USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1084 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 98 SER OG : rot 117:sc= -0.812 USER MOD Set 1.2: A 107 GLN : amide:sc= -0.804 X(o=-1.6,f=-1.6) USER MOD Set 2.1: A 83 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.014) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 80 LYS NZ :NH3+ -158:sc=-0.00711 (180deg=-0.247) USER MOD Set 3.2: A 90 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 34 ASN :FLIP amide:sc= -0.9! F(o=-5.3,f=-3.7!) USER MOD Set 4.2: A 57 ASN :FLIP amide:sc= -2.82! C(o=-4.6!,f=-3.7!) USER MOD Single : A 14 CYS SG : rot 106:sc= -1.06 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.495 K(o=-0.5,f=-4.8!) USER MOD Single : A 40 MET CE :methyl 156:sc= -5.15! (180deg=-6.23!) USER MOD Single : A 41 LYS NZ :NH3+ 157:sc= 1.01 (180deg=0.954) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl -117:sc= -0.146 (180deg=-1.45!) USER MOD Single : A 56 GLN : amide:sc= -0.125 K(o=-0.12,f=-0.92) USER MOD Single : A 59 SER OG : rot 180:sc= -0.371 USER MOD Single : A 64 LYS NZ :NH3+ -139:sc= -0.163 (180deg=-1.21) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 TYR OH : rot 7:sc= 0.368 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot -15:sc= -2.3! USER MOD Single : A 81 TYR OH : rot 150:sc= 0 USER MOD Single : A 93 CYS SG : rot -134:sc= -4.32! USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot 174:sc= -1.82 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.257 X(o=-0.26,f=-0.083) USER MOD Single : A 108 MET CE :methyl -165:sc= 0 (180deg=-0.443) USER MOD Single : A 109 MET CE :methyl -176:sc= -1.77 (180deg=-1.89!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 103:sc= 2.18 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot 85:sc= 1.23 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -156:sc= -0.0448 (180deg=-0.292) USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.0067 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -56:sc= -0.341 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.483 -1.366 -0.778 1.00 25.50 N ATOM 136 CA VAL A 13 16.909 -0.031 -0.678 1.00 53.40 C ATOM 137 C VAL A 13 16.801 0.626 -2.049 1.00 51.54 C ATOM 138 O VAL A 13 17.807 1.019 -2.642 1.00 73.31 O ATOM 139 CB VAL A 13 17.746 0.874 0.248 1.00 72.15 C ATOM 140 CG1 VAL A 13 17.176 2.284 0.273 1.00 11.23 C ATOM 141 CG2 VAL A 13 17.806 0.288 1.650 1.00 30.03 C ATOM 0 HA VAL A 13 15.911 -0.148 -0.255 1.00 53.40 H new ATOM 0 HB VAL A 13 18.762 0.926 -0.143 1.00 72.15 H new ATOM 0 HG11 VAL A 13 17.779 2.909 0.932 1.00 11.23 H new ATOM 0 HG12 VAL A 13 17.190 2.700 -0.734 1.00 11.23 H new ATOM 0 HG13 VAL A 13 16.150 2.255 0.640 1.00 11.23 H new ATOM 0 HG21 VAL A 13 18.400 0.939 2.291 1.00 30.03 H new ATOM 0 HG22 VAL A 13 16.797 0.205 2.053 1.00 30.03 H new ATOM 0 HG23 VAL A 13 18.264 -0.700 1.612 1.00 30.03 H new ATOM 151 N CYS A 14 15.575 0.743 -2.549 1.00 22.21 N ATOM 152 CA CYS A 14 15.335 1.352 -3.853 1.00 31.55 C ATOM 153 C CYS A 14 14.824 2.780 -3.699 1.00 2.41 C ATOM 154 O CYS A 14 14.379 3.178 -2.623 1.00 40.22 O ATOM 155 CB CYS A 14 14.329 0.519 -4.650 1.00 3.43 C ATOM 156 SG CYS A 14 14.962 -1.087 -5.187 1.00 41.43 S ATOM 0 H CYS A 14 14.732 0.424 -2.071 1.00 22.21 H new ATOM 0 HA CYS A 14 16.281 1.381 -4.394 1.00 31.55 H new ATOM 0 HB2 CYS A 14 13.440 0.361 -4.040 1.00 3.43 H new ATOM 0 HB3 CYS A 14 14.017 1.086 -5.527 1.00 3.43 H new ATOM 0 HG CYS A 14 14.431 -2.027 -4.463 1.00 41.43 H new ATOM 162 N GLU A 15 14.893 3.547 -4.783 1.00 4.23 N ATOM 163 CA GLU A 15 14.439 4.932 -4.767 1.00 1.52 C ATOM 164 C GLU A 15 12.952 5.023 -5.097 1.00 65.44 C ATOM 165 O GLU A 15 12.321 4.024 -5.442 1.00 33.33 O ATOM 166 CB GLU A 15 15.246 5.768 -5.764 1.00 60.11 C ATOM 167 CG GLU A 15 16.301 6.644 -5.111 1.00 10.14 C ATOM 168 CD GLU A 15 15.953 8.119 -5.169 1.00 21.10 C ATOM 169 OE1 GLU A 15 16.138 8.731 -6.242 1.00 22.44 O ATOM 170 OE2 GLU A 15 15.495 8.661 -4.141 1.00 2.32 O ATOM 0 H GLU A 15 15.259 3.233 -5.682 1.00 4.23 H new ATOM 0 HA GLU A 15 14.594 5.326 -3.763 1.00 1.52 H new ATOM 0 HB2 GLU A 15 15.731 5.100 -6.476 1.00 60.11 H new ATOM 0 HB3 GLU A 15 14.563 6.399 -6.332 1.00 60.11 H new ATOM 0 HG2 GLU A 15 16.423 6.344 -4.070 1.00 10.14 H new ATOM 0 HG3 GLU A 15 17.259 6.481 -5.604 1.00 10.14 H new ATOM 177 N VAL A 16 12.399 6.226 -4.989 1.00 42.10 N ATOM 178 CA VAL A 16 10.987 6.448 -5.277 1.00 33.54 C ATOM 179 C VAL A 16 10.802 7.131 -6.626 1.00 14.14 C ATOM 180 O VAL A 16 10.925 8.351 -6.738 1.00 34.03 O ATOM 181 CB VAL A 16 10.319 7.303 -4.183 1.00 45.02 C ATOM 182 CG1 VAL A 16 10.926 8.698 -4.152 1.00 34.45 C ATOM 183 CG2 VAL A 16 8.816 7.371 -4.406 1.00 1.44 C ATOM 0 H VAL A 16 12.908 7.063 -4.704 1.00 42.10 H new ATOM 0 HA VAL A 16 10.511 5.468 -5.302 1.00 33.54 H new ATOM 0 HB VAL A 16 10.499 6.833 -3.216 1.00 45.02 H new ATOM 0 HG11 VAL A 16 10.442 9.288 -3.374 1.00 34.45 H new ATOM 0 HG12 VAL A 16 11.993 8.626 -3.942 1.00 34.45 H new ATOM 0 HG13 VAL A 16 10.778 9.181 -5.118 1.00 34.45 H new ATOM 0 HG21 VAL A 16 8.359 7.979 -3.625 1.00 1.44 H new ATOM 0 HG22 VAL A 16 8.612 7.818 -5.379 1.00 1.44 H new ATOM 0 HG23 VAL A 16 8.398 6.365 -4.374 1.00 1.44 H new ATOM 193 N ASP A 17 10.505 6.337 -7.649 1.00 52.34 N ATOM 194 CA ASP A 17 10.300 6.867 -8.992 1.00 72.23 C ATOM 195 C ASP A 17 9.674 8.256 -8.940 1.00 0.42 C ATOM 196 O ASP A 17 8.791 8.536 -8.128 1.00 42.43 O ATOM 197 CB ASP A 17 9.411 5.923 -9.805 1.00 41.11 C ATOM 198 CG ASP A 17 9.361 6.297 -11.273 1.00 65.13 C ATOM 199 OD1 ASP A 17 8.495 7.116 -11.649 1.00 21.21 O ATOM 200 OD2 ASP A 17 10.187 5.771 -12.048 1.00 4.41 O ATOM 0 H ASP A 17 10.401 5.325 -7.574 1.00 52.34 H new ATOM 0 HA ASP A 17 11.273 6.946 -9.477 1.00 72.23 H new ATOM 0 HB2 ASP A 17 9.782 4.903 -9.705 1.00 41.11 H new ATOM 0 HB3 ASP A 17 8.401 5.936 -9.395 1.00 41.11 H new ATOM 205 N PRO A 18 10.140 9.150 -9.825 1.00 62.44 N ATOM 206 CA PRO A 18 9.641 10.526 -9.899 1.00 13.10 C ATOM 207 C PRO A 18 8.213 10.597 -10.433 1.00 24.22 C ATOM 208 O PRO A 18 7.450 11.490 -10.069 1.00 11.00 O ATOM 209 CB PRO A 18 10.609 11.203 -10.872 1.00 21.20 C ATOM 210 CG PRO A 18 11.136 10.094 -11.715 1.00 64.41 C ATOM 211 CD PRO A 18 11.191 8.885 -10.822 1.00 44.14 C ATOM 0 HA PRO A 18 9.602 10.998 -8.917 1.00 13.10 H new ATOM 0 HB2 PRO A 18 10.101 11.954 -11.478 1.00 21.20 H new ATOM 0 HB3 PRO A 18 11.413 11.713 -10.341 1.00 21.20 H new ATOM 0 HG2 PRO A 18 10.489 9.916 -12.574 1.00 64.41 H new ATOM 0 HG3 PRO A 18 12.125 10.336 -12.105 1.00 64.41 H new ATOM 0 HD2 PRO A 18 10.997 7.967 -11.376 1.00 44.14 H new ATOM 0 HD3 PRO A 18 12.170 8.775 -10.355 1.00 44.14 H new ATOM 219 N GLU A 19 7.862 9.648 -11.296 1.00 13.53 N ATOM 220 CA GLU A 19 6.525 9.605 -11.877 1.00 62.04 C ATOM 221 C GLU A 19 5.497 9.146 -10.848 1.00 65.52 C ATOM 222 O GLU A 19 4.316 9.483 -10.940 1.00 4.23 O ATOM 223 CB GLU A 19 6.503 8.670 -13.089 1.00 23.45 C ATOM 224 CG GLU A 19 6.145 7.234 -12.743 1.00 1.02 C ATOM 225 CD GLU A 19 4.724 6.878 -13.134 1.00 31.13 C ATOM 226 OE1 GLU A 19 3.811 7.682 -12.848 1.00 63.14 O ATOM 227 OE2 GLU A 19 4.523 5.796 -13.723 1.00 32.23 O ATOM 0 H GLU A 19 8.483 8.901 -11.607 1.00 13.53 H new ATOM 0 HA GLU A 19 6.264 10.613 -12.199 1.00 62.04 H new ATOM 0 HB2 GLU A 19 5.786 9.049 -13.817 1.00 23.45 H new ATOM 0 HB3 GLU A 19 7.482 8.686 -13.568 1.00 23.45 H new ATOM 0 HG2 GLU A 19 6.837 6.559 -13.247 1.00 1.02 H new ATOM 0 HG3 GLU A 19 6.273 7.079 -11.672 1.00 1.02 H new ATOM 234 N LEU A 20 5.955 8.373 -9.868 1.00 43.54 N ATOM 235 CA LEU A 20 5.076 7.866 -8.821 1.00 32.12 C ATOM 236 C LEU A 20 4.971 8.861 -7.670 1.00 34.34 C ATOM 237 O LEU A 20 3.901 9.046 -7.090 1.00 35.43 O ATOM 238 CB LEU A 20 5.590 6.522 -8.302 1.00 63.34 C ATOM 239 CG LEU A 20 4.528 5.548 -7.791 1.00 54.32 C ATOM 240 CD1 LEU A 20 5.175 4.266 -7.293 1.00 35.43 C ATOM 241 CD2 LEU A 20 3.699 6.193 -6.690 1.00 61.03 C ATOM 0 H LEU A 20 6.929 8.084 -9.777 1.00 43.54 H new ATOM 0 HA LEU A 20 4.084 7.727 -9.250 1.00 32.12 H new ATOM 0 HB2 LEU A 20 6.146 6.035 -9.103 1.00 63.34 H new ATOM 0 HB3 LEU A 20 6.297 6.714 -7.495 1.00 63.34 H new ATOM 0 HG LEU A 20 3.864 5.297 -8.618 1.00 54.32 H new ATOM 0 HD11 LEU A 20 4.404 3.585 -6.933 1.00 35.43 H new ATOM 0 HD12 LEU A 20 5.724 3.795 -8.109 1.00 35.43 H new ATOM 0 HD13 LEU A 20 5.863 4.498 -6.480 1.00 35.43 H new ATOM 0 HD21 LEU A 20 2.948 5.486 -6.338 1.00 61.03 H new ATOM 0 HD22 LEU A 20 4.350 6.474 -5.862 1.00 61.03 H new ATOM 0 HD23 LEU A 20 3.205 7.083 -7.080 1.00 61.03 H new ATOM 253 N LYS A 21 6.089 9.501 -7.343 1.00 52.14 N ATOM 254 CA LYS A 21 6.123 10.481 -6.264 1.00 24.50 C ATOM 255 C LYS A 21 4.938 11.437 -6.358 1.00 71.24 C ATOM 256 O LYS A 21 4.285 11.729 -5.358 1.00 11.33 O ATOM 257 CB LYS A 21 7.433 11.270 -6.305 1.00 44.03 C ATOM 258 CG LYS A 21 7.705 12.064 -5.040 1.00 4.12 C ATOM 259 CD LYS A 21 8.354 13.403 -5.350 1.00 23.11 C ATOM 260 CE LYS A 21 9.836 13.396 -5.009 1.00 22.23 C ATOM 261 NZ LYS A 21 10.291 14.712 -4.481 1.00 10.12 N ATOM 0 H LYS A 21 6.984 9.358 -7.811 1.00 52.14 H new ATOM 0 HA LYS A 21 6.059 9.944 -5.318 1.00 24.50 H new ATOM 0 HB2 LYS A 21 8.258 10.579 -6.474 1.00 44.03 H new ATOM 0 HB3 LYS A 21 7.410 11.953 -7.154 1.00 44.03 H new ATOM 0 HG2 LYS A 21 6.770 12.227 -4.504 1.00 4.12 H new ATOM 0 HG3 LYS A 21 8.354 11.488 -4.380 1.00 4.12 H new ATOM 0 HD2 LYS A 21 8.224 13.636 -6.407 1.00 23.11 H new ATOM 0 HD3 LYS A 21 7.854 14.190 -4.786 1.00 23.11 H new ATOM 0 HE2 LYS A 21 10.035 12.620 -4.270 1.00 22.23 H new ATOM 0 HE3 LYS A 21 10.412 13.143 -5.899 1.00 22.23 H new ATOM 0 HZ1 LYS A 21 11.306 14.665 -4.261 1.00 10.12 H new ATOM 0 HZ2 LYS A 21 10.125 15.449 -5.196 1.00 10.12 H new ATOM 0 HZ3 LYS A 21 9.760 14.942 -3.617 1.00 10.12 H new ATOM 275 N GLU A 22 4.667 11.918 -7.568 1.00 40.53 N ATOM 276 CA GLU A 22 3.560 12.840 -7.792 1.00 41.20 C ATOM 277 C GLU A 22 2.221 12.159 -7.525 1.00 23.13 C ATOM 278 O GLU A 22 1.352 12.714 -6.852 1.00 32.30 O ATOM 279 CB GLU A 22 3.595 13.376 -9.224 1.00 62.45 C ATOM 280 CG GLU A 22 4.983 13.792 -9.685 1.00 71.43 C ATOM 281 CD GLU A 22 4.945 14.868 -10.752 1.00 54.20 C ATOM 282 OE1 GLU A 22 4.025 14.834 -11.597 1.00 64.21 O ATOM 283 OE2 GLU A 22 5.834 15.744 -10.744 1.00 25.22 O ATOM 0 H GLU A 22 5.198 11.685 -8.407 1.00 40.53 H new ATOM 0 HA GLU A 22 3.669 13.673 -7.097 1.00 41.20 H new ATOM 0 HB2 GLU A 22 3.211 12.611 -9.899 1.00 62.45 H new ATOM 0 HB3 GLU A 22 2.925 14.232 -9.299 1.00 62.45 H new ATOM 0 HG2 GLU A 22 5.553 14.154 -8.829 1.00 71.43 H new ATOM 0 HG3 GLU A 22 5.510 12.920 -10.072 1.00 71.43 H new ATOM 290 N THR A 23 2.063 10.951 -8.057 1.00 12.53 N ATOM 291 CA THR A 23 0.830 10.193 -7.878 1.00 0.21 C ATOM 292 C THR A 23 0.389 10.197 -6.418 1.00 51.35 C ATOM 293 O THR A 23 -0.787 10.404 -6.115 1.00 3.12 O ATOM 294 CB THR A 23 0.994 8.736 -8.349 1.00 73.12 C ATOM 295 OG1 THR A 23 0.951 8.677 -9.780 1.00 74.31 O ATOM 296 CG2 THR A 23 -0.101 7.853 -7.767 1.00 43.35 C ATOM 0 H THR A 23 2.773 10.477 -8.615 1.00 12.53 H new ATOM 0 HA THR A 23 0.068 10.680 -8.486 1.00 0.21 H new ATOM 0 HB THR A 23 1.959 8.370 -7.999 1.00 73.12 H new ATOM 0 HG1 THR A 23 1.058 7.748 -10.072 1.00 74.31 H new ATOM 0 HG21 THR A 23 0.035 6.829 -8.113 1.00 43.35 H new ATOM 0 HG22 THR A 23 -0.049 7.878 -6.679 1.00 43.35 H new ATOM 0 HG23 THR A 23 -1.075 8.219 -8.092 1.00 43.35 H new ATOM 304 N LEU A 24 1.339 9.967 -5.518 1.00 14.31 N ATOM 305 CA LEU A 24 1.047 9.945 -4.089 1.00 45.44 C ATOM 306 C LEU A 24 0.564 11.310 -3.610 1.00 50.33 C ATOM 307 O LEU A 24 -0.479 11.419 -2.966 1.00 13.14 O ATOM 308 CB LEU A 24 2.292 9.527 -3.303 1.00 13.14 C ATOM 309 CG LEU A 24 3.036 8.298 -3.826 1.00 14.22 C ATOM 310 CD1 LEU A 24 4.246 7.996 -2.956 1.00 31.31 C ATOM 311 CD2 LEU A 24 2.104 7.096 -3.884 1.00 2.33 C ATOM 0 H LEU A 24 2.316 9.793 -5.752 1.00 14.31 H new ATOM 0 HA LEU A 24 0.253 9.219 -3.916 1.00 45.44 H new ATOM 0 HB2 LEU A 24 2.986 10.367 -3.287 1.00 13.14 H new ATOM 0 HB3 LEU A 24 1.998 9.337 -2.271 1.00 13.14 H new ATOM 0 HG LEU A 24 3.386 8.511 -4.836 1.00 14.22 H new ATOM 0 HD11 LEU A 24 4.763 7.118 -3.344 1.00 31.31 H new ATOM 0 HD12 LEU A 24 4.923 8.850 -2.966 1.00 31.31 H new ATOM 0 HD13 LEU A 24 3.920 7.803 -1.934 1.00 31.31 H new ATOM 0 HD21 LEU A 24 2.650 6.230 -4.258 1.00 2.33 H new ATOM 0 HD22 LEU A 24 1.724 6.881 -2.885 1.00 2.33 H new ATOM 0 HD23 LEU A 24 1.269 7.315 -4.550 1.00 2.33 H new ATOM 323 N ARG A 25 1.329 12.349 -3.931 1.00 51.22 N ATOM 324 CA ARG A 25 0.977 13.708 -3.535 1.00 24.15 C ATOM 325 C ARG A 25 -0.387 14.102 -4.094 1.00 64.51 C ATOM 326 O ARG A 25 -1.076 14.954 -3.534 1.00 53.24 O ATOM 327 CB ARG A 25 2.043 14.694 -4.018 1.00 11.23 C ATOM 328 CG ARG A 25 1.884 16.091 -3.442 1.00 1.10 C ATOM 329 CD ARG A 25 2.877 17.064 -4.060 1.00 1.14 C ATOM 330 NE ARG A 25 2.211 18.212 -4.670 1.00 61.23 N ATOM 331 CZ ARG A 25 1.462 19.074 -3.992 1.00 44.41 C ATOM 332 NH1 ARG A 25 1.287 18.920 -2.687 1.00 12.20 N ATOM 333 NH2 ARG A 25 0.890 20.093 -4.618 1.00 52.24 N ATOM 0 H ARG A 25 2.196 12.276 -4.464 1.00 51.22 H new ATOM 0 HA ARG A 25 0.927 13.741 -2.447 1.00 24.15 H new ATOM 0 HB2 ARG A 25 3.028 14.310 -3.752 1.00 11.23 H new ATOM 0 HB3 ARG A 25 2.006 14.752 -5.106 1.00 11.23 H new ATOM 0 HG2 ARG A 25 0.868 16.445 -3.618 1.00 1.10 H new ATOM 0 HG3 ARG A 25 2.028 16.059 -2.362 1.00 1.10 H new ATOM 0 HD2 ARG A 25 3.569 17.412 -3.293 1.00 1.14 H new ATOM 0 HD3 ARG A 25 3.470 16.546 -4.814 1.00 1.14 H new ATOM 0 HE ARG A 25 2.328 18.360 -5.672 1.00 61.23 H new ATOM 0 HH11 ARG A 25 1.728 18.138 -2.202 1.00 12.20 H new ATOM 0 HH12 ARG A 25 0.711 19.583 -2.168 1.00 12.20 H new ATOM 0 HH21 ARG A 25 1.025 20.216 -5.622 1.00 52.24 H new ATOM 0 HH22 ARG A 25 0.315 20.754 -4.096 1.00 52.24 H new ATOM 347 N LYS A 26 -0.769 13.476 -5.201 1.00 51.13 N ATOM 348 CA LYS A 26 -2.051 13.760 -5.837 1.00 65.20 C ATOM 349 C LYS A 26 -3.162 12.915 -5.221 1.00 64.05 C ATOM 350 O LYS A 26 -4.281 13.389 -5.030 1.00 15.31 O ATOM 351 CB LYS A 26 -1.966 13.493 -7.341 1.00 53.23 C ATOM 352 CG LYS A 26 -0.670 13.971 -7.973 1.00 75.21 C ATOM 353 CD LYS A 26 -0.925 15.006 -9.055 1.00 15.34 C ATOM 354 CE LYS A 26 0.061 14.866 -10.204 1.00 65.03 C ATOM 355 NZ LYS A 26 -0.629 14.797 -11.521 1.00 64.23 N ATOM 0 H LYS A 26 -0.210 12.768 -5.677 1.00 51.13 H new ATOM 0 HA LYS A 26 -2.286 14.812 -5.674 1.00 65.20 H new ATOM 0 HB2 LYS A 26 -2.073 12.423 -7.518 1.00 53.23 H new ATOM 0 HB3 LYS A 26 -2.804 13.983 -7.836 1.00 53.23 H new ATOM 0 HG2 LYS A 26 -0.026 14.398 -7.205 1.00 75.21 H new ATOM 0 HG3 LYS A 26 -0.137 13.121 -8.400 1.00 75.21 H new ATOM 0 HD2 LYS A 26 -1.942 14.897 -9.432 1.00 15.34 H new ATOM 0 HD3 LYS A 26 -0.849 16.006 -8.628 1.00 15.34 H new ATOM 0 HE2 LYS A 26 0.748 15.712 -10.198 1.00 65.03 H new ATOM 0 HE3 LYS A 26 0.661 13.967 -10.061 1.00 65.03 H new ATOM 0 HZ1 LYS A 26 0.077 14.702 -12.278 1.00 64.23 H new ATOM 0 HZ2 LYS A 26 -1.266 13.975 -11.536 1.00 64.23 H new ATOM 0 HZ3 LYS A 26 -1.181 15.666 -11.670 1.00 64.23 H new ATOM 369 N PHE A 27 -2.845 11.662 -4.913 1.00 25.12 N ATOM 370 CA PHE A 27 -3.817 10.752 -4.319 1.00 21.04 C ATOM 371 C PHE A 27 -4.311 11.285 -2.977 1.00 35.14 C ATOM 372 O PHE A 27 -5.463 11.071 -2.598 1.00 34.40 O ATOM 373 CB PHE A 27 -3.200 9.364 -4.133 1.00 72.20 C ATOM 374 CG PHE A 27 -4.219 8.264 -4.041 1.00 22.20 C ATOM 375 CD1 PHE A 27 -5.267 8.194 -4.944 1.00 12.53 C ATOM 376 CD2 PHE A 27 -4.126 7.297 -3.051 1.00 72.25 C ATOM 377 CE1 PHE A 27 -6.206 7.184 -4.861 1.00 24.45 C