USER MOD reduce.3.24.130724 H: found=0, std=0, add=1150, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1152 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 135 LYS NZ :NH3+ 162:sc= -0.292 (180deg=-0.366) USER MOD Set 1.2: A 148 SER OG : rot 30:sc= 0.856 USER MOD Set 2.1: A 95 MET CE :methyl 167:sc= -0.0152 (180deg=-0.226) USER MOD Set 2.2: A 105 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 82 THR OG1 : rot 180:sc= -2.64! USER MOD Set 3.2: A 108 ASN : amide:sc= -0.383 X(o=-3,f=-2.7) USER MOD Set 4.1: A 78 GLN :FLIP amide:sc= -0.259 F(o=-3.2!,f=-0.53) USER MOD Set 4.2: A 80 TYR OH : rot -2:sc= -0.266 USER MOD Set 5.1: A 25 ASN :FLIP amide:sc= 0.408 F(o=-4.8,f=-2.9) USER MOD Set 5.2: A 31 SER OG : rot -89:sc= -3.28! USER MOD Set 6.1: A 29 ASN : amide:sc= 0.625 K(o=2.3,f=-1.2) USER MOD Set 6.2: A 153 GLN : amide:sc= 1.64 K(o=2.3,f=-1.2) USER MOD Single : A 13 ASN : amide:sc= -10.5! C(o=-10!,f=-17!) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 174:sc=-0.00401 (180deg=-0.0772) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN :FLIP amide:sc= -3.52! C(o=-5!,f=-3.5!) USER MOD Single : A 36 ASN : amide:sc= 0.5 K(o=0.5,f=-5.2!) USER MOD Single : A 38 GLN : amide:sc= -0.469 X(o=-0.47,f=-0.099) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.711 USER MOD Single : A 46 HIS : no HD1:sc= -0.0591 X(o=-0.059,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.0593 K(o=-0.059,f=-1.2) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl 162:sc= -0.202 (180deg=-1.26) USER MOD Single : A 59 TYR OH : rot 90:sc= -1.7 USER MOD Single : A 60 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0505) USER MOD Single : A 61 SER OG : rot -2:sc= 0.149 USER MOD Single : A 62 SER OG : rot -60:sc= 0.134 USER MOD Single : A 63 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0129) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 149:sc= 2.07 USER MOD Single : A 75 SER OG : rot -78:sc= 0.151! USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot -150:sc= 0 USER MOD Single : A 84 GLN :FLIP amide:sc= -0.117 F(o=-4.4!,f=-0.12) USER MOD Single : A 88 GLN : amide:sc= -0.388 K(o=-0.39,f=-1.1) USER MOD Single : A 93 LYS NZ :NH3+ 169:sc= 1.3 (180deg=1.19) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -44:sc= 0.276 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= -0.0172 X(o=-0.017,f=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00225 USER MOD Single : A 119 LYS NZ :NH3+ -142:sc= 0.758 (180deg=-1.16!) USER MOD Single : A 120 ASN : amide:sc= -1.94! C(o=-1.9!,f=-8.5!) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot -100:sc= -0.25 USER MOD Single : A 127 HIS : no HD1:sc= -0.125 X(o=-0.13,f=-0.027) USER MOD Single : A 129 ASN : amide:sc= -1.47! C(o=-1.5!,f=-3.5!) USER MOD Single : A 134 THR OG1 : rot 34:sc= -3.69! USER MOD Single : A 136 GLN :FLIP amide:sc= -0.232 F(o=-4.5!,f=-0.23) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 CYS SG : rot -148:sc= 1.21 USER MOD Single : A 150 THR OG1 : rot -140:sc= -0.975! USER MOD Single : A 157 ASN : amide:sc= -0.673 K(o=-0.67,f=-1.7!) USER MOD Single : A 158 GLN : amide:sc= -0.109 K(o=-0.11,f=-1) USER MOD ----------------------------------------------------------------- ATOM 76 N ASN A 13 16.444 -6.802 -0.516 1.00 1.23 N ATOM 77 CA ASN A 13 15.549 -6.774 0.613 1.00 1.00 C ATOM 78 C ASN A 13 14.787 -8.077 0.847 1.00 0.86 C ATOM 79 O ASN A 13 13.688 -8.271 0.358 1.00 1.29 O ATOM 80 CB ASN A 13 14.545 -5.642 0.362 1.00 1.76 C ATOM 81 CG ASN A 13 13.753 -5.819 -0.944 1.00 2.67 C ATOM 82 OD1 ASN A 13 14.120 -6.598 -1.811 1.00 3.27 O ATOM 83 ND2 ASN A 13 12.690 -5.058 -1.121 1.00 3.42 N ATOM 0 HA ASN A 13 16.150 -6.622 1.510 1.00 1.00 H new ATOM 0 HB2 ASN A 13 13.848 -5.590 1.199 1.00 1.76 H new ATOM 0 HB3 ASN A 13 15.078 -4.692 0.331 1.00 1.76 H new ATOM 0 HD21 ASN A 13 12.161 -5.115 -1.991 1.00 3.42 H new ATOM 0 HD22 ASN A 13 12.397 -4.413 -0.387 1.00 3.42 H new ATOM 90 N PHE A 14 15.311 -8.899 1.734 1.00 0.97 N ATOM 91 CA PHE A 14 14.526 -9.866 2.490 1.00 1.06 C ATOM 92 C PHE A 14 14.095 -9.289 3.836 1.00 0.93 C ATOM 93 O PHE A 14 14.957 -8.893 4.622 1.00 1.27 O ATOM 94 CB PHE A 14 15.297 -11.185 2.667 1.00 1.64 C ATOM 95 CG PHE A 14 16.654 -11.052 3.312 1.00 2.26 C ATOM 96 CD1 PHE A 14 17.737 -10.580 2.585 1.00 3.13 C ATOM 97 CD2 PHE A 14 16.841 -11.388 4.644 1.00 2.47 C ATOM 98 CE1 PHE A 14 18.979 -10.447 3.177 1.00 4.16 C ATOM 99 CE2 PHE A 14 18.081 -11.259 5.238 1.00 3.36 C ATOM 100 CZ PHE A 14 19.160 -10.829 4.496 1.00 4.21 C ATOM 0 H PHE A 14 16.306 -8.918 1.956 1.00 0.97 H new ATOM 0 HA PHE A 14 13.623 -10.085 1.920 1.00 1.06 H new ATOM 0 HB2 PHE A 14 14.692 -11.864 3.268 1.00 1.64 H new ATOM 0 HB3 PHE A 14 15.421 -11.649 1.689 1.00 1.64 H new ATOM 0 HD1 PHE A 14 17.609 -10.314 1.546 1.00 3.13 H new ATOM 0 HD2 PHE A 14 16.007 -11.755 5.224 1.00 2.47 H new ATOM 0 HE1 PHE A 14 19.807 -10.046 2.612 1.00 4.16 H new ATOM 0 HE2 PHE A 14 18.205 -11.495 6.284 1.00 3.36 H new ATOM 0 HZ PHE A 14 20.143 -10.790 4.941 1.00 4.21 H new ATOM 110 N MET A 15 12.810 -9.210 4.138 1.00 0.73 N ATOM 111 CA MET A 15 12.421 -9.061 5.523 1.00 0.74 C ATOM 112 C MET A 15 11.703 -10.329 5.952 1.00 0.70 C ATOM 113 O MET A 15 12.235 -11.152 6.696 1.00 0.79 O ATOM 114 CB MET A 15 11.566 -7.816 5.738 1.00 0.84 C ATOM 115 CG MET A 15 11.717 -7.186 7.118 1.00 1.48 C ATOM 116 SD MET A 15 11.212 -8.278 8.462 1.00 2.32 S ATOM 117 CE MET A 15 11.620 -7.269 9.886 1.00 2.91 C ATOM 0 H MET A 15 12.044 -9.245 3.466 1.00 0.73 H new ATOM 0 HA MET A 15 13.307 -8.920 6.142 1.00 0.74 H new ATOM 0 HB2 MET A 15 11.826 -7.075 4.982 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.519 -8.076 5.582 1.00 0.84 H new ATOM 0 HG2 MET A 15 12.758 -6.897 7.266 1.00 1.48 H new ATOM 0 HG3 MET A 15 11.124 -6.273 7.159 1.00 1.48 H new ATOM 0 HE1 MET A 15 11.365 -7.808 10.799 1.00 2.91 H new ATOM 0 HE2 MET A 15 12.687 -7.047 9.881 1.00 2.91 H new ATOM 0 HE3 MET A 15 11.056 -6.337 9.845 1.00 2.91 H new ATOM 127 N ARG A 16 10.492 -10.475 5.428 1.00 0.61 N ATOM 128 CA ARG A 16 9.658 -11.640 5.634 1.00 0.61 C ATOM 129 C ARG A 16 8.447 -11.584 4.704 1.00 0.56 C ATOM 130 O ARG A 16 7.970 -10.498 4.365 1.00 0.52 O ATOM 131 CB ARG A 16 9.203 -11.704 7.088 1.00 0.63 C ATOM 132 CG ARG A 16 8.712 -10.375 7.655 1.00 0.72 C ATOM 133 CD ARG A 16 7.233 -10.135 7.411 1.00 1.06 C ATOM 134 NE ARG A 16 6.723 -9.067 8.268 1.00 1.64 N ATOM 135 CZ ARG A 16 5.633 -9.162 9.030 1.00 2.09 C ATOM 136 NH1 ARG A 16 4.902 -10.268 9.039 1.00 2.43 N ATOM 137 NH2 ARG A 16 5.275 -8.135 9.789 1.00 2.73 N ATOM 0 H ARG A 16 10.058 -9.767 4.835 1.00 0.61 H new ATOM 0 HA ARG A 16 10.235 -12.536 5.407 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.403 -12.439 7.173 1.00 0.63 H new ATOM 0 HB3 ARG A 16 10.031 -12.062 7.700 1.00 0.63 H new ATOM 0 HG2 ARG A 16 8.906 -10.350 8.727 1.00 0.72 H new ATOM 0 HG3 ARG A 16 9.285 -9.562 7.208 1.00 0.72 H new ATOM 0 HD2 ARG A 16 7.072 -9.874 6.365 1.00 1.06 H new ATOM 0 HD3 ARG A 16 6.677 -11.053 7.600 1.00 1.06 H new ATOM 0 HE ARG A 16 7.237 -8.186 8.284 1.00 1.64 H new ATOM 0 HH11 ARG A 16 5.171 -11.062 8.458 1.00 2.43 H new ATOM 0 HH12 ARG A 16 4.071 -10.325 9.627 1.00 2.43 H new ATOM 0 HH21 ARG A 16 5.832 -7.281 9.787 1.00 2.73 H new ATOM 0 HH22 ARG A 16 4.442 -8.200 10.375 1.00 2.73 H new ATOM 151 N ILE A 17 7.962 -12.747 4.291 1.00 0.62 N ATOM 152 CA ILE A 17 6.748 -12.829 3.486 1.00 0.61 C ATOM 153 C ILE A 17 5.508 -12.710 4.369 1.00 0.57 C ATOM 154 O ILE A 17 5.255 -13.556 5.228 1.00 0.64 O ATOM 155 CB ILE A 17 6.691 -14.137 2.662 1.00 0.73 C ATOM 156 CG1 ILE A 17 7.008 -15.353 3.539 1.00 1.68 C ATOM 157 CG2 ILE A 17 7.650 -14.058 1.482 1.00 1.41 C ATOM 158 CD1 ILE A 17 6.939 -16.675 2.800 1.00 2.26 C ATOM 0 H ILE A 17 8.390 -13.649 4.500 1.00 0.62 H new ATOM 0 HA ILE A 17 6.768 -11.994 2.785 1.00 0.61 H new ATOM 0 HB ILE A 17 5.678 -14.258 2.279 1.00 0.73 H new ATOM 0 HG12 ILE A 17 8.006 -15.235 3.961 1.00 1.68 H new ATOM 0 HG13 ILE A 17 6.310 -15.378 4.375 1.00 1.68 H new ATOM 0 HG21 ILE A 17 7.600 -14.985 0.910 1.00 1.41 H new ATOM 0 HG22 ILE A 17 7.371 -13.221 0.842 1.00 1.41 H new ATOM 0 HG23 ILE A 17 8.666 -13.912 1.848 1.00 1.41 H new ATOM 0 HD11 ILE A 17 7.175 -17.488 3.486 1.00 2.26 H new ATOM 0 HD12 ILE A 17 5.934 -16.817 2.401 1.00 2.26 H new ATOM 0 HD13 ILE A 17 7.657 -16.672 1.980 1.00 2.26 H new ATOM 170 N ILE A 18 4.753 -11.640 4.170 1.00 0.49 N ATOM 171 CA ILE A 18 3.579 -11.367 4.988 1.00 0.48 C ATOM 172 C ILE A 18 2.333 -12.025 4.387 1.00 0.48 C ATOM 173 O ILE A 18 2.348 -13.204 4.032 1.00 0.52 O ATOM 174 CB ILE A 18 3.336 -9.846 5.186 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.665 -9.113 5.371 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.445 -9.600 6.403 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.510 -7.634 5.655 1.00 0.94 C ATOM 0 H ILE A 18 4.933 -10.944 3.447 1.00 0.49 H new ATOM 0 HA ILE A 18 3.774 -11.798 5.970 1.00 0.48 H new ATOM 0 HB ILE A 18 2.837 -9.464 4.296 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.214 -9.576 6.191 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.268 -9.240 4.472 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.285 -8.529 6.526 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.485 -10.096 6.257 1.00 0.50 H new ATOM 0 HG23 ILE A 18 2.928 -10.000 7.294 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.494 -7.181 5.774 1.00 0.94 H new ATOM 0 HD12 ILE A 18 3.989 -7.157 4.825 1.00 0.94 H new ATOM 0 HD13 ILE A 18 3.934 -7.498 6.571 1.00 0.94 H new ATOM 189 N LYS A 19 1.260 -11.259 4.288 1.00 0.45 N ATOM 190 CA LYS A 19 -0.048 -11.788 3.921 1.00 0.46 C ATOM 191 C LYS A 19 -0.440 -11.349 2.519 1.00 0.42 C ATOM 192 O LYS A 19 0.128 -10.411 1.980 1.00 0.49 O ATOM 193 CB LYS A 19 -1.102 -11.360 4.940 1.00 0.54 C ATOM 194 CG LYS A 19 -1.049 -12.160 6.232 1.00 1.13 C ATOM 195 CD LYS A 19 -2.074 -11.672 7.242 1.00 1.85 C ATOM 196 CE LYS A 19 -2.178 -12.615 8.430 1.00 2.57 C ATOM 197 NZ LYS A 19 -0.873 -12.794 9.119 1.00 2.68 N ATOM 0 H LYS A 19 1.268 -10.253 4.459 1.00 0.45 H new ATOM 0 HA LYS A 19 0.011 -12.876 3.925 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -0.967 -10.303 5.169 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -2.092 -11.466 4.495 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -1.226 -13.213 6.015 1.00 1.13 H new ATOM 0 HG3 LYS A 19 -0.051 -12.087 6.664 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -1.798 -10.676 7.589 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -3.048 -11.583 6.760 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -2.910 -12.226 9.138 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -2.545 -13.584 8.092 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -1.010 -13.362 9.980 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -0.209 -13.282 8.484 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -0.486 -11.864 9.376 1.00 2.68 H new ATOM 211 N TYR A 20 -1.412 -12.034 1.936 1.00 0.37 N ATOM 212 CA TYR A 20 -1.747 -11.843 0.530 1.00 0.41 C ATOM 213 C TYR A 20 -3.227 -12.120 0.267 1.00 0.31 C ATOM 214 O TYR A 20 -3.881 -12.808 1.053 1.00 0.33 O ATOM 215 CB TYR A 20 -0.878 -12.784 -0.321 1.00 0.67 C ATOM 216 CG TYR A 20 -1.052 -14.254 0.011 1.00 1.13 C ATOM 217 CD1 TYR A 20 -0.494 -14.800 1.161 1.00 1.45 C ATOM 218 CD2 TYR A 20 -1.771 -15.097 -0.830 1.00 1.34 C ATOM 219 CE1 TYR A 20 -0.646 -16.141 1.460 1.00 1.93 C ATOM 220 CE2 TYR A 20 -1.926 -16.436 -0.537 1.00 1.82 C ATOM 221 CZ TYR A 20 -1.380 -16.945 0.633 1.00 2.10 C ATOM 222 OH TYR A 20 -1.519 -18.289 0.898 1.00 2.59 O ATOM 0 H TYR A 20 -1.985 -12.729 2.415 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.552 -10.805 0.262 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.116 -12.629 -1.373 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.170 -12.514 -0.188 1.00 0.67 H new ATOM 0 HD1 TYR A 20 0.067 -14.166 1.832 1.00 1.45 H new ATOM 0 HD2 TYR A 20 -2.216 -14.696 -1.729 1.00 1.34 H new ATOM 0 HE1 TYR A 20 -0.186 -16.553 2.346 1.00 1.93 H new ATOM 0 HE2 TYR A 20 -2.467 -17.082 -1.212 1.00 1.82 H new ATOM 0 HH TYR A 20 -2.075 -18.703 0.205 1.00 2.59 H new ATOM 232 N GLU A 21 -3.733 -11.569 -0.841 1.00 0.33 N ATOM 233 CA GLU A 21 -5.091 -11.849 -1.328 1.00 0.32 C ATOM 234 C GLU A 21 -6.151 -11.491 -0.297 1.00 0.28 C ATOM 235 O GLU A 21 -7.144 -12.197 -0.105 1.00 0.30 O ATOM 236 CB GLU A 21 -5.181 -13.321 -1.729 1.00 0.35 C ATOM 237 CG GLU A 21 -6.425 -13.699 -2.513 1.00 0.98 C ATOM 238 CD GLU A 21 -6.473 -15.179 -2.816 1.00 1.16 C ATOM 239 OE1 GLU A 21 -6.914 -15.953 -1.941 1.00 1.73 O ATOM 240 OE2 GLU A 21 -6.084 -15.574 -3.934 1.00 1.53 O ATOM 0 H GLU A 21 -3.214 -10.916 -1.427 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.287 -11.223 -2.198 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.304 -13.574 -2.325 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -5.140 -13.931 -0.826 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -7.312 -13.416 -1.946 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -6.451 -13.136 -3.446 1.00 0.98 H new ATOM 247 N PHE A 22 -5.917 -10.392 0.367 1.00 0.26 N ATOM 248 CA PHE A 22 -6.859 -9.850 1.302 1.00 0.26 C ATOM 249 C PHE A 22 -7.499 -8.640 0.678 1.00 0.24 C ATOM 250 O PHE A 22 -6.961 -8.056 -0.265 1.00 0.27 O ATOM 251 CB PHE A 22 -6.186 -9.531 2.633 1.00 0.32 C ATOM 252 CG PHE A 22 -5.876 -10.778 3.409 1.00 1.08 C ATOM 253 CD1 PHE A 22 -6.887 -11.571 3.914 1.00 1.98 C ATOM 254 CD2 PHE A 22 -4.558 -11.145 3.645 1.00 1.15 C ATOM 255 CE1 PHE A 22 -6.594 -12.711 4.639 1.00 2.89 C ATOM 256 CE2 PHE A 22 -4.260 -12.281 4.370 1.00 2.05 C ATOM 257 CZ PHE A 22 -5.322 -13.104 4.824 1.00 2.92 C ATOM 0 H PHE A 22 -5.061 -9.845 0.272 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.635 -10.582 1.526 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -5.265 -8.976 2.452 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -6.836 -8.886 3.224 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -7.917 -11.298 3.741 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -3.756 -10.534 3.257 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -7.398 -13.294 5.063 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -3.234 -12.539 4.588 1.00 2.05 H new ATOM 0 HZ PHE A 22 -5.110 -14.042 5.316 1.00 2.92 H new ATOM 267 N ILE A 23 -8.622 -8.256 1.207 1.00 0.22 N ATOM 268 CA ILE A 23 -9.371 -7.171 0.649 1.00 0.21 C ATOM 269 C ILE A 23 -9.012 -5.945 1.412 1.00 0.19 C ATOM 270 O ILE A 23 -9.008 -5.932 2.643 1.00 0.22 O ATOM 271 CB ILE A 23 -10.895 -7.354 0.769 1.00 0.28 C ATOM 272 CG1 ILE A 23 -11.327 -8.738 0.281 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.613 -6.261 -0.008 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.938 -9.025 -1.146 1.00 0.84 C ATOM 0 H ILE A 23 -9.043 -8.683 2.032 1.00 0.22 H new ATOM 0 HA ILE A 23 -9.127 -7.114 -0.412 1.00 0.21 H new ATOM 0 HB ILE A 23 -11.168 -7.276 1.821 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.886 -9.496 0.928 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.409 -8.827 0.378 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.691 -6.398 0.082 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -11.336 -5.287 0.395 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -11.327 -6.314 -1.059 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -11.277 -10.023 -1.422 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -11.401 -8.290 -1.804 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.854 -8.970 -1.246 1.00 0.84 H new ATOM 286 N LEU A 24 -8.697 -4.924 0.682 1.00 0.18 N ATOM 287 CA LEU A 24 -8.212 -3.721 1.303 1.00 0.19 C ATOM 288 C LEU A 24 -9.326 -2.709 1.431 1.00 0.20 C ATOM 289 O LEU A 24 -9.939 -2.313 0.447 1.00 0.23 O ATOM 290 CB LEU A 24 -7.059 -3.137 0.497 1.00 0.23 C ATOM 291 CG LEU A 24 -5.883 -2.684 1.347 1.00 0.53 C ATOM 292 CD1 LEU A 24 -5.035 -3.880 1.755 1.00 1.32 C ATOM 293 CD2 LEU A 24 -5.044 -1.646 0.617 1.00 1.41 C ATOM 0 H LEU A 24 -8.764 -4.892 -0.335 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.850 -3.968 2.301 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.712 -3.884 -0.217 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.425 -2.289 -0.081 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.275 -2.214 2.249 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.196 -3.541 2.363 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -5.643 -4.577 2.331 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.657 -4.380 0.863 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -4.211 -1.341 1.250 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -4.659 -2.075 -0.308 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -5.660 -0.777 0.386 1.00 1.41 H new ATOM 305 N ASN A 25 -9.576 -2.310 2.665 1.00 0.19 N ATOM 306 CA ASN A 25 -10.571 -1.304 2.982 1.00 0.19 C ATOM 307 C ASN A 25 -9.954 -0.294 3.907 1.00 0.18 C ATOM 308 O ASN A 25 -9.132 -0.655 4.728 1.00 0.22 O ATOM 309 CB ASN A 25 -11.779 -1.940 3.670 1.00 0.29 C ATOM 310 CG ASN A 25 -12.756 -2.545 2.693 1.00 0.92 C ATOM 311 OD1 ASN A 25 -12.446 -3.734 2.205 1.00 1.74 O flip ATOM 312 ND2 ASN A 25 -13.775 -1.942 2.361 1.00 1.72 N flip ATOM 0 H ASN A 25 -9.089 -2.679 3.482 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.905 -0.828 2.060 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -11.435 -2.712 4.358 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -12.290 -1.185 4.268 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -13.979 -1.026 2.761 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -14.417 -2.358 1.686 1.00 1.72 H new ATOM 319 N ASP A 26 -10.353 0.948 3.794 1.00 0.16 N ATOM 320 CA ASP A 26 -9.880 1.966 4.709 1.00 0.17 C ATOM 321 C ASP A 26 -10.795 2.097 5.903 1.00 0.18 C ATOM 322 O ASP A 26 -11.713 1.303 6.085 1.00 0.20 