USER MOD reduce.3.24.130724 H: found=0, std=0, add=940, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 939 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 35 ASN : amide:sc= -3.39! C(o=-3.4!,f=-10!) USER MOD Set 1.2: A 89 LYS NZ :NH3+ 150:sc= -0.014 (180deg=-0.235) USER MOD Set 2.1: A 28 TYR OH : rot 76:sc= 0.142 USER MOD Set 2.2: A 47 SER OG : rot -126:sc= 1.01 USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot -160:sc= 0.106 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 41:sc= 0.251 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 63:sc= 1.2 USER MOD Single : A 48 SER OG : rot -127:sc= -0.778 USER MOD Single : A 52 THR OG1 : rot -90:sc= -0.0683 USER MOD Single : A 55 HIS : no HD1:sc= -0.0164 X(o=-0.016,f=-0.007) USER MOD Single : A 56 THR OG1 : rot 170:sc= -1.66 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.0266 X(o=-0.027,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 166:sc= -0.785 (180deg=-1.16!) USER MOD Single : A 65 ASN : amide:sc= 0.114 X(o=0.11,f=0) USER MOD Single : A 67 TYR OH : rot -130:sc= -0.213 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.02 X(o=-1,f=-0.52) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -131:sc= 0.0846 (180deg=-0.235) USER MOD Single : A 96 ASN : amide:sc= -0.552 X(o=-0.55,f=-0.2) USER MOD Single : A 100 MET CE :methyl 145:sc= -3.89! (180deg=-5.97!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 174:sc= -1.33 (180deg=-1.6) USER MOD Single : A 112 THR OG1 : rot -56:sc= -0.352 USER MOD Single : A 113 MET CE :methyl 153:sc= -2.44 (180deg=-2.61) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -1.57 K(o=-1.6,f=-0.88) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.0364 USER MOD Single : A 123 THR OG1 : rot -67:sc= 0.815 USER MOD Single : A 127 LYS NZ :NH3+ -168:sc=0.000196 (180deg=0) USER MOD Single : A 132 ASN : amide:sc= -2.05 K(o=-2,f=-1.3!) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 127 N MET A 21 12.180 -14.130 0.075 1.00 4.22 N ATOM 128 CA MET A 21 11.415 -13.111 0.784 1.00 3.32 C ATOM 129 C MET A 21 11.920 -11.713 0.438 1.00 74.30 C ATOM 130 O MET A 21 13.112 -11.429 0.545 1.00 5.34 O ATOM 131 CB MET A 21 11.501 -13.337 2.295 1.00 43.21 C ATOM 132 CG MET A 21 10.189 -13.784 2.918 1.00 11.21 C ATOM 133 SD MET A 21 10.270 -15.459 3.581 1.00 53.30 S ATOM 134 CE MET A 21 9.873 -16.420 2.122 1.00 4.43 C ATOM 0 HA MET A 21 10.374 -13.190 0.471 1.00 3.32 H new ATOM 0 HB2 MET A 21 12.265 -14.087 2.499 1.00 43.21 H new ATOM 0 HB3 MET A 21 11.825 -12.413 2.774 1.00 43.21 