ATOM 378 CE2 PHE A 27 -5.062 6.283 -2.965 1.00 4.03 C ATOM 379 CZ PHE A 27 -6.102 6.226 -3.871 1.00 45.02 C ATOM 0 H PHE A 27 -1.923 11.254 -5.065 1.00 25.12 H new ATOM 0 HA PHE A 27 -4.668 10.676 -4.996 1.00 21.04 H new ATOM 0 HB2 PHE A 27 -2.529 9.158 -4.967 1.00 72.20 H new ATOM 0 HB3 PHE A 27 -2.593 9.363 -3.228 1.00 72.20 H new ATOM 0 HD1 PHE A 27 -5.351 8.938 -5.722 1.00 12.53 H new ATOM 0 HD2 PHE A 27 -3.314 7.337 -2.340 1.00 72.25 H new ATOM 0 HE1 PHE A 27 -7.020 7.143 -5.569 1.00 24.45 H new ATOM 0 HE2 PHE A 27 -4.980 5.536 -2.189 1.00 4.03 H new ATOM 0 HZ PHE A 27 -6.833 5.434 -3.806 1.00 45.02 H new ATOM 389 N ARG A 28 -3.432 11.980 -2.263 1.00 55.30 N ATOM 390 CA ARG A 28 -3.778 12.542 -0.963 1.00 63.10 C ATOM 391 C ARG A 28 -4.658 13.778 -1.122 1.00 55.13 C ATOM 392 O ARG A 28 -5.468 14.092 -0.250 1.00 52.54 O ATOM 393 CB ARG A 28 -2.510 12.903 -0.186 1.00 72.51 C ATOM 394 CG ARG A 28 -1.363 11.931 -0.408 1.00 74.40 C ATOM 395 CD ARG A 28 -0.744 11.489 0.909 1.00 22.35 C ATOM 396 NE ARG A 28 -0.126 12.602 1.624 1.00 11.24 N ATOM 397 CZ ARG A 28 -0.720 13.260 2.614 1.00 63.12 C ATOM 398 NH1 ARG A 28 -1.940 12.917 3.005 1.00 44.14 N ATOM 399 NH2 ARG A 28 -0.093 14.263 3.216 1.00 62.42 N ATOM 0 H ARG A 28 -2.475 12.167 -2.563 1.00 55.30 H new ATOM 0 HA ARG A 28 -4.336 11.789 -0.406 1.00 63.10 H new ATOM 0 HB2 ARG A 28 -2.189 13.903 -0.476 1.00 72.51 H new ATOM 0 HB3 ARG A 28 -2.744 12.939 0.878 1.00 72.51 H new ATOM 0 HG2 ARG A 28 -1.724 11.058 -0.952 1.00 74.40 H new ATOM 0 HG3 ARG A 28 -0.601 12.401 -1.030 1.00 74.40 H new ATOM 0 HD2 ARG A 28 -1.512 11.037 1.537 1.00 22.35 H new ATOM 0 HD3 ARG A 28 0.005 10.720 0.718 1.00 22.35 H new ATOM 0 HE ARG A 28 0.813 12.890 1.349 1.00 11.24 H new ATOM 0 HH11 ARG A 28 -2.425 12.146 2.546 1.00 44.14 H new ATOM 0 HH12 ARG A 28 -2.393 13.424 3.765 1.00 44.14 H new ATOM 0 HH21 ARG A 28 0.846 14.529 2.919 1.00 62.42 H new ATOM 0 HH22 ARG A 28 -0.550 14.767 3.976 1.00 62.42 H new ATOM 413 N PHE A 29 -4.493 14.476 -2.240 1.00 42.22 N ATOM 414 CA PHE A 29 -5.270 15.680 -2.514 1.00 71.40 C ATOM 415 C PHE A 29 -5.923 15.604 -3.891 1.00 70.33 C ATOM 416 O PHE A 29 -5.991 16.599 -4.613 1.00 31.23 O ATOM 417 CB PHE A 29 -4.379 16.920 -2.426 1.00 44.04 C ATOM 418 CG PHE A 29 -3.158 16.721 -1.574 1.00 51.42 C ATOM 419 CD1 PHE A 29 -3.273 16.267 -0.270 1.00 75.33 C ATOM 420 CD2 PHE A 29 -1.895 16.992 -2.076 1.00 62.10 C ATOM 421 CE1 PHE A 29 -2.153 16.084 0.517 1.00 72.21 C ATOM 422 CE2 PHE A 29 -0.771 16.810 -1.294 1.00 21.33 C ATOM 423 CZ PHE A 29 -0.899 16.357 0.005 1.00 73.23 C ATOM 0 H PHE A 29 -3.827 14.229 -2.972 1.00 42.22 H new ATOM 0 HA PHE A 29 -6.056 15.754 -1.762 1.00 71.40 H new ATOM 0 HB2 PHE A 29 -4.068 17.207 -3.431 1.00 44.04 H new ATOM 0 HB3 PHE A 29 -4.962 17.749 -2.024 1.00 44.04 H new ATOM 0 HD1 PHE A 29 -4.251 16.054 0.136 1.00 75.33 H new ATOM 0 HD2 PHE A 29 -1.788 17.349 -3.090 1.00 62.10 H new ATOM 0 HE1 PHE A 29 -2.257 15.728 1.531 1.00 72.21 H new ATOM 0 HE2 PHE A 29 0.208 17.022 -1.698 1.00 21.33 H new ATOM 0 HZ PHE A 29 -0.021 16.217 0.618 1.00 73.23 H new ATOM 433 N ARG A 30 -6.402 14.417 -4.247 1.00 72.34 N ATOM 434 CA ARG A 30 -7.047 14.210 -5.539 1.00 15.12 C ATOM 435 C ARG A 30 -8.431 14.854 -5.564 1.00 5.30 C ATOM 436 O ARG A 30 -8.923 15.336 -4.544 1.00 25.55 O ATOM 437 CB ARG A 30 -7.165 12.715 -5.840 1.00 74.24 C ATOM 438 CG ARG A 30 -7.956 11.942 -4.797 1.00 51.32 C ATOM 439 CD ARG A 30 -7.568 10.472 -4.779 1.00 3.04 C ATOM 440 NE ARG A 30 -8.718 9.599 -4.998 1.00 43.44 N ATOM 441 CZ ARG A 30 -9.606 9.304 -4.056 1.00 54.00 C ATOM 442 NH1 ARG A 30 -9.477 9.808 -2.836 1.00 52.25 N ATOM 443 NH2 ARG A 30 -10.626 8.502 -4.333 1.00 54.11 N ATOM 0 H ARG A 30 -6.356 13.584 -3.660 1.00 72.34 H new ATOM 0 HA ARG A 30 -6.430 14.681 -6.305 1.00 15.12 H new ATOM 0 HB2 ARG A 30 -7.640 12.586 -6.813 1.00 74.24 H new ATOM 0 HB3 ARG A 30 -6.165 12.288 -5.914 1.00 74.24 H new ATOM 0 HG2 ARG A 30 -7.784 12.377 -3.812 1.00 51.32 H new ATOM 0 HG3 ARG A 30 -9.022 12.035 -5.005 1.00 51.32 H new ATOM 0 HD2 ARG A 30 -6.820 10.285 -5.549 1.00 3.04 H new ATOM 0 HD3 ARG A 30 -7.107 10.231 -3.821 1.00 3.04 H new ATOM 0 HE ARG A 30 -8.846 9.194 -5.925 1.00 43.44 H new ATOM 0 HH11 ARG A 30 -8.694 10.424 -2.619 1.00 52.25 H new ATOM 0 HH12 ARG A 30 -10.161 9.579 -2.115 1.00 52.25 H new ATOM 0 HH21 ARG A 30 -10.728 8.112 -5.270 1.00 54.11 H new ATOM 0 HH22 ARG A 30 -11.308 8.276 -3.609 1.00 54.11 H new ATOM 508 N ASN A 34 -14.295 8.896 -3.482 1.00 31.42 N ATOM 509 CA ASN A 34 -14.610 7.480 -3.331 1.00 65.53 C ATOM 510 C ASN A 34 -13.387 6.698 -2.860 1.00 3.30 C ATOM 511 O ASN A 34 -12.345 7.278 -2.559 1.00 11.42 O ATOM 512 CB ASN A 34 -15.117 6.904 -4.655 1.00 52.22 C ATOM 513 CG ASN A 34 -14.365 7.456 -5.851 1.00 3.20 C ATOM 514 OD1 ASN A 34 -13.711 6.574 -6.597 1.00 2.23 O flip ATOM 515 ND2 ASN A 34 -14.373 8.662 -6.101 1.00 42.20 N flip ATOM 0 HA ASN A 34 -15.393 7.386 -2.578 1.00 65.53 H new ATOM 0 HB2 ASN A 34 -15.019 5.819 -4.637 1.00 52.22 H new ATOM 0 HB3 ASN A 34 -16.179 7.127 -4.762 1.00 52.22 H new ATOM 0 HD21 ASN A 34 -14.890 9.304 -5.500 1.00 42.20 H new ATOM 0 HD22 ASN A 34 -13.863 9.019 -6.909 1.00 42.20 H new ATOM 522 N ASN A 35 -13.522 5.377 -2.801 1.00 52.10 N ATOM 523 CA ASN A 35 -12.428 4.515 -2.367 1.00 3.42 C ATOM 524 C ASN A 35 -11.581 4.071 -3.556 1.00 32.13 C ATOM 525 O ASN A 35 -12.099 3.532 -4.532 1.00 52.34 O ATOM 526 CB ASN A 35 -12.977 3.291 -1.631 1.00 41.15 C ATOM 527 CG ASN A 35 -13.542 3.641 -0.268 1.00 70.34 C ATOM 528 OD1 ASN A 35 -13.301 4.729 0.255 1.00 32.22 O ATOM 529 ND2 ASN A 35 -14.299 2.717 0.313 1.00 50.54 N ATOM 0 H ASN A 35 -14.378 4.880 -3.048 1.00 52.10 H new ATOM 0 HA ASN A 35 -11.796 5.086 -1.687 1.00 3.42 H new ATOM 0 HB2 ASN A 35 -13.756 2.826 -2.236 1.00 41.15 H new ATOM 0 HB3 ASN A 35 -12.182 2.554 -1.514 1.00 41.15 H new ATOM 0 HD21 ASN A 35 -14.708 2.895 1.230 1.00 50.54 H new ATOM 0 HD22 ASN A 35 -14.472 1.829 -0.158 1.00 50.54 H new ATOM 536 N ALA A 36 -10.275 4.301 -3.463 1.00 21.22 N ATOM 537 CA ALA A 36 -9.356 3.923 -4.529 1.00 3.01 C ATOM 538 C ALA A 36 -8.110 3.249 -3.965 1.00 64.31 C ATOM 539 O ALA A 36 -7.833 3.336 -2.769 1.00 43.32 O ATOM 540 CB ALA A 36 -8.972 5.143 -5.353 1.00 34.52 C ATOM 0 H ALA A 36 -9.830 4.747 -2.661 1.00 21.22 H new ATOM 0 HA ALA A 36 -9.863 3.207 -5.176 1.00 3.01 H new ATOM 0 HB1 ALA A 36 -8.285 4.845 -6.145 1.00 34.52 H new ATOM 0 HB2 ALA A 36 -9.867 5.581 -5.794 1.00 34.52 H new ATOM 0 HB3 ALA A 36 -8.488 5.878 -4.710 1.00 34.52 H new ATOM 546 N ALA A 37 -7.361 2.577 -4.834 1.00 41.41 N ATOM 547 CA ALA A 37 -6.144 1.890 -4.423 1.00 21.14 C ATOM 548 C ALA A 37 -5.027 2.094 -5.441 1.00 12.33 C ATOM 549 O ALA A 37 -5.284 2.240 -6.637 1.00 20.20 O ATOM 550 CB ALA A 37 -6.415 0.407 -4.225 1.00 74.41 C ATOM 0 H ALA A 37 -7.577 2.494 -5.827 1.00 41.41 H new ATOM 0 HA ALA A 37 -5.819 2.318 -3.475 1.00 21.14 H new ATOM 0 HB1 ALA A 37 -5.496 -0.093 -3.918 1.00 74.41 H new ATOM 0 HB2 ALA A 37 -7.175 0.276 -3.454 1.00 74.41 H new ATOM 0 HB3 ALA A 37 -6.769 -0.026 -5.161 1.00 74.41 H new ATOM 556 N ILE A 38 -3.788 2.105 -4.960 1.00 53.04 N ATOM 557 CA ILE A 38 -2.634 2.291 -5.829 1.00 22.10 C ATOM 558 C ILE A 38 -1.551 1.258 -5.534 1.00 75.42 C ATOM 559 O ILE A 38 -0.878 1.326 -4.506 1.00 4.11 O ATOM 560 CB ILE A 38 -2.035 3.702 -5.677 1.00 20.41 C ATOM 561 CG1 ILE A 38 -3.129 4.761 -5.821 1.00 41.31 C ATOM 562 CG2 ILE A 38 -0.935 3.925 -6.704 1.00 15.23 C ATOM 563 CD1 ILE A 38 -2.592 6.165 -5.990 1.00 1.31 C ATOM 0 H ILE A 38 -3.559 1.987 -3.973 1.00 53.04 H new ATOM 0 HA ILE A 38 -2.987 2.163 -6.852 1.00 22.10 H new ATOM 0 HB ILE A 38 -1.598 3.790 -4.682 1.00 20.41 H new ATOM 0 HG12 ILE A 38 -3.752 4.513 -6.680 1.00 41.31 H new ATOM 0 HG13 ILE A 38 -3.772 4.730 -4.941 1.00 41.31 H new ATOM 0 HG21 ILE A 38 -0.522 4.927 -6.583 1.00 15.23 H new ATOM 0 HG22 ILE A 38 -0.146 3.187 -6.558 1.00 15.23 H new ATOM 0 HG23 ILE A 38 -1.348 3.821 -7.708 1.00 15.23 H new ATOM 0 HD11 ILE A 38 -3.423 6.863 -6.086 1.00 1.31 H new ATOM 0 HD12 ILE A 38 -1.992 6.432 -5.120 1.00 1.31 H new ATOM 0 HD13 ILE A 38 -1.973 6.212 -6.886 1.00 1.31 H new ATOM 575 N ILE A 39 -1.389 0.303 -6.444 1.00 20.30 N ATOM 576 CA ILE A 39 -0.387 -0.743 -6.283 1.00 51.14 C ATOM 577 C ILE A 39 0.918 -0.364 -6.974 1.00 22.34 C ATOM 578 O ILE A 39 0.965 -0.208 -8.194 1.00 35.05 O ATOM 579 CB ILE A 39 -0.881 -2.089 -6.847 1.00 32.13 C ATOM 580 CG1 ILE A 39 -2.235 -2.455 -6.236 1.00 32.44 C ATOM 581 CG2 ILE A 39 0.141 -3.183 -6.578 1.00 60.30 C ATOM 582 CD1 ILE A 39 -3.192 -3.088 -7.222 1.00 2.11 C ATOM 0 H ILE A 39 -1.939 0.232 -7.300 1.00 20.30 H new ATOM 0 HA ILE A 39 -0.212 -0.850 -5.212 1.00 51.14 H new ATOM 0 HB ILE A 39 -1.004 -1.992 -7.926 1.00 32.13 H new ATOM 0 HG12 ILE A 39 -2.076 -3.142 -5.405 1.00 32.44 H new ATOM 0 HG13 ILE A 39 -2.693 -1.556 -5.823 1.00 32.44 H new ATOM 0 HG21 ILE A 39 -0.222 -4.128 -6.982 1.00 60.30 H new ATOM 0 HG22 ILE A 39 1.086 -2.923 -7.055 1.00 60.30 H new ATOM 0 HG23 ILE A 39 0.293 -3.283 -5.503 1.00 60.30 H new ATOM 0 HD11 ILE A 39 -4.131 -3.321 -6.720 1.00 2.11 H new ATOM 0 HD12 ILE A 39 -3.381 -2.395 -8.042 1.00 2.11 H new ATOM 0 HD13 ILE A 39 -2.754 -4.005 -7.616 1.00 2.11 H new ATOM 594 N MET A 40 1.979 -0.220 -6.186 1.00 71.30 N ATOM 595 CA MET A 40 3.287 0.138 -6.723 1.00 33.43 C ATOM 596 C MET A 40 4.250 -1.043 -6.638 1.00 50.22 C ATOM 597 O MET A 40 4.118 -1.905 -5.769 1.00 1.43 O ATOM 598 CB MET A 40 3.862 1.336 -5.965 1.00 64.33 C ATOM 599 CG MET A 40 2.844 2.434 -5.701 1.00 25.40 C ATOM 600 SD MET A 40 3.117 3.268 -4.127 1.00 3.35 S ATOM 601 CE MET A 40 1.596 2.874 -3.267 1.00 41.03 C ATOM 0 H MET A 40 1.959 -0.346 -5.174 1.00 71.30 H new ATOM 0 HA MET A 40 3.161 0.407 -7.772 1.00 33.43 H new ATOM 0 HB2 MET A 40 4.269 0.992 -5.014 1.00 64.33 H new ATOM 0 HB3 MET A 40 4.693 1.752 -6.535 1.00 64.33 H new ATOM 0 HG2 MET A 40 2.887 3.166 -6.508 1.00 25.40 H new ATOM 0 HG3 MET A 40 1.842 2.006 -5.712 1.00 25.40 H new ATOM 0 HE1 MET A 40 1.762 2.929 -2.191 1.00 41.03 H new ATOM 0 HE2 MET A 40 0.822 3.586 -3.552 1.00 41.03 H new ATOM 0 HE3 MET A 40 1.278 1.866 -3.534 1.00 41.03 H new ATOM 611 N LYS A 41 5.218 -1.076 -7.548 1.00 30.34 N ATOM 612 CA LYS A 41 6.205 -2.150 -7.576 1.00 75.11 C ATOM 613 C LYS A 41 7.620 -1.586 -7.635 1.00 25.01 C ATOM 614 O LYS A 41 7.814 -0.372 -7.704 1.00 52.10 O ATOM 615 CB LYS A 41 5.958 -3.064 -8.778 1.00 63.34 C ATOM 616 CG LYS A 41 6.403 -2.465 -10.101 1.00 4.02 C ATOM 617 CD LYS A 41 7.264 -3.435 -10.891 1.00 5.45 C ATOM 618 CE LYS A 41 6.954 -3.373 -12.379 1.00 13.55 C ATOM 619 NZ LYS A 41 7.792 -4.322 -13.161 1.00 73.45 N ATOM 0 H LYS A 41 5.340 -0.372 -8.276 1.00 30.34 H new ATOM 0 HA LYS A 41 6.102 -2.730 -6.659 1.00 75.11 H new ATOM 0 HB2 LYS A 41 6.483 -4.006 -8.621 1.00 63.34 H new ATOM 0 HB3 LYS A 41 4.895 -3.297 -8.834 1.00 63.34 H new ATOM 0 HG2 LYS A 41 5.528 -2.191 -10.690 1.00 4.02 H new ATOM 0 HG3 LYS A 41 6.962 -1.548 -9.916 1.00 4.02 H new ATOM 0 HD2 LYS A 41 8.317 -3.204 -10.728 1.00 5.45 H new ATOM 0 HD3 LYS A 41 7.100 -4.449 -10.526 1.00 5.45 H new ATOM 0 HE2 LYS A 41 5.900 -3.602 -12.540 1.00 13.55 H new ATOM 0 HE3 LYS A 41 7.119 -2.359 -12.742 1.00 13.55 H new ATOM 0 HZ1 LYS A 41 7.318 -4.544 -14.060 1.00 73.45 H new ATOM 0 HZ2 LYS A 41 8.718 -3.889 -13.355 1.00 73.45 H new ATOM 0 HZ3 LYS A 41 7.927 -5.197 -12.615 1.00 73.45 H new ATOM 633 N VAL A 42 8.609 -2.475 -7.607 1.00 74.34 N ATOM 634 CA VAL A 42 10.007 -2.066 -7.660 1.00 40.12 C ATOM 635 C VAL A 42 10.763 -2.832 -8.741 1.00 34.03 C ATOM 636 O VAL A 42 10.958 -4.043 -8.637 1.00 12.45 O ATOM 637 CB VAL A 42 10.707 -2.285 -6.307 1.00 13.34 C ATOM 638 CG1 VAL A 42 10.128 -3.499 -5.596 1.00 2.21 C ATOM 639 CG2 VAL A 42 12.208 -2.436 -6.501 1.00 63.34 C ATOM 0 H VAL A 42 8.467 -3.483 -7.548 1.00 74.34 H new ATOM 0 HA VAL A 42 10.017 -1.002 -7.898 1.00 40.12 H new ATOM 0 HB VAL A 42 10.531 -1.410 -5.682 1.00 13.34 H new ATOM 0 HG11 VAL A 42 10.635 -3.638 -4.641 1.00 2.21 H new ATOM 0 HG12 VAL A 42 9.063 -3.345 -5.422 1.00 2.21 H new ATOM 0 HG13 VAL A 42 10.270 -4.385 -6.215 1.00 2.21 H new ATOM 0 HG21 VAL A 42 12.686 -2.590 -5.534 1.00 63.34 H new ATOM 0 HG22 VAL A 42 12.407 -3.293 -7.145 1.00 63.34 H new ATOM 0 HG23 VAL A 42 12.608 -1.534 -6.964 1.00 63.34 H new ATOM 649 N ASP A 43 11.187 -2.117 -9.777 1.00 75.23 N ATOM 650 CA ASP A 43 11.923 -2.729 -10.878 1.00 2.23 C ATOM 651 C ASP A 43 13.372 -2.992 -10.481 1.00 44.42 C ATOM 652 O ASP A 43 14.162 -2.060 -10.320 1.00 32.12 O ATOM 653 CB ASP A 43 11.874 -1.830 -12.114 1.00 63.44 C ATOM 654 CG ASP A 43 10.587 -1.993 -12.898 1.00 1.11 C ATOM 655 OD1 ASP A 43 9.947 -3.058 -12.772 1.00 74.23 O ATOM 656 OD2 ASP A 43 10.219 -1.056 -13.638 1.00 24.41 O ATOM 0 H ASP A 43 11.034 -1.114 -9.878 1.00 75.23 H new ATOM 0 HA ASP A 43 11.451 -3.683 -11.114 1.00 2.23 H new ATOM 0 HB2 ASP A 43 11.980 -0.789 -11.807 1.00 63.44 H new ATOM 0 HB3 ASP A 43 12.721 -2.059 -12.760 1.00 63.44 H new ATOM 661 N LYS A 44 13.716 -4.265 -10.324 1.00 60.45 N ATOM 662 CA LYS A 44 15.071 -4.652 -9.947 1.00 70.34 C ATOM 663 C LYS A 44 16.089 -4.111 -10.946 1.00 13.35 C ATOM 664 O LYS A 44 17.256 -3.907 -10.607 1.00 12.20 O ATOM 665 CB LYS A 44 15.184 -6.176 -9.863 1.00 54.44 C ATOM 666 CG LYS A 44 16.579 -6.665 -9.518 1.00 51.24 C ATOM 667 CD LYS A 44 17.073 -7.696 -10.520 1.00 0.12 C ATOM 668 CE LYS A 44 18.222 -8.517 -9.955 1.00 11.13 C ATOM 669 NZ LYS A 44 18.903 -9.316 -11.010 1.00 65.54 N ATOM 0 H LYS A 44 13.075 -5.048 -10.452 1.00 60.45 H new ATOM 0 HA LYS A 44 15.285 -4.223 -8.968 1.00 70.34 H new ATOM 0 HB2 LYS A 44 14.484 -6.543 -9.113 1.00 54.44 H new ATOM 0 HB3 LYS A 44 14.883 -6.607 -10.818 1.00 54.44 H new ATOM 0 HG2 LYS A 44 17.267 -5.820 -9.496 1.00 51.24 H new ATOM 0 HG3 LYS A 44 16.576 -7.100 -8.519 1.00 51.24 H new ATOM 0 HD2 LYS A 44 16.253 -8.358 -10.796 1.00 0.12 H new ATOM 0 HD3 LYS A 44 17.397 -7.193 -11.431 1.00 0.12 H new ATOM 0 HE2 LYS A 44 18.944 -7.853 -9.480 1.00 11.13 H new ATOM 0 HE3 LYS A 44 17.845 -9.185 -9.180 1.00 11.13 H new ATOM 0 HZ1 LYS A 44 19.680 -9.861 -10.585 1.00 65.54 H new ATOM 0 HZ2 LYS A 44 18.220 -9.968 -11.447 1.00 65.54 H new ATOM 0 HZ3 LYS A 44 19.285 -8.678 -11.737 1.00 65.54 H new ATOM 683 N ASP A 45 15.641 -3.879 -12.175 1.00 2.14 N ATOM 684 CA ASP A 45 16.513 -3.358 -13.220 1.00 70.14 C ATOM 685 C ASP A 45 16.906 -1.913 -12.931 1.00 53.33 C ATOM 686 O ASP A 45 18.060 -1.524 -13.114 1.00 14.02 O ATOM 687 CB ASP A 45 15.822 -3.449 -14.582 1.00 4.14 C ATOM 688 CG ASP A 45 16.327 -4.614 -15.411 1.00 3.31 C ATOM 689 OD1 ASP A 45 15.902 -5.758 -15.147 1.00 21.00 O ATOM 690 OD2 ASP A 45 17.149 -4.382 -16.323 1.00 11.21 O ATOM 0 H ASP A 45 14.679 -4.044 -12.472 1.00 2.14 H new ATOM 0 HA ASP A 45 17.419 -3.964 -13.239 1.00 70.14 H new ATOM 0 HB2 ASP A 45 14.747 -3.551 -14.435 1.00 4.14 H new ATOM 0 HB3 ASP A 45 15.982 -2.521 -15.130 1.00 4.14 H new ATOM 695 N ARG A 46 15.939 -1.121 -12.480 1.00 75.34 N ATOM 696 CA ARG A 46 16.183 0.282 -12.168 1.00 72.03 C ATOM 697 C ARG A 46 16.201 0.509 -10.660 1.00 34.52 C ATOM 698 O ARG A 46 16.226 1.648 -10.194 1.00 33.34 O ATOM 699 CB ARG A 46 15.113 1.164 -12.814 1.00 71.01 C ATOM 700 CG ARG A 46 14.956 0.934 -14.308 1.00 55.34 C ATOM 701 CD ARG A 46 13.740 1.663 -14.859 1.00 73.02 C ATOM 702 NE ARG A 46 14.113 2.749 -15.760 1.00 42.32 N ATOM 703 CZ ARG A 46 13.296 3.261 -16.674 1.00 1.33 C ATOM 704 NH1 ARG A 46 12.065 2.788 -16.805 1.00 62.34 N ATOM 705 NH2 