O ATOM 323 CB ASP A 26 -9.785 3.312 3.979 1.00 0.19 C ATOM 324 CG ASP A 26 -10.919 3.587 3.019 1.00 0.40 C ATOM 325 OD1 ASP A 26 -12.089 3.441 3.408 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.642 3.949 1.880 1.00 1.04 O ATOM 0 H ASP A 26 -11.002 1.282 3.081 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.894 1.670 5.068 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.751 4.111 4.720 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.844 3.347 3.430 1.00 0.19 H new ATOM 331 N ALA A 27 -10.457 3.030 6.767 1.00 0.21 N ATOM 332 CA ALA A 27 -11.286 3.344 7.938 1.00 0.25 C ATOM 333 C ALA A 27 -12.557 4.012 7.479 1.00 0.24 C ATOM 334 O ALA A 27 -13.540 4.118 8.215 1.00 0.28 O ATOM 335 CB ALA A 27 -10.556 4.236 8.929 1.00 0.32 C ATOM 0 H ALA A 27 -9.611 3.594 6.690 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.516 2.411 8.452 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.206 4.443 9.779 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -9.654 3.732 9.276 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.284 5.173 8.443 1.00 0.32 H new ATOM 341 N LEU A 28 -12.509 4.474 6.244 1.00 0.21 N ATOM 342 CA LEU A 28 -13.709 4.976 5.572 1.00 0.24 C ATOM 343 C LEU A 28 -14.531 3.788 5.119 1.00 0.23 C ATOM 344 O LEU A 28 -15.727 3.879 4.830 1.00 0.29 O ATOM 345 CB LEU A 28 -13.344 5.850 4.365 1.00 0.25 C ATOM 346 CG LEU A 28 -12.587 7.112 4.700 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.262 7.873 3.428 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.407 7.972 5.651 1.00 0.48 C ATOM 0 H LEU A 28 -11.659 4.515 5.681 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.279 5.594 6.266 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.745 5.257 3.673 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.260 6.122 3.841 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.651 6.851 5.193 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.716 8.783 3.678 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.650 7.249 2.777 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -13.187 8.135 2.914 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.854 8.881 5.888 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.353 8.236 5.179 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.602 7.416 6.568 1.00 0.48 H new ATOM 360 N ASN A 29 -13.829 2.673 5.130 1.00 0.20 N ATOM 361 CA ASN A 29 -14.248 1.400 4.592 1.00 0.23 C ATOM 362 C ASN A 29 -14.619 1.549 3.142 1.00 0.24 C ATOM 363 O ASN A 29 -15.792 1.490 2.784 1.00 0.28 O ATOM 364 CB ASN A 29 -15.452 0.816 5.331 1.00 0.29 C ATOM 365 CG ASN A 29 -15.407 0.988 6.841 1.00 0.60 C ATOM 366 OD1 ASN A 29 -14.898 0.132 7.560 1.00 1.32 O ATOM 367 ND2 ASN A 29 -15.954 2.089 7.334 1.00 1.30 N ATOM 0 H ASN A 29 -12.896 2.632 5.540 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.404 0.721 4.715 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.359 1.286 4.951 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.523 -0.247 5.101 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -15.962 2.248 8.342 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -16.368 2.778 6.706 1.00 1.30 H new ATOM 374 N GLN A 30 -13.623 1.693 2.299 1.00 0.23 N ATOM 375 CA GLN A 30 -13.837 1.615 0.893 1.00 0.24 C ATOM 376 C GLN A 30 -12.819 0.666 0.352 1.00 0.22 C ATOM 377 O GLN A 30 -11.622 0.925 0.427 1.00 0.28 O ATOM 378 CB GLN A 30 -13.688 2.992 0.236 1.00 0.36 C ATOM 379 CG GLN A 30 -15.004 3.675 -0.105 1.00 0.98 C ATOM 380 CD GLN A 30 -15.806 4.064 1.111 1.00 1.41 C ATOM 381 OE1 GLN A 30 -15.118 4.404 2.181 1.00 2.21 O flip ATOM 382 NE2 GLN A 30 -17.036 4.076 1.080 1.00 1.84 N flip ATOM 0 H GLN A 30 -12.656 1.865 2.575 1.00 0.23 H new ATOM 0 HA GLN A 30 -14.848 1.269 0.679 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -13.120 3.639 0.904 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -13.103 2.883 -0.677 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -14.800 4.567 -0.698 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -15.601 3.008 -0.727 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -17.527 3.804 0.228 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -17.564 4.358 1.906 1.00 1.84 H new ATOM 391 N SER A 31 -13.273 -0.450 -0.169 1.00 0.23 N ATOM 392 CA SER A 31 -12.353 -1.387 -0.710 1.00 0.26 C ATOM 393 C SER A 31 -11.723 -0.744 -1.924 1.00 0.21 C ATOM 394 O SER A 31 -12.406 -0.388 -2.882 1.00 0.21 O ATOM 395 CB SER A 31 -13.097 -2.659 -1.071 1.00 0.36 C ATOM 396 OG SER A 31 -13.968 -3.037 -0.024 1.00 1.23 O ATOM 0 H SER A 31 -14.256 -0.716 -0.224 1.00 0.23 H new ATOM 0 HA SER A 31 -11.573 -1.654 0.004 1.00 0.26 H new ATOM 0 HB2 SER A 31 -13.666 -2.507 -1.988 1.00 0.36 H new ATOM 0 HB3 SER A 31 -12.385 -3.461 -1.267 1.00 0.36 H new ATOM 0 HG SER A 31 -13.490 -3.614 0.607 1.00 1.23 H new ATOM 402 N ILE A 32 -10.423 -0.599 -1.882 1.00 0.21 N ATOM 403 CA ILE A 32 -9.728 0.128 -2.912 1.00 0.20 C ATOM 404 C ILE A 32 -9.676 -0.684 -4.217 1.00 0.21 C ATOM 405 O ILE A 32 -8.949 -1.664 -4.321 1.00 0.24 O ATOM 406 CB ILE A 32 -8.308 0.541 -2.456 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.493 1.095 -3.626 1.00 1.11 C ATOM 408 CG2 ILE A 32 -7.586 -0.624 -1.801 1.00 1.23 C ATOM 409 CD1 ILE A 32 -8.091 2.339 -4.244 1.00 1.72 C ATOM 0 H ILE A 32 -9.825 -0.975 -1.146 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.288 1.043 -3.105 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.415 1.333 -1.715 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -6.484 1.320 -3.281 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.404 0.325 -4.393 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -6.591 -0.307 -1.490 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -8.149 -0.958 -0.930 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -7.499 -1.445 -2.513 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -7.460 2.676 -5.067 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -9.089 2.115 -4.620 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -8.155 3.125 -3.491 1.00 1.72 H new ATOM 421 N ILE A 33 -10.506 -0.301 -5.186 1.00 0.21 N ATOM 422 CA ILE A 33 -10.609 -1.029 -6.458 1.00 0.24 C ATOM 423 C ILE A 33 -9.802 -0.340 -7.556 1.00 0.24 C ATOM 424 O ILE A 33 -9.527 0.860 -7.487 1.00 0.24 O ATOM 425 CB ILE A 33 -12.076 -1.121 -6.954 1.00 0.28 C ATOM 426 CG1 ILE A 33 -12.657 0.274 -7.217 1.00 0.80 C ATOM 427 CG2 ILE A 33 -12.945 -1.869 -5.958 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.068 0.255 -7.765 1.00 0.91 C ATOM 0 H ILE A 33 -11.120 0.511 -5.118 1.00 0.21 H new ATOM 0 HA ILE A 33 -10.218 -2.028 -6.263 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.070 -1.676 -7.892 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.646 0.843 -6.287 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.011 0.800 -7.920 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -13.968 -1.918 -6.332 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -12.559 -2.879 -5.825 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -12.933 -1.347 -5.001 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -14.410 1.278 -7.925 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.083 -0.285 -8.712 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.728 -0.241 -7.053 1.00 0.91 H new ATOM 440 N ARG A 34 -9.419 -1.108 -8.568 1.00 0.31 N ATOM 441 CA ARG A 34 -8.796 -0.542 -9.749 1.00 0.35 C ATOM 442 C ARG A 34 -9.856 0.083 -10.645 1.00 0.36 C ATOM 443 O ARG A 34 -10.698 -0.618 -11.203 1.00 0.42 O ATOM 444 CB ARG A 34 -8.031 -1.619 -10.525 1.00 0.48 C ATOM 445 CG ARG A 34 -7.462 -1.127 -11.846 1.00 1.04 C ATOM 446 CD ARG A 34 -6.764 -2.239 -12.611 1.00 1.16 C ATOM 447 NE ARG A 34 -7.674 -3.333 -12.942 1.00 1.48 N ATOM 448 CZ ARG A 34 -7.395 -4.295 -13.817 1.00 1.79 C ATOM 449 NH1 ARG A 34 -6.261 -4.271 -14.505 1.00 2.09 N ATOM 450 NH2 ARG A 34 -8.263 -5.277 -14.016 1.00 2.47 N ATOM 0 H ARG A 34 -9.530 -2.122 -8.591 1.00 0.31 H new ATOM 0 HA ARG A 34 -8.091 0.226 -9.433 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -7.216 -1.993 -9.905 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -8.698 -2.460 -10.716 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -8.266 -0.715 -12.457 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -6.757 -0.317 -11.659 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -6.336 -1.834 -13.528 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -5.936 -2.624 -12.015 1.00 1.16 H new ATOM 0 HE ARG A 34 -8.579 -3.361 -12.473 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -5.595 -3.511 -14.365 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -6.055 -5.013 -15.174 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -9.142 -5.293 -13.499 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -8.052 -6.016 -14.686 1.00 2.47 H new ATOM 464 N ALA A 35 -9.815 1.398 -10.764 1.00 0.37 N ATOM 465 CA ALA A 35 -10.675 2.106 -11.700 1.00 0.46 C ATOM 466 C ALA A 35 -9.930 2.239 -13.011 1.00 0.53 C ATOM 467 O ALA A 35 -10.495 2.136 -14.100 1.00 0.63 O ATOM 468 CB ALA A 35 -11.061 3.474 -11.157 1.00 0.54 C ATOM 0 H ALA A 35 -9.194 2.000 -10.223 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.600 1.548 -11.849 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.704 3.983 -11.876 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.595 3.354 -10.214 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -10.161 4.067 -10.992 1.00 0.54 H new ATOM 474 N ASN A 36 -8.638 2.450 -12.860 1.00 0.53 N ATOM 475 CA ASN A 36 -7.706 2.504 -13.961 1.00 0.66 C ATOM 476 C ASN A 36 -6.422 1.840 -13.482 1.00 0.65 C ATOM 477 O ASN A 36 -6.199 1.735 -12.276 1.00 0.55 O ATOM 478 CB ASN A 36 -7.460 3.972 -14.344 1.00 0.76 C ATOM 479 CG ASN A 36 -6.524 4.139 -15.522 1.00 1.43 C ATOM 480 OD1 ASN A 36 -5.310 4.222 -15.356 1.00 2.25 O ATOM 481 ND2 ASN A 36 -7.085 4.208 -16.716 1.00 1.93 N ATOM 0 H ASN A 36 -8.201 2.591 -11.949 1.00 0.53 H new ATOM 0 HA ASN A 36 -8.087 1.991 -14.844 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -8.415 4.443 -14.579 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -7.047 4.499 -13.484 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -6.505 4.335 -17.545 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -8.098 4.134 -16.808 1.00 1.93 H new ATOM 488 N ASP A 37 -5.587 1.390 -14.402 1.00 0.81 N ATOM 489 CA ASP A 37 -4.360 0.684 -14.036 1.00 0.88 C ATOM 490 C ASP A 37 -3.305 1.641 -13.498 1.00 0.79 C ATOM 491 O ASP A 37 -2.228 1.221 -13.086 1.00 0.88 O ATOM 492 CB ASP A 37 -3.797 -0.097 -15.227 1.00 1.10 C ATOM 493 CG ASP A 37 -4.649 -1.293 -15.600 1.00 1.76 C ATOM 494 OD1 ASP A 37 -4.489 -2.363 -14.974 1.00 2.51 O ATOM 495 OD2 ASP A 37 -5.490 -1.172 -16.516 1.00 2.10 O ATOM 0 H ASP A 37 -5.730 1.498 -15.406 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.619 -0.020 -13.246 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -3.717 0.568 -16.087 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -2.788 -0.435 -14.990 1.00 1.10 H new ATOM 500 N GLN A 38 -3.611 2.930 -13.520 1.00 0.68 N ATOM 501 CA GLN A 38 -2.691 3.945 -13.031 1.00 0.60 C ATOM 502 C GLN A 38 -3.336 4.780 -11.929 1.00 0.44 C ATOM 503 O GLN A 38 -2.644 5.373 -11.103 1.00 0.39 O ATOM 504 CB GLN A 38 -2.221 4.845 -14.178 1.00 0.71 C ATOM 505 CG GLN A 38 -1.458 4.094 -15.262 1.00 1.53 C ATOM 506 CD GLN A 38 -0.195 3.426 -14.740 1.00 2.01 C ATOM 507 OE1 GLN A 38 0.214 2.373 -15.228 1.00 2.57 O ATOM 508 NE2 GLN A 38 0.445 4.047 -13.761 1.00 2.58 N ATOM 0 H GLN A 38 -4.494 3.298 -13.873 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.823 3.438 -12.610 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -3.087 5.333 -14.625 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -1.584 5.632 -13.775 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -2.109 3.337 -15.700 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -1.193 4.788 -16.060 1.00 1.53 H new ATOM 0 HE21 GLN A 38 0.075 4.919 -13.382 1.00 2.58 H new ATOM 0 HE22 GLN A 38 1.308 3.654 -13.386 1.00 2.58 H new ATOM 517 N TYR A 39 -4.665 4.821 -11.928 1.00 0.43 N ATOM 518 CA TYR A 39 -5.415 5.606 -10.954 1.00 0.41 C ATOM 519 C TYR A 39 -6.399 4.714 -10.206 1.00 0.34 C ATOM 520 O TYR A 39 -7.158 3.959 -10.817 1.00 0.36 O ATOM 521 CB TYR A 39 -6.156 6.755 -11.646 1.00 0.64 C ATOM 522 CG TYR A 39 -5.240 7.707 -12.383 1.00 0.92 C ATOM 523 CD1 TYR A 39 -4.460 8.626 -11.692 1.00 1.50 C ATOM 524 CD2 TYR A 39 -5.166 7.695 -13.771 1.00 1.31 C ATOM 525 CE1 TYR A 39 -3.630 9.504 -12.363 1.00 2.23 C ATOM 526 CE2 TYR A 39 -4.336 8.567 -14.449 1.00 1.97 C ATOM 527 CZ TYR A 39 -3.540 9.445 -13.735 1.00 2.39 C ATOM 528 OH TYR A 39 -2.751 10.348 -14.415 1.00 3.17 O ATOM 0 H TYR A 39 -5.248 4.316 -12.596 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.713 6.032 -10.237 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.878 6.340 -12.350 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -6.723 7.313 -10.900 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -4.503 8.655 -10.613 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -5.767 6.992 -14.329 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -3.054 10.234 -11.813 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -4.309 8.563 -15.529 1.00 1.97 H new ATOM 0 HH TYR A 39 -2.799 10.165 -15.377 1.00 3.17 H new ATOM 538 N LEU A 40 -6.408 4.821 -8.886 1.00 0.31 N ATOM 539 CA LEU A 40 -7.171 3.899 -8.058 1.00 0.28 C ATOM 540 C LEU A 40 -8.187 4.627 -7.192 1.00 0.25 C ATOM 541 O LEU A 40 -7.870 5.622 -6.542 1.00 0.29 O ATOM 542 CB LEU A 40 -6.215 3.089 -7.181 1.00 0.30 C ATOM 543 CG LEU A 40 -6.351 1.572 -7.304 1.00 0.51 C ATOM 544 CD1 LEU A 40 -6.143 1.138 -8.744 1.00 1.21 C ATOM 545 CD2 LEU A 40 -5.357 0.867 -6.397 1.00 1.31 C ATOM 0 H LEU A 40 -5.897 5.535 -8.366 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.724 3.230 -8.717 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.192 3.368 -7.432 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.376 3.369 -6.140 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.358 1.294 -6.994 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -6.243 0.055 -8.816 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.890 1.614 -9.379 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -5.146 1.433 -9.073 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -5.472 -0.212 -6.501 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.343 1.153 -6.677 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -5.542 1.154 -5.362 1.00 1.31 H new ATOM 557 N THR A 41 -9.409 4.111 -7.189 1.00 0.24 N ATOM 558 CA THR A 41 -10.483 4.679 -6.394 1.00 0.22 C ATOM 559 C THR A 41 -10.978 3.648 -5.396 1.00 0.19 C ATOM 560 O THR A 41 -11.156 2.481 -5.738 1.00 0.21 O ATOM 561 CB THR A 41 -11.667 5.111 -7.280 1.00 0.27 C ATOM 562 OG1 THR A 41 -12.104 4.000 -8.079 1.00 1.36 O ATOM 563 CG2 THR A 41 -11.285 6.274 -8.181 1.00 1.28 C ATOM 0 H THR A 41 -9.680 3.293 -7.734 1.00 0.24 H new ATOM 0 HA THR A 41 -10.089 5.555 -5.878 1.00 0.22 H new ATOM 0 HB THR A 41 -12.478 5.438 -6.630 1.00 0.27 H new ATOM 0 HG1 THR A 41 -12.858 4.277 -8.640 1.00 1.36 H new ATOM 0 HG21 THR A 41 -12.141 6.556 -8.794 1.00 1.28 H new ATOM 0 HG22 THR A 41 -10.981 7.124 -7.569 1.00 1.28 H new ATOM 0 HG23 THR A 41 -10.458 5.978 -8.827 1.00 1.28 H new ATOM 571 N ALA A 42 -11.196 4.073 -4.173 1.00 0.19 N ATOM 572 CA ALA A 42 -11.710 3.182 -3.149 1.00 0.20 C ATOM 573 C ALA A 42 -13.237 3.216 -3.117 1.00 0.20 C ATOM 574 O ALA A 42 -13.844 4.279 -3.244 1.00 0.27 O ATOM 575 CB ALA A 42 -11.122 3.546 -1.794 1.00 0.26 C ATOM 0 H ALA A 42 -11.027 5.029 -3.859 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.408 2.162 -3.389 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.515 2.871 -1.034 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -10.036 3.457 -1.833 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.393 4.572 -1.543 1.00 0.26 H new ATOM 581 N ALA A 43 -13.847 2.045 -2.958 1.00 0.20 N ATOM 582 CA ALA A 43 -15.311 1.933 -2.881 1.00 0.29 C ATOM 583 C ALA A 43 -15.725 0.766 -1.978 1.00 0.35 C ATOM 584 O ALA A 43 -15.199 -0.339 -2.105 1.00 0.40 O ATOM 585 CB ALA A 43 -15.895 1.752 -4.276 1.00 0.38 C ATOM 0 H ALA A 43 -13.354 1.155 -2.879 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.703 2.853 -2.447 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -16.980 1.670 -4.208 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.634 2.611 -4.894 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.490 0.845 -4.725 1.00 0.38 H new ATOM 591 N ALA A 44 -16.682 1.015 -1.075 1.00 0.63 N ATOM 592 CA ALA A 44 -17.076 0.033 -0.070 1.00 0.65 C ATOM 593 C ALA A 44 -17.664 -1.236 -0.679 1.00 0.46 C ATOM 594 O ALA A 44 -18.672 -1.211 -1.388 1.00 0.79 O ATOM 595 CB ALA A 44 -18.082 0.650 0.891 1.00 1.13 C ATOM 0 H ALA A 44 -17.197 1.894 -1.024 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.170 -0.255 0.463 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.372 -0.089 1.638 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -17.632 1.510 1.386 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -18.964 0.971 0.337 1.00 1.13 H new ATOM 601 N LEU A 45 -17.007 -2.342 -0.382 1.00 0.47 N ATOM 602 CA LEU A 45 -17.472 -3.667 -0.722 1.00 0.66 C ATOM 603 C LEU A 45 -18.532 -4.176 0.240 1.00 0.62 C ATOM 604 O LEU A 45 -18.639 -3.718 1.377 1.00 0.88 O ATOM 605 CB LEU A 45 -16.308 -4.645 -0.771 1.00 1.23 C ATOM 606 CG LEU A 45 -15.999 -5.178 -2.161 1.00 2.25 C ATOM 607 CD1 LEU A 45 -17.192 -5.947 -2.685 1.00 2.87 C ATOM 608 CD2 LEU A 45 -15.636 -4.039 -3.105 1.00 2.93 C ATOM 0 H LEU A 45 -16.115 -2.340 0.114 1.00 0.47 H new ATOM 0 HA LEU A 45 -17.931 -3.595 -1.708 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -15.419 -4.154 -0.377 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -16.526 -5.485 -0.112 1.00 1.23 H new ATOM 0 HG LEU A 45 -15.142 -5.849 -2.102 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -16.970 -6.329 -3.681 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -17.409 -6.781 -2.017 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -18.058 -5.286 -2.734 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -15.418 -4.442 -4.094 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -16.471 -3.342 -3.173 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -14.758 -3.517 -2.725 1.00 2.93 H new ATOM 620 N HIS A 46 -19.316 -5.119 -0.245 1.00 0.61 N ATOM 621 CA HIS A 46 -20.240 -5.864 0.591 1.00 0.80 C ATOM 622 C HIS A 46 -20.155 -7.342 0.195 1.00 0.76 C ATOM 623 O HIS A 46 -20.596 -8.219 0.928 1.00 0.94 O ATOM 624 CB HIS A 46 -21.667 -5.339 0.426 1.00 1.06 C ATOM 625 CG HIS A 46 -22.600 -5.749 1.527 1.00 1.87 C ATOM 626 ND1 HIS A 46 -23.028 -4.881 2.508 1.00 2.69 N ATOM 627 CD2 HIS A 46 -23.197 -6.935 1.793 1.00 2.79 C ATOM 628 CE1 HIS A 46 -23.843 -5.514 3.330 1.00 3.63 C ATOM 629 NE2 HIS A 46 -23.964 -6.761 2.917 1.00 3.71 N ATOM 0 H HIS A 46 -19.331 -5.391 -1.228 1.00 0.61 H new ATOM 0 HA HIS A 46 -19.971 -5.744 1.641 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -21.639 -4.251 0.374 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -22.066 -5.693 -0.525 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -23.089 -7.848 1.226 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -24.328 -5.084 4.194 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -24.535 -7.480 3.361 1.00 3.71 H new ATOM 638 N ASN A 47 -19.574 -7.607 -0.977 1.00 0.66 N ATOM 639 CA ASN A 47 -19.145 -8.966 -1.331 1.00 0.71 C ATOM 640 C ASN A 47 -17.748 -9.213 -0.778 1.00 0.76 C ATOM 641 O ASN A 47 -17.203 -10.313 -0.890 1.00 0.88 O ATOM 642 CB ASN A 47 -19.052 -9.118 -2.842 1.00 0.74 C ATOM 643 CG ASN A 47 -18.995 -10.568 -3.295 1.00 1.42 C ATOM 644 OD1 ASN A 47 -19.522 -11.465 -2.636 1.00 2.21 O ATOM 645 ND2 ASN A 47 -18.346 -10.808 -4.425 1.00 1.94 N ATOM 0 H ASN A 47 -19.390 -6.905 -1.694 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.871 -9.667 -0.920 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.913 -8.633 -3.303 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -18.164 -8.597 -3.199 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -18.270 -11.762 -4.777 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -17.922 -10.038 -4.943 1.00 1.94 H new ATOM 652 N LEU A 48 -17.190 -8.167 -0.178 1.00 0.77 N ATOM 653 CA LEU A 48 -15.821 -8.154 0.313 1.00 0.89 C ATOM 654 C LEU A 48 -14.806 -8.288 -0.840 1.00 0.81 C ATOM 655 O LEU A 48 -14.107 -7.331 -1.157 1.00 0.78 O ATOM 656 CB LEU A 48 -15.657 -9.226 1.388 1.00 1.15 C ATOM 657 CG LEU A 48 -16.502 -8.971 2.645 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.741 -10.254 3.426 1.00 1.71 C ATOM 659 CD2 LEU A 48 -15.838 -7.928 3.528 1.00 1.66 C ATOM 0 H LEU A 48 -17.687 -7.291 -0.018 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.609 -7.189 0.774 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.929 -10.194 0.968 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.606 -9.286 1.673 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.472 -8.593 2.322 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.342 -10.036 4.309 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.268 -10.971 2.796 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.784 -10.676 3.734 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.450 -7.759 4.414 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -14.852 -8.281 3.830 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -15.736 -6.995 2.974 1.00 1.66 H new ATOM 671 N ASP A 49 -14.760 -9.437 -1.498 1.00 0.83 N ATOM 672 CA ASP A 49 -13.812 -9.660 -2.603 1.00 0.83 C ATOM 673 C ASP A 49 -14.363 -9.141 -3.935 1.00 0.75 C ATOM 674 O ASP A 49 -15.011 -9.871 -4.688 1.00 0.83 O ATOM 675 CB ASP A 49 -13.465 -11.148 -2.731 1.00 1.00 C ATOM 676 CG ASP A 49 -12.544 -11.458 -3.899 1.00 1.20 C ATOM 677 OD1 ASP A 49 -11.673 -10.627 -4.221 1.00 1.53 O ATOM 678 OD2 ASP A 49 -12.683 -12.547 -4.497 1.00 1.87 O ATOM 0 H ASP A 49 -15.363 -10.234 -1.294 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.907 -9.100 -2.367 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.993 -11.483 -1.808 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -14.386 -11.719 -2.844 1.00 1.00 H new ATOM 683 N GLU A 50 -14.139 -7.866 -4.188 1.00 0.66 N ATOM 684 CA GLU A 50 -14.482 -7.242 -5.464 1.00 0.72 C ATOM 685 C GLU A 50 -13.459 -6.161 -5.767 1.00 0.62 C ATOM 686 O GLU A 50 -13.177 -5.847 -6.926 1.00 0.68 O ATOM 687 CB GLU A 50 -15.896 -6.667 -5.433 1.00 0.94 C ATOM 688 CG GLU A 50 -16.313 -5.945 -6.702 1.00 1.25 C ATOM 689 CD GLU A 50 -17.705 -5.357 -6.595 1.00 1.93 C ATOM 690 OE1 GLU A 50 -17.829 -4.197 -6.151 1.00 2.66 O ATOM 691 OE2 GLU A 50 -18.683 -6.047 -6.961 1.00 2.35 O ATOM 0 H GLU A 50 -13.713 -7.227 -3.517 1.00 0.66 H new ATOM 0 HA GLU A 50 -14.462 -7.994 -6.253 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.600 -7.478 -5.244 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.974 -5.975 -4.594 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -15.600 -5.149 -6.916 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -16.277 -6.639 -7.541 1.00 1.25 H new ATOM 698 N ALA A 51 -12.885 -5.617 -4.704 1.00 0.52 N ATOM 699 CA ALA A 51 -11.805 -4.665 -4.822 1.00 0.43 C ATOM 700 C ALA A 51 -10.516 -5.394 -5.115 1.00 0.32 C ATOM 701 O ALA A 51 -10.416 -6.605 -4.906 1.00 0.33 O ATOM 702 CB ALA A 51 -11.649 -3.887 -3.536 1.00 0.50 C ATOM 0 H ALA A 51 -13.157 -5.825 -3.743 1.00 0.52 H new ATOM 0 HA ALA A 51 -12.035 -3.975 -5.634 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -10.832 -3.173 -3.639 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -12.573 -3.351 -3.320 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -11.429 -4.575 -2.719 1.00 0.50 H new ATOM 708 N VAL A 52 -9.538 -4.665 -5.611 1.00 0.28 N ATOM 709 CA VAL A 52 -8.276 -5.267 -5.946 1.00 0.26 C ATOM 710 C VAL A 52 -7.542 -5.641 -4.677 1.00 0.22 C ATOM 711 O VAL A 52 -7.408 -4.856 -3.741 1.00 0.23 O ATOM 712 CB VAL A 52 -7.391 -4.384 -6.855 1.00 0.29 C ATOM 713 CG1 VAL A 52 -7.984 -4.302 -8.252 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.206 -2.991 -6.277 1.00 0.31 C ATOM 0 H VAL A 52 -9.597 -3.662 -5.788 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.493 -6.162 -6.529 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.408 -4.851 -6.913 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.350 -3.677 -8.880 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.046 -5.302 -8.680 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -8.982 -3.868 -8.199 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.578 -2.401 -6.944 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -8.178 -2.509 -6.172 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.729 -3.063 -5.300 1.00 0.31 H new ATOM 724 N LYS A 53 -7.103 -6.869 -4.672 1.00 0.22 N ATOM 725 CA LYS A 53 -6.543 -7.509 -3.489 1.00 0.22 C ATOM 726 C LYS A 53 -5.056 -7.373 -3.490 1.00 0.18 C ATOM 727 O LYS A 53 -4.395 -7.632 -4.488 1.00 0.24 O ATOM 728 CB LYS A 53 -6.931 -8.987 -3.447 1.00 0.35 C ATOM 729 CG LYS A 53 -8.429 -9.207 -3.375 1.00 0.78 C ATOM 730 CD LYS A 53 -8.794 -10.680 -3.318 1.00 1.12 C ATOM 731 CE LYS A 53 -8.467 -11.393 -4.618 1.00 1.37 C ATOM 732 NZ LYS A 53 -9.148 -12.710 -4.706 1.00 1.59 N ATOM 0 H LYS A 53 -7.119 -7.471 -5.495 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.946 -7.017 -2.604 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.539 -9.485 -4.334 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -6.459 -9.456 -2.584 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -8.826 -8.702 -2.494 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -8.903 -8.751 -4.244 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -8.257 -11.156 -2.497 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -9.858 -10.783 -3.105 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -8.768 -10.770 -5.461 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -7.389 -11.534 -4.695 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -8.902 -13.169 -5.606 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -8.842 -13.313 -3.916 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -10.178 -12.572 -4.658 1.00 1.59 H new ATOM 746 N PHE A 54 -4.547 -6.934 -2.366 1.00 0.18 N ATOM 747 CA PHE A 54 -3.170 -6.617 -2.235 1.00 0.19 C ATOM 748 C PHE A 54 -2.441 -7.732 -1.533 1.00 0.20 C ATOM 749 O PHE A 54 -3.044 -8.607 -0.905 1.00 0.23 O ATOM 750 CB PHE A 54 -2.993 -5.302 -1.468 1.00 0.25 C ATOM 751 CG PHE A 54 -3.396 -4.079 -2.245 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.726 -3.714 -2.359 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.437 -3.287 -2.852 1.00 1.95 C ATOM 754 CE1 PHE A 54 -5.091 -2.584 -3.063 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.795 -2.156 -3.559 1.00 2.98 C ATOM 756 CZ PHE A 54 -4.125 -1.804 -3.664 1.00 3.31 C ATOM 0 H PHE A 54 -5.092 -6.790 -1.516 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.747 -6.496 -3.232 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.581 -5.347 -0.551 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.948 -5.204 -1.173 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.488 -4.321 -1.892 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.394 -3.557 -2.772 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -6.133 -2.311 -3.143 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -2.036 -1.548 -4.029 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.409 -0.920 -4.215 1.00 3.31 H new ATOM 766 N ASP A 55 -1.144 -7.660 -1.634 1.00 0.21 N ATOM 767 CA ASP A 55 -0.260 -8.583 -0.957 1.00 0.22 C ATOM 768 C ASP A 55 0.879 -7.785 -0.366 1.00 0.23 C ATOM 769 O ASP A 55 1.482 -6.948 -1.040 1.00 0.27 O ATOM 770 CB ASP A 55 0.331 -9.621 -1.926 1.00 0.24 C ATOM 771 CG ASP A 55 -0.681 -10.224 -2.876 1.00 1.33 C ATOM 772 OD1 ASP A 55 -1.628 -10.880 -2.399 1.00 1.89 O ATOM 773 OD2 ASP A 55 -0.548 -10.047 -4.096 1.00 1.93 O ATOM 0 H ASP A 55 -0.661 -6.956 -2.191 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.829 -9.114 -0.194 1.00 0.22 H new ATOM 0 HB2 ASP A 55 1.124 -9.150 -2.507 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.792 -10.421 -1.347 1.00 0.24 H new ATOM 778 N MET A 56 1.142 -8.035 0.902 1.00 0.24 N ATOM 779 CA MET A 56 2.132 -7.312 1.646 1.00 0.25 C ATOM 780 C MET A 56 3.322 -8.210 1.876 1.00 0.25 C ATOM 781 O MET A 56 3.179 -9.371 2.260 1.00 0.30 O ATOM 782 CB MET A 56 1.549 -6.882 2.992 1.00 0.33 C ATOM 783 CG MET A 56 0.086 -6.486 2.912 1.00 0.97 C ATOM 784 SD MET A 56 -0.693 -6.360 4.529 1.00 1.19 S ATOM 785 CE MET A 56 -2.417 -6.313 4.050 1.00 1.85 C ATOM 0 H MET A 56 0.664 -8.756 1.443 1.00 0.24 H new ATOM 0 HA MET A 56 2.438 -6.426 1.089 1.00 0.25 H new ATOM 0 HB2 MET A 56 1.659 -7.699 3.706 1.00 0.33 H new ATOM 0 HB3 MET A 56 2.125 -6.041 3.378 1.00 0.33 H new ATOM 0 HG2 MET A 56 0.001 -5.529 2.398 1.00 0.97 H new ATOM 0 HG3 MET A 56 -0.452 -7.219 2.311 1.00 0.97 H new ATOM 0 HE1 MET A 56 -3.040 -6.555 4.911 1.00 1.85 H new ATOM 0 HE2 MET A 56 -2.667 -5.315 3.690 1.00 1.85 H new ATOM 0 HE3 MET A 56 -2.594 -7.040 3.257 1.00 1.85 H new ATOM 795 N GLY A 57 4.485 -7.679 1.636 1.00 0.26 N ATOM 796 CA GLY A 57 5.687 -8.393 1.906 1.00 0.32 C ATOM 797 C GLY A 57 6.677 -7.443 2.483 1.00 0.31 C ATOM 798 O GLY A 57 6.902 -6.393 1.903 1.00 0.35 O ATOM 0 H GLY A 57 4.621 -6.745 1.250 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.495 -9.210 2.602 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.077 -8.839 0.991 1.00 0.32 H new ATOM 802 N ALA A 58 7.277 -7.758 3.593 1.00 0.37 N ATOM 803 CA ALA A 58 8.134 -6.787 4.214 1.00 0.38 C ATOM 804 C ALA A 58 9.487 -6.875 3.563 1.00 0.42 C ATOM 805 O ALA A 58 9.892 -7.933 3.080 1.00 0.61 O ATOM 806 CB ALA A 58 8.219 -7.016 5.713 1.00 0.51 C ATOM 0 H ALA A 58 7.195 -8.652 4.077 1.00 0.37 H new ATOM 0 HA ALA A 58 7.728 -5.785 4.076 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.874 -6.267 6.159 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.224 -6.934 6.151 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.620 -8.011 5.907 1.00 0.51 H new ATOM 812 N TYR A 59 10.163 -5.768 3.463 1.00 0.45 N ATOM 813 CA TYR A 59 11.454 -5.805 2.823 1.00 0.61 C ATOM 814 C TYR A 59 12.506 -5.203 3.720 1.00 0.72 C ATOM 815 O TYR A 59 12.190 -4.387 4.583 1.00 0.81 O ATOM 816 CB TYR A 59 11.386 -5.122 1.455 1.00 0.93 C ATOM 817 CG TYR A 59 11.727 -3.632 1.391 1.00 1.64 C ATOM 818 CD1 TYR A 59 13.006 -3.181 1.692 1.00 2.54 C ATOM 819 CD2 TYR A 59 10.757 -2.677 1.092 1.00 2.01 C ATOM 820 CE1 TYR A 59 13.307 -1.828 1.682 1.00 3.70 C ATOM 821 CE2 TYR A 59 11.048 -1.331 1.084 1.00 3.08 C ATOM 822 CZ TYR A 59 12.375 -0.930 1.170 1.00 3.92 C ATOM 823 OH TYR A 59 12.607 0.437 1.373 1.00 5.11 O ATOM 0 H TYR A 59 9.860 -4.855 3.802 1.00 0.45 H new ATOM 0 HA TYR A 59 11.743 -6.842 2.650 1.00 0.61 H new ATOM 0 HB2 TYR A 59 12.061 -5.651 0.781 1.00 0.93 H new ATOM 0 HB3 TYR A 59 10.377 -5.253 1.063 1.00 0.93 H new ATOM 0 HD1 TYR A 59 13.778 -3.896 1.938 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.753 -3.000 0.861 1.00 2.01 H new ATOM 0 HE1 TYR A 59 14.253 -1.475 2.067 1.00 3.70 H new ATOM 0 HE2 TYR A 59 10.257 -0.599 1.012 1.00 3.08 H new ATOM 0 HH TYR A 59 13.134 0.794 0.628 1.00 5.11 H new ATOM 833 N LYS A 60 13.754 -5.632 3.566 1.00 0.92 N ATOM 834 CA LYS A 60 14.783 -5.076 4.423 1.00 1.13 C ATOM 835 C LYS A 60 16.077 -4.794 3.678 1.00 1.50 C ATOM 836 O LYS A 60 16.688 -5.678 3.082 1.00 1.77 O ATOM 837 CB LYS A 60 15.052 -6.005 5.613 1.00 1.30 C ATOM 838 CG LYS A 60 15.428 -5.281 6.904 1.00 1.66 C ATOM 839 CD LYS A 60 16.770 -4.575 6.800 1.00 2.14 C ATOM 840 CE LYS A 60 17.066 -3.745 8.040 1.00 2.79 C ATOM 841 NZ LYS A 60 17.186 -4.586 9.261 1.00 3.47 N ATOM 0 H LYS A 60 14.064 -6.329 2.889 1.00 0.92 H new ATOM 0 HA LYS A 60 14.406 -4.120 4.786 1.00 1.13 H new ATOM 0 HB2 LYS A 60 14.163 -6.609 5.795 1.00 1.30 H new ATOM 0 HB3 LYS A 60 15.856 -6.692 5.348 1.00 1.30 H new ATOM 0 HG2 LYS A 60 14.655 -4.552 7.148 1.00 1.66 H new ATOM 0 HG3 LYS A 60 15.460 -5.998 7.724 1.00 1.66 H new ATOM 0 HD2 LYS A 60 17.560 -5.313 6.659 1.00 2.14 H new ATOM 0 HD3 LYS A 60 16.775 -3.931 5.921 1.00 2.14 H new ATOM 0 HE2 LYS A 60 17.992 -3.189 7.891 1.00 2.79 H new ATOM 0 HE3 LYS A 60 16.273 -3.011 8.182 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 17.487 -3.995 10.062 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 16.265 -5.018 9.477 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 17.890 -5.334 9.099 1.00 3.47 H new ATOM 855 N SER A 61 16.457 -3.539 3.719 1.00 1.67 N ATOM 856 CA SER A 61 17.813 -3.099 3.479 1.00 2.15 C ATOM 857 C SER A 61 18.041 -1.977 4.472 1.00 2.02 C ATOM 858 O SER A 61 17.071 -1.357 4.894 1.00 1.72 O ATOM 859 CB SER A 61 17.982 -2.615 2.038 1.00 2.67 C ATOM 860 OG SER A 61 17.683 -3.654 1.118 1.00 3.06 O ATOM 0 H SER A 61 15.815 -2.774 3.926 1.00 1.67 H new ATOM 0 HA SER A 61 18.537 -3.904 3.608 1.00 2.15 H new ATOM 0 HB2 SER A 61 17.327 -1.763 1.857 1.00 2.67 H new ATOM 0 HB3 SER A 61 19.004 -2.269 1.883 1.00 2.67 H new ATOM 0 HG SER A 61 17.470 -4.475 1.609 1.00 3.06 H new ATOM 866 N SER A 62 19.264 -1.674 4.857 1.00 2.37 N ATOM 867 CA SER A 62 19.434 -0.661 5.883 1.00 2.25 C ATOM 868 C SER A 62 19.512 0.726 5.253 1.00 2.37 C ATOM 869 O SER A 62 20.367 1.544 5.600 1.00 2.59 O ATOM 870 CB SER A 62 20.684 -0.956 6.713 1.00 2.65 C ATOM 871 OG SER A 62 20.732 -0.156 7.884 1.00 2.99 O ATOM 0 H SER A 62 20.121 -2.092 4.496 1.00 2.37 H new ATOM 0 HA SER A 62 18.570 -0.682 6.547 1.00 2.25 H new ATOM 0 HB2 SER A 62 20.697 -2.010 6.990 1.00 2.65 H new ATOM 0 HB3 SER A 62 21.574 -0.774 6.110 1.00 2.65 H new ATOM 0 HG SER A 62 20.744 0.791 7.633 1.00 2.99 H new ATOM 877 N LYS A 63 18.599 0.983 4.325 1.00 2.37 N ATOM 878 CA LYS A 63 18.404 2.314 3.790 1.00 2.64 C ATOM 879 C LYS A 63 16.959 2.769 3.940 1.00 2.48 C ATOM 880 O LYS A 63 16.449 3.487 3.077 1.00 2.87 O ATOM 881 CB LYS A 63 18.833 2.395 2.322 1.00 3.20 C ATOM 882 CG LYS A 63 20.324 2.638 2.136 1.00 3.62 C ATOM 883 CD LYS A 63 20.777 3.901 2.861 1.00 4.18 C ATOM 884 CE LYS A 63 20.077 5.151 2.338 1.00 4.77 C ATOM 885 NZ LYS A 63 20.487 5.484 0.950 1.00 5.27 N ATOM 0 H LYS A 63 17.980 0.277 3.928 1.00 2.37 H new ATOM 0 HA LYS A 63 19.036 2.986 4.370 1.00 2.64 H new ATOM 0 HB2 LYS A 63 18.559 1.467 1.820 1.00 3.20 H new ATOM 0 HB3 LYS A 63 18.279 3.197 1.834 1.00 3.20 H new ATOM 0 HG2 LYS A 63 20.883 1.781 2.511 1.00 3.62 H new ATOM 0 HG3 LYS A 63 20.550 2.726 1.073 1.00 3.62 H new ATOM 0 HD2 LYS A 63 20.579 3.796 3.928 1.00 4.18 H new ATOM 0 HD3 LYS A 63 21.855 4.016 2.747 1.00 4.18 H new ATOM 0 HE2 LYS A 63 18.998 5.001 2.370 1.00 4.77 H new ATOM 0 HE3 LYS A 63 20.302 5.992 2.993 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 20.026 6.368 0.654 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 21.519 5.603 0.912 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 20.203 4.715 0.310 1.00 5.27 H new ATOM 899 N ASP A 64 16.284 2.354 5.005 1.00 2.02 N ATOM 900 CA ASP A 64 14.949 2.883 5.265 1.00 2.02 C ATOM 901 C ASP A 64 15.103 4.271 5.886 1.00 2.36 C ATOM 902 O ASP A 64 15.782 5.132 5.321 1.00 2.81 O ATOM 903 CB ASP A 64 14.198 1.960 6.222 1.00 1.53 C ATOM 904 CG ASP A 64 14.159 0.515 5.763 1.00 1.63 C ATOM 905 OD1 ASP A 64 13.459 0.232 4.769 1.00 1.88 O ATOM 906 OD2 ASP A 64 14.837 -0.332 6.379 1.00 1.89 O ATOM 0 H ASP A 64 16.624 1.674 5.685 1.00 2.02 H new ATOM 0 HA ASP A 64 14.381 2.947 4.337 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.668 2.008 7.204 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.177 2.324 6.339 