD22 ASN A 105 11.701 10.534 -3.084 1.00 0.00 H new ATOM 1659 N VAL A 106 8.831 6.975 -4.917 1.00 0.00 N ATOM 1660 CA VAL A 106 8.809 5.732 -5.684 1.00 0.00 C ATOM 1661 C VAL A 106 9.470 5.923 -7.044 1.00 0.00 C ATOM 1662 O VAL A 106 8.855 6.440 -7.977 1.00 0.00 O ATOM 1663 CB VAL A 106 7.374 5.207 -5.892 1.00 0.00 C ATOM 1664 CG1 VAL A 106 7.402 3.786 -6.438 1.00 0.00 C ATOM 1665 CG2 VAL A 106 6.586 5.271 -4.594 1.00 0.00 C ATOM 0 H VAL A 106 8.018 7.575 -5.059 1.00 0.00 H new ATOM 0 HA VAL A 106 9.366 4.997 -5.103 1.00 0.00 H new ATOM 0 HB VAL A 106 6.876 5.845 -6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.381 3.430 -6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 106 7.926 3.774 -7.394 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.919 3.135 -5.733 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.576 4.896 -4.762 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.079 4.659 -3.839 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.537 6.304 -4.249 1.00 0.00 H new ATOM 1675 N GLU A 107 10.726 5.507 -7.147 1.00 0.00 N ATOM 1676 CA GLU A 107 11.475 5.636 -8.392 1.00 0.00 C ATOM 1677 C GLU A 107 11.272 4.414 -9.281 1.00 0.00 C ATOM 1678 O GLU A 107 11.314 4.515 -10.507 1.00 0.00 O ATOM 1679 CB GLU A 107 12.964 5.826 -8.098 1.00 0.00 C ATOM 1680 CG GLU A 107 13.684 6.677 -9.129 1.00 0.00 C ATOM 1681 CD GLU A 107 13.715 8.146 -8.754 1.00 0.00 C ATOM 1682 OE1 GLU A 107 14.520 8.517 -7.873 1.00 0.00 O ATOM 1683 OE2 GLU A 107 12.934 8.926 -9.340 1.00 0.00 O ATOM 0 H GLU A 107 11.248 5.077 -6.383 1.00 0.00 H new ATOM 0 HA GLU A 107 11.101 6.512 -8.922 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.076 6.287 -7.117 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.443 4.848 -8.048 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.705 6.314 -9.245 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.193 6.563 -10.096 1.00 0.00 H new ATOM 1690 N SER A 108 11.056 3.261 -8.658 1.00 0.00 N ATOM 1691 CA SER A 108 10.850 2.025 -9.402 1.00 0.00 C ATOM 1692 C SER A 108 10.127 0.982 -8.557 1.00 0.00 C ATOM 1693 O SER A 108 10.252 0.960 -7.332 1.00 0.00 O ATOM 1694 CB SER A 108 12.190 1.465 -9.882 1.00 0.00 C ATOM 1695 OG SER A 108 12.829 2.362 -10.773 1.00 0.00 O ATOM 0 H SER A 108 11.019 3.157 -7.644 1.00 0.00 H new ATOM 0 HA SER A 108 10.226 2.257 -10.265 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.837 1.277 -9.025 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.031 0.507 -10.378 1.00 0.00 H new ATOM 0 HG SER A 108 12.207 3.078 -11.018 1.00 0.00 H new ATOM 1701 N ILE A 109 9.373 0.117 -9.225 1.00 0.00 N ATOM 1702 CA ILE A 109 8.626 -0.937 -8.555 1.00 0.00 C ATOM 1703 C ILE A 109 9.370 -2.269 -8.634 1.00 0.00 C ATOM 1704 O ILE A 109 10.255 -2.438 -9.473 1.00 0.00 O ATOM 1705 CB ILE A 109 7.224 -1.101 -9.175 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.332 -1.307 -10.694 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.360 0.106 -8.838 1.00 0.00 C ATOM 1708 CD1 ILE A 109 7.214 -0.035 -11.513 1.00 0.00 C ATOM 0 H ILE A 109 9.263 0.127 -10.239 1.00 0.00 H new ATOM 0 HA ILE A 109 8.522 -0.647 -7.510 1.00 0.00 H new ATOM 0 HB ILE A 109 6.748 -1.986 -8.753 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.289 -1.779 -10.916 1.00 0.00 H new ATOM 0 HG13 ILE A 109 6.553 -2.001 -11.010 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.372 -0.019 -9.280 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.265 0.194 -7.756 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.824 1.008 -9.236 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.302 -0.275 -12.573 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.246 0.430 -11.325 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.009 0.655 -11.230 1.00 0.00 H new ATOM 1720 N PRO A 110 9.030 -3.237 -7.763 1.00 0.00 N ATOM 1721 CA PRO A 110 7.990 -3.096 -6.746 1.00 0.00 C ATOM 1722 C PRO A 110 8.511 -2.461 -5.463 1.00 0.00 C ATOM 1723 O PRO A 110 9.679 -2.619 -5.107 1.00 0.00 O ATOM 1724 CB PRO A 110 7.552 -4.548 -6.478 1.00 0.00 C ATOM 1725 CG PRO A 110 8.480 -5.425 -7.271 1.00 0.00 C ATOM 1726 CD PRO A 110 9.633 -4.563 -7.703 1.00 0.00 C ATOM 0 HA PRO A 110 7.184 -2.444 -7.082 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.611 -4.781 -5.415 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.517 -4.704 -6.782 