ARG A 46 13.710 4.250 -17.456 1.00 73.55 N ATOM 0 H ARG A 46 14.979 -1.427 -12.322 1.00 75.34 H new ATOM 0 HA ARG A 46 17.159 0.553 -12.570 1.00 72.03 H new ATOM 0 HB2 ARG A 46 14.157 0.979 -12.324 1.00 71.01 H new ATOM 0 HB3 ARG A 46 15.363 2.211 -12.640 1.00 71.01 H new ATOM 0 HG2 ARG A 46 15.852 1.276 -14.826 1.00 55.34 H new ATOM 0 HG3 ARG A 46 14.862 -0.134 -14.505 1.00 55.34 H new ATOM 0 HD2 ARG A 46 13.103 0.955 -15.389 1.00 73.02 H new ATOM 0 HD3 ARG A 46 13.153 2.063 -14.033 1.00 73.02 H new ATOM 0 HE ARG A 46 15.053 3.136 -15.684 1.00 42.32 H new ATOM 0 HH11 ARG A 46 11.743 2.030 -16.204 1.00 62.34 H new ATOM 0 HH12 ARG A 46 11.439 3.182 -17.507 1.00 62.34 H new ATOM 0 HH21 ARG A 46 14.656 4.618 -17.356 1.00 73.55 H new ATOM 0 HH22 ARG A 46 13.082 4.642 -18.157 1.00 73.55 H new ATOM 719 N GLN A 47 16.187 -0.584 -9.903 1.00 12.53 N ATOM 720 CA GLN A 47 16.200 -0.504 -8.446 1.00 40.44 C ATOM 721 C GLN A 47 15.420 0.713 -7.961 1.00 42.13 C ATOM 722 O GLN A 47 15.927 1.516 -7.178 1.00 73.01 O ATOM 723 CB GLN A 47 17.638 -0.442 -7.931 1.00 44.41 C ATOM 724 CG GLN A 47 18.538 -1.525 -8.504 1.00 53.11 C ATOM 725 CD GLN A 47 18.915 -2.573 -7.476 1.00 41.03 C ATOM 726 OE1 GLN A 47 19.874 -2.403 -6.722 1.00 61.40 O ATOM 727 NE2 GLN A 47 18.162 -3.666 -7.441 1.00 71.34 N ATOM 0 H GLN A 47 16.167 -1.534 -10.274 1.00 12.53 H new ATOM 0 HA GLN A 47 15.720 -1.400 -8.053 1.00 40.44 H new ATOM 0 HB2 GLN A 47 18.059 0.534 -8.172 1.00 44.41 H new ATOM 0 HB3 GLN A 47 17.630 -0.526 -6.844 1.00 44.41 H new ATOM 0 HG2 GLN A 47 18.033 -2.007 -9.341 1.00 53.11 H new ATOM 0 HG3 GLN A 47 19.444 -1.067 -8.900 1.00 53.11 H new ATOM 0 HE21 GLN A 47 17.377 -3.765 -8.084 1.00 71.34 H new ATOM 0 HE22 GLN A 47 18.369 -4.406 -6.771 1.00 71.34 H new ATOM 736 N MET A 48 14.184 0.845 -8.433 1.00 24.44 N ATOM 737 CA MET A 48 13.334 1.965 -8.045 1.00 70.14 C ATOM 738 C MET A 48 11.870 1.541 -7.987 1.00 14.11 C ATOM 739 O MET A 48 11.449 0.625 -8.695 1.00 4.13 O ATOM 740 CB MET A 48 13.503 3.124 -9.029 1.00 11.15 C ATOM 741 CG MET A 48 12.403 3.199 -10.075 1.00 52.25 C ATOM 742 SD MET A 48 12.976 3.899 -11.635 1.00 73.14 S ATOM 743 CE MET A 48 13.261 5.601 -11.157 1.00 0.42 C ATOM 0 H MET A 48 13.749 0.191 -9.084 1.00 24.44 H new ATOM 0 HA MET A 48 13.638 2.294 -7.051 1.00 70.14 H new ATOM 0 HB2 MET A 48 13.529 4.061 -8.473 1.00 11.15 H new ATOM 0 HB3 MET A 48 14.465 3.025 -9.532 1.00 11.15 H new ATOM 0 HG2 MET A 48 12.007 2.199 -10.253 1.00 52.25 H new ATOM 0 HG3 MET A 48 11.581 3.803 -9.690 1.00 52.25 H new ATOM 0 HE1 MET A 48 12.592 6.253 -11.719 1.00 0.42 H new ATOM 0 HE2 MET A 48 13.069 5.716 -10.090 1.00 0.42 H new ATOM 0 HE3 MET A 48 14.295 5.871 -11.371 1.00 0.42 H new ATOM 753 N VAL A 49 11.097 2.212 -7.140 1.00 10.30 N ATOM 754 CA VAL A 49 9.679 1.906 -6.990 1.00 60.43 C ATOM 755 C VAL A 49 8.848 2.626 -8.046 1.00 35.13 C ATOM 756 O VAL A 49 8.734 3.851 -8.032 1.00 54.42 O ATOM 757 CB VAL A 49 9.165 2.297 -5.592 1.00 63.41 C ATOM 758 CG1 VAL A 49 7.790 1.698 -5.342 1.00 75.13 C ATOM 759 CG2 VAL A 49 10.150 1.856 -4.520 1.00 64.30 C ATOM 0 H VAL A 49 11.429 2.972 -6.546 1.00 10.30 H new ATOM 0 HA VAL A 49 9.571 0.829 -7.119 1.00 60.43 H new ATOM 0 HB VAL A 49 9.076 3.382 -5.547 1.00 63.41 H new ATOM 0 HG11 VAL A 49 7.443 1.985 -4.349 1.00 75.13 H new ATOM 0 HG12 VAL A 49 7.090 2.067 -6.092 1.00 75.13 H new ATOM 0 HG13 VAL A 49 7.849 0.611 -5.405 1.00 75.13 H new ATOM 0 HG21 VAL A 49 9.771 2.140 -3.538 1.00 64.30 H new ATOM 0 HG22 VAL A 49 10.273 0.774 -4.562 1.00 64.30 H new ATOM 0 HG23 VAL A 49 11.113 2.337 -4.690 1.00 64.30 H new ATOM 769 N VAL A 50 8.266 1.856 -8.959 1.00 11.11 N ATOM 770 CA VAL A 50 7.441 2.419 -10.022 1.00 0.41 C ATOM 771 C VAL A 50 6.013 1.892 -9.949 1.00 35.05 C ATOM 772 O VAL A 50 5.790 0.705 -9.709 1.00 20.44 O ATOM 773 CB VAL A 50 8.023 2.103 -11.412 1.00 24.41 C ATOM 774 CG1 VAL A 50 9.390 2.749 -11.580 1.00 33.34 C ATOM 775 CG2 VAL A 50 8.107 0.597 -11.623 1.00 12.51 C ATOM 0 H VAL A 50 8.350 0.840 -8.984 1.00 11.11 H new ATOM 0 HA VAL A 50 7.433 3.499 -9.877 1.00 0.41 H new ATOM 0 HB VAL A 50 7.357 2.518 -12.168 1.00 24.41 H new ATOM 0 HG11 VAL A 50 9.784 2.514 -12.569 1.00 33.34 H new ATOM 0 HG12 VAL A 50 9.297 3.830 -11.474 1.00 33.34 H new ATOM 0 HG13 VAL A 50 10.069 2.367 -10.818 1.00 33.34 H new ATOM 0 HG21 VAL A 50 8.520 0.390 -12.610 1.00 12.51 H new ATOM 0 HG22 VAL A 50 8.751 0.158 -10.861 1.00 12.51 H new ATOM 0 HG23 VAL A 50 7.110 0.163 -11.549 1.00 12.51 H new ATOM 785 N LEU A 51 5.048 2.781 -10.156 1.00 41.31 N ATOM 786 CA LEU A 51 3.640 2.406 -10.114 1.00 73.44 C ATOM 787 C LEU A 51 3.393 1.126 -10.907 1.00 41.24 C ATOM 788 O LEU A 51 3.963 0.931 -11.980 1.00 72.04 O ATOM 789 CB LEU A 51 2.772 3.538 -10.668 1.00 62.43 C ATOM 790 CG LEU A 51 1.311 3.546 -10.219 1.00 65.30 C ATOM 791 CD1 LEU A 51 0.797 4.972 -10.099 1.00 43.14 C ATOM 792 CD2 LEU A 51 0.451 2.747 -11.187 1.00 72.31 C ATOM 0 H LEU A 51 5.216 3.767 -10.355 1.00 41.31 H new ATOM 0 HA LEU A 51 3.369 2.225 -9.074 1.00 73.44 H new ATOM 0 HB2 LEU A 51 3.224 4.488 -10.383 1.00 62.43 H new ATOM 0 HB3 LEU A 51 2.796 3.488 -11.757 1.00 62.43 H new ATOM 0 HG LEU A 51 1.250 3.076 -9.237 1.00 65.30 H new ATOM 0 HD11 LEU A 51 -0.245 4.958 -9.778 1.00 43.14 H new ATOM 0 HD12 LEU A 51 1.395 5.514 -9.366 1.00 43.14 H new ATOM 0 HD13 LEU A 51 0.872 5.468 -11.067 1.00 43.14 H new ATOM 0 HD21 LEU A 51 -0.586 2.764 -10.851 1.00 72.31 H new ATOM 0 HD22 LEU A 51 0.518 3.188 -12.182 1.00 72.31 H new ATOM 0 HD23 LEU A 51 0.804 1.716 -11.222 1.00 72.31 H new ATOM 804 N GLU A 52 2.539 0.259 -10.371 1.00 51.43 N ATOM 805 CA GLU A 52 2.217 -1.001 -11.030 1.00 43.25 C ATOM 806 C GLU A 52 0.794 -0.979 -11.580 1.00 34.52 C ATOM 807 O GLU A 52 0.537 -1.452 -12.688 1.00 4.51 O ATOM 808 CB GLU A 52 2.382 -2.168 -10.055 1.00 74.54 C ATOM 809 CG GLU A 52 2.033 -3.519 -10.659 1.00 71.20 C ATOM 810 CD GLU A 52 3.200 -4.486 -10.639 1.00 72.25 C ATOM 811 OE1 GLU A 52 3.393 -5.162 -9.607 1.00 55.10 O ATOM 812 OE2 GLU A 52 3.922 -4.567 -11.655 1.00 50.35 O ATOM 0 H GLU A 52 2.058 0.406 -9.483 1.00 51.43 H new ATOM 0 HA GLU A 52 2.907 -1.133 -11.863 1.00 43.25 H new ATOM 0 HB2 GLU A 52 3.413 -2.193 -9.702 1.00 74.54 H new ATOM 0 HB3 GLU A 52 1.751 -1.995 -9.184 1.00 74.54 H new ATOM 0 HG2 GLU A 52 1.197 -3.953 -10.110 1.00 71.20 H new ATOM 0 HG3 GLU A 52 1.700 -3.378 -11.687 1.00 71.20 H new ATOM 819 N ASP A 53 -0.128 -0.429 -10.797 1.00 20.15 N ATOM 820 CA ASP A 53 -1.526 -0.344 -11.204 1.00 71.50 C ATOM 821 C ASP A 53 -2.274 0.689 -10.368 1.00 5.01 C ATOM 822 O ASP A 53 -1.788 1.127 -9.326 1.00 23.13 O ATOM 823 CB ASP A 53 -2.201 -1.711 -11.071 1.00 44.32 C ATOM 824 CG ASP A 53 -2.094 -2.535 -12.339 1.00 1.32 C ATOM 825 OD1 ASP A 53 -2.646 -2.107 -13.374 1.00 14.31 O ATOM 826 OD2 ASP A 53 -1.456 -3.608 -12.297 1.00 40.30 O ATOM 0 H ASP A 53 0.068 -0.035 -9.877 1.00 20.15 H new ATOM 0 HA ASP A 53 -1.557 -0.031 -12.248 1.00 71.50 H new ATOM 0 HB2 ASP A 53 -1.746 -2.259 -10.246 1.00 44.32 H new ATOM 0 HB3 ASP A 53 -3.252 -1.571 -10.820 1.00 44.32 H new ATOM 831 N GLU A 54 -3.457 1.077 -10.835 1.00 22.33 N ATOM 832 CA GLU A 54 -4.270 2.061 -10.130 1.00 63.44 C ATOM 833 C GLU A 54 -5.757 1.803 -10.360 1.00 25.42 C ATOM 834 O GLU A 54 -6.256 1.939 -11.477 1.00 13.12 O ATOM 835 CB GLU A 54 -3.910 3.475 -10.590 1.00 44.22 C ATOM 836 CG GLU A 54 -3.026 4.227 -9.609 1.00 1.23 C ATOM 837 CD GLU A 54 -3.033 5.725 -9.847 1.00 23.10 C ATOM 838 OE1 GLU A 54 -2.578 6.155 -10.927 1.00 3.31 O ATOM 839 OE2 GLU A 54 -3.493 6.466 -8.954 1.00 33.13 O ATOM 0 H GLU A 54 -3.873 0.725 -11.697 1.00 22.33 H new ATOM 0 HA GLU A 54 -4.063 1.969 -9.064 1.00 63.44 H new ATOM 0 HB2 GLU A 54 -3.402 3.417 -11.553 1.00 44.22 H new ATOM 0 HB3 GLU A 54 -4.828 4.042 -10.747 1.00 44.22 H new ATOM 0 HG2 GLU A 54 -3.362 4.023 -8.592 1.00 1.23 H new ATOM 0 HG3 GLU A 54 -2.004 3.855 -9.688 1.00 1.23 H new ATOM 846 N LEU A 55 -6.457 1.429 -9.295 1.00 64.00 N ATOM 847 CA LEU A 55 -7.886 1.151 -9.379 1.00 33.53 C ATOM 848 C LEU A 55 -8.687 2.168 -8.571 1.00 22.50 C ATOM 849 O LEU A 55 -8.365 2.449 -7.417 1.00 73.12 O ATOM 850 CB LEU A 55 -8.181 -0.264 -8.875 1.00 55.51 C ATOM 851 CG LEU A 55 -7.305 -1.376 -9.450 1.00 30.20 C ATOM 852 CD1 LEU A 55 -7.174 -2.520 -8.456 1.00 72.24 C ATOM 853 CD2 LEU A 55 -7.875 -1.876 -10.769 1.00 71.40 C ATOM 0 H LEU A 55 -6.058 1.311 -8.364 1.00 64.00 H new ATOM 0 HA LEU A 55 -8.185 1.228 -10.424 1.00 33.53 H new ATOM 0 HB2 LEU A 55 -8.077 -0.271 -7.790 1.00 55.51 H new ATOM 0 HB3 LEU A 55 -9.222 -0.498 -9.097 1.00 55.51 H new ATOM 0 HG LEU A 55 -6.311 -0.969 -9.638 1.00 30.20 H new ATOM 0 HD11 LEU A 55 -6.547 -3.303 -8.883 1.00 72.24 H new ATOM 0 HD12 LEU A 55 -6.720 -2.152 -7.536 1.00 72.24 H new ATOM 0 HD13 LEU A 55 -8.161 -2.926 -8.236 1.00 72.24 H new ATOM 0 HD21 LEU A 55 -7.238 -2.668 -11.164 1.00 71.40 H new ATOM 0 HD22 LEU A 55 -8.880 -2.266 -10.607 1.00 71.40 H new ATOM 0 HD23 LEU A 55 -7.916 -1.053 -11.483 1.00 71.40 H new ATOM 865 N GLN A 56 -9.733 2.712 -9.185 1.00 3.45 N ATOM 866 CA GLN A 56 -10.580 3.696 -8.521 1.00 44.24 C ATOM 867 C GLN A 56 -11.935 3.095 -8.164 1.00 72.14 C ATOM 868 O GLN A 56 -12.328 2.061 -8.703 1.00 62.12 O ATOM 869 CB GLN A 56 -10.772 4.921 -9.418 1.00 31.12 C ATOM 870 CG GLN A 56 -9.554 5.828 -9.478 1.00 11.33 C ATOM 871 CD GLN A 56 -8.579 5.425 -10.567 1.00 11.21 C ATOM 872 OE1 GLN A 56 -8.982 5.012 -11.655 1.00 21.33 O ATOM 873 NE2 GLN A 56 -7.288 5.543 -10.280 1.00 0.42 N ATOM 0 H GLN A 56 -10.014 2.488 -10.140 1.00 3.45 H new ATOM 0 HA GLN A 56 -10.085 4.003 -7.599 1.00 44.24 H new ATOM 0 HB2 GLN A 56 -11.016 4.588 -10.427 1.00 31.12 H new ATOM 0 HB3 GLN A 56 -11.625 5.495 -9.057 1.00 31.12 H new ATOM 0 HG2 GLN A 56 -9.878 6.855 -9.648 1.00 11.33 H new ATOM 0 HG3 GLN A 56 -9.044 5.810 -8.515 1.00 11.33 H new ATOM 0 HE21 GLN A 56 -6.998 5.890 -9.365 1.00 0.42 H new ATOM 0 HE22 GLN A 56 -6.586 5.287 -10.974 1.00 0.42 H new ATOM 882 N ASN A 57 -12.645 3.750 -7.252 1.00 34.11 N ATOM 883 CA ASN A 57 -13.957 3.280 -6.821 1.00 61.40 C ATOM 884 C ASN A 57 -13.952 1.767 -6.618 1.00 41.53 C ATOM 885 O ASN A 57 -14.716 1.042 -7.257 1.00 4.42 O ATOM 886 CB ASN A 57 -15.022 3.664 -7.850 1.00 20.40 C ATOM 887 CG ASN A 57 -14.433 3.923 -9.223 1.00 73.24 C ATOM 888 OD1 ASN A 57 -13.861 5.107 -9.407 1.00 33.43 O flip ATOM 889 ND2 ASN A 57 -14.491 3.068 -10.108 1.00 73.55 N flip ATOM 0 H ASN A 57 -12.334 4.608 -6.797 1.00 34.11 H new ATOM 0 HA ASN A 57 -14.192 3.756 -5.869 1.00 61.40 H new ATOM 0 HB2 ASN A 57 -15.761 2.866 -7.919 1.00 20.40 H new ATOM 0 HB3 ASN A 57 -15.548 4.556 -7.509 1.00 20.40 H new ATOM 0 HD21 ASN A 57 -14.940 2.171 -9.922 1.00 73.55 H new ATOM 0 HD22 ASN A 57 -14.090 3.257 -11.027 1.00 73.55 H new ATOM 896 N ILE A 58 -13.088 1.299 -5.724 1.00 1.21 N ATOM 897 CA ILE A 58 -12.985 -0.126 -5.435 1.00 52.05 C ATOM 898 C ILE A 58 -13.086 -0.392 -3.937 1.00 71.43 C ATOM 899 O ILE A 58 -12.527 0.346 -3.126 1.00 31.42 O ATOM 900 CB ILE A 58 -11.662 -0.714 -5.962 1.00 14.32 C ATOM 901 CG1 ILE A 58 -11.037 -1.639 -4.915 1.00 52.51 C ATOM 902 CG2 ILE A 58 -10.697 0.403 -6.333 1.00 13.31 C ATOM 903 CD1 ILE A 58 -10.347 -0.899 -3.790 1.00 22.42 C ATOM 0 H ILE A 58 -12.449 1.886 -5.187 1.00 1.21 H new ATOM 0 HA ILE A 58 -13.817 -0.612 -5.945 1.00 52.05 H new ATOM 0 HB ILE A 58 -11.872 -1.299 -6.857 1.00 14.32 H new ATOM 0 HG12 ILE A 58 -11.814 -2.278 -4.496 1.00 52.51 H new ATOM 0 HG13 ILE A 58 -10.316 -2.294 -5.404 1.00 52.51 H new ATOM 0 HG21 ILE A 58 -9.767 -0.028 -6.704 1.00 13.31 H new ATOM 0 HG22 ILE A 58 -11.143 1.026 -7.108 1.00 13.31 H new ATOM 0 HG23 ILE A 58 -10.489 1.012 -5.453 1.00 13.31 H new ATOM 0 HD11 ILE A 58 -9.928 -1.617 -3.086 1.00 22.42 H new ATOM 0 HD12 ILE A 58 -9.547 -0.281 -4.198 1.00 22.42 H new ATOM 0 HD13 ILE A 58 -11.069 -0.265 -3.275 1.00 22.42 H new ATOM 915 N SER A 59 -13.802 -1.453 -3.577 1.00 5.35 N ATOM 916 CA SER A 59 -13.978 -1.816 -2.176 1.00 60.12 C ATOM 917 C SER A 59 -12.765 -2.584 -1.657 1.00 52.30 C ATOM 918 O SER A 59 -11.883 -2.988 -2.415 1.00 35.24 O ATOM 919 CB SER A 59 -15.243 -2.659 -2.000 1.00 64.32 C ATOM 920 OG SER A 59 -16.244 -1.937 -1.304 1.00 44.10 O ATOM 0 H SER A 59 -14.269 -2.076 -4.236 1.00 5.35 H new ATOM 0 HA SER A 59 -14.079 -0.897 -1.598 1.00 60.12 H new ATOM 0 HB2 SER A 59 -15.621 -2.962 -2.977 1.00 64.32 H new ATOM 0 HB3 SER A 59 -15.003 -3.572 -1.455 1.00 64.32 H new ATOM 0 HG SER A 59 -17.043 -2.497 -1.206 1.00 44.10 H new ATOM 926 N PRO A 60 -12.719 -2.789 -0.332 1.00 1.41 N ATOM 927 CA PRO A 60 -11.622 -3.509 0.319 1.00 31.24 C ATOM 928 C PRO A 60 -11.629 -4.998 -0.010 1.00 73.11 C ATOM 929 O PRO A 60 -10.753 -5.744 0.427 1.00 15.34 O ATOM 930 CB PRO A 60 -11.889 -3.290 1.810 1.00 5.33 C ATOM 931 CG PRO A 60 -13.355 -3.046 1.901 1.00 74.22 C ATOM 932 CD PRO A 60 -13.736 -2.335 0.632 1.00 54.44 C ATOM 0 HA PRO A 60 -10.647 -3.150 -0.011 1.00 31.24 H new ATOM 0 HB2 PRO A 60 -11.596 -4.161 2.397 1.00 5.33 H new ATOM 0 HB3 PRO A 60 -11.322 -2.442 2.193 1.00 5.33 H new ATOM 0 HG2 PRO A 60 -13.901 -3.984 2.002 1.00 74.22 H new ATOM 0 HG3 PRO A 60 -13.596 -2.441 2.775 1.00 74.22 H new ATOM 0 HD2 PRO A 60 -14.743 -2.601 0.309 1.00 54.44 H new ATOM 0 HD3 PRO A 60 -13.717 -1.252 0.757 1.00 54.44 H new ATOM 940 N GLU A 61 -12.622 -5.424 -0.785 1.00 11.24 N ATOM 941 CA GLU A 61 -12.742 -6.824 -1.172 1.00 24.32 C ATOM 942 C GLU A 61 -12.234 -7.041 -2.595 1.00 14.32 C ATOM 943 O GLU A 61 -11.821 -8.142 -2.956 1.00 15.31 O ATOM 944 CB GLU A 61 -14.198 -7.284 -1.062 1.00 42.31 C ATOM 945 CG GLU A 61 -14.495 -8.063 0.207 1.00 3.03 C ATOM 946 CD GLU A 61 -15.888 -8.664 0.211 1.00 2.45 C ATOM 947 OE1 GLU A 61 -16.119 -9.633 -0.541 1.00 4.11 O ATOM 948 OE2 GLU A 61 -16.747 -8.162 0.966 1.00 2.43 O ATOM 0 H GLU A 61 -13.354 -4.819 -1.157 1.00 11.24 H new ATOM 0 HA GLU A 61 -12.129 -7.416 -0.492 1.00 24.32 H new ATOM 0 HB2 GLU A 61 -14.850 -6.412 -1.104 1.00 42.31 H new ATOM 0 HB3 GLU A 61 -14.440 -7.905 -1.925 1.00 42.31 H new ATOM 0 HG2 GLU A 61 -13.760 -8.859 0.320 1.00 3.03 H new ATOM 0 HG3 GLU A 61 -14.386 -7.403 1.068 1.00 3.03 H new ATOM 955 N GLU A 62 -12.270 -5.981 -3.398 1.00 31.13 N ATOM 956 CA GLU A 62 -11.815 -6.057 -4.781 1.00 10.40 C ATOM 957 C GLU A 62 -10.293 -5.978 -4.858 1.00 40.51 C ATOM 958 O GLU A 62 -9.659 -6.721 -5.609 1.00 55.22 O ATOM 959 CB GLU A 62 -12.438 -4.929 -5.607 1.00 72.11 C ATOM 960 CG GLU A 62 -13.738 -5.321 -6.289 1.00 31.20 C ATOM 961 CD GLU A 62 -13.540 -5.713 -7.741 1.00 71.01 C ATOM 962 OE1 GLU A 62 -13.053 -6.835 -7.990 1.00 44.23 O ATOM 963 OE2 GLU A 62 -13.871 -4.897 -8.626 1.00 73.42 O ATOM 0 H GLU A 62 -12.609 -5.062 -3.115 1.00 31.13 H new ATOM 0 HA GLU A 62 -12.132 -7.016 -5.190 1.00 10.40 H new ATOM 0 HB2 GLU A 62 -12.622 -4.073 -4.957 1.00 72.11 H new ATOM 0 HB3 GLU A 62 -11.723 -4.607 -6.364 1.00 72.11 H new ATOM 0 HG2 GLU A 62 -14.190 -6.154 -5.750 1.00 31.20 H new ATOM 0 HG3 GLU A 62 -14.439 -4.488 -6.234 1.00 31.20 H new ATOM 970 N LEU A 63 -9.713 -5.072 -4.078 1.00 51.43 N ATOM 971 CA LEU A 63 -8.265 -4.895 -4.058 1.00 63.11 C ATOM 972 C LEU A 63 -7.558 -6.220 -3.792 1.00 25.15 C ATOM 973 O LEU A 63 -6.676 -6.628 -4.548 1.00 25.32 O ATOM 974 CB LEU A 63 -7.872 -3.870 -2.992 1.00 60.41 C ATOM 975 CG LEU A 63 -6.917 -2.765 -3.444 1.00 63.42 C ATOM 976 CD1 LEU A 63 -6.200 -2.158 -2.248 1.00 1.31 C ATOM 977 CD2 LEU A 63 -5.912 -3.306 -4.451 1.00 13.05 C ATOM 0 H LEU A 63 -10.223 -4.449 -3.452 1.00 51.43 H new ATOM 0 HA LEU A 63 -7.954 -4.529 -5.037 1.00 63.11 H new ATOM 0 HB2 LEU A 63 -8.781 -3.404 -2.612 1.00 60.41 H new ATOM 0 HB3 LEU A 63 -7.413 -4.401 -2.158 1.00 60.41 H new ATOM 0 HG LEU A 63 -7.501 -1.983 -3.928 1.00 63.42 H new ATOM 0 HD11 LEU A 63 -5.524 -1.373 -2.589 1.00 1.31 H new ATOM 0 HD12 LEU A 63 -6.933 -1.733 -1.562 1.00 1.31 H new ATOM 0 HD13 LEU A 63 -5.628 -2.932 -1.735 1.00 1.31 H new ATOM 0 HD21 LEU A 63 -5.241 -2.505 -4.761 1.00 13.05 H new ATOM 0 HD22 LEU A 63 -5.333 -4.108 -3.992 1.00 13.05 H new ATOM 0 HD23 LEU A 63 -6.442 -3.693 -5.321 1.00 13.05 H new ATOM 989 N LYS A 64 -7.953 -6.888 -2.713 1.00 72.51 N ATOM 990 CA LYS A 64 -7.360 -8.170 -2.348 1.00 14.33 C ATOM 991 C LYS A 64 -7.411 -9.146 -3.519 1.00 1.35 C ATOM 992 O LYS A 64 -6.472 -9.913 -3.740 1.00 55.45 O ATOM 993 CB LYS A 64 -8.088 -8.765 -1.140 1.00 74.43 C ATOM 994 CG LYS A 64 -8.301 -10.267 -1.238 1.00 42.43 C ATOM 995 CD LYS A 64 -8.394 -10.907 0.136 1.00 74.41 C ATOM 996 CE LYS A 64 -9.782 -11.476 0.392 1.00 24.00 C ATOM 997 NZ LYS A 64 -9.816 -12.954 0.218 1.00 43.21 N ATOM 0 H LYS A 64 -8.681 -6.563 -2.076 1.00 72.51 H new ATOM 0 HA LYS A 64 -6.316 -7.999 -2.087 1.00 14.33 H new ATOM 0 HB2 LYS A 64 -7.517 -8.545 -0.238 1.00 74.43 H new ATOM 0 HB3 LYS A 64 -9.056 -8.275 -1.032 1.00 74.43 H new ATOM 0 HG2 LYS A 64 -9.214 -10.470 -1.798 1.00 42.43 H new ATOM 0 HG3 LYS A 64 -7.479 -10.717 -1.795 1.00 42.43 H new ATOM 0 HD2 LYS A 64 -7.653 -11.702 0.220 1.00 74.41 H new ATOM 0 HD3 LYS A 64 -8.156 -10.167 0.900 1.00 74.41 H new ATOM 0 HE2 LYS A 64 -10.098 -11.222 1.404 1.00 24.00 H new ATOM 0 HE3 LYS A 64 -10.496 -11.014 -0.290 1.00 24.00 H new ATOM 0 HZ1 LYS A 64 -10.690 -13.225 -0.276 1.00 43.21 H new ATOM 0 HZ2 LYS A 64 -8.994 -13.257 -0.342 1.00 43.21 H new ATOM 0 HZ3 LYS A 64 -9.788 -13.414 1.150 1.00 43.21 H new ATOM 1011 N LEU A 65 -8.509 -9.111 -4.264 1.00 75.21 N ATOM 1012 CA LEU A 65 -8.681 -9.993 -5.414 1.00 44.11 C ATOM 1013 C LEU A 65 -7.708 -9.626 -6.532 1.00 73.10 C ATOM 1014 O LEU A 65 -7.193 -10.499 -7.229 1.00 2.55 O ATOM 1015 CB LEU A 65 -10.118 -9.919 -5.928 1.00 52.44 C ATOM 1016 CG LEU A 65 -11.086 -10.963 -5.370 1.00 54.04 C ATOM 1017 CD1 LEU A 65 -11.001 -11.013 -3.853 1.00 33.11 C ATOM 1018 CD2 LEU A 65 -12.510 -10.664 -5.817 1.00 31.03 C ATOM 0 H LEU A 65 -9.294 -8.482 -4.093 1.00 75.21 H new ATOM 0 HA LEU A 65 -8.469 -11.013 -5.093 1.00 44.11 H new ATOM 0 HB2 LEU A 65 -10.513 -8.929 -5.701 1.00 52.44 H new ATOM 0 HB3 LEU A 65 -10.099 -10.014 -7.014 1.00 52.44 H new ATOM 0 HG LEU A 65 -10.801 -11.940 -5.762 1.00 54.04 H new ATOM 0 HD11 LEU A 65 -11.697 -11.761 -3.474 1.00 33.11 H new ATOM 0 HD12 LEU A 65 -9.986 -11.276 -3.554 1.00 33.11 H new ATOM 0 HD13 LEU A 65 -11.259 -10.037 -3.442 1.00 33.11 H new ATOM 0 HD21 LEU A 65 -13.185 -11.417 -5.410 1.00 31.03 H new ATOM 0 HD22 LEU A 65 -12.806 -9.679 -5.456 1.00 31.03 H new ATOM 0 HD23 LEU A 65 -12.561 -10.681 -6.906 1.00 31.03 H new ATOM 1030 N GLU A 66 -7.463 -8.330 -6.694 1.00 0.04 N ATOM 1031 CA GLU A 66 -6.552 -7.848 -7.726 1.00 12.12 C ATOM 1032 C GLU A 66 -5.105 -8.173 -7.368 1.00 70.34 C ATOM 1033 O GLU A 66 -4.275 -8.408 -8.247 1.00 43.04 O ATOM 1034 CB GLU A 66 -6.716 -6.339 -7.918 1.00 3.14 C ATOM 1035 CG GLU A 66 -8.093 -5.934 -8.413 1.00 55.21 C ATOM 1036 CD GLU A 66 -8.303 -6.254 -9.879 1.00 72.25 C ATOM 1037 OE1 GLU A 66 -7.869 -5.451 -10.731 1.00 50.33 O ATOM 1038 OE2 GLU A 66 -8.902 -7.310 -10.176 1.00 13.54 O ATOM 0 H GLU A 66 -7.882 -7.595 -6.124 1.00 0.04 H new ATOM 0 HA GLU A 66 -6.800 -8.354 -8.659 1.00 12.12 H new ATOM 0 HB2 GLU A 66 -6.518 -5.837 -6.971 1.00 3.14 H new ATOM 0 HB3 GLU A 66 -5.967 -5.988 -8.628 1.00 3.14 H new ATOM 0 HG2 GLU A 66 -8.852 -6.445 -7.821 1.00 55.21 H new ATOM 0 HG3 GLU A 66 -8.232 -4.864 -8.255 1.00 55.21 H new ATOM 1045 N LEU A 67 -4.810 -8.185 -6.074 1.00 13.34 N ATOM 1046 CA LEU A 67 -3.463 -8.480 -5.599 1.00 20.34 C ATOM 1047 C LEU A 67 -3.105 -9.942 -5.850 1.00 21.11 C ATOM 1048 O LEU A 67 -3.970 -10.816 -5.906 1.00 31.41 O ATOM 1049 CB LEU A 67 -3.347 -8.164 -4.106 1.00 51.23 C ATOM 1050 CG LEU A 67 -3.351 -6.681 -3.732 1.00 31.44 C ATOM 1051 CD1 LEU A 67 -3.505 -6.512 -2.228 1.00 44.53 C ATOM 1052 CD2 LEU A 67 -2.080 -6.003 -4.221 1.00 0.12 C ATOM 0 H LEU A 67 -5.485 -7.994 -5.334 1.00 13.34 H new ATOM 0 HA LEU A 67 -2.764 -7.853 -6.153 1.00 20.34 H new ATOM 0 HB2 LEU A 67 -4.172 -8.651 -3.587 1.00 51.23 H new ATOM 0 HB3 LEU A 67 -2.426 -8.610 -3.731 1.00 51.23 H new ATOM 0 HG LEU A 67 -4.201 -6.205 -4.220 1.00 31.44 H new ATOM 0 HD11 LEU A 67 -3.506 -5.451 -1.979 1.00 44.53 H new ATOM 0 HD12 LEU A 67 -4.444 -6.961 -1.906 1.00 44.53 H new ATOM 0 HD13 LEU A 67 -2.675 -7.003 -1.720 1.00 44.53 H new ATOM 0 HD21 LEU A 67 -2.101 -4.949 -3.946 1.00 0.12 H new ATOM 0 HD22 LEU A 67 -1.214 -6.480 -3.763 1.00 0.12 H new ATOM 0 HD23 LEU A 67 -2.013 -6.094 -5.305 1.00 0.12 H new ATOM 1064 N PRO A 68 -1.802 -10.214 -6.002 1.00 3.25 N ATOM 1065 CA PRO A 68 -1.300 -11.570 -6.247 1.00 2.42 C ATOM 1066 C PRO A 68 -1.446 -12.471 -5.026 1.00 32.32 C ATOM 1067 O PRO A 68 -2.024 -12.073 -4.015 1.00 24.32 O ATOM 1068 CB PRO A 68 0.180 -11.347 -6.572 1.00 55.25 C ATOM 1069 CG PRO A 68 0.527 -10.065 -5.898 1.00 2.40 C ATOM 1070 CD PRO A 68 -0.716 -9.220 -5.947 1.00 20.25 C ATOM 0 HA PRO A 68 -1.854 -12.073 -7.040 1.00 2.42 H new ATOM 0 HB2 PRO A 68 0.795 -12.168 -6.202 1.00 55.25 H new ATOM 0 HB3 PRO A 68 0.344 -11.286 -7.648 1.00 55.25 H new ATOM 0 HG2 PRO A 68 0.841 -10.238 -4.869 1.00 2.40 H new ATOM 0 HG3 PRO A 68 1.355 -9.570 -6.405 1.00 2.40 H new ATOM 0 HD2 PRO A 68 -0.801 -8.580 -5.069 1.00 20.25 H new ATOM 0 HD3 PRO A 68 -0.724 -8.567 -6.820 1.00 20.25 H new ATOM 1078 N GLU A 69 -0.918 -13.687 -5.127 1.00 1.33 N ATOM 1079 CA GLU A 69 -0.991 -14.644 -4.029 1.00 25.15 C ATOM 1080 C GLU A 69 0.374 -14.821 -3.369 1.00 41.41 C ATOM 1081 O GLU A 69 0.467 -15.074 -2.168 1.00 51.12 O ATOM 1082 CB GLU A 69 -1.503 -15.995 -4.534 1.00 41.31 C ATOM 1083 CG GLU A 69 -0.656 -16.590 -5.646 1.00 70.24 C ATOM 1084 CD GLU A 69 -1.061 -16.088 -7.019 1.00 51.02 C ATOM 1085 OE1 GLU A 69 -2.278 -16.021 -7.290 1.00 70.31 O ATOM 1086 OE2 GLU A 69 -0.161 -15.764 -7.822 1.00 13.21 O ATOM 0 H GLU A 69 -0.436 -14.032 -5.957 1.00 1.33 H new ATOM 0 HA GLU A 69 -1.687 -14.253 -3.287 1.00 25.15 H new ATOM 0 HB2 GLU A 69 -1.537 -16.696 -3.700 1.00 41.31 H new ATOM 0 HB3 GLU A 69 -2.526 -15.876 -4.892 1.00 41.31 H new ATOM 0 HG2 GLU A 69 0.392 -16.348 -5.469 1.00 70.24 H new ATOM 0 HG3 GLU A 69 -0.741 -17.676 -5.621 1.00 70.24 H new ATOM 1093 N ARG A 70 1.431 -14.685 -4.163 1.00 74.35 N ATOM 1094 CA ARG A 70 2.791 -14.831 -3.659 1.00 22.15 C ATOM 1095 C ARG A 70 3.728 -13.829 -4.324 1.00 44.25 C ATOM 1096 O ARG A 70 4.773 -14.202 -4.857 1.00 41.13 O ATOM 1097 CB ARG A 70 3.296 -16.256 -3.897 1.00 51.25 C ATOM 1098 CG ARG A 70 2.290 -17.330 -3.521 1.00 12.21 C ATOM 1099 CD ARG A 70 2.258 -17.562 -2.018 1.00 43.32 C ATOM 1100 NE ARG A 70 1.935 -18.946 -1.684 1.00 74.12 N ATOM 1101 CZ ARG A 70 0.694 -19.422 -1.645 1.00 42.10 C ATOM 1102 NH1 ARG A 70 -0.332 -18.630 -1.918 1.00 0.31 N ATOM 1103 NH2 ARG A 70 0.480 -20.694 -1.333 1.00 42.30 N ATOM 0 H ARG A 70 1.371 -14.474 -5.159 1.00 74.35 H new ATOM 0 HA ARG A 70 2.778 -14.632 -2.587 1.00 22.15 H new ATOM 0 HB2 ARG A 70 3.558 -16.368 -4.949 1.00 51.25 H new ATOM 0 HB3 ARG A 70 4.210 -16.409 -3.323 1.00 51.25 H new ATOM 0 HG2 ARG A 70 1.298 -17.038 -3.866 1.00 12.21 H new ATOM 0 HG3 ARG A 70 2.543 -18.261 -4.029 1.00 12.21 H new ATOM 0 HD2 ARG A 70 3.227 -17.303 -1.591 1.00 43.32 H new ATOM 0 HD3 ARG A 70 1.522 -16.898 -1.565 1.00 43.32 H new ATOM 0 HE ARG A 70 2.703 -19.582 -1.469 1.00 74.12 H new ATOM 0 HH11 ARG A 70 -0.171 -17.652 -2.159 1.00 0.31 H new ATOM 0 HH12 ARG A 70 -1.283 -18.998 -1.887 1.00 0.31 H new ATOM 0 HH21 ARG A 70 1.268 -21.307 -1.123 1.00 42.30 H new ATOM 0 HH22 ARG A 70 -0.472 -21.059 -1.303 1.00 42.30 H new ATOM 1117 N GLN A 71 3.348 -12.556 -4.289 1.00 75.34 N ATOM 1118 CA GLN A 71 4.155 -11.501 -4.891 1.00 72.24 C ATOM 1119 C GLN A 71 4.113 -10.234 -4.043 1.00 25.45 C ATOM 1120 O GLN A 71 3.082 -9.574 -3.920 1.00 12.43 O ATOM 1121 CB GLN A 71 3.662 -11.197 -6.307 1.00 13.03 C ATOM 1122 CG GLN A 71 4.266 -12.102 -7.368 1.00 71.33 C ATOM 1123 CD GLN A 71 3.550 -11.998 -8.701 1.00 22.15 C ATOM 1124 OE1 GLN A 71 3.740 -11.036 -9.446 1.00 40.04 O ATOM 1125 NE2 GLN A 71 2.722 -12.989 -9.008 1.00 3.02 N ATOM 0 H GLN A 71 2.487 -12.230 -3.850 1.00 75.34 H new ATOM 0 HA GLN A 71 5.186 -11.850 -4.940 1.00 72.24 H new ATOM 0 HB2 GLN A 71 2.577 -11.294 -6.334 1.00 13.03 H new ATOM 0 HB3 GLN A 71 3.896 -10.160 -6.550 1.00 13.03 H new ATOM 0 HG2 GLN A 71 5.317 -11.846 -7.503 1.00 71.33 H new ATOM 0 HG3 GLN A 71 4.232 -13.135 -7.021 1.00 71.33 H new ATOM 0 HE21 GLN A 71 2.595 -13.767 -8.360 1.00 3.02 H new ATOM 0 HE22 GLN A 71 2.213 -12.973 -9.892 1.00 3.02 H new ATOM 1134 N PRO A 72 5.262 -9.886 -3.443 1.00 12.44 N ATOM 1135 CA PRO A 72 5.382 -8.695 -2.596 1.00 21.31 C ATOM 1136 C PRO A 72 5.295 -7.402 -3.399 1.00 30.05 C ATOM 1137 O PRO A 72 5.885 -7.285 -4.473 1.00 32.31 O ATOM 1138 CB PRO A 72 6.772 -8.844 -1.971 1.00 13.22 C ATOM 1139 CG PRO A 72 7.533 -9.687 -2.936 1.00 42.21 C ATOM 1140 CD PRO A 72 6.530 -10.627 -3.546 1.00 2.40 C ATOM 0 HA PRO A 72 4.575 -8.631 -1.866 1.00 21.31 H new ATOM 0 HB2 PRO A 72 7.249 -7.874 -1.831 1.00 13.22 H new ATOM 0 HB3 PRO A 72 6.717 -9.317 -0.990 1.00 13.22 H new ATOM 0 HG2 PRO A 72 8.007 -9.073 -3.701 1.00 42.21 H new ATOM 0 HG3 PRO A 72 8.327 -10.237 -2.431 1.00 42.21 H new ATOM 0 HD2 PRO A 72 6.776 -10.860 -4.582 1.00 2.40 H new ATOM 0 HD3 PRO A 72 6.487 -11.574 -3.008 1.00 2.40 H new ATOM 1148 N ARG A 73 4.557 -6.431 -2.869 1.00 55.22 N ATOM 1149 CA ARG A 73 4.393 -5.146 -3.537 1.00 60.12 C ATOM 1150 C ARG A 73 3.733 -4.131 -2.608 1.00 75.41 C ATOM 1151 O ARG A 73 3.250 -4.482 -1.531 1.00 0.41 O ATOM 1152 CB ARG A 73 3.557 -5.310 -4.807 1.00 61.21 C ATOM 1153 CG ARG A 73 2.278 -6.103 -4.596 1.00 33.10 C ATOM 1154 CD ARG A 73 2.122 -7.199 -5.639 1.00 44.21 C ATOM 1155 NE ARG A 73 1.410 -6.728 -6.824 1.00 63.33 N ATOM 1156 CZ ARG A 73 1.524 -7.292 -8.022 1.00 24.01 C ATOM 1157 NH1 ARG A 73 2.316 -8.342 -8.192 1.00 4.15 N ATOM 1158 NH2 ARG A 73 0.844 -6.807 -9.052 1.00 50.20 N ATOM 0 H ARG A 73 4.064 -6.510 -1.980 1.00 55.22 H new ATOM 0 HA ARG A 73 5.382 -4.776 -3.807 1.00 60.12 H new ATOM 0 HB2 ARG A 73 3.303 -4.323 -5.195 1.00 61.21 H new ATOM 0 HB3 ARG A 73 4.160 -5.806 -5.568 1.00 61.21 H new ATOM 0 HG2 ARG A 73 2.283 -6.546 -3.600 1.00 33.10 H new ATOM 0 HG3 ARG A 73 1.421 -5.431 -4.642 1.00 33.10 H new ATOM 0 HD2 ARG A 73 3.106 -7.566 -5.929 1.00 44.21 H new ATOM 0 HD3 ARG A 73 1.584 -8.041 -5.203 1.00 44.21 H new ATOM 0 HE ARG A 73 0.792 -5.923 -6.727 1.00 63.33 H new ATOM 0 HH11 ARG A 73 2.840 -8.719 -7.402 1.00 4.15 H new ATOM 0 HH12 ARG A 73 2.401 -8.773 -9.113 1.00 4.15 H new ATOM 0 HH21 ARG A 73 0.233 -6.000 -8.925 1.00 50.20 H new ATOM 0 HH22 ARG A 73 0.932 -7.241 -9.971 1.00 50.20 H new ATOM 1172 N PHE A 74 3.715 -2.872 -3.032 1.00 42.30 N ATOM 1173 CA PHE A 74 3.115 -1.806 -2.238 1.00 70.13 C ATOM 1174 C PHE A 74 1.694 -1.510 -2.710 1.00 42.14 C ATOM 1175 O PHE A 74 1.369 -1.686 -3.885 1.00 15.24 O ATOM 1176 CB PHE A 74 3.967 -0.538 -2.323 1.00 1.25 C ATOM 1177 CG PHE A 74 5.418 -0.769 -2.011 1.00 53.33 C ATOM 1178 CD1 PHE A 74 5.800 -1.333 -0.805 1.00 64.43 C ATOM 1179 CD2 PHE A 74 6.399 -0.422 -2.925 1.00 43.50 C ATOM 1180 CE1 PHE A 74 7.134 -1.546 -0.516 1.00 44.13 C ATOM 1181 CE2 PHE A 74 7.736 -0.632 -2.642 1.00 1.24 C ATOM 1182 CZ PHE A 74 8.103 -1.197 -1.435 1.00 44.24 C ATOM 0 H PHE A 74 4.109 -2.565 -3.921 1.00 42.30 H new ATOM 0 HA PHE A 74 3.072 -2.139 -1.201 1.00 70.13 H new ATOM 0 HB2 PHE A 74 3.881 -0.119 -3.326 1.00 1.25 H new ATOM 0 HB3 PHE A 74 3.569 0.205 -1.632 1.00 1.25 H new ATOM 0 HD1 PHE A 74 5.046 -1.609 -0.082 1.00 64.43 H new ATOM 0 HD2 PHE A 74 6.116 0.018 -3.870 1.00 43.50 H new ATOM 0 HE1 PHE A 74 7.419 -1.985 0.429 1.00 44.13 H new ATOM 0 HE2 PHE A 74 8.492 -0.355 -3.362 1.00 1.24 H new ATOM 0 HZ PHE A 74 9.146 -1.365 -1.211 1.00 44.24 H new ATOM 1192 N VAL A 75 0.851 -1.060 -1.786 1.00 64.22 N ATOM 1193 CA VAL A 75 -0.534 -0.739 -2.106 1.00 31.32 C ATOM 1194 C VAL A 75 -1.089 0.314 -1.153 1.00 64.22 C ATOM 1195 O VAL A 75 -1.065 0.139 0.065 1.00 74.32 O ATOM 1196 CB VAL A 75 -1.428 -1.992 -2.046 1.00 52.31 C ATOM 1197 CG1 VAL A 75 -2.822 -1.678 -2.569 1.00 13.55 C ATOM 1198 CG2 VAL A 75 -0.800 -3.133 -2.832 1.00 11.05 C ATOM 0 H VAL A 75 1.104 -0.910 -0.809 1.00 64.22 H new ATOM 0 HA VAL A 75 -0.541 -0.344 -3.122 1.00 31.32 H new ATOM 0 HB VAL A 75 -1.517 -2.304 -1.005 1.00 52.31 H new ATOM 0 HG11 VAL A 75 -3.440 -2.575 -2.519 1.00 13.55 H new ATOM 0 HG12 VAL A 75 -3.271 -0.894 -1.960 1.00 13.55 H new ATOM 0 HG13 VAL A 75 -2.755 -1.340 -3.603 1.00 13.55 H new ATOM 0 HG21 VAL A 75 -1.445 -4.010 -2.779 1.00 11.05 H new ATOM 0 HG22 VAL A 75 -0.679 -2.834 -3.873 1.00 11.05 H new ATOM 0 HG23 VAL A 75 0.175 -3.374 -2.408 1.00 11.05 H new ATOM 1208 N VAL A 76 -1.587 1.410 -1.716 1.00 74.14 N ATOM 1209 CA VAL A 76 -2.149 2.492 -0.918 1.00 11.33 C ATOM 1210 C VAL A 76 -3.664 2.566 -1.079 1.00 71.43 C ATOM 1211 O VAL A 76 -4.168 3.115 -2.059 1.00 20.11 O ATOM 1212 CB VAL A 76 -1.537 3.852 -1.303 1.00 70.55 C ATOM 1213 CG1 VAL A 76 -2.343 4.991 -0.699 1.00 11.51 C ATOM 1214 CG2 VAL A 76 -0.083 3.924 -0.862 1.00 41.41 C ATOM 0 H VAL A 76 -1.613 1.572 -2.723 1.00 74.14 H new ATOM 0 HA VAL A 76 -1.907 2.274 0.122 1.00 11.33 H new ATOM 0 HB VAL A 76 -1.570 3.952 -2.388 1.00 70.55 H new ATOM 0 HG11 VAL A 76 -1.895 5.944 -0.982 1.00 11.51 H new ATOM 0 HG12 VAL A 76 -3.368 4.948 -1.068 1.00 11.51 H new ATOM 0 HG13 VAL A 76 -2.345 4.899 0.387 1.00 11.51 H new ATOM 0 HG21 VAL A 76 0.335 4.891 -1.142 1.00 41.41 H new ATOM 0 HG22 VAL A 76 -0.024 3.802 0.220 1.00 41.41 H new ATOM 0 HG23 VAL A 76 0.484 3.130 -1.348 1.00 41.41 H new ATOM 1224 N TYR A 77 -4.384 2.008 -0.112 1.00 42.25 N ATOM 1225 CA TYR A 77 -5.842 2.008 -0.148 1.00 64.44 C ATOM 1226 C TYR A 77 -6.404 3.224 0.581 1.00 1.10 C ATOM 1227 O TYR A 77 -5.972 3.555 1.685 1.00 34.33 O ATOM 1228 CB TYR A 77 -6.388 0.724 0.480 1.00 4.50 C ATOM 1229 CG TYR A 77 -7.875 0.539 0.280 1.00 23.51 C ATOM 1230 CD1 TYR A 77 -8.468 0.793 -0.950 1.00 51.31 C ATOM 1231 CD2 TYR A 77 -8.687 0.106 1.322 1.00 43.14 C ATOM 1232 CE1 TYR A 77 -9.827 0.625 -1.136 1.00 42.33 C ATOM 1233 CE2 TYR A 77 -10.046 -0.065 1.144 1.00 75.20 C ATOM 1234 CZ TYR A 77 -10.612 0.196 -0.087 1.00 22.32 C ATOM 1235 OH TYR A 77 -11.965 0.026 -0.269 1.00 24.44 O ATOM 0 H TYR A 77 -3.982 1.550 0.706 1.00 42.25 H new ATOM 0 HA TYR A 77 -6.155 2.056 -1.191 1.00 64.44 H new ATOM 0 HB2 TYR A 77 -5.863 -0.131 0.054 1.00 4.50 H new ATOM 0 HB3 TYR A 77 -6.171 0.731 1.548 1.00 4.50 H new ATOM 0 HD1 TYR A 77 -7.857 1.127 -1.775 1.00 51.31 H new ATOM 0 HD2 TYR A 77 -8.248 -0.100 2.287 1.00 43.14 H new ATOM 0 HE1 TYR A 77 -10.272 0.829 -2.099 1.00 42.33 H new ATOM 0 HE2 TYR A 77 -10.663 -0.401 1.964 1.00 75.20 H new ATOM 0 HH TYR A 77 -12.185 0.145 -1.217 1.00 24.44 H new ATOM 1245 N SER A 78 -7.372 3.886 -0.046 1.00 40.14 N ATOM 1246 CA SER A 78 -7.992 5.069 0.541 1.00 74.45 C ATOM 1247 C SER A 78 -9.465 4.813 0.847 1.00 21.30 C ATOM 1248 O SER A 78 -10.321 4.916 -0.032 1.00 15.12 O ATOM 1249 CB SER A 78 -7.858 6.263 -0.405 1.00 5.22 C ATOM 1250 OG SER A 78 -8.392 7.439 0.179 1.00 22.53 O ATOM 0 H SER A 78 -7.743 3.624 -0.959 1.00 40.14 H new ATOM 0 HA SER A 78 -7.477 5.294 1.475 1.00 74.45 H new ATOM 0 HB2 SER A 78 -6.808 6.420 -0.651 1.00 5.22 H new ATOM 0 HB3 SER A 78 -8.376 6.050 -1.340 1.00 5.22 H new ATOM 0 HG SER A 78 -8.293 8.188 -0.445 1.00 22.53 H new ATOM 1256 N TYR A 79 -9.753 4.477 2.099 1.00 5.44 N ATOM 1257 CA TYR A 79 -11.120 4.204 2.524 1.00 75.04 C ATOM 1258 C TYR A 79 -11.837 5.493 2.915 1.00 50.12 C ATOM 1259 O TYR A 79 -11.216 6.547 3.050 1.00 71.40 O ATOM 1260 CB TYR A 79 -11.127 3.227 3.700 1.00 20.32 C ATOM 1261 CG TYR A 79 -12.510 2.928 4.231 1.00 2.34 C ATOM 1262 CD1 TYR A 79 -13.270 1.890 3.706 1.00 32.13 C ATOM 1263 CD2 TYR A 79 -13.058 3.684 5.261 1.00 35.04 C ATOM 1264 CE1 TYR A 79 -14.535 1.614 4.188 1.00 4.15 C ATOM 1265 CE2 TYR A 79 -14.322 3.414 5.751 1.00 3.21 C ATOM 1266 CZ TYR A 79 -15.056 2.379 5.212 1.00 61.33 C ATOM 1267 OH TYR A 79 -16.315 2.107 5.696 1.00 15.11 O ATOM 0 H TYR A 79 -9.056 4.387 2.839 1.00 5.44 H new ATOM 0 HA TYR A 79 -11.650 3.754 1.685 1.00 75.04 H new ATOM 0 HB2 TYR A 79 -10.657 2.294 3.389 1.00 20.32 H new ATOM 0 HB3 TYR A 79 -10.519 3.637 4.506 1.00 20.32 H new ATOM 0 HD1 TYR A 79 -12.864 1.288 2.906 1.00 32.13 H new ATOM 0 HD2 TYR A 79 -12.486 4.496 5.686 1.00 35.04 H new ATOM 0 HE1 TYR A 79 -15.113 0.805 3.766 1.00 4.15 H new ATOM 0 HE2 TYR A 79 -14.732 4.011 6.552 1.00 3.21 H new ATOM 0 HH TYR A 79 -16.788 1.523 5.067 1.00 15.11 H new ATOM 1277 N LYS A 80 -13.150 5.400 3.096 1.00 75.44 N ATOM 1278 CA LYS A 80 -13.955 6.556 3.474 1.00 63.01 C ATOM 1279 C LYS A 80 -14.678 6.306 4.793 1.00 53.52 C ATOM 1280 O LYS A 80 -15.657 5.560 4.845 1.00 3.41 O ATOM 1281 CB LYS A 80 -14.970 6.877 2.375 1.00 75.30 C ATOM 1282 CG LYS A 80 -15.818 8.103 2.669 1.00 4.22 C ATOM 1283 CD LYS A 80 -16.935 8.267 1.652 1.00 25.20 C ATOM 1284 CE LYS A 80 -17.529 9.665 1.698 1.00 11.31 C ATOM 1285 NZ LYS A 80 -17.730 10.228 0.334 1.00 43.41 N ATOM 0 H LYS A 80 -13.680 4.535 2.987 1.00 75.44 H new ATOM 0 HA LYS A 80 -13.287 7.408 3.602 1.00 63.01 H new ATOM 0 HB2 LYS A 80 -14.439 7.030 1.435 1.00 75.30 H new ATOM 0 HB3 LYS A 80 -15.625 6.017 2.235 1.00 75.30 H new ATOM 0 HG2 LYS A 80 -16.245 8.020 3.669 1.00 4.22 H new ATOM 0 HG3 LYS A 80 -15.187 8.992 2.664 1.00 4.22 H new ATOM 0 HD2 LYS A 80 -16.550 8.067 0.652 1.00 25.20 H new ATOM 0 HD3 LYS A 80 -17.716 7.532 1.846 1.00 25.20 H new ATOM 0 HE2 LYS A 80 -18.484 9.637 2.223 1.00 11.31 H new ATOM 0 HE3 LYS A 80 -16.871 10.321 2.268 1.00 11.31 H new ATOM 0 HZ1 LYS A 80 -17.772 11.266 0.390 1.00 43.41 H new ATOM 0 HZ2 LYS A 80 -16.938 9.946 -0.278 1.00 43.41 H new ATOM 0 HZ3 LYS A 80 -18.620 9.866 -0.063 1.00 43.41 H new ATOM 1299 N TYR A 81 -14.193 6.937 5.857 1.00 12.32 N ATOM 1300 CA TYR A 81 -14.793 6.784 7.177 1.00 70.11 C ATOM 1301 C TYR A 81 -15.665 7.987 7.522 1.00 33.02 C ATOM 1302 O TYR A 81 -15.247 9.135 7.373 1.00 4.44 O ATOM 1303 CB TYR A 81 -13.707 6.607 8.237 1.00 24.23 C ATOM 1304 CG TYR A 81 -14.040 5.562 9.278 1.00 70.51 C ATOM 1305 CD1 TYR A 81 -15.112 5.733 10.144 1.00 33.43 C ATOM 1306 CD2 TYR A 81 -13.282 4.403 9.395 1.00 44.02 C ATOM 1307 CE1 TYR A 81 -15.420 4.781 11.097 1.00 52.03 C ATOM 1308 CE2 TYR A 81 -13.583 3.446 10.343 1.00 20.51 C ATOM 1309 CZ TYR A 81 -14.653 3.639 11.192 1.00 1.24 C ATOM 1310 OH TYR A 81 -14.955 2.687 12.140 1.00 54.55 O ATOM 0 H TYR A 81 -13.385 7.560 5.831 1.00 12.32 H new ATOM 0 HA TYR A 81 -15.423 5.894 7.160 1.00 70.11 H new ATOM 0 HB2 TYR A 81 -12.773 6.334 7.746 1.00 24.23 H new ATOM 0 HB3 TYR A 81 -13.538 7.562 8.734 1.00 24.23 H new ATOM 0 HD1 TYR A 81 -15.716 6.626 10.071 1.00 33.43 H new ATOM 0 HD2 TYR A 81 -12.443 4.248 8.733 1.00 44.02 H new ATOM 0 HE1 TYR A 81 -16.257 4.930 11.764 1.00 52.03 H new ATOM 0 HE2 TYR A 81 -12.984 2.551 10.420 1.00 20.51 H new ATOM 0 HH TYR A 81 -14.691 1.802 11.811 1.00 54.55 H new ATOM 1320 N VAL A 82 -16.883 7.715 7.985 1.00 5.13 N ATOM 1321 CA VAL A 82 -17.814 8.774 8.354 1.00 14.32 C ATOM 1322 C VAL A 82 -17.691 9.124 9.832 1.00 34.23 C ATOM 1323 O VAL A 82 -17.130 8.359 10.618 1.00 61.12 O ATOM 1324 CB VAL A 82 -19.270 8.371 8.053 1.00 61.21 C ATOM 1325 CG1 VAL A 82 -20.188 9.580 8.136 1.00 11.33 C ATOM 1326 CG2 VAL A 82 -19.366 7.710 6.686 1.00 11.13 C ATOM 0 H VAL A 82 -17.246 6.771 8.113 1.00 5.13 H new ATOM 0 HA VAL A 82 -17.554 9.646 7.754 1.00 14.32 H new ATOM 0 HB VAL A 82 -19.592 7.650 8.804 1.00 61.21 H new ATOM 0 HG11 VAL A 82 -21.212 9.275 7.920 1.00 11.33 H new ATOM 0 HG12 VAL A 82 -20.140 10.005 9.138 1.00 11.33 H new ATOM 0 HG13 VAL A 82 -19.871 10.328 7.409 1.00 11.33 H new ATOM 0 HG21 VAL A 82 -20.401 7.431 6.489 1.00 11.13 H new ATOM 0 HG22 VAL A 82 -19.025 8.407 5.920 1.00 11.13 H new ATOM 0 HG23 VAL A 82 -18.740 6.818 6.669 1.00 11.13 H new ATOM 1336 N HIS A 83 -18.219 10.285 10.206 1.00 34.13 N ATOM 1337 CA HIS A 83 -18.170 10.737 11.592 1.00 5.15 C ATOM 1338 C HIS A 83 -19.508 10.506 12.288 1.00 72.02 C ATOM 1339 O HIS A 83 -19.760 9.430 12.830 1.00 53.15 O ATOM 1340 CB HIS A 83 -17.797 12.218 11.656 1.00 53.24 C ATOM 1341 CG HIS A 83 -16.369 12.492 11.297 1.00 13.52 C ATOM 1342 ND1 HIS A 83 -15.487 13.120 12.152 1.00 64.32 N ATOM 1343 CD2 HIS A 83 -15.669 12.221 10.171 1.00 14.02 C ATOM 1344 CE1 HIS A 83 -14.306 13.222 11.565 1.00 13.21 C ATOM 1345 NE2 HIS A 83 -14.391 12.683 10.362 1.00 13.41 N ATOM 0 H HIS A 83 -18.686 10.930 9.569 1.00 34.13 H new ATOM 0 HA HIS A 83 -17.407 10.156 12.110 1.00 5.15 H new ATOM 0 HB2 HIS A 83 -18.446 12.777 10.982 1.00 53.24 H new ATOM 0 HB3 HIS A 83 -17.988 12.589 12.663 1.00 53.24 H new ATOM 0 HD2 HIS A 83 -16.046 11.731 9.285 1.00 14.02 H new ATOM 0 HE1 HIS A 83 -13.423 13.670 11.996 1.00 13.21 H new ATOM 0 HE2 HIS A 83 -13.630 12.620 9.685 1.00 13.41 H new ATOM 1354 N ASP A 84 -20.362 11.524 12.268 1.00 22.33 N ATOM 1355 CA ASP A 84 -21.674 11.433 12.896 1.00 11.14 C ATOM 1356 C ASP A 84 -22.495 12.689 12.625 1.00 55.33 C ATOM 1357 O ASP A 84 -23.576 12.622 12.038 1.00 70.43 O ATOM 1358 CB ASP A 84 -21.528 11.220 14.404 1.00 14.52 C ATOM 1359 CG ASP A 84 -22.765 10.597 15.024 1.00 64.12 C ATOM 1360 OD1 ASP A 84 -23.682 11.353 15.404 1.00 75.12 O ATOM 1361 OD2 ASP A 84 -22.812 9.353 15.128 1.00 53.12 O ATOM 0 H ASP A 84 -20.169 12.421 11.824 1.00 22.33 H new ATOM 0 HA ASP A 84 -22.197 10.579 12.465 1.00 11.14 H new ATOM 0 HB2 ASP A 84 -20.667 10.579 14.596 1.00 14.52 H new ATOM 0 HB3 ASP A 84 -21.327 12.177 14.885 1.00 14.52 H new ATOM 1366 N ASP A 85 -21.977 13.833 13.056 1.00 0.11 N ATOM 1367 CA ASP A 85 -22.662 15.105 12.859 1.00 14.31 C ATOM 1368 C ASP A 85 -22.959 15.339 11.381 1.00 53.00 C ATOM 1369 O ASP A 85 -23.757 16.207 11.028 1.00 43.21 O ATOM 1370 CB ASP A 85 -21.816 16.255 13.410 1.00 42.04 C ATOM 1371 CG ASP A 85 -22.656 17.322 14.083 1.00 72.12 C ATOM 1372 OD1 ASP A 85 -23.787 17.005 14.508 1.00 54.03 O ATOM 1373 OD2 ASP A 85 -22.183 18.473 14.186 1.00 60.24 O ATOM 0 H ASP A 85 -21.085 13.906 13.544 1.00 0.11 H new ATOM 0 HA ASP A 85 -23.608 15.068 13.400 1.00 14.31 H new ATOM 0 HB2 ASP A 85 -21.094 15.861 14.125 1.00 42.04 H new ATOM 0 HB3 ASP A 85 -21.246 16.705 12.597 1.00 42.04 H new ATOM 1378 N GLY A 86 -22.313 14.558 10.522 1.00 65.12 N ATOM 1379 CA GLY A 86 -22.521 14.697 9.092 1.00 64.30 C ATOM 1380 C GLY A 86 -21.222 14.884 8.333 1.00 74.25 C ATOM 1381 O GLY A 86 -21.230 15.240 7.154 1.00 74.32 O ATOM 0 H GLY A 86 -21.649 13.831 10.790 1.00 65.12 H new ATOM 0 HA2 GLY A 86 -23.035 13.813 8.715 1.00 64.30 H new ATOM 0 HA3 GLY A 86 -23.174 15.549 8.904 1.00 64.30 H new ATOM 1385 N ARG A 87 -20.103 14.645 9.008 1.00 51.20 N ATOM 1386 CA ARG A 87 -18.791 14.793 8.390 1.00 4.43 C ATOM 1387 C ARG A 87 -18.196 13.431 8.045 1.00 12.04 C ATOM 1388 O ARG A 87 -18.355 12.465 8.792 1.00 31.42 O ATOM 1389 CB ARG A 87 -17.847 15.552 9.324 1.00 42.52 C ATOM 1390 CG ARG A 87 -18.160 17.036 9.434 1.00 30.41 C ATOM 1391 CD ARG A 87 -17.892 17.761 8.125 1.00 65.20 C ATOM 1392 NE ARG A 87 -18.038 19.207 8.261 1.00 70.04 N ATOM 1393 CZ ARG A 87 -18.229 20.025 7.231 1.00 14.42 C ATOM 1394 NH1 ARG A 87 -18.296 19.542 5.999 1.00 44.33 N ATOM 1395 NH2 ARG A 87 -18.354 21.331 7.435 1.00 54.02 N ATOM 0 H ARG A 87 -20.078 14.348 9.983 1.00 51.20 H new ATOM 0 HA ARG A 87 -18.913 15.361 7.468 1.00 4.43 H new ATOM 0 HB2 ARG A 87 -17.895 15.105 10.317 1.00 42.52 H new ATOM 0 HB3 ARG A 87 -16.824 15.431 8.969 1.00 42.52 H new ATOM 0 HG2 ARG A 87 -19.204 17.169 9.717 1.00 30.41 H new ATOM 0 HG3 ARG A 87 -17.556 17.478 10.226 1.00 30.41 H new ATOM 0 HD2 ARG A 87 -16.884 17.529 7.782 1.00 65.20 H new ATOM 0 HD3 ARG A 87 -18.580 17.397 7.362 1.00 65.20 H new ATOM 0 HE ARG A 87 -17.991 19.611 9.196 1.00 70.04 H new ATOM 0 HH11 ARG A 87 -18.201 18.539 5.838 1.00 44.33 H new ATOM 0 HH12 ARG A 87 -18.443 20.173 5.211 1.00 44.33 H new ATOM 0 HH21 ARG A 87 -18.303 21.706 8.382 1.00 54.02 H new ATOM 0 HH22 ARG A 87 -18.501 21.959 6.645 1.00 54.02 H new ATOM 1409 N VAL A 88 -17.511 13.361 6.908 1.00 51.02 N ATOM 1410 CA VAL A 88 -16.892 12.117 6.464 1.00 3.31 C ATOM 1411 C VAL A 88 -15.533 12.378 5.826 1.00 64.14 C ATOM 1412 O VAL A 88 -15.395 13.251 4.968 1.00 21.43 O ATOM 1413 CB VAL A 88 -17.787 11.374 5.455 1.00 74.03 C ATOM 1414 CG1 VAL A 88 -18.175 12.294 4.307 1.00 60.42 C ATOM 1415 CG2 VAL A 88 -17.084 10.128 4.937 1.00 51.23 C ATOM 0 H VAL A 88 -17.371 14.151 6.278 1.00 51.02 H new ATOM 0 HA VAL A 88 -16.761 11.494 7.349 1.00 3.31 H new ATOM 0 HB VAL A 88 -18.699 11.063 5.964 1.00 74.03 H new ATOM 0 HG11 VAL A 88 -18.807 11.752 3.604 1.00 60.42 H new ATOM 0 HG12 VAL A 88 -18.720 13.153 4.698 1.00 60.42 H new ATOM 0 HG13 VAL A 88 -17.276 12.637 3.796 1.00 60.42 H new ATOM 0 HG21 VAL A 88 -17.731 9.615 4.225 1.00 51.23 H new ATOM 0 HG22 VAL A 88 -16.155 10.413 4.443 1.00 51.23 H new ATOM 0 HG23 VAL A 88 -16.862 9.462 5.771 1.00 51.23 H new ATOM 1425 N SER A 89 -14.531 11.614 6.249 1.00 44.11 N ATOM 1426 CA SER A 89 -13.179 11.764 5.720 1.00 11.34 C ATOM 1427 C SER A 89 -12.669 10.445 5.150 1.00 2.11 C ATOM 1428 O SER A 89 -13.264 9.389 5.371 1.00 2.23 O ATOM 1429 CB SER A 89 -12.233 12.260 6.816 1.00 1.11 C ATOM 1430 OG SER A 89 -12.624 13.537 7.288 1.00 33.13 O ATOM 0 H SER A 89 -14.629 10.885 6.956 1.00 44.11 H new ATOM 0 HA SER A 89 -13.209 12.499 4.916 1.00 11.34 H new ATOM 0 HB2 SER A 89 -12.226 11.550 7.643 1.00 1.11 H new ATOM 0 HB3 SER A 89 -11.216 12.308 6.428 1.00 1.11 H new ATOM 0 HG SER A 89 -12.005 13.831 7.989 1.00 33.13 H new ATOM 1436 N TYR A 90 -11.564 10.512 4.417 1.00 54.44 N ATOM 1437 CA TYR A 90 -10.974 9.324 3.811 1.00 15.21 C ATOM 1438 C TYR A 90 -9.590 9.049 4.390 1.00 45.44 C ATOM 1439 O TYR A 90 -8.583 9.602 3.946 1.00 4.20 O ATOM 1440 CB TYR A 90 -10.882 9.491 2.294 1.00 12.13 C ATOM 1441 CG TYR A 90 -11.984 10.346 1.710 1.00 3.35 C ATOM 1442 CD1 TYR A 90 -13.224 9.800 1.402 1.00 22.11 C ATOM 1443 CD2 TYR A 90 -11.785 11.700 1.467 1.00 74.22 C ATOM 1444 CE1 TYR A 90 -14.234 10.576 0.867 1.00 0.34 C ATOM 1445 CE2 TYR A 90 -12.790 12.484 0.935 1.00 32.03 C ATOM 1446 CZ TYR A 90 -14.013 11.919 0.636 1.00 30.45 C ATOM 1447 OH TYR A 90 -15.015 12.696 0.105 1.00 11.04 O ATOM 0 H TYR A 90 -11.058 11.377 4.228 1.00 54.44 H new ATOM 0 HA TYR A 90 -11.618 8.474 4.036 1.00 15.21 H new ATOM 0 HB2 TYR A 90 -9.918 9.935 2.044 1.00 12.13 H new ATOM 0 HB3 TYR A 90 -10.911 8.507 1.826 1.00 12.13 H new ATOM 0 HD1 TYR A 90 -13.401 8.750 1.584 1.00 22.11 H new ATOM 0 HD2 TYR A 90 -10.829 12.146 1.698 1.00 74.22 H new ATOM 0 HE1 TYR A 90 -15.191 10.135 0.631 1.00 0.34 H new ATOM 0 HE2 TYR A 90 -12.619 13.535 0.754 1.00 32.03 H new ATOM 0 HH TYR A 90 -14.697 13.618 0.006 1.00 11.04 H new ATOM 1457 N PRO A 91 -9.536 8.174 5.404 1.00 1.43 N ATOM 1458 CA PRO A 91 -8.281 7.804 6.065 1.00 61.40 C ATOM 1459 C PRO A 91 -7.377 6.967 5.166 1.00 20.22 C ATOM 1460 O PRO A 91 -7.535 5.749 5.071 1.00 41.02 O ATOM 1461 CB PRO A 91 -8.743 6.983 7.272 1.00 72.24 C ATOM 1462 CG PRO A 91 -10.071 6.437 6.871 1.00 23.22 C ATOM 1463 CD PRO A 91 -10.696 7.478 5.984 1.00 34.41 C ATOM 0 HA PRO A 91 -7.687 8.679 6.330 1.00 61.40 H new ATOM 0 HB2 PRO A 91 -8.038 6.183 7.500 1.00 72.24 H new ATOM 0 HB3 PRO A 91 -8.823 7.602 8.165 1.00 72.24 H new ATOM 0 HG2 PRO A 91 -9.960 5.490 6.343 1.00 23.22 H new ATOM 0 HG3 PRO A 91 -10.694 6.244 7.745 1.00 23.22 H new ATOM 0 HD2 PRO A 91 -11.320 7.026 5.213 1.00 34.41 H new ATOM 0 HD3 PRO A 91 -11.331 8.159 6.550 1.00 34.41 H new ATOM 1471 N LEU A 92 -6.429 7.626 4.508 1.00 14.02 N ATOM 1472 CA LEU A 92 -5.499 6.942 3.617 1.00 73.12 C ATOM 1473 C LEU A 92 -4.478 6.134 4.411 1.00 33.02 C ATOM 1474 O LEU A 92 -3.771 6.674 5.263 1.00 53.00 O ATOM 1475 CB LEU A 92 -4.782 7.954 2.722 1.00 30.12 C ATOM 1476 CG LEU A 92 -5.237 8.003 1.264 1.00 72.53 C ATOM 1477 CD1 LEU A 92 -5.844 9.359 0.938 1.00 61.50 C ATOM 1478 CD2 LEU A 92 -4.073 7.699 0.332 1.00 10.10 C ATOM 0 H LEU A 92 -6.285 8.633 4.575 1.00 14.02 H new ATOM 0 HA LEU A 92 -6.071 6.255 2.993 1.00 73.12 H new ATOM 0 HB2 LEU A 92 -4.910 8.946 3.155 1.00 30.12 H new ATOM 0 HB3 LEU A 92 -3.715 7.733 2.741 1.00 30.12 H new ATOM 0 HG LEU A 92 -6.003 7.242 1.117 1.00 72.53 H new ATOM 0 HD11 LEU A 92 -6.162 9.374 -0.105 1.00 61.50 H new ATOM 0 HD12 LEU A 92 -6.705 9.537 1.582 1.00 61.50 H new ATOM 0 HD13 LEU A 92 -5.101 10.139 1.102 1.00 61.50 H new ATOM 0 HD21 LEU A 92 -4.415 7.738 -0.702 1.00 10.10 H new ATOM 0 HD22 LEU A 92 -3.285 8.437 0.482 1.00 10.10 H new ATOM 0 HD23 LEU A 92 -3.684 6.704 0.548 1.00 10.10 H new ATOM 1490 N CYS A 93 -4.406 4.839 4.126 1.00 70.14 N ATOM 1491 CA CYS A 93 -3.470 3.956 4.813 1.00 60.31 C ATOM 1492 C CYS A 93 -2.560 3.246 3.815 1.00 34.23 C ATOM 1493 O CYS A 93 -2.915 3.075 2.649 1.00 72.31 O ATOM 1494 CB CYS A 93 -4.230 2.927 5.651 1.00 22.33 C ATOM 1495 SG CYS A 93 -5.200 3.644 6.999 1.00 63.54 S ATOM 0 H CYS A 93 -4.984 4.377 3.424 1.00 70.14 H new ATOM 0 HA CYS A 93 -2.851 4.565 5.472 1.00 60.31 H new ATOM 0 HB2 CYS A 93 -4.896 2.363 4.998 1.00 22.33 H new ATOM 0 HB3 CYS A 93 -3.517 2.216 6.069 1.00 22.33 H new ATOM 0 HG CYS A 93 -5.007 2.957 8.086 1.00 63.54 H new ATOM 1501 N PHE A 94 -1.387 2.836 4.281 1.00 44.00 N ATOM 1502 CA PHE A 94 -0.424 2.147 3.429 1.00 23.52 C ATOM 1503 C PHE A 94 -0.507 0.635 3.627 1.00 12.32 C ATOM 1504 O PHE A 94 -0.032 0.103 4.631 1.00 54.33 O ATOM 1505 CB PHE A 94 0.996 2.634 3.729 1.00 53.31 C ATOM 1506 CG PHE A 94 2.029 2.090 2.783 1.00 33.44 C ATOM 1507 CD1 PHE A 94 2.145 2.594 1.498 1.00 21.34 C ATOM 1508 CD2 PHE A 94 2.882 1.073 3.181 1.00 70.44 C ATOM 1509 CE1 PHE A 94 3.094 2.094 0.627 1.00 62.13 C ATOM 1510 CE2 PHE A 94 3.833 0.569 2.313 1.00 2.04 C ATOM 1511 CZ PHE A 94 3.940 1.081 1.035 1.00 1.31 C ATOM 0 H PHE A 94 -1.079 2.968 5.244 1.00 44.00 H new ATOM 0 HA PHE A 94 -0.667 2.375 2.391 1.00 23.52 H new ATOM 0 HB2 PHE A 94 1.014 3.723 3.687 1.00 53.31 H new ATOM 0 HB3 PHE A 94 1.262 2.349 4.747 1.00 53.31 H new ATOM 0 HD1 PHE A 94 1.487 3.386 1.173 1.00 21.34 H new ATOM 0 HD2 PHE A 94 2.803 0.670 4.180 1.00 70.44 H new ATOM 0 HE1 PHE A 94 3.174 2.495 -0.373 1.00 62.13 H new ATOM 0 HE2 PHE A 94 4.492 -0.224 2.634 1.00 2.04 H new ATOM 0 HZ PHE A 94 4.683 0.690 0.356 1.00 1.31 H new ATOM 1521 N ILE A 95 -1.114 -0.049 2.663 1.00 51.00 N ATOM 1522 CA ILE A 95 -1.259 -1.497 2.731 1.00 72.23 C ATOM 1523 C ILE A 95 -0.111 -2.199 2.013 1.00 44.35 C ATOM 1524 O ILE A 95 -0.009 -2.150 0.787 1.00 5.42 O ATOM 1525 CB ILE A 95 -2.593 -1.959 2.115 1.00 55.54 C ATOM 1526 CG1 ILE A 95 -3.771 -1.397 2.914 1.00 64.11 C ATOM 1527 CG2 ILE A 95 -2.656 -3.478 2.064 1.00 71.42 C ATOM 1528 CD1 ILE A 95 -5.120 -1.833 2.389 1.00 75.33 C ATOM 0 H ILE A 95 -1.513 0.376 1.826 1.00 51.00 H new ATOM 0 HA ILE A 95 -1.243 -1.766 3.787 1.00 72.23 H new ATOM 0 HB ILE A 95 -2.656 -1.579 1.095 1.00 55.54 H new ATOM 0 HG12 ILE A 95 -3.676 -1.710 3.954 1.00 64.11 H new ATOM 0 HG13 ILE A 95 -3.721 -0.308 2.903 1.00 64.11 H new ATOM 0 HG21 ILE A 95 -3.605 -3.788 1.626 1.00 71.42 H new ATOM 0 HG22 ILE A 95 -1.835 -3.856 1.455 1.00 71.42 H new ATOM 0 HG23 ILE A 95 -2.574 -3.880 3.074 1.00 71.42 H new ATOM 0 HD11 ILE A 95 -5.908 -1.397 3.003 1.00 75.33 H new ATOM 0 HD12 ILE A 95 -5.235 -1.497 1.359 1.00 75.33 H new ATOM 0 HD13 ILE A 95 -5.191 -2.920 2.426 1.00 75.33 H new ATOM 1540 N PHE A 96 0.750 -2.854 2.785 1.00 10.40 N ATOM 1541 CA PHE A 96 1.892 -3.566 2.223 1.00 33.10 C ATOM 1542 C PHE A 96 1.535 -5.021 1.932 1.00 13.00 C ATOM 1543 O PHE A 96 1.397 -5.832 2.847 1.00 35.22 O ATOM 1544 CB PHE A 96 3.082 -3.503 3.183 1.00 74.45 C ATOM 1545 CG PHE A 96 4.292 -4.242 2.686 1.00 42.34 C ATOM 1546 CD1 PHE A 96 4.408 -4.589 1.349 1.00 34.43 C ATOM 1547 CD2 PHE A 96 5.314 -4.588 3.555 1.00 31.10 C ATOM 1548 CE1 PHE A 96 5.520 -5.268 0.889 1.00 33.13 C ATOM 1549 CE2 PHE A 96 6.429 -5.265 3.101 1.00 63.42 C ATOM 1550 CZ PHE A 96 6.532 -5.607 1.766 1.00 12.11 C ATOM 0 H PHE A 96 0.679 -2.906 3.801 1.00 10.40 H new ATOM 0 HA PHE A 96 2.165 -3.082 1.285 1.00 33.10 H new ATOM 0 HB2 PHE A 96 3.347 -2.459 3.352 1.00 74.45 H new ATOM 0 HB3 PHE A 96 2.784 -3.916 4.146 1.00 74.45 H new ATOM 0 HD1 PHE A 96 3.620 -4.326 0.659 1.00 34.43 H new ATOM 0 HD2 PHE A 96 5.238 -4.325 4.600 1.00 31.10 H new ATOM 0 HE1 PHE A 96 5.598 -5.533 -0.155 1.00 33.13 H new ATOM 0 HE2 PHE A 96 7.220 -5.527 3.789 1.00 63.42 H new ATOM 0 HZ PHE A 96 7.402 -6.138 1.409 1.00 12.11 H new ATOM 1560 N SER A 97 1.385 -5.343 0.651 1.00 1.44 N ATOM 1561 CA SER A 97 1.040 -6.698 0.239 1.00 0.30 C ATOM 1562 C SER A 97 2.266 -7.605 0.271 1.00 22.42 C ATOM 1563 O SER A 97 3.018 -7.687 -0.700 1.00 53.41 O ATOM 1564 CB SER A 97 0.437 -6.687 -1.167 1.00 60.21 C ATOM 1565 OG SER A 97 0.192 -8.005 -1.627 1.00 73.11 O ATOM 0 H SER A 97 1.497 -4.684 -0.119 1.00 1.44 H new ATOM 0 HA SER A 97 0.303 -7.088 0.941 1.00 0.30 H new ATOM 0 HB2 SER A 97 -0.495 -6.121 -1.162 1.00 60.21 H new ATOM 0 HB3 SER A 97 1.115 -6.179 -1.853 1.00 60.21 H new ATOM 0 HG SER A 97 -0.195 -7.971 -2.527 1.00 73.11 H new ATOM 1571 N SER A 98 2.460 -8.286 1.396 1.00 45.50 N ATOM 1572 CA SER A 98 3.597 -9.184 1.559 1.00 21.22 C ATOM 1573 C SER A 98 3.137 -10.564 2.021 1.00 22.41 C ATOM 1574 O SER A 98 2.875 -10.796 3.201 1.00 72.34 O ATOM 1575 CB SER A 98 4.594 -8.604 2.564 1.00 52.13 C ATOM 1576 OG SER A 98 5.910 -9.060 2.299 1.00 15.21 O ATOM 0 H SER A 98 1.845 -8.233 2.208 1.00 45.50 H new ATOM 0 HA SER A 98 4.087 -9.288 0.591 1.00 21.22 H new ATOM 0 HB2 SER A 98 4.567 -7.515 2.520 1.00 52.13 H new ATOM 0 HB3 SER A 98 4.304 -8.890 3.575 1.00 52.13 H new ATOM 0 HG SER A 98 6.478 -8.298 2.060 1.00 15.21 H new ATOM 1582 N PRO A 99 3.037 -11.502 1.068 1.00 71.44 N ATOM 1583 CA PRO A 99 2.609 -12.875 1.352 1.00 73.42 C ATOM 1584 C PRO A 99 3.650 -13.655 2.147 1.00 44.32 C ATOM 1585 O PRO A 99 4.556 -13.071 2.742 1.00 63.05 O ATOM 1586 CB PRO A 99 2.432 -13.487 -0.041 1.00 23.10 C ATOM 1587 CG PRO A 99 3.333 -12.691 -0.921 1.00 32.10 C ATOM 1588 CD PRO A 99 3.333 -11.296 -0.360 1.00 21.55 C ATOM 0 HA PRO A 99 1.707 -12.902 1.963 1.00 73.42 H new ATOM 0 HB2 PRO A 99 2.704 -14.543 -0.047 1.00 23.10 H new ATOM 0 HB3 PRO A 99 1.396 -13.423 -0.373 1.00 23.10 H new ATOM 0 HG2 PRO A 99 4.340 -13.109 -0.929 1.00 32.10 H new ATOM 0 HG3 PRO A 99 2.978 -12.697 -1.951 1.00 32.10 H new ATOM 0 HD2 PRO A 99 4.295 -10.805 -0.504 1.00 21.55 H new ATOM 0 HD3 PRO A 99 2.581 -10.670 -0.840 1.00 21.55 H new ATOM 1596 N VAL A 100 3.516 -14.978 2.154 1.00 63.15 N ATOM 1597 CA VAL A 100 4.447 -15.837 2.875 1.00 41.04 C ATOM 1598 C VAL A 100 5.123 -16.826 1.933 1.00 61.45 C ATOM 1599 O VAL A 100 6.299 -17.152 2.097 1.00 33.43 O ATOM 1600 CB VAL A 100 3.736 -16.617 3.997 1.00 62.24 C ATOM 1601 CG1 VAL A 100 4.622 -17.744 4.508 1.00 53.45 C ATOM 1602 CG2 VAL A 100 3.344 -15.681 5.130 1.00 71.12 C ATOM 0 H VAL A 100 2.771 -15.478 1.668 1.00 63.15 H new ATOM 0 HA VAL A 100 5.202 -15.186 3.317 1.00 41.04 H new ATOM 0 HB VAL A 100 2.826 -17.058 3.589 1.00 62.24 H new ATOM 0 HG11 VAL A 100 4.103 -18.284 5.300 1.00 53.45 H new ATOM 0 HG12 VAL A 100 4.848 -18.428 3.690 1.00 53.45 H new ATOM 0 HG13 VAL A 100 5.550 -17.328 4.900 1.00 53.45 H new ATOM 0 HG21 VAL A 100 2.843 -16.249 5.914 1.00 71.12 H new ATOM 0 HG22 VAL A 100 4.238 -15.210 5.538 1.00 71.12 H new ATOM 0 HG23 VAL A 100 2.670 -14.913 4.751 1.00 71.12 H new ATOM 1612 N GLY A 101 4.374 -17.302 0.943 1.00 35.12 N ATOM 1613 CA GLY A 101 4.918 -18.250 -0.012 1.00 12.33 C ATOM 1614 C GLY A 101 5.804 -17.586 -1.047 1.00 11.23 C ATOM 1615 O GLY A 101 6.146 -18.192 -2.061 1.00 60.55 O ATOM 0 H GLY A 101 3.399 -17.048 0.785 1.00 35.12 H new ATOM 0 HA2 GLY A 101 5.492 -19.009 0.520 1.00 12.33 H new ATOM 0 HA3 GLY A 101 4.099 -18.765 -0.515 1.00 12.33 H new ATOM 1619 N CYS A 102 6.174 -16.336 -0.792 1.00 42.20 N ATOM 1620 CA CYS A 102 7.024 -15.588 -1.711 1.00 52.31 C ATOM 1621 C CYS A 102 8.497 -15.893 -1.462 1.00 30.34 C ATOM 1622 O CYS A 102 8.837 -16.695 -0.591 1.00 11.20 O ATOM 1623 CB CYS A 102 6.770 -14.086 -1.566 1.00 5.23 C ATOM 1624 SG CYS A 102 6.707 -13.511 0.148 1.00 35.22 S ATOM 0 H CYS A 102 5.899 -15.819 0.043 1.00 42.20 H new ATOM 0 HA CYS A 102 6.776 -15.895 -2.727 1.00 52.31 H new ATOM 0 HB2 CYS A 102 7.555 -13.543 -2.092 1.00 5.23 H new ATOM 0 HB3 CYS A 102 5.828 -13.838 -2.056 1.00 5.23 H new ATOM 0 HG CYS A 102 6.618 -12.214 0.168 1.00 35.22 H new ATOM 1630 N LYS A 103 9.368 -15.252 -2.232 1.00 51.44 N ATOM 1631 CA LYS A 103 10.805 -15.455 -2.096 1.00 4.53 C ATOM 1632 C LYS A 103 11.439 -14.333 -1.278 1.00 72.41 C ATOM 1633 O LYS A 103 11.002 -13.183 -1.315 1.00 43.33 O ATOM 1634 CB LYS A 103 11.464 -15.528 -3.476 1.00 1.33 C ATOM 1635 CG LYS A 103 10.629 -16.263 -4.510 1.00 2.34 C ATOM 1636 CD LYS A 103 10.356 -15.393 -5.726 1.00 21.34 C ATOM 1637 CE LYS A 103 11.643 -15.016 -6.442 1.00 22.44 C ATOM 1638 NZ LYS A 103 11.783 -15.728 -7.743 1.00 4.02 N ATOM 0 H LYS A 103 9.104 -14.586 -2.958 1.00 51.44 H new ATOM 0 HA LYS A 103 10.965 -16.398 -1.573 1.00 4.53 H new ATOM 0 HB2 LYS A 103 11.658 -14.516 -3.831 1.00 1.33 H new ATOM 0 HB3 LYS A 103 12.430 -16.024 -3.382 1.00 1.33 H new ATOM 0 HG2 LYS A 103 11.147 -17.170 -4.820 1.00 2.34 H new ATOM 0 HG3 LYS A 103 9.684 -16.572 -4.063 1.00 2.34 H new ATOM 0 HD2 LYS A 103 9.698 -15.924 -6.414 1.00 21.34 H new ATOM 0 HD3 LYS A 103 9.832 -14.489 -5.417 1.00 21.34 H new ATOM 0 HE2 LYS A 103 11.661 -13.940 -6.613 1.00 22.44 H new ATOM 0 HE3 LYS A 103 12.496 -15.252 -5.805 1.00 22.44 H new ATOM 0 HZ1 LYS A 103 12.673 -15.444 -8.200 1.00 4.02 H new ATOM 0 HZ2 LYS A 103 11.791 -16.755 -7.578 1.00 4.02 H new ATOM 0 HZ3 LYS A 103 10.983 -15.483 -8.361 1.00 4.02 H new ATOM 1652 N PRO A 104 12.492 -14.673 -0.522 1.00 4.15 N ATOM 1653 CA PRO A 104 13.209 -13.708 0.318 1.00 71.31 C ATOM 1654 C PRO A 104 14.001 -12.700 -0.506 1.00 5.30 C ATOM 1655 O PRO A 104 14.355 -11.627 -0.017 1.00 11.22 O ATOM 1656 CB PRO A 104 14.154 -14.587 1.140 1.00 21.41 C ATOM 1657 CG PRO A 104 14.360 -15.806 0.308 1.00 34.13 C ATOM 1658 CD PRO A 104 13.067 -16.026 -0.429 1.00 71.00 C ATOM 0 HA PRO A 104 12.528 -13.109 0.923 1.00 71.31 H new ATOM 0 HB2 PRO A 104 15.098 -14.078 1.336 1.00 21.41 H new ATOM 0 HB3 PRO A 104 13.720 -14.837 2.108 1.00 21.41 H new ATOM 0 HG2 PRO A 104 15.188 -15.669 -0.388 1.00 34.13 H new ATOM 0 HG3 PRO A 104 14.606 -16.666 0.930 1.00 34.13 H new ATOM 0 HD2 PRO A 104 13.235 -16.460 -1.415 1.00 71.00 H new ATOM 0 HD3 PRO A 104 12.408 -16.706 0.110 1.00 71.00 H new ATOM 1666 N GLU A 105 14.276 -13.050 -1.759 1.00 4.52 N ATOM 1667 CA GLU A 105 15.027 -12.173 -2.649 1.00 23.44 C ATOM 1668 C GLU A 105 14.199 -10.952 -3.038 1.00 33.43 C ATOM 1669 O GLU A 105 14.729 -9.852 -3.186 1.00 33.24 O ATOM 1670 CB GLU A 105 15.457 -12.933 -3.906 1.00 14.23 C ATOM 1671 CG GLU A 105 16.744 -13.721 -3.731 1.00 74.53 C ATOM 1672 CD GLU A 105 17.959 -12.828 -3.576 1.00 13.42 C ATOM 1673 OE1 GLU A 105 18.218 -12.373 -2.441 1.00 53.42 O ATOM 1674 OE2 GLU A 105 18.650 -12.584 -4.586 1.00 63.44 O ATOM 0 H GLU A 105 13.990 -13.934 -2.180 1.00 4.52 H new ATOM 0 HA GLU A 105 15.915 -11.833 -2.117 1.00 23.44 H new ATOM 0 HB2 GLU A 105 14.659 -13.616 -4.198 1.00 14.23 H new ATOM 0 HB3 GLU A 105 15.584 -12.223 -4.724 1.00 14.23 H new ATOM 0 HG2 GLU A 105 16.656 -14.363 -2.855 1.00 74.53 H new ATOM 0 HG3 GLU A 105 16.885 -14.374 -4.592 1.00 74.53 H new ATOM 1681 N GLN A 106 12.895 -11.157 -3.201 1.00 3.32 N ATOM 1682 CA GLN A 106 11.994 -10.073 -3.573 1.00 74.11 C ATOM 1683 C GLN A 106 11.466 -9.355 -2.336 1.00 3.52 C ATOM 1684 O GLN A 106 11.673 -8.153 -2.169 1.00 72.25 O ATOM 1685 CB GLN A 106 10.826 -10.614 -4.399 1.00 74.43 C ATOM 1686 CG GLN A 106 11.225 -11.716 -5.369 1.00 11.43 C ATOM 1687 CD GLN A 106 12.005 -11.191 -6.558 1.00 73.12 C ATOM 1688 OE1 GLN A 106 13.103 -11.664 -6.853 1.00 72.24 O ATOM 1689 NE2 GLN A 106 11.442 -10.207 -7.249 1.00 73.42 N ATOM 0 H GLN A 106 12.440 -12.062 -3.081 1.00 3.32 H new ATOM 0 HA GLN A 106 12.556 -9.358 -4.174 1.00 74.11 H new ATOM 0 HB2 GLN A 106 10.060 -10.996 -3.724 1.00 74.43 H new ATOM 0 HB3 GLN A 106 10.377 -9.794 -4.959 1.00 74.43 H new ATOM 0 HG2 GLN A 106 11.826 -12.458 -4.843 1.00 11.43 H new ATOM 0 HG3 GLN A 106 10.329 -12.225 -5.723 1.00 11.43 H new ATOM 0 HE21 GLN A 106 10.530 -9.844 -6.970 1.00 73.42 H new ATOM 0 HE22 GLN A 106 11.921 -9.814 -8.059 1.00 73.42 H new ATOM 1698 N GLN A 107 10.784 -10.099 -1.471 1.00 52.32 N ATOM 1699 CA GLN A 107 10.226 -9.532 -0.249 1.00 12.42 C ATOM 1700 C GLN A 107 11.143 -8.452 0.318 1.00 74.41 C ATOM 1701 O GLN A 107 10.681 -7.391 0.738 1.00 5.15 O ATOM 1702 CB GLN A 107 10.004 -10.629 0.794 1.00 54.43 C ATOM 1703 CG GLN A 107 8.590 -10.662 1.351 1.00 52.54 C ATOM 1704 CD GLN A 107 8.502 -10.094 2.754 1.00 72.33 C ATOM 1705 OE1 GLN A 107 8.020 -10.755 3.673 1.00 33.04 O ATOM 1706 NE2 GLN A 107 8.969 -8.863 2.925 1.00 25.22 N ATOM 0 H GLN A 107 10.605 -11.096 -1.594 1.00 52.32 H new ATOM 0 HA GLN A 107 9.267 -9.077 -0.495 1.00 12.42 H new ATOM 0 HB2 GLN A 107 10.232 -11.596 0.346 1.00 54.43 H new ATOM 0 HB3 GLN A 107 10.706 -10.485 1.615 1.00 54.43 H new ATOM 0 HG2 GLN A 107 7.931 -10.097 0.692 1.00 52.54 H new ATOM 0 HG3 GLN A 107 8.230 -11.691 1.356 1.00 52.54 H new ATOM 0 HE21 GLN A 107 9.360 -8.352 2.134 1.00 25.22 H new ATOM 0 HE22 GLN A 107 8.937 -8.429 3.847 1.00 25.22 H new ATOM 1715 N MET A 108 12.442 -8.731 0.327 1.00 33.12 N ATOM 1716 CA MET A 108 13.423 -7.784 0.842 1.00 1.11 C ATOM 1717 C MET A 108 13.429 -6.503 0.014 1.00 61.43 C ATOM 1718 O MET A 108 13.435 -5.400 0.559 1.00 34.33 O ATOM 1719 CB MET A 108 14.819 -8.411 0.843 1.00 34.11 C ATOM 1720 CG MET A 108 15.095 -9.278 2.061 1.00 12.54 C ATOM 1721 SD MET A 108 16.849 -9.362 2.469 1.00 62.53 S ATOM 1722 CE MET A 108 17.556 -9.682 0.855 1.00 41.32 C ATOM 0 H MET A 108 12.840 -9.605 -0.017 1.00 33.12 H new ATOM 0 HA MET A 108 13.145 -7.533 1.866 1.00 1.11 H new ATOM 0 HB2 MET A 108 14.938 -9.015 -0.057 1.00 34.11 H new ATOM 0 HB3 MET A 108 15.565 -7.617 0.795 1.00 34.11 H new ATOM 0 HG2 MET A 108 14.545 -8.883 2.916 1.00 12.54 H new ATOM 0 HG3 MET A 108 14.720 -10.285 1.878 1.00 12.54 H new ATOM 0 HE1 MET A 108 18.585 -10.022 0.970 1.00 41.32 H new ATOM 0 HE2 MET A 108 16.974 -10.452 0.349 1.00 41.32 H new ATOM 0 HE3 MET A 108 17.540 -8.767 0.263 1.00 41.32 H new ATOM 1732 N MET A 109 13.429 -6.658 -1.306 1.00 50.35 N ATOM 1733 CA MET A 109 13.433 -5.513 -2.209 1.00 41.42 C ATOM 1734 C MET A 109 12.392 -4.482 -1.786 1.00 42.24 C ATOM 1735 O MET A 109 12.602 -3.278 -1.929 1.00 14.22 O ATOM 1736 CB MET A 109 13.165 -5.967 -3.645 1.00 32.11 C ATOM 1737 CG MET A 109 14.348 -6.669 -4.293 1.00 2.24 C ATOM 1738 SD MET A 109 13.922 -7.444 -5.864 1.00 1.24 S ATOM 1739 CE MET A 109 13.380 -6.021 -6.807 1.00 4.22 C ATOM 0 H MET A 109 13.426 -7.564 -1.774 1.00 50.35 H new ATOM 0 HA MET A 109 14.418 -5.048 -2.161 1.00 41.42 H new ATOM 0 HB2 MET A 109 12.307 -6.639 -3.650 1.00 32.11 H new ATOM 0 HB3 MET A 109 12.894 -5.099 -4.247 1.00 32.11 H new ATOM 0 HG2 MET A 109 15.149 -5.948 -4.454 1.00 2.24 H new ATOM 0 HG3 MET A 109 14.733 -7.427 -3.611 1.00 2.24 H new ATOM 0 HE1 MET A 109 13.016 -6.347 -7.781 1.00 4.22 H new ATOM 0 HE2 MET A 109 12.578 -5.513 -6.271 1.00 4.22 H new ATOM 0 HE3 MET A 109 14.216 -5.335 -6.943 1.00 4.22 H new ATOM 1749 N TYR A 110 11.268 -4.963 -1.266 1.00 31.14 N ATOM 1750 CA TYR A 110 10.191 -4.084 -0.824 1.00 70.21 C ATOM 1751 C TYR A 110 10.313 -3.779 0.666 1.00 71.31 C ATOM 1752 O TYR A 110 10.021 -2.670 1.110 1.00 42.32 O ATOM 1753 CB TYR A 110 8.832 -4.721 -1.116 1.00 50.20 C ATOM 1754 CG TYR A 110 8.715 -5.282 -2.515 1.00 63.51 C ATOM 1755 CD1 TYR A 110 9.245 -6.528 -2.831 1.00 52.41 C ATOM 1756 CD2 TYR A 110 8.075 -4.569 -3.520 1.00 73.31 C ATOM 1757 CE1 TYR A 110 9.142 -7.044 -4.109 1.00 32.24 C ATOM 1758 CE2 TYR A 110 7.964 -5.079 -4.799 1.00 32.51 C ATOM 1759 CZ TYR A 110 8.500 -6.317 -5.088 1.00 51.32 C ATOM 1760 OH TYR A 110 8.393 -6.828 -6.361 1.00 73.01 O ATOM 0 H TYR A 110 11.079 -5.957 -1.140 1.00 31.14 H new ATOM 0 HA TYR A 110 10.272 -3.147 -1.376 1.00 70.21 H new ATOM 0 HB2 TYR A 110 8.653 -5.520 -0.397 1.00 50.20 H new ATOM 0 HB3 TYR A 110 8.051 -3.976 -0.966 1.00 50.20 H new ATOM 0 HD1 TYR A 110 9.745 -7.102 -2.065 1.00 52.41 H new ATOM 0 HD2 TYR A 110 7.657 -3.598 -3.298 1.00 73.31 H new ATOM 0 HE1 TYR A 110 9.562 -8.012 -4.339 1.00 32.24 H new ATOM 0 HE2 TYR A 110 7.461 -4.512 -5.568 1.00 32.51 H new ATOM 0 HH TYR A 110 7.912 -6.191 -6.930 1.00 73.01 H new ATOM 1770 N ALA A 111 10.748 -4.773 1.433 1.00 71.45 N ATOM 1771 CA ALA A 111 10.912 -4.613 2.872 1.00 13.03 C ATOM 1772 C ALA A 111 11.963 -3.554 3.191 1.00 41.05 C ATOM 1773 O ALA A 111 11.950 -2.957 4.266 1.00 65.24 O ATOM 1774 CB ALA A 111 11.288 -5.941 3.512 1.00 54.11 C ATOM 0 H ALA A 111 10.993 -5.698 1.081 1.00 71.45 H new ATOM 0 HA ALA A 111 9.960 -4.279 3.286 1.00 13.03 H new ATOM 0 HB1 ALA A 111 11.407 -5.806 4.587 1.00 54.11 H new ATOM 0 HB2 ALA A 111 10.501 -6.672 3.323 1.00 54.11 H new ATOM 0 HB3 ALA A 111 12.225 -6.298 3.085 1.00 54.11 H new ATOM 1780 N GLY A 112 12.873 -3.328 2.247 1.00 55.22 N ATOM 1781 CA GLY A 112 13.918 -2.342 2.447 1.00 44.33 C ATOM 1782 C GLY A 112 13.565 -0.993 1.850 1.00 31.31 C ATOM 1783 O GLY A 112 14.068 0.040 2.293 1.00 71.32 O ATOM 0 H GLY A 112 12.904 -3.810 1.349 1.00 55.22 H new ATOM 0 HA2 GLY A 112 14.104 -2.226 3.515 1.00 44.33 H new ATOM 0 HA3 GLY A 112 14.844 -2.703 1.999 1.00 44.33 H new ATOM 1787 N SER A 113 12.701 -1.002 0.843 1.00 54.14 N ATOM 1788 CA SER A 113 12.285 0.229 0.180 1.00 20.33 C ATOM 1789 C SER A 113 10.927 0.693 0.699 1.00 44.11 C ATOM 1790 O SER A 113 10.417 1.736 0.290 1.00 14.11 O ATOM 1791 CB SER A 113 12.221 0.022 -1.334 1.00 4.13 C ATOM 1792 OG SER A 113 13.377 -0.649 -1.807 1.00 34.13 O ATOM 0 H SER A 113 12.274 -1.848 0.467 1.00 54.14 H new ATOM 0 HA SER A 113 13.023 1.000 0.403 1.00 20.33 H new ATOM 0 HB2 SER A 113 11.332 -0.556 -1.588 1.00 4.13 H new ATOM 0 HB3 SER A 113 12.127 0.987 -1.832 1.00 4.13 H new ATOM 0 HG SER A 113 13.160 -1.587 -1.988 1.00 34.13 H new ATOM 1798 N LYS A 114 