H new ATOM 0 HG2 MET A 21 9.917 -13.094 3.717 1.00 11.21 H new ATOM 0 HG3 MET A 21 9.399 -13.732 2.169 1.00 11.21 H new ATOM 0 HE1 MET A 21 9.883 -17.481 2.371 1.00 4.43 H new ATOM 0 HE2 MET A 21 8.883 -16.141 1.761 1.00 4.43 H new ATOM 0 HE3 MET A 21 10.611 -16.223 1.345 1.00 4.43 H new ATOM 144 N VAL A 22 11.004 -10.845 0.022 1.00 55.43 N ATOM 145 CA VAL A 22 11.356 -9.477 -0.340 1.00 14.44 C ATOM 146 C VAL A 22 10.220 -8.513 -0.015 1.00 11.12 C ATOM 147 O VAL A 22 9.060 -8.914 0.080 1.00 12.03 O ATOM 148 CB VAL A 22 11.699 -9.362 -1.837 1.00 30.23 C ATOM 149 CG1 VAL A 22 12.259 -7.984 -2.152 1.00 51.44 C ATOM 150 CG2 VAL A 22 12.681 -10.451 -2.242 1.00 74.25 C ATOM 0 H VAL A 22 10.012 -11.065 -0.073 1.00 55.43 H new ATOM 0 HA VAL A 22 12.235 -9.211 0.248 1.00 14.44 H new ATOM 0 HB VAL A 22 10.784 -9.496 -2.414 1.00 30.23 H new ATOM 0 HG11 VAL A 22 12.496 -7.921 -3.214 1.00 51.44 H new ATOM 0 HG12 VAL A 22 11.519 -7.224 -1.900 1.00 51.44 H new ATOM 0 HG13 VAL A 22 13.164 -7.817 -1.568 1.00 51.44 H new ATOM 0 HG21 VAL A 22 12.913 -10.356 -3.303 1.00 74.25 H new ATOM 0 HG22 VAL A 22 13.597 -10.350 -1.660 1.00 74.25 H new ATOM 0 HG23 VAL A 22 12.238 -11.429 -2.054 1.00 74.25 H new ATOM 160 N ARG A 23 10.562 -7.240 0.154 1.00 14.30 N ATOM 161 CA ARG A 23 9.571 -6.218 0.469 1.00 54.10 C ATOM 162 C ARG A 23 9.947 -4.882 -0.165 1.00 54.03 C ATOM 163 O ARG A 23 11.125 -4.541 -0.265 1.00 3.21 O ATOM 164 CB ARG A 23 9.438 -6.056 1.984 1.00 11.24 C ATOM 165 CG ARG A 23 10.532 -5.201 2.604 1.00 73.24 C ATOM 166 CD ARG A 23 11.037 -5.801 3.906 1.00 30.14 C ATOM 167 NE ARG A 23 11.363 -4.774 4.892 1.00 14.20 N ATOM 168 CZ ARG A 23 11.511 -5.020 6.189 1.00 64.42 C ATOM 169 NH1 ARG A 23 11.365 -6.253 6.654 1.00 72.44 N ATOM 170 NH2 ARG A 23 11.808 -4.032 7.023 1.00 31.55 N ATOM 0 H ARG A 23 11.518 -6.892 0.078 1.00 14.30 H new ATOM 0 HA ARG A 23 8.613 -6.538 0.059 1.00 54.10 H new ATOM 0 HB2 ARG A 23 8.469 -5.611 2.210 1.00 11.24 H new ATOM 0 HB3 ARG A 23 9.452 -7.042 2.449 1.00 11.24 H new ATOM 0 HG2 ARG A 23 11.360 -5.103 1.902 1.00 73.24 H new ATOM 0 HG3 ARG A 23 10.150 -4.197 2.789 1.00 73.24 H new ATOM 0 HD2 ARG A 23 10.279 -6.469 4.315 1.00 30.14 H new ATOM 0 HD3 ARG A 23 11.921 -6.406 3.707 1.00 30.14 H new ATOM 0 HE ARG A 23 11.484 -3.815 4.567 1.00 14.20 H new ATOM 0 HH11 ARG A 23 11.139 -7.015 6.015 1.00 72.44 H new ATOM 0 HH12 ARG A 23 11.479 -6.439 7.650 1.00 72.44 H new ATOM 0 HH21 ARG A 23 11.923 -3.083 6.669 1.00 31.55 H new ATOM 0 HH22 ARG A 23 11.921 -4.222 8.019 1.00 31.55 H