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.829 -6.263 -6.668 1.00 0.00 H new ATOM 0 HG3 PRO A 110 7.968 -5.847 -8.136 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.458 -4.602 -6.991 1.00 0.00 H new ATOM 0 HD3 PRO A 110 10.031 -4.872 -8.670 1.00 0.00 H new ATOM 1734 N THR A 111 7.634 -1.745 -4.768 1.00 0.00 N ATOM 1735 CA THR A 111 7.998 -1.091 -3.519 1.00 0.00 C ATOM 1736 C THR A 111 6.843 -1.157 -2.522 1.00 0.00 C ATOM 1737 O THR A 111 5.735 -1.565 -2.868 1.00 0.00 O ATOM 1738 CB THR A 111 8.404 0.366 -3.777 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.291 0.822 -2.772 1.00 0.00 O ATOM 1740 CG2 THR A 111 7.234 1.327 -3.826 1.00 0.00 C ATOM 0 H THR A 111 6.664 -1.603 -5.050 1.00 0.00 H new ATOM 0 HA THR A 111 8.851 -1.617 -3.090 1.00 0.00 H new ATOM 0 HB THR A 111 8.880 0.358 -4.758 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.541 1.752 -2.954 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.600 2.337 -4.012 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.556 1.034 -4.627 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.703 1.303 -2.874 1.00 0.00 H new ATOM 1748 N LEU A 112 7.103 -0.734 -1.290 1.00 0.00 N ATOM 1749 CA LEU A 112 6.065 -0.731 -0.254 1.00 0.00 C ATOM 1750 C LEU A 112 6.276 0.434 0.708 1.00 0.00 C ATOM 1751 O LEU A 112 7.360 0.601 1.267 1.00 0.00 O ATOM 1752 CB LEU A 112 6.014 -2.084 0.505 1.00 0.00 C ATOM 1753 CG LEU A 112 4.955 -2.219 1.618 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.686 -1.447 1.316 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.607 -3.672 1.854 1.00 0.00 C ATOM 0 H LEU A 112 8.013 -0.391 -0.982 1.00 0.00 H new ATOM 0 HA LEU A 112 5.100 -0.600 -0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.843 -2.876 -0.224 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.995 -2.263 0.946 1.00 0.00 H new ATOM 0 HG LEU A 112 5.402 -1.792 2.516 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.977 -1.579 2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.921 -0.388 1.207 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.246 -1.818 0.390 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.858 -3.743 2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.209 -4.105 0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.503 -4.217 2.153 1.00 0.00 H new ATOM 1767 N ILE A 113 5.239 1.248 0.885 1.00 0.00 N ATOM 1768 CA ILE A 113 5.317 2.408 1.769 1.00 0.00 C ATOM 1769 C ILE A 113 4.118 2.467 2.714 1.00 0.00 C ATOM 1770 O ILE A 113 2.995 2.140 2.329 1.00 0.00 O ATOM 1771 CB ILE A 113 5.386 3.714 0.949 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.546 3.645 -0.048 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.533 4.926 1.861 1.00 0.00 C ATOM 1774 CD1 ILE A 113 6.749 4.923 -0.832 1.00 0.00 C ATOM 0 H ILE A 113 4.335 1.126 0.428 1.00 0.00 H new ATOM 0 HA ILE A 113 6.226 2.304 2.362 1.00 0.00 H new ATOM 0 HB ILE A 113 4.453 3.824 0.397 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.464 3.410 0.491 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.367 2.826 -0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.579 5.832 1.257 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.677 4.981 2.533 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.448 4.833 2.446 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.587 4.800 -1.518 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.846 5.149 -1.399 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.960 5.742 -0.144 1.00 0.00 H new ATOM 1786 N GLY A 114 4.363 2.894 3.952 1.00 0.00 N ATOM 1787 CA GLY A 114 3.293 2.995 4.926 1.00 0.00 C ATOM 1788 C GLY A 114 2.992 4.433 5.300 1.00 0.00 C ATOM 1789 O GLY A 114 3.907 5.230 5.509 1.00 0.00 O ATOM 0 H GLY A 114 5.283 3.171 4.295 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.393 2.530 4.524 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.566 2.438 5.822 1.00 0.00 H new ATOM 1793 N VAL A 115 1.708 4.766 5.389 1.00 0.00 N ATOM 1794 CA VAL A 115 1.295 6.113 5.742 1.00 0.00 C ATOM 1795 C VAL A 115 0.211 6.080 6.810 1.00 0.00 C ATOM 1796 O VAL A 115 -0.621 5.174 6.841 1.00 0.00 O ATOM 1797 CB VAL A 115 0.787 6.904 4.513 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.641 6.604 3.291 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.678 6.604 4.230 1.00 0.00 C ATOM 0 H VAL A 115 0.938 4.119 5.221 