10.348 -0.089 1.603 1.00 72.01 N ATOM 1799 CA LYS A 114 9.049 0.240 2.181 1.00 4.13 C ATOM 1800 C LYS A 114 9.055 1.651 2.762 1.00 61.53 C ATOM 1801 O LYS A 114 8.383 2.545 2.249 1.00 25.04 O ATOM 1802 CB LYS A 114 8.681 -0.770 3.270 1.00 24.35 C ATOM 1803 CG LYS A 114 7.248 -0.646 3.756 1.00 72.12 C ATOM 1804 CD LYS A 114 6.868 -1.798 4.671 1.00 73.24 C ATOM 1805 CE LYS A 114 7.118 -1.455 6.132 1.00 74.35 C ATOM 1806 NZ LYS A 114 6.510 -2.460 7.048 1.00 30.14 N ATOM 0 H LYS A 114 10.757 -0.956 1.952 1.00 72.01 H new ATOM 0 HA LYS A 114 8.304 0.195 1.387 1.00 4.13 H new ATOM 0 HB2 LYS A 114 8.840 -1.778 2.887 1.00 24.35 H new ATOM 0 HB3 LYS A 114 9.355 -0.640 4.117 1.00 24.35 H new ATOM 0 HG2 LYS A 114 7.123 0.298 4.287 1.00 72.12 H new ATOM 0 HG3 LYS A 114 6.573 -0.622 2.900 1.00 72.12 H new ATOM 0 HD2 LYS A 114 5.816 -2.045 4.529 1.00 73.24 H new ATOM 0 HD3 LYS A 114 7.443 -2.684 4.401 1.00 73.24 H new ATOM 0 HE2 LYS A 114 8.191 -1.400 6.314 1.00 74.35 H new ATOM 0 HE3 LYS A 114 6.707 -0.469 6.349 1.00 74.35 H new ATOM 0 HZ1 LYS A 114 6.702 -2.192 8.034 1.00 30.14 H new ATOM 0 HZ2 LYS A 114 5.482 -2.495 6.892 1.00 30.14 H new ATOM 0 HZ3 LYS A 114 6.921 -3.396 6.858 1.00 30.14 H new ATOM 1820 N ASN A 115 9.817 1.842 3.833 1.00 1.04 N ATOM 1821 CA ASN A 115 9.910 3.144 4.483 1.00 11.13 C ATOM 1822 C ASN A 115 10.155 4.247 3.458 1.00 52.22 C ATOM 1823 O ASN A 115 9.549 5.317 3.525 1.00 34.51 O ATOM 1824 CB ASN A 115 11.032 3.140 5.522 1.00 11.33 C ATOM 1825 CG ASN A 115 10.542 2.741 6.902 1.00 44.45 C ATOM 1826 OD1 ASN A 115 9.690 3.410 7.486 1.00 32.41 O ATOM 1827 ND2 ASN A 115 11.082 1.649 7.428 1.00 33.43 N ATOM 0 H ASN A 115 10.379 1.112 4.270 1.00 1.04 H new ATOM 0 HA ASN A 115 8.962 3.341 4.983 1.00 11.13 H new ATOM 0 HB2 ASN A 115 11.815 2.451 5.204 1.00 11.33 H new ATOM 0 HB3 ASN A 115 11.481 4.132 5.572 1.00 11.33 H new ATOM 0 HD21 ASN A 115 10.794 1.333 8.354 1.00 33.43 H new ATOM 0 HD22 ASN A 115 11.785 1.126 6.906 1.00 33.43 H new ATOM 1834 N ARG A 116 11.048 3.979 2.510 1.00 73.22 N ATOM 1835 CA ARG A 116 11.373 4.948 1.471 1.00 1.43 C ATOM 1836 C ARG A 116 10.128 5.336 0.680 1.00 73.14 C ATOM 1837 O ARG A 116 9.830 6.519 0.507 1.00 44.10 O ATOM 1838 CB ARG A 116 12.434 4.380 0.527 1.00 2.30 C ATOM 1839 CG ARG A 116 12.637 5.208 -0.732 1.00 34.02 C ATOM 1840 CD ARG A 116 13.199 6.583 -0.409 1.00 40.44 C ATOM 1841 NE ARG A 116 14.651 6.631 -0.563 1.00 72.52 N ATOM 1842 CZ ARG A 116 15.503 6.338 0.413 1.00 42.21 C ATOM 1843 NH1 ARG A 116 15.052 5.980 1.607 1.00 61.43 N ATOM 1844 NH2 ARG A 116 16.811 6.404 0.195 1.00 71.32 N ATOM 0 H ARG A 116 11.559 3.099 2.441 1.00 73.22 H new ATOM 0 HA ARG A 116 11.768 5.842 1.954 1.00 1.43 H new ATOM 0 HB2 ARG A 116 13.382 4.308 1.061 1.00 2.30 H new ATOM 0 HB3 ARG A 116 12.150 3.367 0.243 1.00 2.30 H new ATOM 0 HG2 ARG A 116 13.315 4.686 -1.407 1.00 34.02 H new ATOM 0 HG3 ARG A 116 11.687 5.316 -1.255 1.00 34.02 H new ATOM 0 HD2 ARG A 116 12.740 7.325 -1.063 1.00 40.44 H new ATOM 0 HD3 ARG A 116 12.934 6.852 0.613 1.00 40.44 H new ATOM 0 HE ARG A 116 15.031 6.904 -1.469 1.00 72.52 H new ATOM 0 HH11 ARG A 116 14.048 5.929 1.779 1.00 61.43 H new ATOM 0 HH12 ARG A 116 15.709 5.756 2.354 1.00 61.43 H new ATOM 0 HH21 ARG A 116 17.162 6.680 -0.722 1.00 71.32 H new ATOM 0 HH22 ARG A 116 17.465 6.179 0.945 1.00 71.32 H new ATOM 1858 N LEU A 117 9.402 4.332 0.199 1.00 70.10 N ATOM 1859 CA LEU A 117 8.188 4.566 -0.575 1.00 10.33 C ATOM 1860 C LEU A 117 7.128 5.263 0.271 1.00 24.15 C ATOM 1861 O LEU A 117 6.609 6.314 -0.106 1.00 23.35 O ATOM 1862 CB LEU A 117 7.640 3.245 -1.114 1.00 33.31 C ATOM 1863 CG LEU A 117 6.428 3.349 -2.041 1.00 64.51 C ATOM 1864 CD1 LEU A 117 5.191 3.758 -1.258 1.00 74.11 C ATOM 1865 CD2 LEU A 117 6.701 4.336 -3.166 1.00 21.22 C ATOM 0 H LEU A 117 9.634 3.348 0.332 1.00 70.10 H new ATOM 0 HA LEU A 117 8.441 5.215 -1.413 1.00 10.33 H new ATOM 0 HB2 LEU A 117 8.440 2.735 -1.651 1.00 33.31 H new ATOM 0 HB3 LEU A 117 7.371 2.614 -0.267 1.00 33.31 H new ATOM 0 HG LEU A 117 6.246 2.369 -2.481 1.00 64.51 H new ATOM 0 HD11 LEU A 117 4.339 3.827 -1.934 1.00 74.11 H new ATOM 0 HD12 LEU A 117 4.985 3.014 -0.489 1.00 74.11 H new ATOM 0 HD13 LEU A 117 5.361 4.727 -0.789 1.00 74.11 H new ATOM 0 HD21 LEU A 117 5.828 4.397 -3.816 1.00 21.22 H new ATOM 0 HD22 LEU A 117 6.910 5.319 -2.745 1.00 21.22 H new ATOM 0 HD23 LEU A 117 7.561 3.999 -3.745 1.00 21.22 H new ATOM 1877 N VAL A 118 6.812 4.672 1.420 1.00 45.31 N ATOM 1878 CA VAL A 118 5.817 5.238 2.323 1.00 30.41 C ATOM 1879 C VAL A 118 6.134 6.692 2.650 1.00 25.30 C ATOM 1880 O VAL A 118 5.296 7.575 2.474 1.00 34.04 O ATOM 1881 CB VAL A 118 5.729 4.435 3.634 1.00 3.23 C ATOM 1882 CG1 VAL A 118 4.920 5.197 4.673 1.00 35.44 C ATOM 1883 CG2 VAL A 118 5.127 3.062 3.379 1.00 73.05 C ATOM 0 H VAL A 118 7.231 3.801 1.747 1.00 45.31 H new ATOM 0 HA VAL A 118 4.857 5.187 1.809 1.00 30.41 H new ATOM 0 HB VAL A 118 6.738 4.297 4.023 1.00 3.23 H new ATOM 0 HG11 VAL A 118 4.868 4.614 5.593 1.00 35.44 H new ATOM 0 HG12 VAL A 118 5.399 6.155 4.876 1.00 35.44 H new ATOM 0 HG13 VAL A 118 3.912 5.369 4.295 1.00 35.44 H new ATOM 0 HG21 VAL A 118 5.073 2.509 4.317 1.00 73.05 H new ATOM 0 HG22 VAL A 118 4.125 3.175 2.966 1.00 73.05 H new ATOM 0 HG23 VAL A 118 5.752 2.517 2.672 1.00 73.05 H new ATOM 1893 N GLN A 119 7.352 6.934 3.126 1.00 24.43 N ATOM 1894 CA GLN A 119 7.780 8.282 3.478 1.00 1.34 C ATOM 1895 C GLN A 119 7.497 9.257 2.341 1.00 53.11 C ATOM 1896 O GLN A 119 7.122 10.407 2.573 1.00 73.11 O ATOM 1897 CB GLN A 119 9.273 8.294 3.816 1.00 52.34 C ATOM 1898 CG GLN A 119 9.566 8.032 5.284 1.00 21.22 C ATOM 1899 CD GLN A 119 10.908 8.585 5.719 1.00 1.20 C ATOM 1900 OE1 GLN A 119 11.029 9.765 6.049 1.00 41.05 O ATOM 1901 NE2 GLN A 119 11.927 7.733 5.723 1.00 62.02 N ATOM 0 H GLN A 119 8.059 6.214 3.276 1.00 24.43 H new ATOM 0 HA GLN A 119 7.214 8.599 4.354 1.00 1.34 H new ATOM 0 HB2 GLN A 119 9.780 7.541 3.213 1.00 52.34 H new ATOM 0 HB3 GLN A 119 9.692 9.261 3.537 1.00 52.34 H new ATOM 0 HG2 GLN A 119 8.779 8.478 5.893 1.00 21.22 H new ATOM 0 HG3 GLN A 119 9.543 6.958 5.469 1.00 21.22 H new ATOM 0 HE21 GLN A 119 11.782 6.763 5.442 1.00 62.02 H new ATOM 0 HE22 GLN A 119 12.854 8.048 6.007 1.00 62.02 H new ATOM 1910 N THR A 120 7.679 8.792 1.109 1.00 51.45 N ATOM 1911 CA THR A 120 7.444 9.624 -0.065 1.00 31.21 C ATOM 1912 C THR A 120 5.975 10.015 -0.177 1.00 0.03 C ATOM 1913 O THR A 120 5.650 11.166 -0.469 1.00 61.24 O ATOM 1914 CB THR A 120 7.871 8.903 -1.358 1.00 24.01 C ATOM 1915 OG1 THR A 120 9.148 8.282 -1.174 1.00 12.11 O ATOM 1916 CG2 THR A 120 7.940 9.878 -2.523 1.00 41.54 C ATOM 0 H THR A 120 7.989 7.843 0.898 1.00 51.45 H new ATOM 0 HA THR A 120 8.048 10.523 0.058 1.00 31.21 H new ATOM 0 HB THR A 120 7.126 8.141 -1.586 1.00 24.01 H new ATOM 0 HG1 THR A 120 9.027 7.399 -0.768 1.00 12.11 H new ATOM 0 HG21 THR A 120 8.243 9.346 -3.425 1.00 41.54 H new ATOM 0 HG22 THR A 120 6.960 10.328 -2.679 1.00 41.54 H new ATOM 0 HG23 THR A 120 8.667 10.660 -2.301 1.00 41.54 H new ATOM 1924 N ALA A 121 5.091 9.051 0.060 1.00 2.32 N ATOM 1925 CA ALA A 121 3.656 9.297 -0.010 1.00 44.14 C ATOM 1926 C ALA A 121 3.173 10.087 1.201 1.00 42.11 C ATOM 1927 O ALA A 121 2.164 10.786 1.135 1.00 15.34 O ATOM 1928 CB ALA A 121 2.900 7.981 -0.121 1.00 51.21 C ATOM 0 H ALA A 121 5.344 8.093 0.302 1.00 2.32 H new ATOM 0 HA ALA A 121 3.458 9.893 -0.901 1.00 44.14 H new ATOM 0 HB1 ALA A 121 1.829 8.180 -0.172 1.00 51.21 H new ATOM 0 HB2 ALA A 121 3.215 7.455 -1.022 1.00 51.21 H new ATOM 0 HB3 ALA A 121 3.113 7.364 0.752 1.00 51.21 H new ATOM 1934 N GLU A 122 3.903 9.970 2.307 1.00 72.23 N ATOM 1935 CA GLU A 122 3.546 10.673 3.534 1.00 60.44 C ATOM 1936 C GLU A 122 2.349 10.012 4.211 1.00 12.33 C ATOM 1937 O GLU A 122 1.324 10.653 4.448 1.00 62.00 O ATOM 1938 CB GLU A 122 3.232 12.139 3.235 1.00 41.55 C ATOM 1939 CG GLU A 122 3.378 13.052 4.441 1.00 5.42 C ATOM 1940 CD GLU A 122 4.783 13.606 4.586 1.00 11.43 C ATOM 1941 OE1 GLU A 122 5.251 14.285 3.649 1.00 52.25 O ATOM 1942 OE2 GLU A 122 5.413 13.361 5.636 1.00 54.02 O ATOM 0 H GLU A 122 4.743 9.396 2.378 1.00 72.23 H new ATOM 0 HA GLU A 122 4.398 10.623 4.212 1.00 60.44 H new ATOM 0 HB2 GLU A 122 3.894 12.489 2.443 1.00 41.55 H new ATOM 0 HB3 GLU A 122 2.213 12.213 2.855 1.00 41.55 H new ATOM 0 HG2 GLU A 122 2.673 13.878 4.354 1.00 5.42 H new ATOM 0 HG3 GLU A 122 3.114 12.501 5.344 1.00 5.42 H new ATOM 1949 N LEU A 123 2.486 8.727 4.519 1.00 55.33 N ATOM 1950 CA LEU A 123 1.415 7.978 5.168 1.00 1.43 C ATOM 1951 C LEU A 123 1.791 7.627 6.604 1.00 75.01 C ATOM 1952 O LEU A 123 2.640 6.768 6.844 1.00 21.04 O ATOM 1953 CB LEU A 123 1.110 6.701 4.383 1.00 50.55 C ATOM 1954 CG LEU A 123 0.776 6.889 2.902 1.00 11.04 C ATOM 1955 CD1 LEU A 123 1.108 5.630 2.116 1.00 35.32 C ATOM 1956 CD2 LEU A 123 -0.691 7.256 2.728 1.00 2.42 C ATOM 0 H LEU A 123 3.327 8.182 4.330 1.00 55.33 H new ATOM 0 HA LEU A 123 0.525 8.607 5.187 1.00 1.43 H new ATOM 0 HB2 LEU A 123 1.971 6.037 4.460 1.00 50.55 H new ATOM 0 HB3 LEU A 123 0.273 6.194 4.863 1.00 50.55 H new ATOM 0 HG LEU A 123 1.383 7.707 2.514 1.00 11.04 H new ATOM 0 HD11 LEU A 123 0.864 5.782 1.065 1.00 35.32 H new ATOM 0 HD12 LEU A 123 2.171 5.410 2.213 1.00 35.32 H new ATOM 0 HD13 LEU A 123 0.527 4.794 2.506 1.00 35.32 H new ATOM 0 HD21 LEU A 123 -0.910 7.386 1.668 1.00 2.42 H new ATOM 0 HD22 LEU A 123 -1.316 6.460 3.133 1.00 2.42 H new ATOM 0 HD23 LEU A 123 -0.899 8.186 3.258 1.00 2.42 H new ATOM 1968 N THR A 124 1.150 8.296 7.558 1.00 13.21 N ATOM 1969 CA THR A 124 1.413 8.054 8.971 1.00 45.42 C ATOM 1970 C THR A 124 0.933 6.670 9.392 1.00 21.12 C ATOM 1971 O THR A 124 1.416 6.105 10.373 1.00 74.12 O ATOM 1972 CB THR A 124 0.734 9.113 9.859 1.00 12.12 C ATOM 1973 OG1 THR A 124 0.733 8.680 11.224 1.00 70.14 O ATOM 1974 CG2 THR A 124 -0.694 9.368 9.402 1.00 72.42 C ATOM 0 H THR A 124 0.445 9.010 7.377 1.00 13.21 H new ATOM 0 HA THR A 124 2.493 8.117 9.105 1.00 45.42 H new ATOM 0 HB THR A 124 1.297 10.042 9.773 1.00 12.12 H new ATOM 0 HG1 THR A 124 0.301 9.360 11.782 1.00 70.14 H new ATOM 0 HG21 THR A 124 -1.153 10.120 10.044 1.00 72.42 H new ATOM 0 HG22 THR A 124 -0.688 9.725 8.372 1.00 72.42 H new ATOM 0 HG23 THR A 124 -1.266 8.442 9.461 1.00 72.42 H new ATOM 1982 N LYS A 125 -0.021 6.127 8.643 1.00 21.02 N ATOM 1983 CA LYS A 125 -0.567 4.808 8.936 1.00 30.42 C ATOM 1984 C LYS A 125 -0.001 3.761 7.983 1.00 74.54 C ATOM 1985 O LYS A 125 -0.253 3.804 6.778 1.00 60.23 O ATOM 1986 CB LYS A 125 -2.094 4.832 8.838 1.00 31.32 C ATOM 1987 CG LYS A 125 -2.743 5.896 9.706 1.00 44.54 C ATOM 1988 CD LYS A 125 -4.253 5.905 9.540 1.00 51.31 C ATOM 1989 CE LYS A 125 -4.700 6.985 8.565 1.00 75.52 C ATOM 1990 NZ LYS A 125 -4.482 8.352 9.112 1.00 30.21 N ATOM 0 H LYS A 125 -0.432 6.581 7.828 1.00 21.02 H new ATOM 0 HA LYS A 125 -0.279 4.541 9.953 1.00 30.42 H new ATOM 0 HB2 LYS A 125 -2.380 4.998 7.799 1.00 31.32 H new ATOM 0 HB3 LYS A 125 -2.483 3.855 9.124 1.00 31.32 H new ATOM 0 HG2 LYS A 125 -2.492 5.717 10.751 1.00 44.54 H new ATOM 0 HG3 LYS A 125 -2.341 6.875 9.445 1.00 44.54 H new ATOM 0 HD2 LYS A 125 -4.587 4.931 9.183 1.00 51.31 H new ATOM 0 HD3 LYS A 125 -4.726 6.069 10.508 1.00 51.31 H new ATOM 0 HE2 LYS A 125 -4.153 6.877 7.628 1.00 75.52 H new ATOM 0 HE3 LYS A 125 -5.757 6.851 8.334 1.00 75.52 H new ATOM 0 HZ1 LYS A 125 -5.132 9.019 8.649 1.00 30.21 H new ATOM 0 HZ2 LYS A 125 -4.661 8.348 10.137 1.00 30.21 H new ATOM 0 HZ3 LYS A 125 -3.500 8.645 8.933 1.00 30.21 H new ATOM 2004 N VAL A 126 0.762 2.819 8.528 1.00 5.23 N ATOM 2005 CA VAL A 126 1.361 1.760 7.726 1.00 34.11 C ATOM 2006 C VAL A 126 0.991 0.384 8.269 1.00 35.50 C ATOM 2007 O VAL A 126 1.449 -0.017 9.339 1.00 0.32 O ATOM 2008 CB VAL A 126 2.895 1.887 7.683 1.00 62.40 C ATOM 2009 CG1 VAL A 126 3.486 0.888 6.701 1.00 61.34 C ATOM 2010 CG2 VAL A 126 3.301 3.307 7.321 1.00 45.34 C ATOM 0 H VAL A 126 0.980 2.768 9.523 1.00 5.23 H new ATOM 0 HA VAL A 126 0.967 1.867 6.715 1.00 34.11 H new ATOM 0 HB VAL A 126 3.289 1.662 8.674 1.00 62.40 H new ATOM 0 HG11 VAL A 126 4.571 0.993 6.684 1.00 61.34 H new ATOM 0 HG12 VAL A 126 3.224 -0.124 7.009 1.00 61.34 H new ATOM 0 HG13 VAL A 126 3.088 1.078 5.704 1.00 61.34 H new ATOM 0 HG21 VAL A 126 4.388 3.379 7.295 1.00 45.34 H new ATOM 0 HG22 VAL A 126 2.897 3.562 6.341 1.00 45.34 H new ATOM 0 HG23 VAL A 126 2.909 3.999 8.067 1.00 45.34 H new ATOM 2020 N PHE A 127 0.159 -0.337 7.523 1.00 41.30 N ATOM 2021 CA PHE A 127 -0.273 -1.668 7.930 1.00 71.21 C ATOM 2022 C PHE A 127 0.367 -2.740 7.051 1.00 3.24 C ATOM 2023 O PHE A 127 0.441 -2.595 5.832 1.00 5.42 O ATOM 2024 CB PHE A 127 -1.797 -1.777 7.856 1.00 31.33 C ATOM 2025 CG PHE A 127 -2.513 -0.706 8.628 1.00 30.22 C ATOM 2026 CD1 PHE A 127 -2.039 -0.290 9.863 1.00 53.24 C ATOM 2027 CD2 PHE A 127 -3.658 -0.115 8.121 1.00 72.42 C ATOM 2028 CE1 PHE A 127 -2.696 0.694 10.576 1.00 54.45 C ATOM 2029 CE2 PHE A 127 -4.319 0.871 8.829 1.00 32.20 C ATOM 2030 CZ PHE A 127 -3.837 1.276 10.058 1.00 14.32 C ATOM 0 H PHE A 127 -0.229 -0.021 6.634 1.00 41.30 H new ATOM 0 HA PHE A 127 0.047 -1.828 8.960 1.00 71.21 H new ATOM 0 HB2 PHE A 127 -2.106 -1.729 6.812 1.00 31.33 H new ATOM 0 HB3 PHE A 127 -2.102 -2.752 8.235 1.00 31.33 H new ATOM 0 HD1 PHE A 127 -1.146 -0.740 10.272 1.00 53.24 H new ATOM 0 HD2 PHE A 127 -4.039 -0.428 7.160 1.00 72.42 H new ATOM 0 HE1 PHE A 127 -2.318 1.008 11.538 1.00 54.45 H new ATOM 0 HE2 PHE A 127 -5.211 1.324 8.422 1.00 32.20 H new ATOM 0 HZ PHE A 127 -4.351 2.046 10.613 1.00 14.32 H new ATOM 2040 N GLU A 128 0.830 -3.815 7.682 1.00 14.25 N ATOM 2041 CA GLU A 128 1.465 -4.910 6.959 1.00 2.53 C ATOM 2042 C GLU A 128 0.592 -6.161 6.988 1.00 40.34 C ATOM 2043 O GLU A 128 0.259 -6.673 8.057 1.00 51.22 O ATOM 2044 CB GLU A 128 2.838 -5.218 7.560 1.00 32.40 C ATOM 2045 CG GLU A 128 3.703 -6.106 6.681 1.00 54.35 C ATOM 2046 CD GLU A 128 4.244 -7.313 7.422 1.00 2.32 C ATOM 2047 OE1 GLU A 128 3.432 -8.083 7.975 1.00 70.43 O ATOM 2048 OE2 GLU A 128 5.481 -7.485 7.450 1.00 74.34 O ATOM 0 H GLU A 128 0.777 -3.950 8.692 1.00 14.25 H new ATOM 0 HA GLU A 128 1.591 -4.601 5.921 1.00 2.53 H new ATOM 0 HB2 GLU A 128 3.363 -4.281 7.743 1.00 32.40 H new ATOM 0 HB3 GLU A 128 2.701 -5.701 8.527 1.00 32.40 H new ATOM 0 HG2 GLU A 128 3.119 -6.442 5.825 1.00 54.35 H new ATOM 0 HG3 GLU A 128 4.536 -5.522 6.289 1.00 54.35 H new ATOM 2055 N ILE A 129 0.225 -6.646 5.806 1.00 13.44 N ATOM 2056 CA ILE A 129 -0.609 -7.837 5.697 1.00 52.55 C ATOM 2057 C ILE A 129 0.224 -9.059 5.329 1.00 64.44 C ATOM 2058 O ILE A 129 1.049 -9.010 4.416 1.00 42.14 O ATOM 2059 CB ILE A 129 -1.719 -7.650 4.645 1.00 42.03 C ATOM 2060 CG1 ILE A 129 -1.128 -7.120 3.336 1.00 14.12 C ATOM 2061 CG2 ILE A 129 -2.793 -6.708 5.168 1.00 4.24 C ATOM 2062 CD1 ILE A 129 -2.096 -7.164 2.175 1.00 22.13 C ATOM 0 H ILE A 129 0.492 -6.233 4.912 1.00 13.44 H new ATOM 0 HA ILE A 129 -1.067 -7.994 6.674 1.00 52.55 H new ATOM 0 HB ILE A 129 -2.179 -8.619 4.448 1.00 42.03 H new ATOM 0 HG12 ILE A 129 -0.799 -6.092 3.485 1.00 14.12 H new ATOM 0 HG13 ILE A 129 -0.243 -7.704 3.083 1.00 14.12 H new ATOM 0 HG21 ILE A 129 -3.570 -6.587 4.413 1.00 4.24 H new ATOM 0 HG22 ILE A 129 -3.231 -7.124 6.075 1.00 4.24 H new ATOM 0 HG23 ILE A 129 -2.349 -5.738 5.391 1.00 4.24 H new ATOM 0 HD11 ILE A 129 -1.610 -6.774 1.281 1.00 22.13 H new ATOM 0 HD12 ILE A 129 -2.406 -8.194 1.999 1.00 22.13 H new ATOM 0 HD13 ILE A 129 -2.971 -6.556 2.407 1.00 22.13 H new ATOM 2074 N ARG A 130 0.003 -10.156 6.045 