1.00 1.53 H new ATOM 911 N ASP A 65 14.487 4.519 7.034 1.00 2.27 N ATOM 912 CA ASP A 65 14.955 5.593 7.904 1.00 2.65 C ATOM 913 C ASP A 65 15.152 5.085 9.327 1.00 2.35 C ATOM 914 O ASP A 65 16.252 4.723 9.747 1.00 2.28 O ATOM 915 CB ASP A 65 13.982 6.774 7.890 1.00 3.22 C ATOM 916 CG ASP A 65 14.512 7.970 8.657 1.00 3.59 C ATOM 917 OD1 ASP A 65 15.266 8.775 8.066 1.00 4.06 O ATOM 918 OD2 ASP A 65 14.179 8.107 9.853 1.00 3.75 O ATOM 0 H ASP A 65 13.678 4.004 7.381 1.00 2.27 H new ATOM 0 HA ASP A 65 15.916 5.939 7.522 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.784 7.066 6.859 1.00 3.22 H new ATOM 0 HB3 ASP A 65 13.031 6.462 8.321 1.00 3.22 H new ATOM 923 N ALA A 66 14.031 5.056 10.042 1.00 2.40 N ATOM 924 CA ALA A 66 13.918 4.497 11.380 1.00 2.34 C ATOM 925 C ALA A 66 12.708 3.577 11.409 1.00 2.24 C ATOM 926 O ALA A 66 12.159 3.269 12.464 1.00 2.63 O ATOM 927 CB ALA A 66 13.786 5.605 12.415 1.00 2.98 C ATOM 0 H ALA A 66 13.150 5.433 9.693 1.00 2.40 H new ATOM 0 HA ALA A 66 14.816 3.931 11.626 1.00 2.34 H new ATOM 0 HB1 ALA A 66 13.703 5.166 13.409 1.00 2.98 H new ATOM 0 HB2 ALA A 66 14.666 6.247 12.374 1.00 2.98 H new ATOM 0 HB3 ALA A 66 12.895 6.196 12.204 1.00 2.98 H new ATOM 933 N LYS A 67 12.313 3.147 10.222 1.00 1.96 N ATOM 934 CA LYS A 67 10.966 2.647 9.952 1.00 1.89 C ATOM 935 C LYS A 67 11.060 1.477 9.000 1.00 1.44 C ATOM 936 O LYS A 67 11.955 1.428 8.165 1.00 1.95 O ATOM 937 CB LYS A 67 10.109 3.746 9.307 1.00 2.82 C ATOM 938 CG LYS A 67 10.151 5.085 10.028 1.00 3.45 C ATOM 939 CD LYS A 67 9.545 5.005 11.420 1.00 4.32 C ATOM 940 CE LYS A 67 9.808 6.280 12.207 1.00 5.01 C ATOM 941 NZ LYS A 67 9.208 6.227 13.565 1.00 5.31 N ATOM 0 H LYS A 67 12.924 3.133 9.405 1.00 1.96 H new ATOM 0 HA LYS A 67 10.505 2.340 10.890 1.00 1.89 H new ATOM 0 HB2 LYS A 67 10.441 3.891 8.279 1.00 2.82 H new ATOM 0 HB3 LYS A 67 9.075 3.404 9.263 1.00 2.82 H new ATOM 0 HG2 LYS A 67 11.184 5.424 10.102 1.00 3.45 H new ATOM 0 HG3 LYS A 67 9.613 5.829 9.441 1.00 3.45 H new ATOM 0 HD2 LYS A 67 8.471 4.837 11.343 1.00 4.32 H new ATOM 0 HD3 LYS A 67 9.964 4.152 11.954 1.00 4.32 H new ATOM 0 HE2 LYS A 67 10.883 6.439 12.291 1.00 5.01 H new ATOM 0 HE3 LYS A 67 9.401 7.133 11.663 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 9.410 7.114 14.069 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 8.179 6.101 13.485 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 9.615 5.429 14.093 1.00 5.31 H new ATOM 955 N ILE A 68 10.156 0.531 9.142 1.00 0.88 N ATOM 956 CA ILE A 68 10.262 -0.718 8.432 1.00 0.76 C ATOM 957 C ILE A 68 9.347 -0.695 7.249 1.00 0.43 C ATOM 958 O ILE A 68 8.261 -0.102 7.285 1.00 0.37 O ATOM 959 CB ILE A 68 9.915 -1.945 9.295 1.00 0.97 C ATOM 960 CG1 ILE A 68 8.545 -1.768 9.964 1.00 1.07 C ATOM 961 CG2 ILE A 68 10.998 -2.191 10.336 1.00 1.51 C ATOM 962 CD1 ILE A 68 8.097 -2.968 10.773 1.00 1.66 C ATOM 0 H ILE A 68 9.338 0.607 9.746 1.00 0.88 H new ATOM 0 HA ILE A 68 11.305 -0.816 8.131 1.00 0.76 H new ATOM 0 HB ILE A 68 9.864 -2.818 8.644 1.00 0.97 H new ATOM 0 HG12 ILE A 68 8.580 -0.895 10.616 1.00 1.07 H new ATOM 0 HG13 ILE A 68 7.800 -1.562 9.195 1.00 1.07 H new ATOM 0 HG21 ILE A 68 10.735 -3.062 10.936 1.00 1.51 H new ATOM 0 HG22 ILE A 68 11.950 -2.369 9.836 1.00 1.51 H new ATOM 0 HG23 ILE A 68 11.086 -1.318 10.983 1.00 1.51 H new ATOM 0 HD11 ILE A 68 7.121 -2.766 11.214 1.00 1.66 H new ATOM 0 HD12 ILE A 68 8.028 -3.840 10.123 1.00 1.66 H new ATOM 0 HD13 ILE A 68 8.820 -3.163 11.565 1.00 1.66 H new ATOM 974 N THR A 69 9.788 -1.349 6.215 1.00 0.47 N ATOM 975 CA THR A 69 9.154 -1.242 4.948 1.00 0.38 C ATOM 976 C THR A 69 8.465 -2.540 4.572 1.00 0.34 C ATOM 977 O THR A 69 9.000 -3.628 4.768 1.00 0.46 O ATOM 978 CB THR A 69 10.206 -0.863 3.911 1.00 0.55 C ATOM 979 OG1 THR A 69 11.396 -1.632 4.124 1.00 1.50 O ATOM 980 CG2 THR A 69 10.538 0.608 4.022 1.00 1.23 C ATOM 0 H THR A 69 10.597 -1.970 6.233 1.00 0.47 H new ATOM 0 HA THR A 69 8.384 -0.471 4.989 1.00 0.38 H new ATOM 0 HB THR A 69 9.809 -1.070 2.917 1.00 0.55 H new ATOM 0 HG1 THR A 69 11.845 -1.785 3.266 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.290 0.868 3.277 1.00 1.23 H new ATOM 0 HG22 THR A 69 9.638 1.198 3.850 1.00 1.23 H new ATOM 0 HG23 THR A 69 10.926 0.819 5.019 1.00 1.23 H new ATOM 988 N VAL A 70 7.254 -2.412 4.083 1.00 0.27 N ATOM 989 CA VAL A 70 6.498 -3.538 3.578 1.00 0.28 C ATOM 990 C VAL A 70 5.959 -3.161 2.200 1.00 0.26 C ATOM 991 O VAL A 70 5.875 -1.972 1.876 1.00 0.29 O ATOM 992 CB VAL A 70 5.387 -3.962 4.581 1.00 0.33 C ATOM 993 CG1 VAL A 70 4.910 -2.775 5.394 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.212 -4.644 3.896 1.00 1.06 C ATOM 0 H VAL A 70 6.762 -1.521 4.023 1.00 0.27 H new ATOM 0 HA VAL A 70 7.134 -4.417 3.471 1.00 0.28 H new ATOM 0 HB VAL A 70 5.836 -4.693 5.253 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.134 -3.098 6.088 1.00 0.98 H new ATOM 0 HG12 VAL A 70 5.747 -2.358 5.954 1.00 0.98 H new ATOM 0 HG13 VAL A 70 4.506 -2.015 4.725 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.466 -4.919 4.642 1.00 1.06 H new ATOM 0 HG22 VAL A 70 3.767 -3.962 3.172 1.00 1.06 H new ATOM 0 HG23 VAL A 70 4.560 -5.541 3.383 1.00 1.06 H new ATOM 1004 N ILE A 71 5.623 -4.161 1.400 1.00 0.25 N ATOM 1005 CA ILE A 71 5.341 -3.974 -0.006 1.00 0.28 C ATOM 1006 C ILE A 71 3.857 -4.108 -0.269 1.00 0.28 C ATOM 1007 O ILE A 71 3.241 -5.082 0.152 1.00 0.33 O ATOM 1008 CB ILE A 71 6.128 -5.032 -0.813 1.00 0.39 C ATOM 1009 CG1 ILE A 71 7.594 -4.601 -0.927 1.00 1.29 C ATOM 1010 CG2 ILE A 71 5.508 -5.286 -2.180 1.00 1.34 C ATOM 1011 CD1 ILE A 71 8.502 -5.653 -1.522 1.00 2.12 C ATOM 0 H ILE A 71 5.539 -5.128 1.714 1.00 0.25 H new ATOM 0 HA ILE A 71 5.648 -2.974 -0.312 1.00 0.28 H new ATOM 0 HB ILE A 71 6.080 -5.981 -0.278 1.00 0.39 H new ATOM 0 HG12 ILE A 71 7.650 -3.700 -1.538 1.00 1.29 H new ATOM 0 HG13 ILE A 71 7.962 -4.337 0.064 1.00 1.29 H new ATOM 0 HG21 ILE A 71 6.094 -6.036 -2.712 1.00 1.34 H new ATOM 0 HG22 ILE A 71 4.486 -5.645 -2.055 1.00 1.34 H new ATOM 0 HG23 ILE A 71 5.499 -4.359 -2.753 1.00 1.34 H new ATOM 0 HD11 ILE A 71 9.521 -5.270 -1.568 1.00 2.12 H new ATOM 0 HD12 ILE A 71 8.478 -6.548 -0.900 1.00 2.12 H new ATOM 0 HD13 ILE A 71 8.162 -5.901 -2.527 1.00 2.12 H new ATOM 1023 N LEU A 72 3.277 -3.118 -0.925 1.00 0.28 N ATOM 1024 CA LEU A 72 1.863 -3.201 -1.283 1.00 0.29 C ATOM 1025 C LEU A 72 1.686 -3.426 -2.787 1.00 0.27 C ATOM 1026 O LEU A 72 2.059 -2.578 -3.597 1.00 0.30 O ATOM 1027 CB LEU A 72 1.123 -1.939 -0.836 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.371 -2.128 -0.548 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.570 -3.075 0.626 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -1.032 -0.788 -0.269 1.00 0.88 C ATOM 0 H LEU A 72 3.748 -2.262 -1.218 1.00 0.28 H new ATOM 0 HA LEU A 72 1.433 -4.058 -0.764 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.604 -1.554 0.063 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.235 -1.178 -1.609 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.840 -2.567 -1.429 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.636 -3.198 0.817 1.00 0.79 H new ATOM 0 HD12 LEU A 72 -0.129 -4.044 0.391 1.00 0.79 H new ATOM 0 HD13 LEU A 72 -0.088 -2.662 1.512 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -2.092 -0.940 -0.067 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.560 -0.323 0.597 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.918 -0.138 -1.137 1.00 0.88 H new ATOM 1042 N ARG A 73 1.119 -4.565 -3.157 1.00 0.24 N ATOM 1043 CA ARG A 73 0.849 -4.871 -4.563 1.00 0.24 C ATOM 1044 C ARG A 73 -0.530 -5.481 -4.709 1.00 0.21 C ATOM 1045 O ARG A 73 -1.011 -6.087 -3.775 1.00 0.24 O ATOM 1046 CB ARG A 73 1.859 -5.882 -5.089 1.00 0.28 C ATOM 1047 CG ARG A 73 1.541 -7.318 -4.682 1.00 0.43 C ATOM 1048 CD ARG A 73 2.097 -8.288 -5.706 1.00 0.58 C ATOM 1049 NE ARG A 73 1.614 -9.653 -5.531 1.00 0.91 N ATOM 1050 CZ ARG A 73 2.125 -10.698 -6.174 1.00 1.04 C ATOM 1051 NH1 ARG A 73 3.164 -10.531 -6.985 1.00 1.27 N ATOM 1052 NH2 ARG A 73 1.606 -11.907 -6.002 1.00 1.67 N ATOM 0 H ARG A 73 0.835 -5.297 -2.505 1.00 0.24 H new ATOM 0 HA ARG A 73 0.917 -3.940 -5.126 1.00 0.24 H new ATOM 0 HB2 ARG A 73 1.894 -5.819 -6.177 1.00 0.28 H new ATOM 0 HB3 ARG A 73 2.851 -5.619 -4.723 1.00 0.28 H new ATOM 0 HG2 ARG A 73 1.968 -7.529 -3.701 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.462 -7.449 -4.595 1.00 0.43 H new ATOM 0 HD2 ARG A 73 1.832 -7.942 -6.705 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.185 -8.285 -5.646 1.00 0.58 H new ATOM 0 HE ARG A 73 0.844 -9.814 -4.882 1.00 0.91 H new ATOM 0 HH11 ARG A 73 3.567 -9.603 -7.113 1.00 1.27 H new ATOM 0 HH12 ARG A 73 3.558 -11.331 -7.480 1.00 1.27 H new ATOM 0 HH21 ARG A 73 0.812 -12.037 -5.375 1.00 1.67 H new ATOM 0 HH22 ARG A 73 2.001 -12.707 -6.497 1.00 1.67 H new ATOM 1066 N ILE A 74 -1.172 -5.334 -5.858 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.368 -6.099 -6.133 1.00 0.24 C ATOM 1068 C ILE A 74 -2.001 -7.454 -6.740 1.00 0.27 C ATOM 1069 O ILE A 74 -1.199 -7.533 -7.660 1.00 0.30 O ATOM 1070 CB ILE A 74 -3.357 -5.345 -7.037 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.726 -4.976 -8.382 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.858 -4.098 -6.330 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.687 -4.310 -9.346 1.00 1.81 C ATOM 0 H ILE A 74 -0.886 -4.699 -6.603 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.875 -6.259 -5.182 1.00 0.24 H new ATOM 0 HB ILE A 74 -4.198 -6.008 -7.240 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -1.882 -4.309 -8.206 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -2.328 -5.878 -8.846 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.558 -3.569 -6.977 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.361 -4.381 -5.406 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -3.015 -3.447 -6.099 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -3.168 -4.079 -10.276 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -4.519 -4.983 -9.553 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -4.066 -3.389 -8.903 1.00 1.81 H new ATOM 1085 N SER A 75 -2.541 -8.512 -6.155 1.00 0.30 N ATOM 1086 CA SER A 75 -2.341 -9.885 -6.621 1.00 0.38 C ATOM 1087 C SER A 75 -2.606 -10.052 -8.122 1.00 0.44 C ATOM 1088 O SER A 75 -2.084 -10.972 -8.752 1.00 0.50 O ATOM 1089 CB SER A 75 -3.280 -10.819 -5.859 1.00 0.47 C ATOM 1090 OG SER A 75 -3.330 -10.486 -4.485 1.00 1.16 O ATOM 0 H SER A 75 -3.139 -8.445 -5.332 1.00 0.30 H new ATOM 0 HA SER A 75 -1.295 -10.132 -6.438 1.00 0.38 H new ATOM 0 HB2 SER A 75 -4.281 -10.760 -6.287 1.00 0.47 H new ATOM 0 HB3 SER A 75 -2.944 -11.850 -5.974 1.00 0.47 H new ATOM 0 HG SER A 75 -2.529 -10.829 -4.036 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.436 -9.179 -8.680 1.00 0.45 N ATOM 1097 CA LYS A 76 -4.010 -9.408 -10.001 1.00 0.54 C ATOM 1098 C LYS A 76 -3.131 -8.895 -11.142 1.00 0.55 C ATOM 1099 O LYS A 76 -2.739 -9.657 -12.027 1.00 0.61 O ATOM 1100 CB LYS A 76 -5.361 -8.709 -10.036 1.00 0.60 C ATOM 1101 CG LYS A 76 -6.374 -9.357 -9.107 1.00 1.21 C ATOM 1102 CD LYS A 76 -7.795 -8.904 -9.392 1.00 1.70 C ATOM 1103 CE LYS A 76 -8.784 -9.646 -8.508 1.00 2.16 C ATOM 1104 NZ LYS A 76 -10.196 -9.357 -8.865 1.00 2.51 N ATOM 0 H LYS A 76 -3.727 -8.306 -8.239 1.00 0.45 H new ATOM 0 HA LYS A 76 -4.101 -10.483 -10.155 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -5.233 -7.663 -9.757 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -5.747 -8.722 -11.055 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -6.314 -10.441 -9.208 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -6.120 -9.119 -8.074 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -7.881 -7.831 -9.221 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -8.034 -9.080 -10.441 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -8.605 -10.718 -8.589 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -8.613 -9.372 -7.467 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -10.829 -9.887 -8.233 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -10.378 -8.338 -8.763 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -10.371 -9.643 -9.850 1.00 2.51 H new ATOM 1118 N THR A 77 -2.828 -7.615 -11.125 1.00 0.51 N ATOM 1119 CA THR A 77 -1.864 -7.046 -12.048 1.00 0.53 C ATOM 1120 C THR A 77 -0.674 -6.602 -11.219 1.00 0.47 C ATOM 1121 O THR A 77 -0.787 -6.558 -10.005 1.00 0.46 O ATOM 1122 CB THR A 77 -2.478 -5.856 -12.804 1.00 0.62 C ATOM 1123 OG1 THR A 77 -3.869 -6.113 -13.049 1.00 1.45 O ATOM 1124 CG2 THR A 77 -1.770 -5.629 -14.132 1.00 1.29 C ATOM 0 H THR A 77 -3.238 -6.942 -10.477 1.00 0.51 H new ATOM 0 HA THR A 77 -1.561 -7.777 -12.797 1.00 0.53 H new ATOM 0 HB THR A 77 -2.362 -4.962 -12.191 1.00 0.62 H new ATOM 0 HG1 THR A 77 -4.144 -5.663 -13.875 1.00 1.45 H new ATOM 0 HG21 THR A 77 -2.224 -4.782 -14.646 1.00 1.29 H new ATOM 0 HG22 THR A 77 -0.715 -5.421 -13.951 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.863 -6.521 -14.751 1.00 1.29 H new ATOM 1132 N GLN A 78 0.453 -6.242 -11.801 1.00 0.50 N ATOM 1133 CA GLN A 78 1.551 -5.862 -10.940 1.00 0.49 C ATOM 1134 C GLN A 78 1.687 -4.350 -10.885 1.00 0.46 C ATOM 1135 O GLN A 78 2.658 -3.766 -11.368 1.00 0.48 O ATOM 1136 CB GLN A 78 2.856 -6.517 -11.402 1.00 0.59 C ATOM 1137 CG GLN A 78 2.729 -8.014 -11.660 1.00 1.49 C ATOM 1138 CD GLN A 78 2.068 -8.779 -10.521 1.00 2.14 C ATOM 1139 OE1 GLN A 78 2.257 -8.321 -9.293 1.00 2.69 O flip ATOM 1140 NE2 GLN A 78 1.393 -9.779 -10.750 1.00 2.90 N flip ATOM 0 H GLN A 78 0.628 -6.205 -12.805 1.00 0.50 H new ATOM 0 HA GLN A 78 1.338 -6.219 -9.932 1.00 0.49 H new ATOM 0 HB2 GLN A 78 3.196 -6.027 -12.315 1.00 0.59 H new ATOM 0 HB3 GLN A 78 3.624 -6.351 -10.646 1.00 0.59 H new ATOM 0 HG2 GLN A 78 2.153 -8.169 -12.572 1.00 1.49 H new ATOM 0 HG3 GLN A 78 3.722 -8.429 -11.836 1.00 1.49 H new ATOM 0 HE21 GLN A 78 1.270 -10.102 -11.710 1.00 2.90 H new ATOM 0 HE22 GLN A 78 0.956 -10.286 -9.981 1.00 2.90 H new ATOM 1149 N LEU A 79 0.724 -3.739 -10.212 1.00 0.46 N ATOM 1150 CA LEU A 79 0.776 -2.329 -9.898 1.00 0.45 C ATOM 1151 C LEU A 79 1.252 -2.167 -8.476 1.00 0.42 C ATOM 1152 O LEU A 79 0.573 -2.576 -7.530 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.584 -1.648 -10.094 1.00 0.59 C ATOM 1154 CG LEU A 79 -0.976 -1.361 -11.549 1.00 0.95 C ATOM 1155 CD1 LEU A 79 0.192 -0.757 -12.312 1.00 1.95 C ATOM 1156 CD2 LEU A 79 -1.477 -2.616 -12.240 1.00 1.61 C ATOM 0 H LEU A 79 -0.113 -4.211 -9.870 1.00 0.46 H new ATOM 0 HA LEU A 79 1.471 -1.843 -10.583 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -1.353 -2.277 -9.646 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.582 -0.707 -9.544 1.00 0.59 H new ATOM 0 HG LEU A 79 -1.791 -0.637 -11.539 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -0.108 -0.561 -13.341 1.00 1.95 H new ATOM 0 HD12 LEU A 79 0.492 0.177 -11.838 1.00 1.95 H new ATOM 0 HD13 LEU A 79 1.031 -1.453 -12.305 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -1.747 -2.381 -13.270 1.00 1.61 H new ATOM 0 HD22 LEU A 79 -0.692 -3.372 -12.234 1.00 1.61 H new ATOM 0 HD23 LEU A 79 -2.352 -2.997 -11.713 1.00 1.61 H new ATOM 1168 N TYR A 80 2.426 -1.605 -8.325 1.00 0.34 N ATOM 1169 CA TYR A 80 3.024 -1.447 -7.025 1.00 0.38 C ATOM 1170 C TYR A 80 2.938 0.009 -6.619 1.00 0.34 C ATOM 1171 O TYR A 80 2.819 0.891 -7.457 1.00 0.45 O ATOM 1172 CB TYR A 80 4.464 -1.978 -7.036 1.00 0.60 C ATOM 1173 CG TYR A 80 4.539 -3.498 -7.126 1.00 1.27 C ATOM 1174 CD1 TYR A 80 3.760 -4.205 -8.035 1.00 2.27 C ATOM 1175 CD2 TYR A 80 5.379 -4.223 -6.296 1.00 1.56 C ATOM 1176 CE1 TYR A 80 3.815 -5.582 -8.108 1.00 3.30 C ATOM 1177 CE2 TYR A 80 5.444 -5.603 -6.364 1.00 2.49 C ATOM 1178 CZ TYR A 80 4.658 -6.277 -7.273 1.00 3.33 C ATOM 1179 OH TYR A 80 4.709 -7.651 -7.343 1.00 4.39 O ATOM 0 H TYR A 80 2.990 -1.247 -9.096 1.00 0.34 H new ATOM 0 HA TYR A 80 2.484 -2.033 -6.281 1.00 0.38 H new ATOM 0 HB2 TYR A 80 4.999 -1.543 -7.880 1.00 0.60 H new ATOM 0 HB3 TYR A 80 4.974 -1.648 -6.131 1.00 0.60 H new ATOM 0 HD1 TYR A 80 3.099 -3.666 -8.697 1.00 2.27 H new ATOM 0 HD2 TYR A 80 5.996 -3.699 -5.581 1.00 1.56 H new ATOM 0 HE1 TYR A 80 3.198 -6.112 -8.819 1.00 3.30 H new ATOM 0 HE2 TYR A 80 6.107 -6.149 -5.709 1.00 2.49 H new ATOM 0 HH TYR A 80 4.065 -7.969 -8.010 1.00 4.39 H new ATOM 1189 N VAL A 81 2.969 0.248 -5.336 1.00 0.32 N ATOM 1190 CA VAL A 81 2.677 1.562 -4.787 1.00 0.32 C ATOM 1191 C VAL A 81 3.882 2.487 -4.867 1.00 0.32 C ATOM 1192 O VAL A 81 4.929 2.195 -4.309 1.00 0.36 O ATOM 1193 CB VAL A 81 2.210 1.446 -3.319 1.00 0.36 C ATOM 1194 CG1 VAL A 81 2.102 2.814 -2.663 1.00 0.46 C ATOM 1195 CG2 VAL A 81 0.881 0.711 -3.244 1.00 0.38 C ATOM 0 H VAL A 81 3.196 -0.457 -4.634 1.00 0.32 H new ATOM 0 HA VAL A 81 1.877 1.992 -5.389 1.00 0.32 H new ATOM 0 HB VAL A 81 2.959 0.874 -2.772 1.00 0.36 H new ATOM 0 HG11 VAL A 81 1.771 2.698 -1.631 1.00 0.46 H new ATOM 0 HG12 VAL A 81 3.076 3.303 -2.679 1.00 0.46 H new ATOM 0 HG13 VAL A 81 1.381 3.423 -3.208 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.564 0.637 -2.204 1.00 0.38 H new ATOM 0 HG22 VAL A 81 0.130 1.258 -3.814 1.00 0.38 H new ATOM 0 HG23 VAL A 81 0.995 -0.290 -3.661 1.00 0.38 H new ATOM 1205 N THR A 82 3.735 3.583 -5.600 1.00 0.32 N ATOM 1206 CA THR A 82 4.769 4.599 -5.651 1.00 0.32 C ATOM 1207 C THR A 82 4.385 5.746 -4.733 1.00 0.31 C ATOM 1208 O THR A 82 3.208 6.077 -4.577 1.00 0.32 O ATOM 1209 CB THR A 82 4.990 5.143 -7.087 1.00 0.32 C ATOM 1210 OG1 THR A 82 6.348 5.493 -7.310 1.00 1.22 O ATOM 1211 CG2 THR A 82 4.159 6.377 -7.363 1.00 1.37 C ATOM 0 H THR A 82 2.911 3.788 -6.165 1.00 0.32 H new ATOM 0 HA THR A 82 5.703 4.139 -5.327 1.00 0.32 H new ATOM 0 HB THR A 82 4.689 4.334 -7.753 1.00 0.32 H new ATOM 0 HG1 THR A 82 6.453 5.830 -8.224 1.00 1.22 H new ATOM 0 HG21 THR A 82 4.347 6.722 -8.380 1.00 1.37 H new ATOM 0 HG22 THR A 82 3.102 6.136 -7.251 1.00 1.37 H new ATOM 0 HG23 THR A 82 4.429 7.163 -6.658 1.00 1.37 H new ATOM 1219 N ALA A 83 5.375 6.323 -4.108 1.00 0.33 N ATOM 1220 CA ALA A 83 5.148 7.465 -3.246 1.00 0.32 C ATOM 1221 C ALA A 83 5.474 8.761 -3.975 1.00 0.27 C ATOM 1222 O ALA A 83 6.586 8.945 -4.469 1.00 0.31 O ATOM 1223 CB ALA A 83 5.963 7.338 -1.969 1.00 0.41 C ATOM 0 H ALA A 83 6.348 6.026 -4.175 1.00 0.33 H new ATOM 0 HA ALA A 83 4.093 7.489 -2.974 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.780 8.204 -1.333 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.671 6.431 -1.439 1.00 0.41 H new ATOM 0 HB3 ALA A 83 7.023 7.287 -2.217 1.00 0.41 H new ATOM 1229 N GLN A 84 4.478 9.638 -4.069 1.00 0.25 N ATOM 1230 CA GLN A 84 4.648 10.926 -4.726 1.00 0.26 C ATOM 1231 C GLN A 84 5.089 11.975 -3.714 1.00 0.25 C ATOM 1232 O GLN A 84 6.150 11.848 -3.123 1.00 0.28 O ATOM 1233 CB GLN A 84 3.352 11.363 -5.417 1.00 0.33 C ATOM 1234 CG GLN A 84 3.474 11.564 -6.922 1.00 0.77 C ATOM 1235 CD GLN A 84 4.243 12.817 -7.333 1.00 1.32 C ATOM 1236 OE1 GLN A 84 5.235 13.218 -6.553 1.00 2.05 O flip ATOM 1237 NE2 GLN A 84 3.953 13.409 -8.372 1.00 2.02 N flip ATOM 0 H GLN A 84 3.542 9.477 -3.696 1.00 0.25 H new ATOM 0 HA GLN A 84 5.420 10.824 -5.489 1.00 0.26 H new ATOM 0 HB2 GLN A 84 2.583 10.615 -5.224 1.00 0.33 H new ATOM 0 HB3 GLN A 84 3.011 12.295 -4.965 1.00 0.33 H new ATOM 0 HG2 GLN A 84 3.967 10.693 -7.353 1.00 0.77 H new ATOM 0 HG3 GLN A 84 2.473 11.610 -7.352 1.00 0.77 H new ATOM 0 HE21 GLN A 84 3.183 13.075 -8.951 1.00 2.02 H new ATOM 0 HE22 GLN A 84 4.483 14.234 -8.654 1.00 2.02 H new ATOM 1246 N ASP A 85 4.288 13.019 -3.531 1.00 0.24 N ATOM 1247 CA ASP A 85 4.625 14.047 -2.545 1.00 0.28 C ATOM 1248 C ASP A 85 3.378 14.607 -1.871 1.00 0.26 C ATOM 1249 O ASP A 85 2.638 15.385 -2.475 1.00 0.27 O ATOM 1250 CB ASP A 85 5.416 15.177 -3.211 1.00 0.34 C ATOM 1251 CG ASP A 85 5.855 16.241 -2.226 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.843 16.013 -1.499 1.00 0.53 O ATOM 1253 OD2 ASP A 85 5.229 17.320 -2.190 1.00 0.56 O ATOM 0 H ASP A 85 3.418 13.177 -4.039 1.00 0.24 H new ATOM 0 HA ASP A 85 5.240 13.581 -1.775 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.294 14.759 -3.704 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.803 15.636 -3.987 1.00 0.34 H new ATOM 1258 N GLU A 86 3.166 14.196 -0.619 1.00 0.27 N ATOM 1259 CA GLU A 86 2.066 14.673 0.218 1.00 0.29 C ATOM 1260 C GLU A 86 0.749 14.600 -0.558 1.00 0.22 C ATOM 1261 O GLU A 86 0.543 13.608 -1.222 1.00 0.19 O ATOM 1262 CB GLU A 86 2.395 16.051 0.788 1.00 0.40 C ATOM 1263 CG GLU A 86 1.376 16.570 1.797 1.00 0.51 C ATOM 1264 CD GLU A 86 1.810 17.850 2.479 1.00 0.78 C ATOM 1265 OE1 GLU A 86 1.730 18.920 1.843 1.00 1.62 O ATOM 1266 OE2 GLU A 86 2.246 17.792 3.647 1.00 1.04 O ATOM 0 H GLU A 86 3.763 13.513 -0.153 1.00 0.27 H new ATOM 0 HA GLU A 86 1.935 14.025 1.084 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.374 16.010 1.266 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.471 16.763 -0.034 1.00 0.40 H new ATOM 0 HG2 GLU A 86 0.426 16.740 1.290 1.00 0.51 H new ATOM 0 HG3 GLU A 86 1.201 15.805 2.553 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.115 15.623 -0.537 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.419 15.502 -1.190 1.00 0.20 C ATOM 1275 C ASP A 87 -1.264 15.496 -2.704 1.00 0.23 C ATOM 1276 O ASP A 87 -1.516 16.479 -3.402 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.384 16.605 -0.748 1.00 0.28 C ATOM 1278 CG ASP A 87 -3.803 16.342 -1.231 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.459 15.411 -0.708 1.00 0.56 O ATOM 1280 OD2 ASP A 87 -4.272 17.054 -2.141 1.00 0.61 O ATOM 0 H ASP A 87 0.061 16.521 -0.086 1.00 0.22 H new ATOM 0 HA ASP A 87 -1.851 14.550 -0.881 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.378 16.679 0.339 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -2.041 17.565 -1.134 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.840 14.341 -3.168 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.750 13.978 -4.561 1.00 0.24 C ATOM 1287 C GLN A 88 -0.859 12.471 -4.590 1.00 0.21 C ATOM 1288 O GLN A 88 -0.059 11.788 -3.952 1.00 0.19 O ATOM 1289 CB GLN A 88 0.576 14.435 -5.182 1.00 0.32 C ATOM 1290 CG GLN A 88 0.550 15.862 -5.706 1.00 1.03 C ATOM 1291 CD GLN A 88 -0.445 16.038 -6.838 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -0.710 15.105 -7.597 1.00 1.89 O ATOM 1293 NE2 GLN A 88 -1.000 17.232 -6.965 1.00 1.93 N ATOM 0 H GLN A 88 -0.533 13.591 -2.548 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.535 14.460 -5.144 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.365 14.347 -4.436 1.00 0.32 H new ATOM 0 HB3 GLN A 88 0.834 13.762 -6.000 1.00 0.32 H new ATOM 0 HG2 GLN A 88 0.296 16.542 -4.892 1.00 1.03 H new ATOM 0 HG3 GLN A 88 1.546 16.138 -6.053 1.00 1.03 H new ATOM 0 HE21 GLN A 88 -0.755 17.980 -6.316 1.00 1.93 H new ATOM 0 HE22 GLN A 88 -1.673 17.405 -7.712 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.840 11.929 -5.308 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.236 10.533 -5.145 1.00 0.24 C ATOM 1304 C PRO A 89 -1.108 9.561 -5.443 1.00 0.21 C ATOM 1305 O PRO A 89 -0.221 9.840 -6.251 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.372 10.357 -6.162 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.842 11.738 -6.467 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.635 12.619 -6.334 1.00 0.33 C ATOM 0 HA PRO A 89 -2.526 10.320 -4.116 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -3.020 9.853 -7.062 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.178 9.749 -5.751 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -4.260 11.796 -7.472 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.628 12.045 -5.777 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -2.092 12.706 -7.275 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -2.904 13.629 -6.026 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.154 8.423 -4.766 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.200 7.356 -4.996 1.00 0.24 C ATOM 1318 C VAL A 90 -0.309 6.862 -6.432 1.00 0.24 C ATOM 1319 O VAL A 90 -1.398 6.556 -6.923 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.418 6.181 -4.011 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -1.895 5.863 -3.853 1.00 1.31 C ATOM 1322 CG2 VAL A 90 0.330 4.944 -4.470 1.00 1.10 C ATOM 0 H VAL A 90 -1.849 8.217 -4.048 1.00 0.23 H new ATOM 0 HA VAL A 90 0.800 7.755 -4.825 1.00 0.24 H new ATOM 0 HB VAL A 90 -0.025 6.490 -3.042 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -2.016 5.034 -3.156 1.00 1.31 H new ATOM 0 HG12 VAL A 90 -2.417 6.740 -3.469 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -2.313 5.587 -4.821 1.00 1.31 H new ATOM 0 HG21 VAL A 90 0.161 4.133 -3.762 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -0.029 4.646 -5.455 1.00 1.10 H new ATOM 0 HG23 VAL A 90 1.397 5.163 -4.524 1.00 1.10 H new ATOM 1332 N LEU A 91 0.829 6.803 -7.104 1.00 0.22 N ATOM 1333 CA LEU A 91 0.860 6.502 -8.516 1.00 0.24 C ATOM 1334 C LEU A 91 1.202 5.041 -8.673 1.00 0.26 C ATOM 1335 O LEU A 91 1.936 4.487 -7.858 1.00 0.33 O ATOM 1336 CB LEU A 91 1.862 7.395 -9.254 1.00 0.30 C ATOM 1337 CG LEU A 91 1.713 8.898 -8.996 1.00 0.31 C ATOM 1338 CD1 LEU A 91 2.773 9.668 -9.765 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.324 9.375 -9.395 1.00 0.34 C ATOM 0 H LEU A 91 1.746 6.961 -6.686 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.115 6.703 -8.961 1.00 0.24 H new ATOM 0 HB2 LEU A 91 2.870 7.093 -8.971 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.764 7.215 -10.325 1.00 0.30 H new ATOM 0 HG LEU A 91 1.847 9.081 -7.930 1.00 0.31 H new ATOM 0 HD11 LEU A 91 2.658 10.735 -9.574 1.00 0.42 H new ATOM 0 HD12 LEU A 91 3.763 9.346 -9.441 1.00 0.42 H new ATOM 0 HD13 LEU A 91 2.660 9.476 -10.832 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.238 10.445 -9.204 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.164 9.182 -10.456 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.426 8.841 -8.811 1.00 0.34 H new ATOM 1351 N LEU A 92 0.667 4.388 -9.673 1.00 0.27 N ATOM 1352 CA LEU A 92 0.821 2.959 -9.738 1.00 0.28 C ATOM 1353 C LEU A 92 2.035 2.624 -10.577 1.00 0.29 C ATOM 1354 O LEU A 92 2.043 2.709 -11.806 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.440 2.295 -10.289 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.675 2.420 -9.389 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -2.853 1.673 -9.991 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.372 1.896 -7.992 1.00 1.30 C ATOM 0 H LEU A 92 0.135 4.809 -10.434 1.00 0.27 H new ATOM 0 HA LEU A 92 0.972 2.569 -8.731 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.670 2.732 -11.261 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.234 1.238 -10.456 1.00 0.32 H new ATOM 0 HG LEU A 92 -1.938 3.475 -9.313 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.720 1.773 -9.338 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.086 2.090 -10.970 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.599 0.618 -10.097 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.260 1.992 -7.367 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.083 0.847 -8.052 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.557 2.473 -7.556 1.00 1.30 H new ATOM 1370 N LYS A 93 3.082 2.291 -9.840 1.00 0.31 N ATOM 1371 CA LYS A 93 4.389 2.001 -10.369 1.00 0.37 C ATOM 1372 C LYS A 93 4.453 0.508 -10.634 1.00 0.38 C ATOM 1373 O LYS A 93 4.337 -0.295 -9.714 1.00 0.39 O ATOM 1374 CB LYS A 93 5.451 2.397 -9.317 1.00 0.46 C ATOM 1375 CG LYS A 93 6.830 2.701 -9.865 1.00 1.29 C ATOM 1376 CD LYS A 93 7.296 1.708 -10.913 1.00 2.11 C ATOM 1377 CE LYS A 93 8.634 2.118 -11.502 1.00 2.85 C ATOM 1378 NZ LYS A 93 9.051 1.212 -12.605 1.00 3.26 N ATOM 0 H LYS A 93 3.036 2.215 -8.824 1.00 0.31 H new ATOM 0 HA LYS A 93 4.578 2.555 -11.289 1.00 0.37 H new ATOM 0 HB2 LYS A 93 5.093 3.273 -8.777 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.538 1.588 -8.591 1.00 0.46 H new ATOM 0 HG2 LYS A 93 6.828 3.701 -10.299 1.00 1.29 H new ATOM 0 HG3 LYS A 93 7.545 2.712 -9.042 1.00 1.29 H new ATOM 0 HD2 LYS A 93 7.381 0.717 -10.467 1.00 2.11 H new ATOM 0 HD3 LYS A 93 6.553 1.638 -11.707 1.00 2.11 H new ATOM 0 HE2 LYS A 93 8.569 3.140 -11.876 1.00 2.85 H new ATOM 0 HE3 LYS A 93 9.393 2.112 -10.720 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 9.866 1.624 -13.103 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 9.317 0.286 -12.212 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 8.262 1.091 -13.272 1.00 3.26 H new ATOM 1392 N GLU A 94 4.653 0.126 -11.879 1.00 0.43 N ATOM 1393 CA GLU A 94 4.514 -1.266 -12.242 1.00 0.47 C ATOM 1394 C GLU A 94 5.871 -1.941 -12.177 1.00 0.52 C ATOM 1395 O GLU A 94 6.674 -1.899 -13.111 1.00 0.62 O ATOM 1396 CB GLU A 94 3.912 -1.394 -13.646 1.00 0.56 C ATOM 1397 CG GLU A 94 3.679 -2.832 -14.083 1.00 1.38 C ATOM 1398 CD GLU A 94 3.070 -2.933 -15.463 1.00 1.76 C ATOM 1399 OE1 GLU A 94 3.821 -2.874 -16.460 1.00 2.33 O ATOM 1400 OE2 GLU A 94 1.833 -3.054 -15.559 1.00 2.05 O ATOM 0 H GLU A 94 4.908 0.750 -12.644 1.00 0.43 H new ATOM 0 HA GLU A 94 3.839 -1.756 -11.540 1.00 0.47 H new ATOM 0 HB2 GLU A 94 2.964 -0.857 -13.676 1.00 0.56 H new ATOM 0 HB3 GLU A 94 4.576 -0.909 -14.362 1.00 0.56 H new ATOM 0 HG2 GLU A 94 4.627 -3.369 -14.069 1.00 1.38 H new ATOM 0 HG3 GLU A 94 3.023 -3.324 -13.364 1.00 1.38 H new ATOM 1407 N MET A 95 6.101 -2.550 -11.025 1.00 0.50 N ATOM 1408 CA MET A 95 7.335 -3.255 -10.733 1.00 0.59 C ATOM 1409 C MET A 95 7.022 -4.736 -10.592 1.00 0.66 C ATOM 1410 O MET A 95 6.292 -5.133 -9.691 1.00 0.65 O ATOM 1411 CB MET A 95 7.949 -2.719 -9.433 1.00 0.60 C ATOM 1412 CG MET A 95 9.429 -2.390 -9.549 1.00 1.21 C ATOM 1413 SD MET A 95 9.754 -1.089 -10.754 1.00 1.67 S ATOM 1414 CE MET A 95 11.530 -0.926 -10.602 1.00 2.39 C ATOM 0 H MET A 95 5.428 -2.568 -10.259 1.00 0.50 H new ATOM 0 HA MET A 95 8.052 -3.103 -11.540 1.00 0.59 H new ATOM 0 HB2 MET A 95 7.409 -1.823 -9.129 1.00 0.60 H new ATOM 0 HB3 MET A 95 7.810 -3.458 -8.644 1.00 0.60 H new ATOM 0 HG2 MET A 95 9.807 -2.081 -8.574 1.00 1.21 H new ATOM 0 HG3 MET A 95 9.977 -3.289 -9.833 1.00 1.21 H new ATOM 0 HE1 MET A 95 11.914 -0.334 -11.433 1.00 2.39 H new ATOM 0 HE2 MET A 95 11.771 -0.430 -9.662 1.00 2.39 H new ATOM 0 HE3 MET A 95 11.989 -1.915 -10.618 1.00 2.39 H new ATOM 1424 N PRO A 96 7.555 -5.575 -11.479 1.00 0.82 N ATOM 1425 CA PRO A 96 7.171 -6.984 -11.535 1.00 0.95 C ATOM 1426 C PRO A 96 7.719 -7.824 -10.376 1.00 0.93 C ATOM 1427 O PRO A 96 8.934 -7.911 -10.173 1.00 0.98 O ATOM 1428 CB PRO A 96 7.759 -7.443 -12.865 1.00 1.19 C ATOM 1429 CG PRO A 96 8.930 -6.552 -13.094 1.00 1.26 C ATOM 1430 CD PRO A 96 8.558 -5.222 -12.501 1.00 0.99 C ATOM 0 HA PRO A 96 6.091 -7.107 -11.452 1.00 0.95 H new ATOM 0 HB2 PRO A 96 8.061 -8.489 -12.823 1.00 1.19 H new ATOM 0 HB3 PRO A 96 7.031 -7.353 -13.671 1.00 1.19 H new ATOM 0 HG2 PRO A 96 9.825 -6.954 -12.620 1.00 1.26 H new ATOM 0 HG3 PRO A 96 9.147 -6.458 -14.158 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.421 -4.722 -12.062 1.00 0.99 H new ATOM 0 HD3 PRO A 96 8.147 -4.547 -13.252 1.00 0.99 H new ATOM 1438 N GLU A 97 6.788 -8.472 -9.664 1.00 0.98 N ATOM 1439 CA GLU A 97 7.081 -9.403 -8.572 1.00 1.06 C ATOM 1440 C GLU A 97 7.799 -8.764 -7.376 1.00 0.90 C ATOM 1441 O GLU A 97 8.617 -7.857 -7.516 1.00 0.88 O ATOM 1442 CB GLU A 97 7.848 -10.609 -9.098 1.00 1.32 C ATOM 1443 CG GLU A 97 7.023 -11.466 -10.048 1.00 1.84 C ATOM 1444 CD GLU A 97 5.790 -12.056 -9.387 1.00 2.42 C ATOM 1445 OE1 GLU A 97 4.930 -11.280 -8.930 1.00 3.15 O ATOM 1446 OE2 GLU A 97 5.665 -13.294 -9.329 1.00 2.74 O ATOM 0 H GLU A 97 5.789 -8.360 -9.837 1.00 0.98 H new ATOM 0 HA GLU A 97 6.116 -9.728 -8.183 1.00 1.06 H new ATOM 0 HB2 GLU A 97 8.746 -10.266 -9.612 1.00 1.32 H new ATOM 0 HB3 GLU A 97 8.176 -11.220 -8.257 1.00 1.32 H new ATOM 0 HG2 GLU A 97 6.718 -10.862 -10.903 1.00 1.84 H new ATOM 0 HG3 GLU A 97 7.645 -12.274 -10.434 1.00 1.84 H new ATOM 1453 N ILE A 98 7.453 -9.259 -6.188 1.00 1.08 N ATOM 1454 CA ILE A 98 8.008 -8.767 -4.933 1.00 1.17 C ATOM 1455 C ILE A 98 9.487 -9.144 -4.803 1.00 1.10 C ATOM 1456 O ILE A 98 9.860 -10.315 -4.913 1.00 1.29 O ATOM 1457 CB ILE A 98 7.205 -9.320 -3.724 1.00 1.61 C ATOM 1458 CG1 ILE A 98 7.902 -8.974 -2.405 1.00 2.25 C ATOM 1459 CG2 ILE A 98 7.000 -10.826 -3.850 1.00 2.35 C ATOM 1460 CD1 ILE A 98 7.143 -9.420 -1.176 1.00 3.20 C ATOM 0 H ILE A 98 6.778 -10.015 -6.071 1.00 1.08 H new ATOM 0 HA ILE A 98 7.930 -7.680 -4.936 1.00 1.17 H new ATOM 0 HB ILE A 98 6.224 -8.845 -3.724 1.00 1.61 H new ATOM 0 HG12 ILE A 98 8.890 -9.433 -2.396 1.00 2.25 H new ATOM 0 HG13 ILE A 98 8.051 -7.895 -2.356 1.00 2.25 H new ATOM 0 HG21 ILE A 98 6.435 -11.189 -2.991 1.00 2.35 H new ATOM 0 HG22 ILE A 98 6.449 -11.043 -4.765 1.00 2.35 H new ATOM 0 HG23 ILE A 98 7.969 -11.324 -3.884 1.00 2.35 H new ATOM 0 HD11 ILE A 98 7.700 -9.139 -0.282 1.00 3.20 H new ATOM 0 HD12 ILE A 98 6.164 -8.941 -1.159 1.00 3.20 H new ATOM 0 HD13 ILE A 98 7.016 -10.502 -1.199 1.00 3.20 H new ATOM 1472 N PRO A 99 10.345 -8.135 -4.600 1.00 1.08 N ATOM 1473 CA PRO A 99 11.796 -8.311 -4.543 1.00 1.14 C ATOM 1474 C PRO A 99 12.308 -8.928 -3.236 1.00 1.08 C ATOM 1475 O PRO A 99 11.751 -8.724 -2.159 1.00 1.15 O ATOM 1476 CB PRO A 99 12.345 -6.880 -4.694 1.00 1.38 C ATOM 1477 CG PRO A 99 11.165 -6.019 -5.008 1.00 1.61 C ATOM 1478 CD PRO A 99 9.975 -6.728 -4.443 1.00 1.28 C ATOM 0 HA PRO A 99 12.121 -9.009 -5.315 1.00 1.14 H new ATOM 0 HB2 PRO A 99 12.835 -6.551 -3.778 1.00 1.38 H new ATOM 0 HB3 PRO A 99 13.088 -6.829 -5.490 1.00 1.38 H new ATOM 0 HG2 PRO A 99 11.276 -5.029 -4.566 1.00 1.61 H new ATOM 0 HG3 PRO A 99 11.060 -5.878 -6.084 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.804 -6.467 -3.399 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.062 -6.485 -4.986 1.00 1.28 H new ATOM 1486 N LYS A 100 13.379 -9.697 -3.388 1.00 1.10 N ATOM 1487 CA LYS A 100 14.176 -10.236 -2.282 1.00 1.07 C ATOM 1488 C LYS A 100 15.403 -9.339 -2.112 1.00 1.03 C ATOM 1489 O LYS A 100 16.172 -9.434 -1.147 1.00 0.99 O ATOM 1490 CB LYS A 100 14.589 -11.683 -2.575 1.00 1.15 C ATOM 1491 CG LYS A 100 15.499 -11.829 -3.786 1.00 1.99 C ATOM 1492 CD LYS A 100 15.660 -13.283 -4.196 1.00 2.34 C ATOM 1493 CE LYS A 100 14.377 -13.837 -4.797 1.00 3.09 C ATOM 1494 NZ LYS A 100 14.528 -15.255 -5.217 1.00 3.70 N ATOM 0 H LYS A 100 13.730 -9.973 -4.305 1.00 1.10 H new ATOM 0 HA LYS A 100 13.593 -10.247 -1.361 1.00 1.07 H new ATOM 0 HB2 LYS A 100 15.096 -12.091 -1.700 1.00 1.15 H new ATOM 0 HB3 LYS A 100 13.692 -12.282 -2.732 1.00 1.15 H new ATOM 0 HG2 LYS A 100 15.089 -11.259 -4.620 1.00 1.99 H new ATOM 0 HG3 LYS A 100 16.477 -11.404 -3.560 1.00 1.99 H new ATOM 0 HD2 LYS A 100 16.470 -13.371 -4.920 1.00 2.34 H new ATOM 0 HD3 LYS A 100 15.943 -13.878 -3.328 1.00 2.34 H new ATOM 0 HE2 LYS A 100 13.571 -13.758 -4.067 1.00 3.09 H new ATOM 0 HE3 LYS A 100 14.089 -13.233 -5.657 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 13.632 -15.595 -5.621 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 15.280 -15.327 -5.932 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 14.778 -15.837 -4.392 1.00 3.70 H new ATOM 1508 N THR A 101 15.585 -8.547 -3.157 1.00 1.10 N ATOM 1509 CA THR A 101 16.680 -7.638 -3.364 1.00 1.11 C ATOM 1510 C THR A 101 16.116 -6.307 -3.901 1.00 1.16 C ATOM 1511 O THR A 101 15.572 -6.257 -5.004 1.00 1.30 O ATOM 1512 CB THR A 101 17.682 -8.271 -4.361 1.00 1.30 C ATOM 1513 OG1 THR A 101 18.791 -7.400 -4.623 1.00 1.73 O ATOM 1514 CG2 THR A 101 17.005 -8.647 -5.672 1.00 1.92 C ATOM 0 H THR A 101 14.921 -8.528 -3.931 1.00 1.10 H new ATOM 0 HA THR A 101 17.208 -7.442 -2.431 1.00 1.11 H new ATOM 0 HB THR A 101 18.058 -9.179 -3.889 