1.00 0.00 H new ATOM 0 HA VAL A 115 2.176 6.623 6.133 1.00 0.00 H new ATOM 0 HB VAL A 115 0.872 7.966 4.742 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.267 7.170 2.438 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.674 6.888 3.490 1.00 0.00 H new ATOM 0 HG13 VAL A 115 1.595 5.538 3.068 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.005 7.175 3.361 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.800 5.539 4.031 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.280 6.883 5.095 1.00 0.00 H new ATOM 1809 N ASP A 116 0.228 7.075 7.678 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.753 7.174 8.749 1.00 0.00 C ATOM 1811 C ASP A 116 -1.772 8.261 8.444 1.00 0.00 C ATOM 1812 O ASP A 116 -1.444 9.448 8.426 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.064 7.466 10.083 1.00 0.00 C ATOM 1814 CG ASP A 116 0.493 6.216 10.733 1.00 0.00 C ATOM 1815 OD1 ASP A 116 -0.194 5.173 10.705 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.619 6.278 11.271 1.00 0.00 O ATOM 0 H ASP A 116 0.913 7.831 7.664 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.272 6.218 8.822 1.00 0.00 H new ATOM 0 HB2 ASP A 116 0.744 8.179 9.922 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -0.776 7.938 10.760 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.011 7.851 8.206 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.081 8.792 7.902 1.00 0.00 C ATOM 1823 C ALA A 117 -4.237 9.813 9.026 1.00 0.00 C ATOM 1824 O ALA A 117 -4.233 11.021 8.788 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.386 8.046 7.664 1.00 0.00 C ATOM 0 H ALA A 117 -3.300 6.873 8.218 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.821 9.332 6.991 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.178 8.760 7.438 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.265 7.360 6.825 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.651 7.482 8.558 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.367 9.315 10.250 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.518 10.164 11.416 1.00 0.00 C ATOM 1833 C ASP A 118 -3.340 11.121 11.574 1.00 0.00 C ATOM 1834 O ASP A 118 -3.517 12.338 11.627 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.647 9.286 12.653 1.00 0.00 C ATOM 1836 CG ASP A 118 -3.545 8.248 12.756 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -3.547 7.298 11.945 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -2.681 8.386 13.647 1.00 0.00 O ATOM 0 H ASP A 118 -4.370 8.316 10.457 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.415 10.770 11.289 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.631 9.915 13.543 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -5.614 8.782 12.636 1.00 0.00 H new ATOM 1843 N SER A 119 -2.142 10.560 11.659 1.00 0.00 N ATOM 1844 CA SER A 119 -0.929 11.354 11.824 1.00 0.00 C ATOM 1845 C SER A 119 -0.757 12.346 10.679 1.00 0.00 C ATOM 1846 O SER A 119 -0.428 13.512 10.901 1.00 0.00 O ATOM 1847 CB SER A 119 0.294 10.440 11.907 1.00 0.00 C ATOM 1848 OG SER A 119 1.371 11.084 12.567 1.00 0.00 O ATOM 0 H SER A 119 -1.982 9.554 11.616 1.00 0.00 H new ATOM 0 HA SER A 119 -1.022 11.917 12.752 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.032 9.525 12.439 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.602 10.148 10.903 1.00 0.00 H new ATOM 0 HG SER A 119 2.139 10.477 12.608 1.00 0.00 H new ATOM 1854 N GLY A 120 -0.984 11.884 9.453 1.00 0.00 N ATOM 1855 CA GLY A 120 -0.848 12.756 8.302 1.00 0.00 C ATOM 1856 C GLY A 120 -0.389 12.025 7.056 1.00 0.00 C ATOM 1857 O GLY A 120 -1.038 11.082 6.604 1.00 0.00 O ATOM 0 H GLY A 120 -1.258 10.926 9.237 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.806 13.237 8.102 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.136 13.548 8.535 1.00 0.00 H new ATOM 1861 N ASP A 121 0.732 12.468 6.494 1.00 0.00 N ATOM 1862 CA ASP A 121 1.278 11.860 5.285 1.00 0.00 C ATOM 1863 C ASP A 121 2.095 10.611 5.612 1.00 0.00 C ATOM 1864 O ASP A 121 2.032 10.090 6.725 1.00 0.00 O ATOM 1865 CB ASP A 121 2.143 12.875 4.531 1.00 0.00 C ATOM 1866 CG ASP A 121 3.406 13.240 5.290 1.00 0.00 C ATOM 1867 OD1 ASP A 121 3.450 13.003 6.515 1.00 0.00 O ATOM 1868 OD2 ASP A 121 4.349 13.759 4.657 1.00 0.00 O ATOM 0 H ASP A 121 1.281 13.247 6.857 1.00 0.00 H new ATOM 0 HA ASP A 121 0.444 11.559 4.652 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.413 