new ATOM 184 N ARG A 24 8.937 -4.131 -0.593 1.00 0.22 N ATOM 185 CA ARG A 24 9.162 -2.833 -1.219 1.00 33.51 C ATOM 186 C ARG A 24 9.469 -1.769 -0.169 1.00 72.24 C ATOM 187 O ARG A 24 8.629 -0.923 0.135 1.00 40.23 O ATOM 188 CB ARG A 24 7.937 -2.419 -2.037 1.00 64.54 C ATOM 189 CG ARG A 24 7.263 -3.578 -2.754 1.00 23.34 C ATOM 190 CD ARG A 24 6.687 -3.146 -4.093 1.00 31.03 C ATOM 191 NE ARG A 24 5.333 -3.655 -4.296 1.00 22.11 N ATOM 192 CZ ARG A 24 5.067 -4.879 -4.739 1.00 40.32 C ATOM 193 NH1 ARG A 24 6.056 -5.714 -5.024 1.00 24.13 N ATOM 194 NH2 ARG A 24 3.809 -5.269 -4.898 1.00 52.02 N ATOM 0 H ARG A 24 7.956 -4.399 -0.518 1.00 0.22 H new ATOM 0 HA ARG A 24 10.022 -2.922 -1.883 1.00 33.51 H new ATOM 0 HB2 ARG A 24 7.214 -1.942 -1.376 1.00 64.54 H new ATOM 0 HB3 ARG A 24 8.237 -1.673 -2.773 1.00 64.54 H new ATOM 0 HG2 ARG A 24 7.984 -4.380 -2.909 1.00 23.34 H new ATOM 0 HG3 ARG A 24 6.467 -3.981 -2.128 1.00 23.34 H new ATOM 0 HD2 ARG A 24 6.677 -2.057 -4.149 1.00 31.03 H new ATOM 0 HD3 ARG A 24 7.332 -3.501 -4.897 1.00 31.03 H new ATOM 0 HE ARG A 24 4.549 -3.037 -4.086 1.00 22.11 H new ATOM 0 HH11 ARG A 24 7.024 -5.418 -4.903 1.00 24.13 H new ATOM 0 HH12 ARG A 24 5.849 -6.653 -5.364 1.00 24.13 H new ATOM 0 HH21 ARG A 24 3.045 -4.629 -4.680 1.00 52.02 H new ATOM 0 HH22 ARG A 24 3.606 -6.209 -5.238 1.00 52.02 H new ATOM 208 N ALA A 25 10.678 -1.819 0.381 1.00 73.45 N ATOM 209 CA ALA A 25 11.096 -0.859 1.394 1.00 21.44 C ATOM 210 C ALA A 25 11.855 0.305 0.768 1.00 44.04 C ATOM 211 O ALA A 25 11.882 0.455 -0.454 1.00 12.50 O ATOM 212 CB ALA A 25 11.953 -1.545 2.448 1.00 2.33 C ATOM 0 H ALA A 25 11.385 -2.514 0.142 1.00 73.45 H new ATOM 0 HA ALA A 25 10.202 -0.459 1.872 1.00 21.44 H new ATOM 0 HB1 ALA A 25 12.259 -0.816 3.199 1.00 2.33 H new ATOM 0 HB2 ALA A 25 11.377 -2.338 2.925 1.00 2.33 H new ATOM 0 HB3 ALA A 25 12.838 -1.972 1.976 1.00 2.33 H new ATOM 218 N ARG A 26 12.471 1.127 1.612 1.00 62.45 N ATOM 219 CA ARG A 26 13.229 2.279 1.140 1.00 64.13 C ATOM 220 C ARG A 26 14.637 1.868 0.717 1.00 31.34 C ATOM 221 O ARG A 26 14.994 0.690 0.770 1.00 15.34 O ATOM 222 CB ARG A 26 13.305 3.348 2.231 1.00 52.30 C ATOM 223 CG ARG A 26 13.170 4.767 1.704 1.00 53.44 C ATOM 224 CD ARG A 26 12.094 5.539 2.451 1.00 12.42 C ATOM 225 NE ARG A 26 12.171 6.975 2.193 1.00 74.24 N ATOM 226 CZ ARG A 26 13.136 7.756 2.665 1.00 72.14 C ATOM 227 NH1 ARG A 26 14.101 7.243 3.415 1.00 60.10 N ATOM 228 NH2 ARG A 26 13.137 9.053 2.386 1.00 41.24 N ATOM 0 H ARG A 26 12.460 1.016 2.626 1.00 62.45 H new ATOM 0 