1.00 1.30 H new ATOM 0 HG1 THR A 101 19.404 -7.832 -5.254 1.00 1.73 H new ATOM 0 HG21 THR A 101 17.739 -9.088 -6.347 1.00 1.92 H new ATOM 0 HG22 THR A 101 16.211 -9.368 -5.478 1.00 1.92 H new ATOM 0 HG23 THR A 101 16.580 -7.754 -6.131 1.00 1.92 H new ATOM 1522 N ILE A 102 16.196 -5.234 -3.117 1.00 1.14 N ATOM 1523 CA ILE A 102 15.623 -3.962 -3.557 1.00 1.18 C ATOM 1524 C ILE A 102 16.712 -3.038 -4.032 1.00 1.22 C ATOM 1525 O ILE A 102 17.617 -2.708 -3.297 1.00 1.37 O ATOM 1526 CB ILE A 102 14.789 -3.239 -2.470 1.00 1.31 C ATOM 1527 CG1 ILE A 102 14.175 -1.965 -3.056 1.00 2.08 C ATOM 1528 CG2 ILE A 102 15.631 -2.914 -1.239 1.00 1.98 C ATOM 1529 CD1 ILE A 102 13.260 -1.231 -2.106 1.00 2.69 C ATOM 0 H ILE A 102 16.639 -5.216 -2.198 1.00 1.14 H new ATOM 0 HA ILE A 102 14.941 -4.212 -4.369 1.00 1.18 H new ATOM 0 HB ILE A 102 13.991 -3.909 -2.148 1.00 1.31 H new ATOM 0 HG12 ILE A 102 14.978 -1.294 -3.362 1.00 2.08 H new ATOM 0 HG13 ILE A 102 13.616 -2.224 -3.955 1.00 2.08 H new ATOM 0 HG21 ILE A 102 15.012 -2.407 -0.498 1.00 1.98 H new ATOM 0 HG22 ILE A 102 16.024 -3.837 -0.813 1.00 1.98 H new ATOM 0 HG23 ILE A 102 16.459 -2.265 -1.525 1.00 1.98 H new ATOM 0 HD11 ILE A 102 12.866 -0.341 -2.596 1.00 2.69 H new ATOM 0 HD12 ILE A 102 12.435 -1.883 -1.819 1.00 2.69 H new ATOM 0 HD13 ILE A 102 13.818 -0.939 -1.216 1.00 2.69 H new ATOM 1541 N THR A 103 16.631 -2.584 -5.239 1.00 1.15 N ATOM 1542 CA THR A 103 17.695 -1.777 -5.748 1.00 1.20 C ATOM 1543 C THR A 103 17.144 -0.469 -6.267 1.00 1.08 C ATOM 1544 O THR A 103 16.272 -0.443 -7.123 1.00 1.05 O ATOM 1545 CB THR A 103 18.517 -2.532 -6.822 1.00 1.39 C ATOM 1546 OG1 THR A 103 19.540 -1.685 -7.363 1.00 1.58 O ATOM 1547 CG2 THR A 103 17.632 -3.049 -7.948 1.00 1.57 C ATOM 0 H THR A 103 15.857 -2.752 -5.882 1.00 1.15 H new ATOM 0 HA THR A 103 18.386 -1.554 -4.935 1.00 1.20 H new ATOM 0 HB THR A 103 18.979 -3.388 -6.331 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.050 -2.179 -8.038 1.00 1.58 H new ATOM 0 HG21 THR A 103 18.245 -3.573 -8.681 1.00 1.57 H new ATOM 0 HG22 THR A 103 16.888 -3.734 -7.541 1.00 1.57 H new ATOM 0 HG23 THR A 103 17.128 -2.211 -8.429 1.00 1.57 H new ATOM 1555 N GLY A 104 17.732 0.604 -5.752 1.00 1.08 N ATOM 1556 CA GLY A 104 17.258 1.979 -5.950 1.00 1.03 C ATOM 1557 C GLY A 104 15.762 2.163 -6.239 1.00 0.92 C ATOM 1558 O GLY A 104 15.020 2.529 -5.331 1.00 0.84 O ATOM 0 H GLY A 104 18.569 0.547 -5.172 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.504 2.555 -5.058 1.00 1.03 H new ATOM 0 HA3 GLY A 104 17.819 2.416 -6.776 1.00 1.03 H new ATOM 1562 N SER A 105 15.324 1.922 -7.471 1.00 0.96 N ATOM 1563 CA SER A 105 14.034 2.416 -7.980 1.00 0.92 C ATOM 1564 C SER A 105 12.786 1.828 -7.287 1.00 0.81 C ATOM 1565 O SER A 105 11.716 2.427 -7.367 1.00 0.77 O ATOM 1566 CB SER A 105 13.950 2.171 -9.490 1.00 1.05 C ATOM 1567 OG SER A 105 12.798 2.782 -10.049 1.00 1.47 O ATOM 0 H SER A 105 15.851 1.377 -8.153 1.00 0.96 H new ATOM 0 HA SER A 105 14.018 3.481 -7.748 1.00 0.92 H new ATOM 0 HB2 SER A 105 14.844 2.564 -9.974 1.00 1.05 H new ATOM 0 HB3 SER A 105 13.927 1.099 -9.686 1.00 1.05 H new ATOM 0 HG SER A 105 12.772 2.610 -11.013 1.00 1.47 H new ATOM 1573 N GLU A 106 12.888 0.691 -6.606 1.00 0.79 N ATOM 1574 CA GLU A 106 11.705 0.079 -5.980 1.00 0.72 C ATOM 1575 C GLU A 106 11.338 0.796 -4.677 1.00 0.56 C ATOM 1576 O GLU A 106 10.432 0.384 -3.955 1.00 0.51 O ATOM 1577 CB GLU A 106 11.918 -1.413 -5.686 1.00 0.82 C ATOM 1578 CG GLU A 106 12.097 -2.288 -6.916 1.00 1.28 C ATOM 1579 CD GLU A 106 13.505 -2.251 -7.464 1.00 1.74 C ATOM 1580 OE1 GLU A 106 14.435 -2.699 -6.764 1.00 2.39 O ATOM 1581 OE2 GLU A 106 13.688 -1.767 -8.596 1.00 2.11 O ATOM 0 H GLU A 106 13.758 0.177 -6.471 1.00 0.79 H new ATOM 0 HA GLU A 106 10.889 0.181 -6.696 1.00 0.72 H new ATOM 0 HB2 GLU A 106 12.796 -1.521 -5.050 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.065 -1.782 -5.117 1.00 0.82 H new ATOM 0 HG2 GLU A 106 11.837 -3.316 -6.665 1.00 1.28 H new ATOM 0 HG3 GLU A 106 11.402 -1.964 -7.691 1.00 1.28 H new ATOM 1588 N THR A 107 12.055 1.872 -4.398 1.00 0.55 N ATOM 1589 CA THR A 107 11.943 2.610 -3.169 1.00 0.49 C ATOM 1590 C THR A 107 10.631 3.374 -3.085 1.00 0.37 C ATOM 1591 O THR A 107 10.328 3.956 -2.051 1.00 0.38 O ATOM 1592 CB THR A 107 13.116 3.603 -3.026 1.00 0.62 C ATOM 1593 OG1 THR A 107 13.129 4.179 -1.718 1.00 1.41 O ATOM 1594 CG2 THR A 107 13.028 4.713 -4.068 1.00 1.27 C ATOM 0 H THR A 107 12.746 2.259 -5.041 1.00 0.55 H new ATOM 0 HA THR A 107 11.972 1.883 -2.357 1.00 0.49 H new ATOM 0 HB THR A 107 14.039 3.046 -3.185 1.00 0.62 H new ATOM 0 HG1 THR A 107 12.216 4.427 -1.461 1.00 1.41 H new ATOM 0 HG21 THR A 107 13.867 5.397 -3.943 1.00 1.27 H new ATOM 0 HG22 THR A 107 13.061 4.278 -5.067 1.00 1.27 H new ATOM 0 HG23 THR A 107 12.093 5.259 -3.940 1.00 1.27 H new ATOM 1602 N ASN A 108 9.867 3.433 -4.170 1.00 0.34 N ATOM 1603 CA ASN A 108 8.599 4.076 -4.119 1.00 0.29 C ATOM 1604 C ASN A 108 7.647 3.234 -3.292 1.00 0.25 C ATOM 1605 O ASN A 108 6.761 3.752 -2.616 1.00 0.27 O ATOM 1606 CB ASN A 108 8.104 4.259 -5.540 1.00 0.40 C ATOM 1607 CG ASN A 108 9.062 5.099 -6.371 1.00 0.58 C ATOM 1608 OD1 ASN A 108 9.938 4.572 -7.053 1.00 1.39 O ATOM 1609 ND2 ASN A 108 8.910 6.413 -6.312 1.00 1.22 N ATOM 0 H ASN A 108 10.117 3.042 -5.078 1.00 0.34 H new ATOM 0 HA ASN A 108 8.669 5.056 -3.646 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.977 3.283 -6.009 1.00 0.40 H new ATOM 0 HB3 ASN A 108 7.124 4.735 -5.524 1.00 0.40 H new ATOM 0 HD21 ASN A 108 9.531 7.023 -6.844 1.00 1.22 H new ATOM 0 HD22 ASN A 108 8.171 6.816 -5.735 1.00 1.22 H new ATOM 1616 N LEU A 109 7.882 1.928 -3.343 1.00 0.25 N ATOM 1617 CA LEU A 109 7.028 0.948 -2.702 1.00 0.26 C ATOM 1618 C LEU A 109 7.451 0.622 -1.265 1.00 0.21 C ATOM 1619 O LEU A 109 7.315 -0.520 -0.815 1.00 0.23 O ATOM 1620 CB LEU A 109 7.070 -0.321 -3.548 1.00 0.41 C ATOM 1621 CG LEU A 109 6.227 -1.495 -3.062 1.00 0.54 C ATOM 1622 CD1 LEU A 109 4.753 -1.197 -3.225 1.00 0.83 C ATOM 1623 CD2 LEU A 109 6.630 -2.738 -3.820 1.00 0.95 C ATOM 0 H LEU A 109 8.678 1.521 -3.835 1.00 0.25 H new ATOM 0 HA LEU A 109 6.022 1.363 -2.635 1.00 0.26 H new ATOM 0 HB2 LEU A 109 6.750 -0.067 -4.559 1.00 0.41 H new ATOM 0 HB3 LEU A 109 8.107 -0.651 -3.615 1.00 0.41 H new ATOM 0 HG LEU A 109 6.404 -1.660 -1.999 1.00 0.54 H new ATOM 0 HD11 LEU A 109 4.169 -2.047 -2.873 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.494 -0.312 -2.643 1.00 0.83 H new ATOM 0 HD13 LEU A 109 4.532 -1.016 -4.277 1.00 0.83 H new ATOM 0 HD21 LEU A 109 6.032 -3.583 -3.478 1.00 0.95 H new ATOM 0 HD22 LEU A 109 6.464 -2.584 -4.886 1.00 0.95 H new ATOM 0 HD23 LEU A 109 7.685 -2.946 -3.643 1.00 0.95 H new ATOM 1635 N LEU A 110 7.927 1.594 -0.511 1.00 0.20 N ATOM 1636 CA LEU A 110 8.102 1.360 0.895 1.00 0.21 C ATOM 1637 C LEU A 110 6.952 1.985 1.672 1.00 0.23 C ATOM 1638 O LEU A 110 6.506 3.090 1.357 1.00 0.31 O ATOM 1639 CB LEU A 110 9.465 1.891 1.369 1.00 0.28 C ATOM 1640 CG LEU A 110 10.057 3.092 0.615 1.00 0.81 C ATOM 1641 CD1 LEU A 110 9.165 4.320 0.741 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.447 3.400 1.149 1.00 1.64 C ATOM 0 H LEU A 110 8.190 2.523 -0.841 1.00 0.20 H new ATOM 0 HA LEU A 110 8.091 0.286 1.082 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.373 2.165 2.420 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.183 1.072 1.315 1.00 0.28 H new ATOM 0 HG LEU A 110 10.122 2.832 -0.442 1.00 0.81 H new ATOM 0 HD11 LEU A 110 9.612 5.152 0.197 1.00 1.71 H new ATOM 0 HD12 LEU A 110 8.182 4.100 0.324 1.00 1.71 H new ATOM 0 HD13 LEU A 110 9.062 4.588 1.792 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.863 4.252 0.611 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.385 3.636 2.211 1.00 1.64 H new ATOM 0 HD23 LEU A 110 12.092 2.532 1.008 1.00 1.64 H new ATOM 1654 N PHE A 111 6.470 1.290 2.690 1.00 0.22 N ATOM 1655 CA PHE A 111 5.394 1.832 3.506 1.00 0.25 C ATOM 1656 C PHE A 111 5.551 1.436 4.965 1.00 0.23 C ATOM 1657 O PHE A 111 5.793 0.276 5.290 1.00 0.27 O ATOM 1658 CB PHE A 111 3.989 1.526 2.932 1.00 0.42 C ATOM 1659 CG PHE A 111 3.299 0.257 3.372 1.00 0.91 C ATOM 1660 CD1 PHE A 111 2.850 0.120 4.675 1.00 1.64 C ATOM 1661 CD2 PHE A 111 3.158 -0.818 2.505 1.00 1.18 C ATOM 1662 CE1 PHE A 111 2.272 -1.059 5.103 1.00 2.38 C ATOM 1663 CE2 PHE A 111 2.572 -1.996 2.925 1.00 1.90 C ATOM 1664 CZ PHE A 111 1.927 -2.039 4.133 1.00 2.46 C ATOM 0 H PHE A 111 6.799 0.366 2.968 1.00 0.22 H new ATOM 0 HA PHE A 111 5.479 2.918 3.469 1.00 0.25 H new ATOM 0 HB2 PHE A 111 3.338 2.363 3.183 1.00 0.42 H new ATOM 0 HB3 PHE A 111 4.072 1.500 1.845 1.00 0.42 H new ATOM 0 HD1 PHE A 111 2.953 0.945 5.364 1.00 1.64 H new ATOM 0 HD2 PHE A 111 3.511 -0.732 1.488 1.00 1.18 H new ATOM 0 HE1 PHE A 111 2.086 -1.233 6.153 1.00 2.38 H new ATOM 0 HE2 PHE A 111 2.622 -2.879 2.305 1.00 1.90 H new ATOM 0 HZ PHE A 111 1.182 -2.792 4.341 1.00 2.46 H new ATOM 1674 N PHE A 112 5.489 2.443 5.817 1.00 0.21 N ATOM 1675 CA PHE A 112 5.710 2.284 7.257 1.00 0.25 C ATOM 1676 C PHE A 112 4.442 1.814 7.930 1.00 0.25 C ATOM 1677 O PHE A 112 3.455 2.546 8.020 1.00 0.26 O ATOM 1678 CB PHE A 112 6.187 3.581 7.922 1.00 0.30 C ATOM 1679 CG PHE A 112 6.168 3.517 9.426 1.00 0.57 C ATOM 1680 CD1 PHE A 112 6.950 2.595 10.104 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.354 4.367 10.157 1.00 0.95 C ATOM 1682 CE1 PHE A 112 6.921 2.525 11.483 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.320 4.299 11.537 1.00 1.43 C ATOM 1684 CZ PHE A 112 6.105 3.378 12.199 1.00 1.50 C ATOM 0 H PHE A 112 5.283 3.402 5.536 1.00 0.21 H new ATOM 0 HA PHE A 112 6.497 1.539 7.377 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.200 3.802 7.587 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.555 4.405 7.592 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.589 1.924 9.548 1.00 0.79 H new ATOM 0 HD2 PHE A 112 4.739 5.091 9.643 1.00 0.95 H new ATOM 0 HE1 PHE A 112 7.536 1.804 12.001 1.00 1.21 H new ATOM 0 HE2 PHE A 112 4.680 4.966 12.096 1.00 1.43 H new ATOM 0 HZ PHE A 112 6.081 3.324 13.277 1.00 1.50 H new ATOM 1694 N TRP A 113 4.480 0.578 8.373 1.00 0.31 N ATOM 1695 CA TRP A 113 3.282 -0.116 8.818 1.00 0.35 C ATOM 1696 C TRP A 113 3.094 0.028 10.334 1.00 0.33 C ATOM 1697 O TRP A 113 3.787 -0.613 11.129 1.00 0.37 O ATOM 1698 CB TRP A 113 3.448 -1.589 8.409 1.00 0.48 C ATOM 1699 CG TRP A 113 2.339 -2.522 8.792 1.00 1.08 C ATOM 1700 CD1 TRP A 113 1.073 -2.553 8.288 1.00 2.30 C ATOM 1701 CD2 TRP A 113 2.428 -3.608 9.723 1.00 1.17 C ATOM 1702 NE1 TRP A 113 0.359 -3.574 8.870 1.00 3.02 N ATOM 1703 CE2 TRP A 113 1.173 -4.239 9.750 1.00 2.29 C ATOM 1704 CE3 TRP A 113 3.449 -4.101 10.541 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 0.910 -5.338 10.563 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 3.190 -5.193 11.345 1.00 1.47 C ATOM 1707 CH2 TRP A 113 1.931 -5.802 11.351 1.00 2.02 C ATOM 0 H TRP A 113 5.334 0.024 8.437 1.00 0.31 H new ATOM 0 HA TRP A 113 2.390 0.310 8.359 1.00 0.35 H new ATOM 0 HB2 TRP A 113 3.569 -1.630 7.327 1.00 0.48 H new ATOM 0 HB3 TRP A 113 4.374 -1.962 8.848 1.00 0.48 H new ATOM 0 HD1 TRP A 113 0.687 -1.875 7.541 1.00 2.30 H new ATOM 0 HE1 TRP A 113 -0.617 -3.800 8.678 1.00 3.02 H new ATOM 0 HE3 TRP A 113 4.424 -3.636 10.544 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 -0.063 -5.808 10.572 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 3.972 -5.583 11.979 1.00 1.47 H new ATOM 0 HH2 TRP A 113 1.760 -6.656 11.990 1.00 2.02 H new ATOM 1718 N GLU A 114 2.160 0.901 10.714 1.00 0.32 N ATOM 1719 CA GLU A 114 1.721 1.045 12.100 1.00 0.37 C ATOM 1720 C GLU A 114 0.313 0.469 12.258 1.00 0.39 C ATOM 1721 O GLU A 114 -0.674 1.107 11.873 1.00 0.42 O ATOM 1722 CB GLU A 114 1.747 2.516 12.524 1.00 0.43 C ATOM 1723 CG GLU A 114 1.286 2.745 13.956 1.00 0.96 C ATOM 1724 CD GLU A 114 2.150 2.031 14.978 1.00 1.50 C ATOM 1725 OE1 GLU A 114 1.878 0.847 15.273 1.00 2.32 O ATOM 1726 OE2 GLU A 114 3.090 2.659 15.506 1.00 1.90 O ATOM 0 H GLU A 114 1.686 1.530 10.066 1.00 0.32 H new ATOM 0 HA GLU A 114 2.405 0.494 12.745 1.00 0.37 H new ATOM 0 HB2 GLU A 114 2.761 2.900 12.412 1.00 0.43 H new ATOM 0 HB3 GLU A 114 1.112 3.091 11.850 1.00 0.43 H new ATOM 0 HG2 GLU A 114 1.292 3.814 14.167 1.00 0.96 H new ATOM 0 HG3 GLU A 114 0.255 2.405 14.059 1.00 0.96 H new ATOM 1733 N THR A 115 0.211 -0.707 12.846 1.00 0.47 N ATOM 1734 CA THR A 115 -1.054 -1.422 12.892 1.00 0.49 C ATOM 1735 C THR A 115 -1.755 -1.242 14.238 1.00 0.52 C ATOM 1736 O THR A 115 -1.158 -1.437 15.295 1.00 0.64 O ATOM 1737 CB THR A 115 -0.850 -2.924 12.593 1.00 0.67 C ATOM 1738 OG1 THR A 115 -2.091 -3.631 12.710 1.00 1.38 O ATOM 1739 CG2 THR A 115 0.185 -3.538 13.530 1.00 1.39 C ATOM 0 H THR A 115 0.987 -1.189 13.299 1.00 0.47 H new ATOM 0 HA THR A 115 -1.694 -0.995 12.120 1.00 0.49 H new ATOM 0 HB THR A 115 -0.483 -3.012 11.570 1.00 0.67 H new ATOM 0 HG1 THR A 115 -1.946 -4.581 12.516 1.00 1.38 H new ATOM 0 HG21 THR A 115 0.307 -4.595 13.295 1.00 1.39 H new ATOM 0 HG22 THR A 115 1.139 -3.026 13.404 1.00 1.39 H new ATOM 0 HG23 THR A 115 -0.150 -3.432 14.562 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.014 -0.826 14.194 1.00 0.47 N ATOM 1748 CA HIS A 116 -3.810 -0.677 15.404 1.00 0.56 C ATOM 1749 C HIS A 116 -5.121 -1.440 15.275 1.00 0.56 C ATOM 1750 O HIS A 116 -6.079 -0.957 14.670 1.00 0.55 O ATOM 1751 CB HIS A 116 -4.086 0.800 15.698 1.00 0.66 C ATOM 1752 CG HIS A 116 -2.879 1.556 16.160 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -2.503 2.778 15.644 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -1.967 1.258 17.114 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -1.412 3.195 16.261 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -1.068 2.291 17.157 1.00 2.89 N ATOM 0 H HIS A 116 -3.505 -0.586 13.333 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.241 -1.092 16.236 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -4.478 1.274 14.798 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.862 0.871 16.460 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -1.951 0.370 17.728 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -0.890 4.120 16.065 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -0.263 2.351 17.781 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.154 -2.635 15.846 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.339 -3.464 15.769 1.00 0.71 C ATOM 1767 C GLY A 117 -6.505 -4.083 14.398 1.00 0.69 C ATOM 1768 O GLY A 117 -5.816 -5.046 14.059 1.00 0.74 O ATOM 0 H GLY A 117 -4.377 -3.047 16.364 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.280 -4.253 16.519 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.218 -2.864 16.006 1.00 0.71 H new ATOM 1772 N THR A 118 -7.421 -3.537 13.615 1.00 0.66 N ATOM 1773 CA THR A 118 -7.623 -3.986 12.247 1.00 0.69 C ATOM 1774 C THR A 118 -7.035 -2.990 11.256 1.00 0.56 C ATOM 1775 O THR A 118 -6.403 -3.374 10.271 1.00 0.57 O ATOM 1776 CB THR A 118 -9.120 -4.188 11.946 1.00 0.81 C ATOM 1777 OG1 THR A 118 -9.872 -3.060 12.415 1.00 1.60 O ATOM 1778 CG2 THR A 118 -9.636 -5.457 12.605 1.00 1.39 C ATOM 0 H THR A 118 -8.039 -2.779 13.905 1.00 0.66 H new ATOM 0 HA THR A 118 -7.110 -4.941 12.138 1.00 0.69 H new ATOM 0 HB THR A 118 -9.242 -4.281 10.867 1.00 0.81 H new ATOM 0 HG1 THR A 118 -10.822 -3.196 12.218 1.00 1.60 H new ATOM 0 HG21 THR A 118 -10.695 -5.579 12.379 1.00 1.39 H new ATOM 0 HG22 THR A 118 -9.082 -6.315 12.225 1.00 1.39 H new ATOM 0 HG23 THR A 118 -9.501 -5.387 13.684 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.247 -1.710 11.529 1.00 0.50 N ATOM 1787 CA LYS A 119 -6.800 -0.657 10.645 1.00 0.41 C ATOM 1788 C LYS A 119 -5.310 -0.357 10.860 1.00 0.35 C ATOM 1789 O LYS A 119 -4.727 -0.689 11.898 1.00 0.40 O ATOM 1790 CB LYS A 119 -7.638 0.602 10.876 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.315 1.342 12.165 1.00 0.98 C ATOM 1792 CD LYS A 119 -8.235 2.536 12.358 1.00 1.36 C ATOM 1793 CE LYS A 119 -7.511 3.693 13.025 1.00 1.79 C ATOM 1794 NZ LYS A 119 -6.457 4.263 12.144 1.00 2.49 N ATOM 0 H LYS A 119 -7.730 -1.380 12.364 1.00 0.50 H new ATOM 0 HA LYS A 119 -6.930 -0.988 9.615 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.492 1.280 10.035 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -8.692 0.326 10.884 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -7.414 0.663 13.012 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -6.278 1.678 12.145 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -8.624 2.857 11.392 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -9.092 2.243 12.965 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -8.229 4.471 13.284 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -7.061 3.352 13.957 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -5.630 4.526 12.717 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -6.176 3.555 11.436 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -6.827 5.107 11.662 1.00 2.49 H new ATOM 1808 N ASN A 120 -4.715 0.265 9.863 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.309 0.653 9.864 1.00 0.28 C ATOM 1810 C ASN A 120 -3.095 1.780 8.856 1.00 0.28 C ATOM 1811 O ASN A 120 -3.775 1.820 7.832 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.452 -0.563 9.484 1.00 0.36 C ATOM 1813 CG ASN A 120 -1.143 -0.200 8.794 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -0.118 -0.039 9.434 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -1.172 -0.076 7.475 1.00 2.07 N ATOM 0 H ASN A 120 -5.203 0.524 9.006 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.019 1.002 10.855 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -2.231 -1.136 10.385 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -3.030 -1.213 8.827 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -0.320 0.161 6.966 