12.465 3.558 1.00 0.00 H new ATOM 0 HB3 ASP A 121 1.560 13.778 4.346 1.00 0.00 H new ATOM 1873 N VAL A 122 2.858 10.138 4.630 1.00 0.00 N ATOM 1874 CA VAL A 122 3.688 8.951 4.799 1.00 0.00 C ATOM 1875 C VAL A 122 4.627 9.091 5.995 1.00 0.00 C ATOM 1876 O VAL A 122 5.241 10.138 6.198 1.00 0.00 O ATOM 1877 CB VAL A 122 4.525 8.673 3.536 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.323 7.387 3.689 1.00 0.00 C ATOM 1879 CG2 VAL A 122 3.631 8.612 2.304 1.00 0.00 C ATOM 0 H VAL A 122 2.918 10.562 3.704 1.00 0.00 H new ATOM 0 HA VAL A 122 3.010 8.116 4.975 1.00 0.00 H new ATOM 0 HB VAL A 122 5.230 9.494 3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 122 5.906 7.211 2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 122 5.995 7.475 4.543 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.641 6.552 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.240 8.415 1.422 1.00 0.00 H new ATOM 0 HG22 VAL A 122 2.899 7.814 2.425 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.114 9.564 2.182 1.00 0.00 H new ATOM 1889 N VAL A 123 4.731 8.023 6.780 1.00 0.00 N ATOM 1890 CA VAL A 123 5.591 8.013 7.953 1.00 0.00 C ATOM 1891 C VAL A 123 6.865 7.211 7.701 1.00 0.00 C ATOM 1892 O VAL A 123 7.879 7.414 8.369 1.00 0.00 O ATOM 1893 CB VAL A 123 4.864 7.422 9.175 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.700 7.599 10.434 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.494 8.060 9.339 1.00 0.00 C ATOM 0 H VAL A 123 4.227 7.151 6.622 1.00 0.00 H new ATOM 0 HA VAL A 123 5.854 9.051 8.158 1.00 0.00 H new ATOM 0 HB VAL A 123 4.724 6.354 9.010 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.169 7.175 11.286 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.655 7.089 10.311 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.876 8.661 10.608 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.994 7.631 10.207 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.608 9.135 9.480 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.896 7.873 8.447 1.00 0.00 H new ATOM 1905 N THR A 124 6.808 6.296 6.736 1.00 0.00 N ATOM 1906 CA THR A 124 7.956 5.465 6.401 1.00 0.00 C ATOM 1907 C THR A 124 7.921 5.086 4.922 1.00 0.00 C ATOM 1908 O THR A 124 6.851 4.867 4.359 1.00 0.00 O ATOM 1909 CB THR A 124 7.978 4.204 7.278 1.00 0.00 C ATOM 1910 OG1 THR A 124 8.571 3.117 6.589 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.603 3.760 7.742 1.00 0.00 C ATOM 0 H THR A 124 5.977 6.113 6.173 1.00 0.00 H new ATOM 0 HA THR A 124 8.866 6.034 6.592 1.00 0.00 H new ATOM 0 HB THR A 124 8.563 4.482 8.154 1.00 0.00 H new ATOM 0 HG1 THR A 124 9.359 2.807 7.083 1.00 0.00 H new ATOM 0 HG21 THR A 124 6.698 2.864 8.356 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.143 4.555 8.329 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.980 3.541 6.875 1.00 0.00 H new ATOM 1919 N THR A 125 9.093 5.016 4.293 1.00 0.00 N ATOM 1920 CA THR A 125 9.174 4.672 2.879 1.00 0.00 C ATOM 1921 C THR A 125 10.063 3.453 2.656 1.00 0.00 C ATOM 1922 O THR A 125 10.641 3.279 1.583 1.00 0.00 O ATOM 1923 CB THR A 125 9.698 5.863 2.078 1.00 0.00 C ATOM 1924 OG1 THR A 125 11.037 6.158 2.433 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.879 7.119 2.284 1.00 0.00 C ATOM 0 H THR A 125 9.993 5.192 4.739 1.00 0.00 H new ATOM 0 HA THR A 125 8.171 4.423 2.533 1.00 0.00 H new ATOM 0 HB THR A 125 9.628 5.566 1.032 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.354 6.922 1.908 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.300 7.930 1.689 1.00 0.00 H new ATOM 0 HG22 THR A 125 7.850 6.938 1.973 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.896 7.396 3.338 1.00 0.00 H new ATOM 1933 N ARG A 126 10.155 2.604 3.673 1.00 0.00 N ATOM 1934 CA ARG A 126 10.958 1.389 3.592 1.00 0.00 C ATOM 1935 C ARG A 126 10.160 0.206 4.124 1.00 0.00 C ATOM 1936 O ARG A 126 10.658 -0.589 4.922 1.00 0.00 O ATOM 1937 CB ARG A 126 12.264 1.538 4.385 1.00 0.00 C ATOM 1938 CG ARG A 126 12.713 2.979 4.583 1.00 0.00 C ATOM 1939 CD ARG A 126 12.328 3.499 5.960 1.00 0.00 C ATOM 1940 NE ARG A 126 13.481 4.022 6.688 1.00 0.00 N ATOM 1941 CZ ARG A 126 13.511 4.186 8.009 1.00 0.00 C ATOM 1942 NH1 ARG A 126 12.455 3.875 8.749 1.00 0.00 N ATOM 1943 NH2 ARG A 126 14.603 4.663 8.592 1.00 0.00 N ATOM 0 H ARG A 126 9.681 2.735 4.567 1.00 0.00 H new ATOM 0 HA ARG