HA ARG A 26 12.713 2.691 0.272 1.00 64.13 H new ATOM 0 HB2 ARG A 26 12.518 3.165 2.963 1.00 52.30 H new ATOM 0 HB3 ARG A 26 14.256 3.253 2.755 1.00 52.30 H new ATOM 0 HG2 ARG A 26 14.124 5.285 1.801 1.00 53.44 H new ATOM 0 HG3 ARG A 26 12.929 4.740 0.641 1.00 53.44 H new ATOM 0 HD2 ARG A 26 11.112 5.170 2.156 1.00 12.42 H new ATOM 0 HD3 ARG A 26 12.194 5.357 3.521 1.00 12.42 H new ATOM 0 HE ARG A 26 11.444 7.401 1.619 1.00 74.24 H new ATOM 0 HH11 ARG A 26 14.104 6.246 3.631 1.00 60.10 H new ATOM 0 HH12 ARG A 26 14.841 7.845 3.776 1.00 60.10 H new ATOM 0 HH21 ARG A 26 12.396 9.451 1.809 1.00 41.24 H new ATOM 0 HH22 ARG A 26 13.878 9.652 2.749 1.00 41.24 H new ATOM 242 N CYS A 27 15.432 2.846 0.298 1.00 65.34 N ATOM 243 CA CYS A 27 16.800 2.587 -0.135 1.00 64.10 C ATOM 244 C CYS A 27 17.606 3.881 -0.195 1.00 40.52 C ATOM 245 O CYS A 27 17.226 4.830 -0.883 1.00 25.14 O ATOM 246 CB CYS A 27 16.804 1.907 -1.506 1.00 21.25 C ATOM 247 SG CYS A 27 17.947 0.494 -1.631 1.00 61.14 S ATOM 0 H CYS A 27 15.153 3.826 0.249 1.00 65.34 H new ATOM 0 HA CYS A 27 17.265 1.923 0.594 1.00 64.10 H new ATOM 0 HB2 CYS A 27 15.794 1.565 -1.733 1.00 21.25 H new ATOM 0 HB3 CYS A 27 17.069 2.644 -2.264 1.00 21.25 H new ATOM 252 N TYR A 28 18.719 3.913 0.529 1.00 64.25 N ATOM 253 CA TYR A 28 19.578 5.091 0.560 1.00 71.04 C ATOM 254 C TYR A 28 21.041 4.704 0.364 1.00 12.43 C ATOM 255 O TYR A 28 21.472 3.607 0.717 1.00 21.44 O ATOM 256 CB TYR A 28 19.408 5.837 1.884 1.00 23.44 C ATOM 257 CG TYR A 28 19.906 5.062 3.083 1.00 32.55 C ATOM 258 CD1 TYR A 28 21.255 5.047 3.415 1.00 32.03 C ATOM 259 CD2 TYR A 28 19.026 4.344 3.885 1.00 2.43 C ATOM 260 CE1 TYR A 28 21.714 4.340 4.509 1.00 33.55 C ATOM 261 CE2 TYR A 28 19.476 3.635 4.982 1.00 10.33 C ATOM 262 CZ TYR A 28 20.821 3.636 5.290 1.00 75.50 C ATOM 263 OH TYR A 28 21.273 2.931 6.382 1.00 64.34 O ATOM 0 H TYR A 28 19.048 3.136 1.103 1.00 64.25 H new ATOM 0 HA TYR A 28 19.282 5.747 -0.259 1.00 71.04 H new ATOM 0 HB2 TYR A 28 19.941 6.786 1.828 1.00 23.44 H new ATOM 0 HB3 TYR A 28 18.353 6.072 2.026 1.00 23.44 H new ATOM 0 HD1 TYR A 28 21.957 5.598 2.807 1.00 32.03 H new ATOM 0 HD2 TYR A 28 17.973 4.340 3.646 1.00 2.43 H new ATOM 0 HE1 TYR A 28 22.766 4.338 4.752 1.00 33.55 H new ATOM 0 HE2 TYR A 28 18.779 3.083 5.595 1.00 10.33 H new ATOM 0 HH TYR A 28 21.471 3.552 7.113 1.00 64.34 H new ATOM 273 N PRO A 29 21.824 5.629 -0.212 1.00 31.44 N ATOM 274 CA PRO A 29 23.251 5.409 -0.466 1.00 52.45 C ATOM 275 C PRO A 29 24.071 5.374 0.819 1.00 55.12 C ATOM 276 O PRO A 29 