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -2.046 -0.217 6.969 1.00 2.07 H new ATOM 1822 N TYR A 121 -2.147 2.672 9.130 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.788 3.716 8.172 1.00 0.37 C ATOM 1824 C TYR A 121 -0.385 3.468 7.629 1.00 0.30 C ATOM 1825 O TYR A 121 0.381 2.707 8.220 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.915 5.120 8.778 1.00 0.66 C ATOM 1827 CG TYR A 121 -1.043 5.400 9.982 1.00 1.06 C ATOM 1828 CD1 TYR A 121 0.260 5.858 9.827 1.00 1.41 C ATOM 1829 CD2 TYR A 121 -1.537 5.247 11.272 1.00 1.46 C ATOM 1830 CE1 TYR A 121 1.045 6.155 10.922 1.00 2.01 C ATOM 1831 CE2 TYR A 121 -0.754 5.535 12.372 1.00 1.98 C ATOM 1832 CZ TYR A 121 0.536 5.991 12.192 1.00 2.23 C ATOM 1833 OH TYR A 121 1.313 6.302 13.283 1.00 2.84 O ATOM 0 H TYR A 121 -1.616 2.694 10.001 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.495 3.671 7.343 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -1.680 5.851 8.005 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -2.955 5.280 9.062 1.00 0.66 H new ATOM 0 HD1 TYR A 121 0.665 5.983 8.833 1.00 1.41 H new ATOM 0 HD2 TYR A 121 -2.549 4.898 11.416 1.00 1.46 H new ATOM 0 HE1 TYR A 121 2.054 6.514 10.784 1.00 2.01 H new ATOM 0 HE2 TYR A 121 -1.149 5.404 13.369 1.00 1.98 H new ATOM 0 HH TYR A 121 0.807 6.131 14.105 1.00 2.84 H new ATOM 1843 N PHE A 122 -0.033 4.110 6.517 1.00 0.30 N ATOM 1844 CA PHE A 122 1.206 3.798 5.837 1.00 0.29 C ATOM 1845 C PHE A 122 2.016 5.062 5.629 1.00 0.26 C ATOM 1846 O PHE A 122 1.737 5.814 4.721 1.00 0.32 O ATOM 1847 CB PHE A 122 0.940 3.168 4.463 1.00 0.34 C ATOM 1848 CG PHE A 122 -0.344 2.385 4.342 1.00 1.05 C ATOM 1849 CD1 PHE A 122 -1.555 3.036 4.176 1.00 1.56 C ATOM 1850 CD2 PHE A 122 -0.333 1.004 4.363 1.00 1.45 C ATOM 1851 CE1 PHE A 122 -2.729 2.324 4.038 1.00 2.27 C ATOM 1852 CE2 PHE A 122 -1.504 0.285 4.228 1.00 2.18 C ATOM 1853 CZ PHE A 122 -2.702 0.946 4.065 1.00 2.54 C ATOM 0 H PHE A 122 -0.589 4.843 6.076 1.00 0.30 H new ATOM 0 HA PHE A 122 1.754 3.091 6.460 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.933 3.961 3.715 1.00 0.34 H new ATOM 0 HB3 PHE A 122 1.772 2.507 4.219 1.00 0.34 H new ATOM 0 HD1 PHE A 122 -1.581 4.115 4.154 1.00 1.56 H new ATOM 0 HD2 PHE A 122 0.603 0.480 4.487 1.00 1.45 H new ATOM 0 HE1 PHE A 122 -3.666 2.845 3.909 1.00 2.27 H new ATOM 0 HE2 PHE A 122 -1.481 -0.795 4.250 1.00 2.18 H new ATOM 0 HZ PHE A 122 -3.619 0.385 3.959 1.00 2.54 H new ATOM 1863 N THR A 123 3.019 5.297 6.446 1.00 0.22 N ATOM 1864 CA THR A 123 3.867 6.452 6.258 1.00 0.22 C ATOM 1865 C THR A 123 4.999 6.060 5.325 1.00 0.20 C ATOM 1866 O THR A 123 5.554 4.981 5.455 1.00 0.19 O ATOM 1867 CB THR A 123 4.443 6.914 7.614 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.374 7.127 8.549 1.00 0.32 O ATOM 1869 CG2 THR A 123 5.246 8.194 7.463 1.00 0.33 C ATOM 0 H THR A 123 3.266 4.708 7.241 1.00 0.22 H new ATOM 0 HA THR A 123 3.291 7.273 5.831 1.00 0.22 H new ATOM 0 HB THR A 123 5.108 6.133 7.983 1.00 0.24 H new ATOM 0 HG1 THR A 123 3.744 7.418 9.408 1.00 0.32 H new ATOM 0 HG21 THR A 123 5.638 8.494 8.435 1.00 0.33 H new ATOM 0 HG22 THR A 123 6.073 8.025 6.774 1.00 0.33 H new ATOM 0 HG23 THR A 123 4.603 8.983 7.072 1.00 0.33 H new ATOM 1877 N SER A 124 5.328 6.893 4.355 1.00 0.21 N ATOM 1878 CA SER A 124 6.362 6.513 3.422 1.00 0.23 C ATOM 1879 C SER A 124 7.693 6.582 4.132 1.00 0.29 C ATOM 1880 O SER A 124 8.077 7.616 4.670 1.00 0.34 O ATOM 1881 CB SER A 124 6.352 7.400 2.176 1.00 0.26 C ATOM 1882 OG SER A 124 5.148 7.227 1.444 1.00 1.17 O ATOM 0 H SER A 124 4.907 7.809 4.198 1.00 0.21 H new ATOM 0 HA SER A 124 6.180 5.495 3.076 1.00 0.23 H new ATOM 0 HB2 SER A 124 6.459 8.445 2.467 1.00 0.26 H new ATOM 0 HB3 SER A 124 7.206 7.156 1.544 1.00 0.26 H new ATOM 0 HG SER A 124 5.309 6.626 0.687 1.00 1.17 H new ATOM 1888 N VAL A 125 8.388 5.462 4.138 1.00 0.33 N ATOM 1889 CA VAL A 125 9.592 5.322 4.916 1.00 0.43 C ATOM 1890 C VAL A 125 10.735 6.099 4.270 1.00 0.53 C ATOM 1891 O VAL A 125 11.709 6.462 4.934 1.00 0.65 O ATOM 1892 CB VAL A 125 9.933 3.822 5.074 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.345 3.622 5.598 1.00 0.81 C ATOM 1894 CG2 VAL A 125 8.934 3.156 6.001 1.00 0.47 C ATOM 0 H VAL A 125 8.132 4.631 3.605 1.00 0.33 H new ATOM 0 HA VAL A 125 9.438 5.742 5.910 1.00 0.43 H new ATOM 0 HB VAL A 125 9.875 3.361 4.088 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.549 2.556 5.696 1.00 0.81 H new ATOM 0 HG12 VAL A 125 12.057 4.065 4.902 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.443 4.101 6.572 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.183 2.100 6.106 1.00 0.47 H new ATOM 0 HG22 VAL A 125 8.969 3.636 6.979 1.00 0.47 H new ATOM 0 HG23 VAL A 125 7.931 3.253 5.585 1.00 0.47 H new ATOM 1904 N ALA A 126 10.595 6.395 2.986 1.00 0.53 N ATOM 1905 CA ALA A 126 11.581 7.229 2.312 1.00 0.63 C ATOM 1906 C ALA A 126 11.464 8.680 2.783 1.00 0.63 C ATOM 1907 O ALA A 126 12.461 9.303 3.144 1.00 0.72 O ATOM 1908 CB ALA A 126 11.414 7.146 0.802 1.00 0.68 C ATOM 0 H ALA A 126 9.824 6.078 2.399 1.00 0.53 H new ATOM 0 HA ALA A 126 12.574 6.859 2.567 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.160 7.776 0.318 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.545 6.114 0.478 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.416 7.488 0.527 1.00 0.68 H new ATOM 1914 N HIS A 127 10.241 9.209 2.793 1.00 0.56 N ATOM 1915 CA HIS A 127 9.970 10.500 3.370 1.00 0.58 C ATOM 1916 C HIS A 127 8.550 10.480 3.910 1.00 0.47 C ATOM 1917 O HIS A 127 7.597 10.385 3.145 1.00 0.44 O ATOM 1918 CB HIS A 127 10.144 11.622 2.340 1.00 0.72 C ATOM 1919 CG HIS A 127 10.312 12.977 2.964 1.00 1.15 C ATOM 1920 ND1 HIS A 127 9.681 14.114 2.504 1.00 1.70 N ATOM 1921 CD2 HIS A 127 11.065 13.373 4.019 1.00 1.99 C ATOM 1922 CE1 HIS A 127 10.040 15.145 3.247 1.00 2.29 C ATOM 1923 NE2 HIS A 127 10.877 14.721 4.170 1.00 2.47 N ATOM 0 H HIS A 127 9.421 8.747 2.400 1.00 0.56 H new ATOM 0 HA HIS A 127 10.679 10.699 4.174 1.00 0.58 H new ATOM 0 HB2 HIS A 127 11.013 11.405 1.719 1.00 0.72 H new ATOM 0 HB3 HIS A 127 9.277 11.638 1.680 1.00 0.72 H new ATOM 0 HD2 HIS A 127 11.696 12.742 4.628 1.00 1.99 H new ATOM 0 HE1 HIS A 127 9.704 16.163 3.119 1.00 2.29 H new ATOM 0 HE2 HIS A 127 11.315 15.303 4.884 1.00 2.47 H new ATOM 1932 N PRO A 128 8.416 10.543 5.233 1.00 0.47 N ATOM 1933 CA PRO A 128 7.131 10.605 5.952 1.00 0.43 C ATOM 1934 C PRO A 128 6.065 11.479 5.297 1.00 0.40 C ATOM 1935 O PRO A 128 4.880 11.161 5.362 1.00 0.39 O ATOM 1936 CB PRO A 128 7.558 11.222 7.259 1.00 0.53 C ATOM 1937 CG PRO A 128 8.876 10.603 7.528 1.00 0.79 C ATOM 1938 CD PRO A 128 9.550 10.535 6.186 1.00 0.60 C ATOM 0 HA PRO A 128 6.655 9.626 6.004 1.00 0.43 H new ATOM 0 HB2 PRO A 128 7.633 12.307 7.184 1.00 0.53 H new ATOM 0 HB3 PRO A 128 6.845 11.007 8.055 1.00 0.53 H new ATOM 0 HG2 PRO A 128 9.456 11.199 8.232 1.00 0.79 H new ATOM 0 HG3 PRO A 128 8.765 9.611 7.966 1.00 0.79 H new ATOM 0 HD2 PRO A 128 10.215 11.384 6.027 1.00 0.60 H new ATOM 0 HD3 PRO A 128 10.154 9.633 6.085 1.00 0.60 H new ATOM 1946 N ASN A 129 6.477 12.619 4.740 1.00 0.44 N ATOM 1947 CA ASN A 129 5.528 13.613 4.247 1.00 0.47 C ATOM 1948 C ASN A 129 4.744 13.103 3.042 1.00 0.39 C ATOM 1949 O ASN A 129 3.791 13.721 2.583 1.00 0.44 O ATOM 1950 CB ASN A 129 6.261 14.905 3.898 1.00 0.57 C ATOM 1951 CG ASN A 129 5.322 16.000 3.435 1.00 1.07 C ATOM 1952 OD1 ASN A 129 5.250 16.314 2.247 1.00 1.84 O ATOM 1953 ND2 ASN A 129 4.571 16.564 4.368 1.00 1.44 N ATOM 0 H ASN A 129 7.457 12.874 4.620 1.00 0.44 H new ATOM 0 HA ASN A 129 4.809 13.810 5.042 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.815 15.251 4.771 1.00 0.57 H new ATOM 0 HB3 ASN A 129 6.992 14.704 3.115 1.00 0.57 H new ATOM 0 HD21 ASN A 129 3.900 17.289 4.113 1.00 1.44 H new ATOM 0 HD22 ASN A 129 4.663 16.273 5.341 1.00 1.44 H new ATOM 1960 N LEU A 130 5.169 11.992 2.518 1.00 0.32 N ATOM 1961 CA LEU A 130 4.338 11.202 1.661 1.00 0.26 C ATOM 1962 C LEU A 130 3.778 10.103 2.535 1.00 0.24 C ATOM 1963 O LEU A 130 4.551 9.454 3.238 1.00 0.26 O ATOM 1964 CB LEU A 130 5.186 10.584 0.541 1.00 0.30 C ATOM 1965 CG LEU A 130 6.582 11.197 0.352 1.00 0.58 C ATOM 1966 CD1 LEU A 130 7.415 10.354 -0.599 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.483 12.622 -0.163 1.00 1.28 C ATOM 0 H LEU A 130 6.101 11.608 2.673 1.00 0.32 H new ATOM 0 HA LEU A 130 3.551 11.798 1.200 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.300 9.519 0.742 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.639 10.675 -0.397 1.00 0.30 H new ATOM 0 HG LEU A 130 7.074 11.215 1.325 1.00 0.58 H new ATOM 0 HD11 LEU A 130 8.400 10.806 -0.719 1.00 1.38 H new ATOM 0 HD12 LEU A 130 7.524 9.348 -0.193 1.00 1.38 H new ATOM 0 HD13 LEU A 130 6.919 10.302 -1.568 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.484 13.034 -0.289 1.00 1.28 H new ATOM 0 HD22 LEU A 130 5.966 12.627 -1.122 1.00 1.28 H new ATOM 0 HD23 LEU A 130 5.928 13.229 0.552 1.00 1.28 H new ATOM 1979 N PHE A 131 2.484 9.874 2.530 1.00 0.23 N ATOM 1980 CA PHE A 131 1.979 8.667 3.144 1.00 0.27 C ATOM 1981 C PHE A 131 0.594 8.289 2.617 1.00 0.26 C ATOM 1982 O PHE A 131 -0.223 9.152 2.291 1.00 0.26 O ATOM 1983 CB PHE A 131 2.204 8.673 4.677 1.00 0.42 C ATOM 1984 CG PHE A 131 1.125 9.086 5.628 1.00 0.36 C ATOM 1985 CD1 PHE A 131 0.054 8.249 5.866 1.00 0.63 C ATOM 1986 CD2 PHE A 131 1.118 10.347 6.189 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.997 8.656 6.654 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.072 10.750 6.990 1.00 0.96 C ATOM 1989 CZ PHE A 131 -0.747 9.790 7.545 1.00 1.05 C ATOM 0 H PHE A 131 1.780 10.488 2.120 1.00 0.23 H new ATOM 0 HA PHE A 131 2.574 7.811 2.826 1.00 0.27 H new ATOM 0 HB2 PHE A 131 2.502 7.662 4.957 1.00 0.42 H new ATOM 0 HB3 PHE A 131 3.059 9.322 4.868 1.00 0.42 H new ATOM 0 HD1 PHE A 131 0.041 7.262 5.428 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.939 11.023 5.999 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -1.958 8.164 6.617 1.00 0.97 H new ATOM 0 HE2 PHE A 131 -0.103 11.799 7.180 1.00 0.96 H new ATOM 0 HZ PHE A 131 -1.163 9.867 8.539 1.00 1.05 H new ATOM 1999 N ILE A 132 0.355 6.987 2.555 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.593 6.368 1.651 1.00 0.27 C ATOM 2001 C ILE A 132 -2.016 6.386 2.197 1.00 0.25 C ATOM 2002 O ILE A 132 -2.376 5.657 3.116 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.135 4.911 1.411 1.00 0.34 C ATOM 2004 CG1 ILE A 132 1.208 4.902 0.681 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.178 4.127 0.623 1.00 0.80 C ATOM 2006 CD1 ILE A 132 1.881 3.547 0.670 1.00 1.39 C ATOM 0 H ILE A 132 0.833 6.314 3.154 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.612 6.935 0.720 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.017 4.424 2.379 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.056 5.231 -0.347 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.873 5.625 1.152 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -0.827 3.106 0.470 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.116 4.109 1.178 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -1.338 4.604 -0.344 1.00 0.80 H new ATOM 0 HD11 ILE A 132 2.828 3.616 0.135 1.00 1.39 H new ATOM 0 HD12 ILE A 132 2.065 3.224 1.695 1.00 1.39 H new ATOM 0 HD13 ILE A 132 1.235 2.824 0.172 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.786 7.282 1.614 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.171 7.535 1.976 1.00 0.23 C ATOM 2020 C ALA A 133 -5.173 6.762 1.140 1.00 0.23 C ATOM 2021 O ALA A 133 -4.881 6.351 0.019 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.444 9.002 1.813 1.00 0.25 C ATOM 0 H ALA A 133 -2.457 7.874 0.851 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.296 7.202 3.006 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.480 9.211 2.080 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.779 9.570 2.464 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.271 9.291 0.776 1.00 0.25 H new ATOM 2028 N THR A 134 -6.371 6.597 1.694 1.00 0.23 N ATOM 2029 CA THR A 134 -7.475 5.989 0.987 1.00 0.25 C ATOM 2030 C THR A 134 -8.696 6.890 1.136 1.00 0.26 C ATOM 2031 O THR A 134 -9.091 7.263 2.244 1.00 0.31 O ATOM 2032 CB THR A 134 -7.753 4.583 1.502 1.00 0.31 C ATOM 2033 OG1 THR A 134 -7.713 4.632 2.902 1.00 0.96 O ATOM 2034 CG2 THR A 134 -6.730 3.580 0.986 1.00 1.01 C ATOM 0 H THR A 134 -6.596 6.884 2.647 1.00 0.23 H new ATOM 0 HA THR A 134 -7.225 5.888 -0.069 1.00 0.25 H new ATOM 0 HB THR A 134 -8.729 4.252 1.146 1.00 0.31 H new ATOM 0 HG1 THR A 134 -8.055 5.498 3.209 1.00 0.96 H new ATOM 0 HG21 THR A 134 -6.963 2.589 1.376 1.00 1.01 H new ATOM 0 HG22 THR A 134 -6.760 3.558 -0.103 1.00 1.01 H new ATOM 0 HG23 THR A 134 -5.734 3.874 1.316 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.248 7.270 0.023 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.356 8.208 -0.005 1.00 0.31 C ATOM 2044 C LYS A 135 -11.639 7.482 -0.404 1.00 0.40 C ATOM 2045 O LYS A 135 -11.615 6.556 -1.209 1.00 0.47 O ATOM 2046 CB LYS A 135 -10.050 9.389 -0.951 1.00 0.35 C ATOM 2047 CG LYS A 135 -9.140 10.465 -0.336 1.00 0.69 C ATOM 2048 CD LYS A 135 -8.933 11.649 -1.289 1.00 0.76 C ATOM 2049 CE LYS A 135 -8.548 12.943 -0.557 1.00 0.89 C ATOM 2050 NZ LYS A 135 -7.083 13.065 -0.271 1.00 0.63 N ATOM 0 H LYS A 135 -8.951 6.945 -0.897 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.497 8.624 0.993 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -9.579 9.004 -1.856 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -10.990 9.852 -1.253 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -9.578 10.821 0.597 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -8.174 10.025 -0.087 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -8.153 11.398 -2.008 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -9.848 11.817 -1.857 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -8.863 13.796 -1.158 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -9.097 12.994 0.383 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.851 14.057 -0.064 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -6.839 12.474 0.549 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.540 12.748 -1.100 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.751 7.945 0.146 1.00 0.49 N ATOM 2065 CA GLN A 136 -14.046 7.284 -0.003 1.00 0.63 C ATOM 2066 C GLN A 136 -14.686 7.593 -1.348 1.00 0.58 C ATOM 2067 O GLN A 136 -15.484 6.813 -1.872 1.00 0.69 O ATOM 2068 CB GLN A 136 -14.961 7.726 1.142 1.00 0.82 C ATOM 2069 CG GLN A 136 -16.403 7.273 1.015 1.00 1.05 C ATOM 2070 CD GLN A 136 -17.163 7.419 2.314 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -16.463 7.238 3.426 1.00 1.75 O flip ATOM 2072 NE2 GLN A 136 -18.367 7.668 2.321 1.00 1.20 N flip ATOM 0 H GLN A 136 -12.785 8.793 0.711 1.00 0.49 H new ATOM 0 HA GLN A 136 -13.895 6.205 0.036 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -14.556 7.345 2.080 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -14.941 8.814 1.205 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -16.898 7.856 0.239 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -16.428 6.231 0.696 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -18.866 7.800 1.441 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -18.867 7.743 3.207 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.337 8.735 -1.894 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.956 9.215 -3.132 1.00 0.52 C ATOM 2083 C ASP A 137 -13.912 9.532 -4.187 1.00 0.47 C ATOM 2084 O ASP A 137 -14.150 9.362 -5.382 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.789 10.472 -2.877 1.00 0.63 C ATOM 2086 CG ASP A 137 -17.042 10.216 -2.065 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -16.940 10.086 -0.828 1.00 2.21 O ATOM 2088 OD2 ASP A 137 -18.139 10.186 -2.655 1.00 1.43 O ATOM 0 H ASP A 137 -13.627 9.358 -1.508 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.601 8.414 -3.493 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -15.173 11.206 -2.357 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -16.070 10.912 -3.834 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.765 10.010 -3.746 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.701 10.404 -4.655 1.00 0.38 C ATOM 2095 C TYR A 138 -10.711 9.267 -4.844 1.00 0.32 C ATOM 2096 O TYR A 138 -10.897 8.177 -4.307 1.00 0.31 O ATOM 2097 CB TYR A 138 -10.969 11.645 -4.137 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.822 12.888 -4.079 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.176 13.561 -5.239 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -12.264 13.395 -2.864 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -12.946 14.706 -5.193 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -13.037 14.538 -2.808 1.00 1.98 C ATOM 2103 CZ TYR A 138 -13.376 15.190 -3.977 1.00 1.94 C ATOM 2104 OH TYR A 138 -14.139 16.334 -3.929 1.00 2.50 O ATOM 0 H TYR A 138 -12.543 10.136 -2.758 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.157 10.643 -5.616 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.584 11.436 -3.139 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.108 11.838 -4.777 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -11.844 13.183 -6.194 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -11.999 12.887 -1.948 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -13.210 15.220 -6.106 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -13.374 14.920 -1.856 1.00 1.98 H new ATOM 0 HH TYR A 138 -14.361 16.540 -2.997 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.660 9.528 -5.603 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.581 8.567 -5.748 1.00 0.33 C ATOM 2116 C TRP A 139 -7.813 8.488 -4.437 1.00 0.30 C ATOM 2117 O TRP A 139 -7.857 9.417 -3.624 1.00 0.32 O ATOM 2118 CB TRP A 139 -7.625 8.993 -6.870 