A 126 11.212 1.215 2.546 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.138 1.071 5.362 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.053 0.991 3.870 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.794 3.045 4.457 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.264 3.610 3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.579 4.284 5.855 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.869 2.695 6.536 1.00 0.00 H new ATOM 0 HE ARG A 126 14.312 4.276 6.153 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.613 3.507 8.307 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.485 4.003 9.760 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.418 4.904 8.028 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.627 4.789 9.604 1.00 0.00 H new ATOM 1957 N ALA A 127 8.909 0.108 3.687 1.00 0.00 N ATOM 1958 CA ALA A 127 8.029 -0.963 4.127 1.00 0.00 C ATOM 1959 C ALA A 127 8.288 -2.262 3.371 1.00 0.00 C ATOM 1960 O ALA A 127 7.784 -3.318 3.752 1.00 0.00 O ATOM 1961 CB ALA A 127 6.574 -0.537 3.979 1.00 0.00 C ATOM 0 H ALA A 127 8.483 0.759 3.028 1.00 0.00 H new ATOM 0 HA ALA A 127 8.241 -1.156 5.179 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.923 -1.345 4.311 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.391 0.349 4.586 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.366 -0.310 2.933 1.00 0.00 H new ATOM 1967 N ARG A 128 9.083 -2.188 2.310 1.00 0.00 N ATOM 1968 CA ARG A 128 9.403 -3.374 1.530 1.00 0.00 C ATOM 1969 C ARG A 128 10.380 -4.257 2.297 1.00 0.00 C ATOM 1970 O ARG A 128 10.299 -5.482 2.242 1.00 0.00 O ATOM 1971 CB ARG A 128 9.991 -2.984 0.171 1.00 0.00 C ATOM 1972 CG ARG A 128 11.333 -2.273 0.263 1.00 0.00 C ATOM 1973 CD ARG A 128 12.490 -3.231 0.022 1.00 0.00 C ATOM 1974 NE ARG A 128 13.483 -2.669 -0.891 1.00 0.00 N ATOM 1975 CZ ARG A 128 14.388 -1.760 -0.535 1.00 0.00 C ATOM 1976 NH1 ARG A 128 14.428 -1.307 0.712 1.00 0.00 N ATOM 1977 NH2 ARG A 128 15.255 -1.302 -1.427 1.00 0.00 N ATOM 0 H ARG A 128 9.514 -1.327 1.973 1.00 0.00 H new ATOM 0 HA ARG A 128 8.484 -3.934 1.357 1.00 0.00 H new ATOM 0 HB2 ARG A 128 10.107 -3.882 -0.435 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.283 -2.338 -0.349 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.369 -1.466 -0.469 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.437 -1.816 1.247 1.00 0.00 H new ATOM 0 HD2 ARG A 128 12.966 -3.471 0.973 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.108 -4.166 -0.388 1.00 0.00 H new ATOM 0 HE ARG A 128 13.483 -2.992 -1.858 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.763 -1.655 1.403 1.00 0.00 H new ATOM 0 HH12 ARG A 128 15.123 -0.610 0.980 1.00 0.00 H new ATOM 0 HH21 ARG A 128 15.229 -1.646 -2.387 1.00 0.00 H new ATOM 0 HH22 ARG A 128 15.948 -0.605 -1.154 1.00 0.00 H new ATOM 1991 N ALA A 129 11.300 -3.619 3.012 1.00 0.00 N ATOM 1992 CA ALA A 129 12.299 -4.329 3.802 1.00 0.00 C ATOM 1993 C ALA A 129 11.766 -4.704 5.183 1.00 0.00 C ATOM 1994 O ALA A 129 11.904 -5.841 5.628 1.00 0.00 O ATOM 1995 CB ALA A 129 13.545 -3.470 3.949 1.00 0.00 C ATOM 0 H ALA A 129 11.374 -2.603 3.060 1.00 0.00 H new ATOM 0 HA ALA A 129 12.545 -5.252 3.276 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.288 -4.005 4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.955 -3.251 2.963 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.287 -2.537 4.450 1.00 0.00 H new ATOM 2001 N THR A 130 11.188 -3.720 5.862 1.00 0.00 N ATOM 2002 CA THR A 130 10.662 -3.889 7.195 1.00 0.00 C ATOM 2003 C THR A 130 9.611 -4.981 7.282 1.00 0.00 C ATOM 2004 O THR A 130 9.674 -5.836 8.160 1.00 0.00 O ATOM 2005 CB THR A 130 10.105 -2.559 7.675 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.097 -2.091 6.802 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.161 -1.477 7.785 1.00 0.00 C ATOM 0 H THR A 130 11.074 -2.776 5.492 1.00 0.00 H new ATOM 0 HA THR A 130 11.478 -4.210 7.842 1.00 0.00 H new ATOM 0 HB THR A 130 9.701 -2.755 8.668 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.394 -1.648 7.322 1.00 0.00 H new ATOM 0 HG21 THR A 130 10.700 -0.552 8.132 1.00 0.00 H new ATOM 0 HG22 THR A 130 11.928 -1.788 8.494 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.615 -1.311 6.808 1.00 0.00 H new ATOM 2015 N LEU A 131 8.644 -4.961 6.385 1.00 0.00 N ATOM 2016 CA LEU A 131 7.596 -5.968 6.407 