1.00 32.30 N ATOM 2075 CA ARG A 130 0.732 -11.394 5.794 1.00 44.41 C ATOM 2076 C ARG A 130 0.200 -12.096 4.548 1.00 21.04 C ATOM 2077 O ARG A 130 0.893 -12.910 3.937 1.00 75.44 O ATOM 2078 CB ARG A 130 0.629 -12.326 7.002 1.00 61.03 C ATOM 2079 CG ARG A 130 1.799 -13.288 7.131 1.00 13.23 C ATOM 2080 CD ARG A 130 3.021 -12.603 7.722 1.00 1.53 C ATOM 2081 NE ARG A 130 3.245 -12.987 9.113 1.00 13.31 N ATOM 2082 CZ ARG A 130 3.534 -14.226 9.495 1.00 72.41 C ATOM 2083 NH1 ARG A 130 3.634 -15.195 8.596 1.00 43.14 N ATOM 2084 NH2 ARG A 130 3.725 -14.497 10.780 1.00 75.43 N ATOM 0 H ARG A 130 -0.676 -10.213 6.804 1.00 32.30 H new ATOM 0 HA ARG A 130 1.779 -11.142 5.628 1.00 44.41 H new ATOM 0 HB2 ARG A 130 0.562 -11.725 7.909 1.00 61.03 H new ATOM 0 HB3 ARG A 130 -0.295 -12.899 6.930 1.00 61.03 H new ATOM 0 HG2 ARG A 130 1.512 -14.129 7.762 1.00 13.23 H new ATOM 0 HG3 ARG A 130 2.047 -13.694 6.151 1.00 13.23 H new ATOM 0 HD2 ARG A 130 3.900 -12.857 7.130 1.00 1.53 H new ATOM 0 HD3 ARG A 130 2.896 -11.522 7.660 1.00 1.53 H new ATOM 0 HE ARG A 130 3.176 -12.265 9.830 1.00 13.31 H new ATOM 0 HH11 ARG A 130 3.489 -14.990 7.607 1.00 43.14 H new ATOM 0 HH12 ARG A 130 3.856 -16.145 8.893 1.00 43.14 H new ATOM 0 HH21 ARG A 130 3.650 -13.754 11.475 1.00 75.43 H new ATOM 0 HH22 ARG A 130 3.947 -15.448 11.073 1.00 75.43 H new ATOM 2098 N THR A 131 -1.037 -11.776 4.178 1.00 25.22 N ATOM 2099 CA THR A 131 -1.663 -12.378 3.007 1.00 14.35 C ATOM 2100 C THR A 131 -2.895 -11.589 2.578 1.00 71.23 C ATOM 2101 O THR A 131 -3.605 -11.022 3.410 1.00 45.12 O ATOM 2102 CB THR A 131 -2.072 -13.838 3.278 1.00 43.04 C ATOM 2103 OG1 THR A 131 -2.941 -14.304 2.239 1.00 4.20 O ATOM 2104 CG2 THR A 131 -2.768 -13.967 4.624 1.00 52.33 C ATOM 0 H THR A 131 -1.624 -11.104 4.672 1.00 25.22 H new ATOM 0 HA THR A 131 -0.924 -12.358 2.206 1.00 14.35 H new ATOM 0 HB THR A 131 -1.168 -14.447 3.296 1.00 43.04 H new ATOM 0 HG1 THR A 131 -3.195 -15.233 2.418 1.00 4.20 H new ATOM 0 HG21 THR A 131 -3.047 -15.007 4.791 1.00 52.33 H new ATOM 0 HG22 THR A 131 -2.093 -13.640 5.415 1.00 52.33 H new ATOM 0 HG23 THR A 131 -3.664 -13.346 4.631 1.00 52.33 H new ATOM 2112 N THR A 132 -3.145 -11.557 1.273 1.00 53.43 N ATOM 2113 CA THR A 132 -4.291 -10.837 0.731 1.00 35.41 C ATOM 2114 C THR A 132 -5.549 -11.114 1.547 1.00 55.02 C ATOM 2115 O THR A 132 -6.254 -10.189 1.952 1.00 21.11 O ATOM 2116 CB THR A 132 -4.552 -11.219 -0.738 1.00 44.31 C ATOM 2117 OG1 THR A 132 -4.540 -12.642 -0.884 1.00 31.52 O ATOM 2118 CG2 THR A 132 -3.502 -10.602 -1.651 1.00 54.12 C ATOM 0 H THR A 132 -2.569 -12.022 0.571 1.00 53.43 H new ATOM 0 HA THR A 132 -4.051 -9.775 0.785 1.00 35.41 H new ATOM 0 HB THR A 132 -5.531 -10.834 -1.022 1.00 44.31 H new ATOM 0 HG1 THR A 132 -4.708 -12.876 -1.821 1.00 31.52 H new ATOM 0 HG21 THR A 132 -3.706 -10.885 -2.684 1.00 54.12 H new ATOM 0 HG22 THR A 132 -3.533 -9.516 -1.559 1.00 54.12 H new ATOM 0 HG23 THR A 132 -2.514 -10.962 -1.365 1.00 54.12 H new ATOM 2126 N ASP A 133 -5.825 -12.391 1.784 1.00 21.14 N ATOM 2127 CA ASP A 133 -6.998 -12.790 2.553 1.00 32.54 C ATOM 2128 C ASP A 133 -7.227 -11.841 3.726 1.00 51.25 C ATOM 2129 O ASP A 133 -8.365 -11.601 4.130 1.00 41.34 O ATOM 2130 CB ASP A 133 -6.837 -14.223 3.064 1.00 4.34 C ATOM 2131 CG ASP A 133 -7.418 -15.246 2.109 1.00 25.44 C ATOM 2132 OD1 ASP A 133 -7.108 -15.175 0.902 1.00 63.02 O ATOM 2133 OD2 ASP A 133 -8.183 -16.120 2.570 1.00 52.15 O ATOM 0 H ASP A 133 -5.252 -13.168 1.455 1.00 21.14 H new ATOM 0 HA ASP A 133 -7.866 -12.743 1.896 1.00 32.54 H new ATOM 0 HB2 ASP A 133 -5.779 -14.434 3.218 1.00 4.34 H new ATOM 0 HB3 ASP A 133 -7.325 -14.317 4.034 1.00 4.34 H new ATOM 2138 N ASP A 134 -6.139 -11.306 4.268 1.00 21.34 N ATOM 2139 CA ASP A 134 -6.221 -10.383 5.394 1.00 34.34 C ATOM 2140 C ASP A 134 -6.977 -9.117 5.006 1.00 35.34 C ATOM 2141 O ASP A 134 -7.834 -8.639 5.752 1.00 62.35 O ATOM 2142 CB ASP A 134 -4.819 -10.023 5.889 1.00 30.23 C ATOM 2143 CG ASP A 134 -4.767 -9.830 7.392 1.00 72.21 C ATOM 2144 OD1 ASP A 134 -5.781 -10.119 8.064 1.00 72.24 O ATOM 2145 OD2 ASP A 134 -3.713 -9.392 7.898 1.00 13.21 O ATOM 0 H ASP A 134 -5.190 -11.495 3.946 1.00 21.34 H new ATOM 0 HA ASP A 134 -6.766 -10.878 6.198 1.00 34.34 H new ATOM 0 HB2 ASP A 134 -4.122 -10.811 5.603 1.00 30.23 H new ATOM 0 HB3 ASP A 134 -4.487 -9.109 5.397 1.00 30.23 H new ATOM 2150 N LEU A 135 -6.656 -8.578 3.835 1.00 71.31 N ATOM 2151 CA LEU A 135 -7.304 -7.366 3.348 1.00 74.24 C ATOM 2152 C LEU A 135 -8.810 -7.570 3.214 1.00 13.32 C ATOM 2153 O LEU A 135 -9.299 -8.021 2.177 1.00 24.14 O ATOM 2154 CB LEU A 135 -6.713 -6.955 1.998 1.00 20.02 C ATOM 2155 CG LEU A 135 -7.511 -5.923 1.201 1.00 2.51 C ATOM 2156 CD1 LEU A 135 -8.020 -4.819 2.117 1.00 20.31 C ATOM 2157 CD2 LEU A 135 -6.661 -5.338 0.082 1.00 74.51 C ATOM 0 H LEU A 135 -5.951 -8.961 3.205 1.00 71.31 H new ATOM 0 HA LEU A 135 -7.126 -6.572 4.073 1.00 74.24 H new ATOM 0 HB2 LEU A 135 -5.712 -6.558 2.168 1.00 20.02 H new ATOM 0 HB3 LEU A 135 -6.601 -7.850 1.386 1.00 20.02 H new ATOM 0 HG LEU A 135 -8.370 -6.423 0.754 1.00 2.51 H new ATOM 0 HD11 LEU A 135 -8.586 -4.093 1.533 1.00 20.31 H new ATOM 0 HD12 LEU A 135 -8.665 -5.250 2.883 1.00 20.31 H new ATOM 0 HD13 LEU A 135 -7.174 -4.322 2.592 1.00 20.31 H new ATOM 0 HD21 LEU A 135 -7.246 -4.606 -0.474 1.00 74.51 H new ATOM 0 HD22 LEU A 135 -5.783 -4.853 0.508 1.00 74.51 H new ATOM 0 HD23 LEU A 135 -6.345 -6.136 -0.590 1.00 74.51 H new ATOM 2169 N THR A 136 -9.545 -7.232 4.270 1.00 4.33 N ATOM 2170 CA THR A 136 -10.994 -7.377 4.272 1.00 62.25 C ATOM 2171 C THR A 136 -11.673 -6.116 4.796 1.00 23.01 C ATOM 2172 O THR A 136 -11.121 -5.409 5.638 1.00 3.52 O ATOM 2173 CB THR A 136 -11.438 -8.579 5.127 1.00 1.15 C ATOM 2174 OG1 THR A 136 -10.553 -8.740 6.241 1.00 2.04 O ATOM 2175 CG2 THR A 136 -11.458 -9.855 4.299 1.00 2.15 C ATOM 0 H THR A 136 -9.158 -6.855 5.136 1.00 4.33 H new ATOM 0 HA THR A 136 -11.295 -7.545 3.238 1.00 62.25 H new ATOM 0 HB THR A 136 -12.447 -8.386 5.490 1.00 1.15 H new ATOM 0 HG1 THR A 136 -9.632 -8.829 5.917 1.00 2.04 H new ATOM 0 HG21 THR A 136 -11.775 -10.690 4.924 1.00 2.15 H new ATOM 0 HG22 THR A 136 -12.155 -9.739 3.469 1.00 2.15 H new ATOM 0 HG23 THR A 136 -10.459 -10.052 3.910 1.00 2.15 H new ATOM 2183 N GLU A 137 -12.872 -5.842 4.293 1.00 21.13 N ATOM 2184 CA GLU A 137 -13.624 -4.665 4.712 1.00 74.51 C ATOM 2185 C GLU A 137 -13.449 -4.411 6.207 1.00 72.34 C ATOM 2186 O GLU A 137 -13.241 -3.275 6.635 1.00 24.43 O ATOM 2187 CB GLU A 137 -15.109 -4.839 4.384 1.00 2.22 C ATOM 2188 CG GLU A 137 -15.970 -3.666 4.823 1.00 34.33 C ATOM 2189 CD GLU A 137 -17.300 -4.105 5.404 1.00 73.40 C ATOM 2190 OE1 GLU A 137 -17.903 -5.053 4.857 1.00 42.54 O ATOM 2191 OE2 GLU A 137 -17.739 -3.502 6.405 1.00 52.44 O ATOM 0 H GLU A 137 -13.343 -6.418 3.596 1.00 21.13 H new ATOM 0 HA GLU A 137 -13.236 -3.804 4.167 1.00 74.51 H new ATOM 0 HB2 GLU A 137 -15.221 -4.979 3.309 1.00 2.22 H new ATOM 0 HB3 GLU A 137 -15.475 -5.747 4.864 1.00 2.22 H new ATOM 0 HG2 GLU A 137 -15.429 -3.080 5.566 1.00 34.33 H new ATOM 0 HG3 GLU A 137 -16.149 -3.012 3.970 1.00 34.33 H new ATOM 2198 N THR A 138 -13.535 -5.477 6.996 1.00 34.41 N ATOM 2199 CA THR A 138 -13.389 -5.370 8.442 1.00 22.44 C ATOM 2200 C THR A 138 -11.933 -5.136 8.832 1.00 54.45 C ATOM 2201 O THR A 138 -11.601 -4.120 9.442 1.00 13.25 O ATOM 2202 CB THR A 138 -13.899 -6.638 9.154 1.00 51.14 C ATOM 2203 OG1 THR A 138 -15.190 -6.996 8.648 1.00 62.43 O ATOM 2204 CG2 THR A 138 -13.982 -6.418 10.657 1.00 32.30 C ATOM 0 H THR A 138 -13.705 -6.424 6.658 1.00 34.41 H new ATOM 0 HA THR A 138 -13.990 -4.517 8.757 1.00 22.44 H new ATOM 0 HB THR A 138 -13.194 -7.447 8.959 1.00 51.14 H new ATOM 0 HG1 THR A 138 -15.507 -7.804 9.103 1.00 62.43 H new ATOM 0 HG21 THR A 138 -14.344 -7.326 11.138 1.00 32.30 H new ATOM 0 HG22 THR A 138 -12.993 -6.172 11.044 1.00 32.30 H new ATOM 0 HG23 THR A 138 -14.668 -5.598 10.867 1.00 32.30 H new ATOM 2212 N TRP A 139 -11.070 -6.079 8.472 1.00 53.50 N ATOM 2213 CA TRP A 139 -9.649 -5.974 8.784 1.00 11.41 C ATOM 2214 C TRP A 139 -9.122 -4.581 8.455 1.00 13.43 C ATOM 2215 O TRP A 139 -8.100 -4.151 8.990 1.00 43.20 O ATOM 2216 CB TRP A 139 -8.857 -7.028 8.010 1.00 40.34 C ATOM 2217 CG TRP A 139 -7.389 -6.734 7.938 1.00 52.14 C ATOM 2218 CD1 TRP A 139 -6.394 -7.351 8.642 1.00 3.31 C ATOM 2219 CD2 TRP A 139 -6.752 -5.748 7.118 1.00 20.03 C ATOM 2220 NE1 TRP A 139 -5.177 -6.807 8.309 1.00 61.24 N ATOM 2221 CE2 TRP A 139 -5.369 -5.823 7.376 1.00 31.12 C ATOM 2222 CE3 TRP A 139 -7.214 -4.811 6.191 1.00 41.54 C ATOM 2223 CZ2 TRP A 139 -4.448 -4.995 6.739 1.00 24.23 C ATOM 2224 CZ3 TRP A 139 -6.298 -3.990 5.560 1.00 12.52 C ATOM 2225 CH2 TRP A 139 -4.929 -4.087 5.835 1.00 5.14 C ATOM 0 H TRP A 139 -11.329 -6.925 7.964 1.00 53.50 H new ATOM 0 HA TRP A 139 -9.523 -6.147 9.853 1.00 11.41 H new ATOM 0 HB2 TRP A 139 -9.003 -8.000 8.481 1.00 40.34 H new ATOM 0 HB3 TRP A 139 -9.256 -7.101 6.998 1.00 40.34 H new ATOM 0 HD1 TRP A 139 -6.542 -8.149 9.355 1.00 3.31 H new ATOM 0 HE1 TRP A 139 -4.276 -7.090 8.694 1.00 61.24 H new ATOM 0 HE3 TRP A 139 -8.268 -4.729 5.971 1.00 41.54 H new ATOM 0 HZ2 TRP A 139 -3.391 -5.067 6.951 1.00 24.23 H new ATOM 0 HZ3 TRP A 139 -6.645 -3.261 4.842 1.00 12.52 H new ATOM 0 HH2 TRP A 139 -4.239 -3.432 5.324 1.00 5.14 H new ATOM 2236 N LEU A 140 -9.825 -3.880 7.573 1.00 74.13 N ATOM 2237 CA LEU A 140 -9.428 -2.534 7.173 1.00 71.35 C ATOM 2238 C LEU A 140 -10.031 -1.489 8.104 1.00 15.34 C ATOM 2239 O LEU A 140 -9.311 -0.750 8.776 1.00 20.52 O ATOM 2240 CB LEU A 140 -9.861 -2.261 5.732 1.00 43.42 C ATOM 2241 CG LEU A 140 -9.833 -0.798 5.289 1.00 43.44 C ATOM 2242 CD1 LEU A 140 -11.139 -0.106 5.648 1.00 4.31 C ATOM 2243 CD2 LEU A 140 -8.652 -0.072 5.917 1.00 24.34 C ATOM 0 H LEU A 140 -10.673 -4.221 7.121 1.00 74.13 H new ATOM 0 HA LEU A 140 -8.342 -2.468 7.238 1.00 71.35 H new ATOM 0 HB2 LEU A 140 -9.217 -2.834 5.065 1.00 43.42 H new ATOM 0 HB3 LEU A 140 -10.874 -2.640 5.600 1.00 43.42 H new ATOM 0 HG LEU A 140 -9.716 -0.769 4.206 1.00 43.44 H new ATOM 0 HD11 LEU A 140 -11.100 0.934 5.325 1.00 4.31 H new ATOM 0 HD12 LEU A 140 -11.967 -0.610 5.150 1.00 4.31 H new ATOM 0 HD13 LEU A 140 -11.287 -0.145 6.727 1.00 4.31 H new ATOM 0 HD21 LEU A 140 -8.649 0.968 5.590 1.00 24.34 H new ATOM 0 HD22 LEU A 140 -8.737 -0.111 7.003 1.00 24.34 H new ATOM 0 HD23 LEU A 140 -7.724 -0.552 5.608 1.00 24.34 H new ATOM 2255 N LYS A 141 -11.359 -1.433 8.142 1.00 43.11 N ATOM 2256 CA LYS A 141 -12.061 -0.480 8.993 1.00 3.11 C ATOM 2257 C LYS A 141 -11.677 -0.673 10.457 1.00 51.32 C ATOM 2258 O LYS A 141 -11.889 0.213 11.284 1.00 0.04 O ATOM 2259 CB LYS A 141 -13.575 -0.636 8.827 1.00 21.43 C ATOM 2260 CG LYS A 141 -14.178 0.325 7.818 1.00 12.13 C ATOM 2261 CD LYS A 141 -15.327 -0.315 7.057 1.00 44.43 C ATOM 2262 CE LYS A 141 -16.673 0.196 7.546 1.00 12.14 C ATOM 2263 NZ LYS A 141 -17.170 -0.581 8.715 1.00 60.13 N ATOM 0 H LYS A 141 -11.970 -2.037 7.593 1.00 43.11 H new ATOM 0 HA LYS A 141 -11.770 0.525 8.688 1.00 3.11 H new ATOM 0 HB2 LYS A 141 -13.795 -1.658 8.519 1.00 21.43 H new ATOM 0 HB3 LYS A 141 -14.056 -0.484 9.793 1.00 21.43 H new ATOM 0 HG2 LYS A 141 -14.533 1.218 8.332 1.00 12.13 H new ATOM 0 HG3 LYS A 141 -13.409 0.646 7.115 1.00 12.13 H new ATOM 0 HD2 LYS A 141 -15.222 -0.105 5.993 1.00 44.43 H new ATOM 0 HD3 LYS A 141 -15.284 -1.398 7.174 1.00 44.43 H new ATOM 0 HE2 LYS A 141 -16.585 1.247 7.820 1.00 12.14 H new ATOM 0 HE3 LYS A 141 -17.400 0.138 6.736 1.00 12.14 H new ATOM 0 HZ1 LYS A 141 -18.090 -0.202 9.018 1.00 60.13 H new ATOM 0 HZ2 LYS A 141 -17.279 -1.580 8.447 1.00 60.13 H new ATOM 0 HZ3 LYS A 141 -16.489 -0.505 9.497 1.00 60.13 H new ATOM 2277 N GLU A 142 -11.109 -1.833 10.767 1.00 61.54 N ATOM 2278 CA GLU A 142 -10.695 -2.141 12.132 1.00 42.34 C ATOM 2279 C GLU A 142 -9.450 -1.345 12.514 1.00 11.21 C ATOM 2280 O GLU A 142 -9.371 -0.780 13.605 1.00 55.31 O ATOM 2281 CB GLU A 142 -10.421 -3.639 12.281 1.00 51.14 C ATOM 2282 CG GLU A 142 -11.663 -4.456 12.592 1.00 12.22 C ATOM 2283 CD GLU A 142 -11.360 -5.679 13.436 1.00 0.52 C ATOM 2284 OE1 GLU A 142 -10.688 -5.528 14.478 1.00 2.21 O ATOM 2285 OE2 GLU A 142 -11.793 -6.786 13.056 1.00 52.02 O ATOM 0 H GLU A 142 -10.925 -2.576 10.092 1.00 61.54 H new ATOM 0 HA GLU A 142 -11.507 -1.860 12.803 1.00 42.34 H new ATOM 0 HB2 GLU A 142 -9.973 -4.011 11.360 1.00 51.14 H new ATOM 0 HB3 GLU A 142 -9.689 -3.789 13.075 1.00 51.14 H new ATOM 0 HG2 GLU A 142 -12.385 -3.828 13.114 1.00 12.22 H new ATOM 0 HG3 GLU A 142 -12.130 -4.770 11.659 1.00 12.22 H new ATOM 2292 N LYS A 143 -8.479 -1.304 11.608 1.00 11.41 N ATOM 2293 CA LYS A 143 -7.238 -0.577 11.848 1.00 75.32 C ATOM 2294 C LYS A 143 -7.499 0.921 11.962 1.00 43.10 C ATOM 2295 O LYS A 143 -6.807 1.627 12.697 1.00 14.51 O ATOM 2296 CB LYS A 143 -6.239 -0.848 10.721 1.00 3.13 C ATOM 2297 CG LYS A 143 -5.908 -2.320 10.542 1.00 51.24 C ATOM 2298 CD LYS A 143 -4.532 -2.653 11.091 1.00 64.44 C ATOM 2299 CE LYS A 143 -3.846 -3.729 10.262 1.00 31.22 C ATOM 2300 NZ LYS A 143 -2.442 -3.957 10.701 1.00 61.31 N ATOM 0 H LYS A 143 -8.528 -1.766 10.700 1.00 11.41 H new ATOM 0 HA LYS A 143 -6.817 -0.927 12.790 1.00 75.32 H new ATOM 0 HB2 LYS A 143 -6.644 -0.459 9.787 1.00 3.13 H new ATOM 0 HB3 LYS A 143 -5.319 -0.299 10.923 1.00 3.13 H new ATOM 0 HG2 LYS A 143 -6.659 -2.927 11.048 1.00 51.24 H new ATOM 0 HG3 LYS A 143 -5.950 -2.577 9.484 1.00 51.24 H new ATOM 0 HD2 LYS A 143 -3.916 -1.754 11.103 1.00 64.44 H new ATOM 0 HD3 LYS A 143 -4.623 -2.990 12.123 1.00 64.44 H new ATOM 0 HE2 LYS A 143 -4.407 -4.660 10.341 1.00 31.22 H new ATOM 0 HE3 LYS A 143 -3.855 -3.439 9.211 1.00 31.22 H new ATOM 0 HZ1 LYS A 143 -2.010 -4.697 10.112 1.00 61.31 H new ATOM 0 HZ2 LYS A 143 -1.900 -3.075 10.602 1.00 61.31 H new ATOM 0 HZ3 LYS A 143 -2.434 -4.259 11.696 1.00 61.31 H new ATOM 2314 N LEU A 144 -8.499 1.400 11.232 1.00 41.43 N ATOM 2315 CA LEU A 144 -8.851 2.816 11.251 1.00 31.31 C ATOM 2316 C LEU A 144 -9.643 3.162 12.508 1.00 31.42 C ATOM 2317 O LEU A 144 -9.327 4.123 13.208 1.00 0.24 O ATOM 2318 CB LEU A 144 -9.664 3.177 10.007 1.00 53.31 C ATOM 2319 CG LEU A 144 -9.227 2.511 8.702 1.00 31.50 C ATOM 2320 CD1 LEU A 144 -10.248 2.762 7.605 1.00 35.11 C ATOM 2321 CD2 LEU A 144 -7.854 3.014 8.281 1.00 44.33 C ATOM 0 H LEU A 144 -9.081 0.829 10.619 1.00 41.43 H new ATOM 0 HA LEU A 144 -7.927 3.395 11.254 1.00 31.31 H new ATOM 0 HB2 LEU A 144 -10.707 2.919 10.192 1.00 53.31 H new ATOM 0 HB3 LEU A 144 -9.622 4.258 9.871 1.00 53.31 H new ATOM 0 HG LEU A 144 -9.163 1.436 8.869 1.00 31.50 H new ATOM 0 HD11 LEU A 144 -9.919 2.280 6.684 1.00 35.11 H new ATOM 0 HD12 LEU A 144 -11.212 2.352 7.905 1.00 35.11 H new ATOM 0 HD13 LEU A 144 -10.346 3.835 7.438 1.00 35.11 H new ATOM 0 HD21 LEU A 144 -7.559 2.530 7.350 1.00 44.33 H new ATOM 0 HD22 LEU A 144 -7.892 4.093 8.132 1.00 44.33 H new ATOM 0 HD23 LEU A 144 -7.127 2.780 9.058 1.00 44.33 H new ATOM 2333 N ALA A 145 -10.673 2.370 12.790 1.00 42.13 N ATOM 2334 CA ALA A 145 -11.507 2.590 13.964 1.00 73.52 C ATOM 2335 C ALA A 145 -10.657 2.896 15.193 1.00 62.32 C ATOM 2336 O ALA A 145 -10.772 3.966 15.788 1.00 51.34 O ATOM 2337 CB ALA A 145 -12.390 1.377 14.219 1.00 21.22 C ATOM 0 H ALA A 145 -10.949 1.570 12.221 1.00 42.13 H new ATOM 0 HA ALA A 145 -12.142 3.454 13.770 1.00 73.52 H new ATOM 0 HB1 ALA A 145 -13.008 1.555 15.099 1.00 21.22 H new ATOM 0 HB2 ALA A 145 -13.031 1.205 13.354 1.00 21.22 H new ATOM 0 HB3 ALA A 145 -11.764 0.500 14.386 1.00 21.22 H new