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.271 9.099 -8.219 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -8.533 8.078 -9.085 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -8.721 10.299 -8.863 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -9.125 8.567 -10.225 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -9.251 9.926 -10.113 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -8.729 11.651 -8.503 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -9.784 10.855 -11.002 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -9.259 12.572 -9.388 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -9.780 12.169 -10.625 1.00 2.74 C ATOM 0 H TRP A 139 -9.531 10.394 -6.126 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.003 7.594 -6.000 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -7.187 9.957 -6.612 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -6.806 8.276 -6.927 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -8.308 7.038 -8.902 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -9.422 8.008 -11.025 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -8.329 11.969 -7.552 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -10.187 10.548 -11.956 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -9.272 13.619 -9.122 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -10.187 12.912 -11.295 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.119 7.385 -4.226 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.316 7.224 -3.028 1.00 0.33 C ATOM 2140 C VAL A 140 -5.105 8.146 -3.088 1.00 0.30 C ATOM 2141 O VAL A 140 -4.234 7.997 -3.944 1.00 0.32 O ATOM 2142 CB VAL A 140 -5.877 5.758 -2.829 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -7.049 4.935 -2.330 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -5.331 5.162 -4.121 1.00 1.28 C ATOM 0 H VAL A 140 -7.095 6.591 -4.865 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.930 7.497 -2.169 1.00 0.33 H new ATOM 0 HB VAL A 140 -5.078 5.739 -2.088 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -6.734 3.901 -2.191 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -7.399 5.339 -1.380 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -7.857 4.973 -3.060 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -5.031 4.129 -3.947 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -6.103 5.191 -4.890 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -4.468 5.740 -4.452 1.00 1.28 H new ATOM 2154 N CYS A 141 -5.069 9.121 -2.195 1.00 0.30 N ATOM 2155 CA CYS A 141 -4.069 10.166 -2.281 1.00 0.26 C ATOM 2156 C CYS A 141 -2.940 9.939 -1.275 1.00 0.25 C ATOM 2157 O CYS A 141 -2.731 8.828 -0.789 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.754 11.517 -2.027 1.00 0.33 C ATOM 2159 SG CYS A 141 -3.790 12.970 -2.514 1.00 1.21 S ATOM 0 H CYS A 141 -5.715 9.209 -1.410 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.621 10.155 -3.275 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.702 11.533 -2.564 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -4.988 11.594 -0.965 1.00 0.33 H new ATOM 0 HG CYS A 141 -4.063 13.959 -1.716 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.217 11.003 -0.993 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.061 10.982 -0.133 1.00 0.23 C ATOM 2167 C LEU A 142 -1.097 12.230 0.727 1.00 0.24 C ATOM 2168 O LEU A 142 -1.783 13.185 0.378 1.00 0.23 O ATOM 2169 CB LEU A 142 0.147 10.929 -1.072 1.00 0.21 C ATOM 2170 CG LEU A 142 1.453 10.389 -0.533 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.399 8.873 -0.429 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.586 10.813 -1.442 1.00 0.25 C ATOM 0 H LEU A 142 -2.426 11.929 -1.367 1.00 0.21 H new ATOM 0 HA LEU A 142 -1.022 10.132 0.548 1.00 0.23 H new ATOM 0 HB2 LEU A 142 -0.130 10.326 -1.936 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.330 11.940 -1.435 1.00 0.21 H new ATOM 0 HG LEU A 142 1.622 10.793 0.465 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.347 8.501 -0.040 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.592 8.583 0.243 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.220 8.447 -1.416 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.528 10.425 -1.055 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.416 10.419 -2.444 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.632 11.901 -1.483 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.438 12.204 1.866 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.127 13.422 2.596 1.00 0.33 C ATOM 2186 C ALA A 143 0.935 13.129 3.635 1.00 0.60 C ATOM 2187 O ALA A 143 1.197 11.977 3.937 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.375 13.992 3.256 1.00 0.38 C ATOM 0 H ALA A 143 -0.104 11.349 2.311 1.00 0.34 H new ATOM 0 HA ALA A 143 0.250 14.167 1.896 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.117 14.903 3.796 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.118 14.221 2.492 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -1.784 13.261 3.953 1.00 0.38 H new ATOM 2194 N GLY A 144 1.567 14.162 4.161 1.00 0.63 N ATOM 2195 CA GLY A 144 2.491 13.957 5.264 1.00 0.93 C ATOM 2196 C GLY A 144 1.791 14.141 6.574 1.00 0.93 C ATOM 2197 O GLY A 144 2.371 14.546 7.582 1.00 1.13 O ATOM 0 H GLY A 144 1.463 15.129 3.853 1.00 0.63 H new ATOM 0 HA2 GLY A 144 2.915 12.955 5.209 1.00 0.93 H new ATOM 0 HA3 GLY A 144 3.321 14.659 5.186 1.00 0.93 H new ATOM 2236 N SER A 148 -6.549 12.909 4.672 1.00 0.49 N ATOM 2237 CA SER A 148 -6.806 11.682 3.989 1.00 0.43 C ATOM 2238 C SER A 148 -6.932 10.540 4.983 1.00 0.37 C ATOM 2239 O SER A 148 -6.241 10.522 5.997 1.00 0.37 O ATOM 2240 CB SER A 148 -5.696 11.441 2.993 1.00 0.57 C ATOM 2241 OG SER A 148 -5.673 12.452 2.001 1.00 0.64 O ATOM 0 HA SER A 148 -7.752 11.741 3.451 1.00 0.43 H new ATOM 0 HB2 SER A 148 -4.738 11.414 3.511 1.00 0.57 H new ATOM 0 HB3 SER A 148 -5.831 10.468 2.522 1.00 0.57 H new ATOM 0 HG SER A 148 -5.999 13.293 2.384 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.804 9.600 4.705 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.958 8.449 5.564 1.00 0.32 C ATOM 2249 C ILE A 149 -7.020 7.378 5.107 1.00 0.26 C ATOM 2250 O ILE A 149 -7.302 6.676 4.172 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.394 7.914 5.590 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -10.345 8.961 6.197 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.463 6.624 6.396 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -10.574 10.200 5.348 1.00 1.21 C ATOM 0 H ILE A 149 -8.418 9.609 3.891 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.724 8.759 6.583 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.703 7.708 4.565 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -11.308 8.487 6.385 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -9.948 9.271 7.164 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.489 6.256 6.406 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.813 5.876 5.942 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -9.137 6.816 7.418 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -11.258 10.874 5.864 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -9.624 10.707 5.180 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -11.005 9.910 4.390 1.00 1.21 H new ATOM 2266 N THR A 150 -5.887 7.300 5.738 1.00 0.24 N ATOM 2267 CA THR A 150 -4.825 6.436 5.286 1.00 0.25 C ATOM 2268 C THR A 150 -4.989 5.096 5.947 1.00 0.26 C ATOM 2269 O THR A 150 -4.028 4.434 6.303 1.00 0.34 O ATOM 2270 CB THR A 150 -3.468 7.055 5.685 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.498 7.391 7.081 1.00 0.53 O ATOM 2272 CG2 THR A 150 -3.199 8.320 4.888 1.00 0.69 C ATOM 0 H THR A 150 -5.668 7.831 6.581 1.00 0.24 H new ATOM 0 HA THR A 150 -4.861 6.320 4.203 1.00 0.25 H new ATOM 0 HB THR A 150 -2.681 6.330 5.479 1.00 0.28 H new ATOM 0 HG1 THR A 150 -3.042 8.247 7.221 1.00 0.53 H new ATOM 0 HG21 THR A 150 -2.238 8.740 5.185 1.00 0.69 H new ATOM 0 HG22 THR A 150 -3.178 8.082 3.824 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.988 9.047 5.082 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.224 4.689 6.102 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.485 3.469 6.772 1.00 0.25 C ATOM 2282 C ASP A 151 -6.665 2.323 5.830 1.00 0.26 C ATOM 2283 O ASP A 151 -7.054 2.463 4.686 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.610 3.593 7.765 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.089 3.921 9.151 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.300 3.124 9.698 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -7.460 4.979 9.703 1.00 1.07 O ATOM 0 H ASP A 151 -7.049 5.190 5.771 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.592 3.238 7.352 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.300 4.372 7.440 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.174 2.661 7.797 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.299 1.203 6.320 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.631 -0.039 5.722 1.00 0.27 C ATOM 2294 C PHE A 152 -7.034 -0.987 6.823 1.00 0.28 C ATOM 2295 O PHE A 152 -6.813 -0.716 7.984 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.447 -0.583 4.918 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.766 -1.793 5.510 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -3.808 -1.649 6.501 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -5.082 -3.068 5.075 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -3.179 -2.751 7.042 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -4.456 -4.175 5.616 1.00 3.35 C ATOM 2302 CZ PHE A 152 -3.524 -4.026 6.603 1.00 3.93 C ATOM 0 H PHE A 152 -5.745 1.117 7.172 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.458 0.082 5.022 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.795 -0.836 3.917 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.709 0.211 4.808 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.551 -0.661 6.854 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -5.826 -3.200 4.304 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -2.423 -2.625 7.802 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -4.705 -5.163 5.257 1.00 3.35 H new ATOM 0 HZ PHE A 152 -3.056 -4.895 7.042 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.595 -2.087 6.431 1.00 0.30 N ATOM 2313 CA GLN A 153 -8.041 -3.124 7.326 1.00 0.33 C ATOM 2314 C GLN A 153 -8.154 -4.390 6.518 1.00 0.38 C ATOM 2315 O GLN A 153 -8.496 -4.334 5.333 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.369 -2.773 8.003 1.00 0.44 C ATOM 2317 CG GLN A 153 -10.433 -2.261 7.055 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.777 -2.106 7.727 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -12.130 -2.875 8.624 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -12.517 -1.092 7.324 1.00 1.20 N ATOM 0 H GLN A 153 -7.764 -2.301 5.448 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.324 -3.247 8.137 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -9.749 -3.658 8.514 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -9.186 -2.018 8.768 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -10.121 -1.299 6.648 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -10.527 -2.948 6.214 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -12.183 -0.482 6.578 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -13.423 -0.918 7.759 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.850 -5.519 7.117 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.709 -6.729 6.344 1.00 0.45 C ATOM 2331 C ILE A 154 -9.042 -7.455 6.311 1.00 0.44 C ATOM 2332 O ILE A 154 -9.551 -7.947 7.319 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.604 -7.629 6.957 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -6.628 -9.034 6.352 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -6.742 -7.692 8.474 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -5.589 -9.963 6.943 1.00 1.63 C ATOM 0 H ILE A 154 -7.698 -5.624 8.120 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.413 -6.483 5.324 1.00 0.45 H new ATOM 0 HB ILE A 154 -5.640 -7.182 6.716 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -7.617 -9.468 6.499 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -6.469 -8.961 5.276 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -5.958 -8.328 8.885 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -6.650 -6.689 8.890 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -7.717 -8.105 8.734 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -5.663 -10.941 6.468 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -4.594 -9.551 6.773 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -5.761 -10.066 8.014 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.594 -7.489 5.108 1.00 0.43 N ATOM 2349 CA LEU A 155 -10.960 -7.928 4.873 1.00 0.44 C ATOM 2350 C LEU A 155 -10.985 -9.265 4.149 1.00 0.57 C ATOM 2351 O LEU A 155 -10.364 -9.429 3.110 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.755 -6.877 4.072 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.119 -5.559 4.796 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.606 -5.283 4.640 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -11.761 -5.601 6.273 1.00 0.73 C ATOM 0 H LEU A 155 -9.101 -7.210 4.260 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.436 -8.050 5.846 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.179 -6.625 3.182 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.680 -7.342 3.732 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.538 -4.759 4.337 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.859 -4.354 5.151 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -13.850 -5.193 3.582 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.176 -6.104 5.075 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -12.034 -4.655 6.741 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -12.303 -6.414 6.756 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -10.689 -5.764 6.383 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.664 -10.224 4.728 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.834 -11.527 4.112 1.00 0.89 C ATOM 2369 C GLU A 156 -13.029 -11.440 3.174 1.00 0.99 C ATOM 2370 O GLU A 156 -13.842 -10.543 3.319 1.00 0.90 O ATOM 2371 CB GLU A 156 -12.084 -12.582 5.191 1.00 1.04 C ATOM 2372 CG GLU A 156 -12.163 -14.002 4.659 1.00 1.58 C ATOM 2373 CD GLU A 156 -12.524 -15.002 5.733 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -13.731 -15.187 5.997 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -11.600 -15.606 6.319 1.00 2.53 O ATOM 0 H GLU A 156 -12.116 -10.129 5.638 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.939 -11.813 3.559 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -11.286 -12.526 5.931 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -13.015 -12.346 5.707 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -12.904 -14.047 3.861 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -11.204 -14.276 4.219 1.00 1.58 H new ATOM 2382 N ASN A 157 -13.122 -12.338 2.206 1.00 1.23 N ATOM 2383 CA ASN A 157 -14.170 -12.264 1.192 1.00 1.41 C ATOM 2384 C ASN A 157 -15.422 -12.988 1.663 1.00 1.66 C ATOM 2385 O ASN A 157 -15.402 -13.714 2.659 1.00 1.82 O ATOM 2386 CB ASN A 157 -13.678 -12.842 -0.140 1.00 1.68 C ATOM 2387 CG ASN A 157 -13.934 -14.328 -0.311 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -13.981 -15.077 0.652 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -14.106 -14.761 -1.551 1.00 2.44 N ATOM 0 H ASN A 157 -12.486 -13.128 2.098 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.420 -11.215 1.035 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -14.163 -12.306 -0.956 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -12.607 -12.657 -0.229 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -14.285 -15.750 -1.726 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -14.060 -14.105 -2.331 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.500 -12.765 0.953 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.795 -13.299 1.329 1.00 2.06 C ATOM 2398 C GLN A 158 -17.855 -14.781 0.992 1.00 2.49 C ATOM 2399 O GLN A 158 -18.113 -15.627 1.853 1.00 2.73 O ATOM 2400 CB GLN A 158 -18.900 -12.536 0.592 1.00 2.08 C ATOM 2401 CG GLN A 158 -20.303 -12.826 1.092 1.00 2.54 C ATOM 2402 CD GLN A 158 -20.521 -12.380 2.525 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -19.899 -11.431 2.999 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -21.422 -13.054 3.217 1.00 2.98 N ATOM 0 H GLN A 158 -16.510 -12.209 0.098 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.942 -13.178 2.402 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -18.709 -11.467 0.683 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -18.848 -12.780 -0.469 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -21.024 -12.325 0.447 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -20.497 -13.896 1.016 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -21.916 -13.835 2.786 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -21.624 -12.793 4.182 1.00 2.98 H new ATOM 2413 N ALA A 159 -17.557 -15.070 -0.268 1.00 2.67 N ATOM 2414 CA ALA A 159 -17.606 -16.413 -0.815 1.00 3.14 C ATOM 2415 C ALA A 159 -17.141 -16.368 -2.263 1.00 3.38 C ATOM 2416 O ALA A 159 -16.288 -17.190 -2.655 1.00 3.55 O ATOM 2417 CB ALA A 159 -19.016 -16.987 -0.725 1.00 3.37 C ATOM 2418 OXT ALA A 159 -17.609 -15.467 -2.994 1.00 3.78 O ATOM 0 H ALA A 159 -17.270 -14.364 -0.947 1.00 2.67 H new ATOM 0 HA ALA A 159 -16.949 -17.063 -0.236 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -19.026 -17.994 -1.141 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -19.328 -17.023 0.319 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -19.703 -16.355 -1.288 1.00 3.37 H new