1.00 0.00 C ATOM 2017 C LEU A 131 8.193 -7.372 6.428 1.00 0.00 C ATOM 2018 O LEU A 131 7.639 -8.283 7.043 1.00 0.00 O ATOM 2019 CB LEU A 131 6.682 -5.808 5.194 1.00 0.00 C ATOM 2020 CG LEU A 131 5.306 -6.461 5.336 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.205 -5.466 5.003 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.204 -7.692 4.447 1.00 0.00 C ATOM 0 H LEU A 131 8.560 -4.269 5.640 1.00 0.00 H new ATOM 0 HA LEU A 131 7.010 -5.828 7.315 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.545 -4.745 4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.181 -6.231 4.322 1.00 0.00 H new ATOM 0 HG LEU A 131 5.180 -6.776 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.234 -5.949 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.264 -4.616 5.683 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.327 -5.119 3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.218 -8.143 4.562 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.352 -7.403 3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.969 -8.413 4.735 1.00 0.00 H new ATOM 2034 N VAL A 132 9.325 -7.541 5.751 1.00 0.00 N ATOM 2035 CA VAL A 132 9.996 -8.825 5.692 1.00 0.00 C ATOM 2036 C VAL A 132 10.999 -8.993 6.828 1.00 0.00 C ATOM 2037 O VAL A 132 11.181 -10.086 7.362 1.00 0.00 O ATOM 2038 CB VAL A 132 10.736 -9.020 4.353 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.389 -10.364 3.732 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.448 -7.890 3.380 1.00 0.00 C ATOM 0 H VAL A 132 9.795 -6.797 5.235 1.00 0.00 H new ATOM 0 HA VAL A 132 9.213 -9.578 5.788 1.00 0.00 H new ATOM 0 HB VAL A 132 11.804 -9.004 4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.923 -10.478 2.789 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.679 -11.165 4.412 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.316 -10.414 3.549 1.00 0.00 H new ATOM 0 HG21 VAL A 132 10.988 -8.065 2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.378 -7.849 3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 132 10.771 -6.944 3.815 1.00 0.00 H new ATOM 2050 N LYS A 133 11.692 -7.902 7.148 1.00 0.00 N ATOM 2051 CA LYS A 133 12.733 -7.918 8.167 1.00 0.00 C ATOM 2052 C LYS A 133 12.254 -7.372 9.515 1.00 0.00 C ATOM 2053 O LYS A 133 13.065 -7.013 10.368 1.00 0.00 O ATOM 2054 CB LYS A 133 13.933 -7.120 7.656 1.00 0.00 C ATOM 2055 CG LYS A 133 14.318 -7.463 6.224 1.00 0.00 C ATOM 2056 CD LYS A 133 15.013 -8.814 6.144 1.00 0.00 C ATOM 2057 CE LYS A 133 14.072 -9.898 5.646 1.00 0.00 C ATOM 2058 NZ LYS A 133 14.757 -11.213 5.516 1.00 0.00 N ATOM 0 H LYS A 133 11.548 -6.991 6.712 1.00 0.00 H new ATOM 0 HA LYS A 133 13.016 -8.955 8.346 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.706 -6.056 7.719 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.787 -7.303 8.308 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.425 -7.474 5.598 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.976 -6.690 5.827 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.872 -8.743 5.477 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.395 -9.086 7.128 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.232 -9.993 6.334 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.661 -9.606 4.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.080 -11.925 5.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.543 -11.130 4.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 15.127 -11.505 6.443 1.00 0.00 H new ATOM 2072 N ASP A 134 10.941 -7.332 9.708 1.00 0.00 N ATOM 2073 CA ASP A 134 10.359 -6.852 10.962 1.00 0.00 C ATOM 2074 C ASP A 134 9.075 -7.614 11.276 1.00 0.00 C ATOM 2075 O ASP A 134 7.984 -7.043 11.271 1.00 0.00 O ATOM 2076 CB ASP A 134 10.076 -5.348 10.903 1.00 0.00 C ATOM 2077 CG ASP A 134 11.336 -4.526 10.713 1.00 0.00 C ATOM 2078 OD1 ASP A 134 12.364 -4.861 11.338 1.00 0.00 O ATOM 2079 OD2 ASP A 134 11.294 -3.545 9.941 1.00 0.00 O ATOM 0 H ASP A 134 10.255 -7.626 9.012 1.00 0.00 H new ATOM 0 HA ASP A 134 11.083 -7.030 11.757 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.386 -5.143 10.084 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.580 -5.039 11.823 1.00 0.00 H new ATOM 2084 N PRO A 135 9.193 -8.925 11.549 1.00 0.00 N ATOM 2085 CA PRO A 135 8.049 -9.776 11.860 1.00 0.00 C ATOM 2086 C PRO A 135 7.665 -9.740 13.338 1.00 0.00 C ATOM 2087 O PRO A 135 6.994 -10.647 13.831 1.00 0.00 O ATOM 2088 CB PRO A 135 8.557 -11.161 11.476 1.00 0.00 C ATOM 2089 CG PRO A 135 10.019 -11.116 11.770 1.00 0.00 C ATOM 2090 CD PRO A 135 10.459 -9.686 11.566 1.00 0.00 C ATOM 0 HA PRO A 135 7.146 -9.461 11.336 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.060 -11.941 12.053 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.370 -11.375 10.424 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.218 -11.440 12.791 1.00 0.00 H new ATOM 0 HG3 PRO A 135 10.567 -11.788 11.109 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.116 -9.351 12.369 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.010 -9.566 10.633 1.00 0.00 H new ATOM 2098 N GLU A 136 8.083 -8.691 14.041 1.00 0.00 N ATOM 2099 CA GLU A 136 7.765 -8.552 15.452 1.00 0.00 C ATOM 2100 C GLU A 136 6.733 -7.453 15.652 1.00 0.00 C ATOM 2101 O GLU A 136 5.937 -7.497 16.589 1.00 0.00 O ATOM 2102 CB GLU A 136 9.030 -8.238 16.254 1.00 0.00 C ATOM 2103 CG GLU A 136 10.150 -9.241 16.041 1.00 0.00 C ATOM 2104 CD GLU A 136 11.305 -9.039 17.002 1.00 0.00 C ATOM 2105 OE1 GLU A 136 11.139 -9.341 18.203 1.00 0.00 O ATOM 2106 OE2 GLU A 136 12.377 -8.578 16.555 1.00 0.00 O ATOM 0 H GLU A 136 8.641 -7.929 13.655 1.00 0.00 H new ATOM 0 HA GLU A 136 7.350 -9.494 15.809 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.386 -7.245 15.980 1.00 0.00 H new ATOM 0 HB3 GLU A 136 8.779 -8.206 17.314 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.756 -10.250 16.160 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.516 -9.160 15.017 1.00 0.00 H new ATOM 2113 N GLY A 137 6.756 -6.464 14.763 1.00 0.00 N ATOM 2114 CA GLY A 137 5.820 -5.366 14.863 1.00 0.00 C ATOM 2115 C GLY A 137 6.145 -4.462 16.027 1.00 0.00 C ATOM 2116 O GLY A 137 5.251 -3.914 16.673 1.00 0.00 O ATOM 0 H GLY A 137 7.405 -6.406 13.979 1.00 0.00 H new ATOM 0 HA2 GLY A 137 5.835 -4.789 13.938 1.00 0.00 H new ATOM 0 HA3 GLY A 137 4.809 -5.758 14.977 1.00 0.00 H new ATOM 2120 N GLU A 138 7.435 -4.313 16.298 1.00 0.00 N ATOM 2121 CA GLU A 138 7.884 -3.471 17.405 1.00 0.00 C ATOM 2122 C GLU A 138 7.956 -1.998 17.004 1.00 0.00 C ATOM 2123 O GLU A 138 7.815 -1.116 17.852 1.00 0.00 O ATOM 2124 CB GLU A 138 9.242 -3.931 17.976 1.00 0.00 C ATOM 2125 CG GLU A 138 10.224 -4.537 16.973 1.00 0.00 C ATOM 2126 CD GLU A 138 10.296 -3.786 15.655 1.00 0.00 C ATOM 2127 OE1 GLU A 138 9.356 -3.907 14.844 1.00 0.00 O ATOM 2128 OE2 GLU A 138 11.305 -3.085 15.431 1.00 0.00 O ATOM 0 H GLU A 138 8.186 -4.760 15.772 1.00 0.00 H new ATOM 0 HA GLU A 138 7.135 -3.579 18.190 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.722 -3.075 18.451 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.054 -4.666 18.758 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.217 -4.562 17.421 1.00 0.00 H new ATOM 0 HG3 GLU A 138 9.937 -5.570 16.777 1.00 0.00 H new ATOM 2135 N GLN A 139 8.176 -1.728 15.720 1.00 0.00 N ATOM 2136 CA GLN A 139 8.265 -0.353 15.242 1.00 0.00 C ATOM 2137 C GLN A 139 7.607 -0.209 13.880 1.00 0.00 C ATOM 2138 O GLN A 139 8.114 0.511 13.033 1.00 0.00 O ATOM 2139 CB GLN A 139 9.726 0.077 15.100 1.00 0.00 C ATOM 2140 CG GLN A 139 10.687 -0.554 16.089 1.00 0.00 C ATOM 2141 CD GLN A 139 11.061 0.382 17.221 1.00 0.00 C ATOM 2142 OE1 GLN A 139 11.203 1.589 17.024 1.00 0.00 O ATOM 2143 NE2 GLN A 139 11.226 -0.172 18.417 1.00 0.00 N ATOM 0 H GLN A 139 8.295 -2.438 14.997 1.00 0.00 H new ATOM 0 HA GLN A 139 7.755 0.274 15.973 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.061 -0.161 14.091 1.00 0.00 H new ATOM 0 HB3 GLN A 139 9.781 1.160 15.206 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.236 -1.456 16.503 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.591 -0.862 15.564 1.00 0.00 H new ATOM 0 HE21 GLN A 139 11.098 -1.177 18.536 1.00 0.00 H new ATOM 0 HE22 GLN A 139 11.480 0.408 19.217 1.00 0.00 H new ATOM 2152 N PHE A 140 6.504 -0.912 13.656 1.00 0.00 N ATOM 2153 CA PHE A 140 5.832 -0.874 12.358 1.00 0.00 C ATOM 2154 C PHE A 140 5.801 0.503 11.706 1.00 0.00 C ATOM 2155 O PHE A 140 6.035 0.601 10.504 1.00 0.00 O ATOM 2156 CB PHE A 140 4.446 -1.504 12.412 1.00 0.00 C ATOM 2157 CG PHE A 140 3.559 -0.993 13.512 1.00 0.00 C ATOM 2158 CD1 PHE A 140 3.726 -1.426 14.819 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.552 -0.082 13.237 1.00 0.00 C ATOM 2160 CE1 PHE A 140 2.907 -0.958 15.828 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.730 0.389 14.243 1.00 0.00 C ATOM 2162 CZ PHE A 140 1.907 -0.049 15.541 1.00 0.00 C ATOM 0 H PHE A 140 6.056 -1.512 14.349 1.00 0.00 H new ATOM 0 HA PHE A 140 6.453 -1.486 11.704 1.00 0.00 H new ATOM 0 HB2 PHE A 140 3.949 -1.335 11.457 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.558 -2.582 12.527 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.505 -2.137 15.050 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.408 0.264 12.224 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.048 -1.303 16.842 1.00 0.00 H new ATOM 0 HE2 PHE A 140 0.949 1.099 14.014 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.266 0.318 16.329 1.00 0.00 H new ATOM 2172 N PRO A 141 5.559 1.599 12.439 1.00 0.00 N ATOM 2173 CA PRO A 141 5.580 2.915 11.812 1.00 0.00 C ATOM 2174 C PRO A 141 7.011 3.317 11.444 1.00 0.00 C ATOM 2175 O PRO A 141 7.255 4.453 11.039 1.00 0.00 O ATOM 2176 CB PRO A 141 5.017 3.839 12.886 1.00 0.00 C ATOM 2177 CG PRO A 141 5.316 3.153 14.176 1.00 0.00 C ATOM 2178 CD PRO A 141 5.290 1.673 13.890 1.00 0.00 C ATOM 0 HA PRO A 141 5.009 2.950 10.884 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.483 4.823 12.844 1.00 0.00 H new ATOM 0 HB3 PRO A 141 3.945 3.988 12.757 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.290 3.457 14.560 1.00 0.00 H new ATOM 0 HG3 PRO A 141 4.578 3.415 14.935 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.046 1.139 14.466 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.326 1.232 14.143 1.00 0.00 H new ATOM 2186 N TRP A 142 7.949 2.357 11.601 1.00 0.00 N ATOM 2187 CA TRP A 142 9.382 2.545 11.313 1.00 0.00 C ATOM 2188 C TRP A 142 9.707 3.977 10.899 1.00 0.00 C ATOM 2189 O TRP A 142 10.100 4.240 9.763 1.00 0.00 O ATOM 2190 CB TRP A 142 9.852 1.552 10.240 1.00 0.00 C ATOM 2191 CG TRP A 142 9.092 0.256 10.264 1.00 0.00 C ATOM 2192 CD1 TRP A 142 9.121 -0.707 11.239 1.00 0.00 C ATOM 2193 CD2 TRP A 142 8.184 -0.216 9.263 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.252 -1.724 10.920 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.678 -1.453 9.704 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.742 0.294 8.040 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.754 -2.186 8.966 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.826 -0.437 7.307 1.00 0.00 C ATOM 2199 CH2 TRP A 142 6.340 -1.664 7.772 1.00 0.00 C ATOM 0 H TRP A 142 7.726 1.420 11.936 1.00 0.00 H new ATOM 0 HA TRP A 142 9.924 2.349 12.238 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.745 2.011 9.257 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.913 1.347 10.383 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.735 -0.672 12.126 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.065 -2.546 11.494 1.00 0.00 H new ATOM 0 HE3 TRP A 142 8.109 1.242 7.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 6.377 -3.133 9.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.479 -0.054 6.358 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.624 -2.210 7.176 1.00 0.00 H new ATOM 2210 N LYS A 143 9.529 4.893 11.843 1.00 0.00 N ATOM 2211 CA LYS A 143 9.787 6.312 11.611 1.00 0.00 C ATOM 2212 C LYS A 143 11.151 6.532 10.964 1.00 0.00 C ATOM 2213 O LYS A 143 12.081 5.752 11.166 1.00 0.00 O ATOM 2214 CB LYS A 143 9.705 7.085 12.927 1.00 0.00 C ATOM 2215 CG LYS A 143 8.401 6.872 13.680 1.00 0.00 C ATOM 2216 CD LYS A 143 7.484 8.080 13.564 1.00 0.00 C ATOM 2217 CE LYS A 143 6.361 8.028 14.588 1.00 0.00 C ATOM 2218 NZ LYS A 143 6.861 7.662 15.942 1.00 0.00 N ATOM 0 H LYS A 143 9.204 4.677 12.785 1.00 0.00 H new ATOM 0 HA LYS A 143 9.024 6.682 10.926 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.536 6.787 13.566 1.00 0.00 H new ATOM 0 HB3 LYS A 143 9.826 8.149 12.722 1.00 0.00 H new ATOM 0 HG2 LYS A 143 7.894 5.990 13.288 1.00 0.00 H new ATOM 0 HG3 LYS A 143 8.615 6.676 14.731 1.00 0.00 H new ATOM 0 HD2 LYS A 143 8.063 8.993 13.704 1.00 0.00 H new ATOM 0 HD3 LYS A 143 7.061 8.122 12.560 1.00 0.00 H new ATOM 0 HE2 LYS A 143 5.866 8.998 14.634 1.00 0.00 H new ATOM 0 HE3 LYS A 143 5.612 7.303 14.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 6.185 7.988 16.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 6.964 6.629 16.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 7.784 8.113 16.105 1.00 0.00 H new