24.205 6.384 1.511 1.00 53.15 O ATOM 277 CB PRO A 29 23.648 6.616 -1.321 1.00 32.21 C ATOM 278 CG PRO A 29 22.664 7.675 -0.961 1.00 72.04 C ATOM 279 CD PRO A 29 21.377 6.959 -0.658 1.00 30.22 C ATOM 0 HA PRO A 29 23.436 4.448 -0.946 1.00 52.45 H new ATOM 0 HB2 PRO A 29 24.668 6.934 -1.107 1.00 32.21 H new ATOM 0 HB3 PRO A 29 23.604 6.380 -2.384 1.00 32.21 H new ATOM 0 HG2 PRO A 29 23.005 8.247 -0.098 1.00 72.04 H new ATOM 0 HG3 PRO A 29 22.534 8.382 -1.781 1.00 72.04 H new ATOM 0 HD2 PRO A 29 20.805 7.471 0.116 1.00 30.22 H new ATOM 0 HD3 PRO A 29 20.737 6.894 -1.538 1.00 30.22 H new ATOM 287 N THR A 30 24.618 4.204 1.134 1.00 4.40 N ATOM 288 CA THR A 30 25.425 4.037 2.337 1.00 54.44 C ATOM 289 C THR A 30 26.698 4.872 2.265 1.00 63.10 C ATOM 290 O THR A 30 26.825 5.889 2.947 1.00 33.31 O ATOM 291 CB THR A 30 25.804 2.561 2.558 1.00 35.03 C ATOM 292 OG1 THR A 30 24.991 1.718 1.734 1.00 21.42 O ATOM 293 CG2 THR A 30 25.630 2.171 4.018 1.00 12.14 C ATOM 0 H THR A 30 24.517 3.358 0.573 1.00 4.40 H new ATOM 0 HA THR A 30 24.818 4.378 3.175 1.00 54.44 H new ATOM 0 HB THR A 30 26.852 2.433 2.286 1.00 35.03 H new ATOM 0 HG1 THR A 30 25.000 0.805 2.091 1.00 21.42 H new ATOM 0 HG21 THR A 30 25.904 1.124 4.150 1.00 12.14 H new ATOM 0 HG22 THR A 30 26.272 2.795 4.640 1.00 12.14 H new ATOM 0 HG23 THR A 30 24.590 2.314 4.311 1.00 12.14 H new ATOM 301 N SER A 31 27.640 4.436 1.434 1.00 31.02 N ATOM 302 CA SER A 31 28.906 5.142 1.276 1.00 60.11 C ATOM 303 C SER A 31 28.998 5.790 -0.102 1.00 51.30 C ATOM 304 O SER A 31 28.112 5.623 -0.939 1.00 20.20 O ATOM 305 CB SER A 31 30.079 4.181 1.479 1.00 31.20 C ATOM 306 OG SER A 31 30.184 3.783 2.835 1.00 13.42 O ATOM 0 H SER A 31 27.550 3.598 0.860 1.00 31.02 H new ATOM 0 HA SER A 31 28.953 5.926 2.031 1.00 60.11 H new ATOM 0 HB2 SER A 31 29.946 3.302 0.848 1.00 31.20 H new ATOM 0 HB3 SER A 31 31.006 4.662 1.165 1.00 31.20 H new ATOM 0 HG SER A 31 30.940 3.168 2.938 1.00 13.42 H new ATOM 312 N ASN A 32 30.077 6.532 -0.329 1.00 63.23 N ATOM 313 CA ASN A 32 30.286 7.207 -1.605 1.00 60.22 C ATOM 314 C ASN A 32 30.244 6.211 -2.761 1.00 11.35 C ATOM 315 O ASN A 32 29.531 6.414 -3.743 1.00 13.54 O ATOM 316 CB ASN A 32 31.626 7.945 -1.602 1.00 62.00 C ATOM 317 CG ASN A 32 31.457 9.450 -1.680 1.00 44.04 C ATOM 318 OD1 ASN A 32 31.608 10.048 -2.746 1.00 13.01 O ATOM 319 ND2 ASN A 32 31.143 10.070 -0.549 1.00 24.34 N ATOM 0 H ASN A 32 30.820 6.681 0.354 1.00 63.23 H new ATOM 0 HA ASN A 32 29.481 7.929 -1.741 1.00 60.22 H new ATOM 0 HB2 ASN A 32 32.176 7.690 -0.696 1.00 62.00 H new ATOM 0 HB3 ASN A 32 32.227 7.605 -2.446 1.00 62.00 H new ATOM 0 HD21 ASN A 32 31.017 11.082 -0.540 1.00 24.34 H new ATOM 0 HD22 ASN A 32 31.028 9.534 0.311 1.00 24.34 H new ATOM 326 N ALA A 33 31.013 5.134 -2.635 1.00 14.41 N ATOM 327 CA ALA A 33 31.061 4.106 -3.667 1.00 22.03 C ATOM 328 C ALA A 33 30.132 2.945 -3.329 1.00 11.11 C ATOM 329 O ALA A 33 29.256 2.587 -4.117 1.00 14.42 O ATOM 330 CB ALA A 33 32.487 3.607 -3.848 1.00 42.52 C ATOM 0 H ALA A 33 31.611 4.951 -1.829 1.00 14.41 H new ATOM 0 HA ALA A 33 30.721 4.549 -4.603 1.00 22.03 H new ATOM 0 HB1 ALA A 33 32.508 2.840 -4.622 1.00 42.52 H new ATOM 0 HB2 ALA A 33 33.128 4.438 -4.143 1.00 42.52 H new ATOM 0 HB3 ALA A 33 32.847 3.186 -2.909 1.00 42.52 H new ATOM 336 N THR A 34 30.329 2.358 -2.152 1.00 52.42 N ATOM 337 CA THR A 34 29.510 1.237 -1.711 1.00 32.41 C ATOM 338 C THR A 34 29.905 0.785 -0.310 1.00 20.13 C ATOM 339 O THR A 34 31.087 0.739 0.027 1.00 23.32 O ATOM 340 CB THR A 34 29.627 0.041 -2.676 1.00 5.54 C ATOM 341 OG1 THR A 34 29.040 -1.124 -2.086 1.00 1.21 O ATOM 342 CG2 THR A 34 31.083 -0.236 -3.018 1.00 24.31 C ATOM 0 H THR A 34 31.049 2.641 -1.488 1.00 52.42 H new ATOM 0 HA THR A 34 28.477 1.586 -1.700 1.00 32.41 H new ATOM 0 HB THR A 34 29.095 0.289 -3.594 1.00 5.54 H new ATOM 0 HG1 THR A 34 28.208 -0.876 -1.631 1.00 1.21 H new ATOM 0 HG21 THR A 34 31.142 -1.084 -3.700 1.00 24.31 H new ATOM 0 HG22 THR A 34 31.519 0.643 -3.493 1.00 24.31 H new ATOM 0 HG23 THR A 34 31.634 -0.466 -2.106 1.00 24.31 H new ATOM 350 N ASN A 35 28.908 0.452 0.503 1.00 35.20 N ATOM 351 CA ASN A 35 29.152 0.003 1.869 1.00 10.10 C ATOM 352 C ASN A 35 30.175 -1.128 1.895 1.00 22.31 C ATOM 353 O ASN A 35 30.292 -1.898 0.941 1.00 75.12 O ATOM 354 CB ASN A 35 27.846 -0.461 2.517 1.00 12.51 C ATOM 355 CG ASN A 35 28.054 -0.988 3.924 1.00 73.14 C ATOM 356 OD1 ASN A 35 28.035 -2.197 4.154 1.00 33.30 O ATOM 357 ND2 ASN A 35 28.253 -0.081 4.872 1.00 4.43 N ATOM 0 H ASN A 35 27.923 0.485 0.240 1.00 35.20 H new ATOM 0 HA ASN A 35 29.552 0.844 2.435 1.00 10.10 H new ATOM 0 HB2 ASN A 35 27.141 0.370 2.544 1.00 12.51 H new ATOM 0 HB3 ASN A 35 27.396 -1.241 1.903 1.00 12.51 H new ATOM 0 HD21 ASN A 35 28.398 -0.376 5.838 1.00 4.43 H new ATOM 0 HD22 ASN A 35 28.261 0.911 4.635 1.00 4.43 H new ATOM 364 N THR A 36 30.916 -1.224 2.995 1.00 11.00 N ATOM 365 CA THR A 36 31.930 -2.260 3.146 1.00 34.11 C ATOM 366 C THR A 36 31.714 -3.057 4.428 1.00 64.03 C ATOM 367 O THR A 36 31.230 -2.526 5.428 1.00 43.35 O ATOM 368 CB THR A 36 33.348 -1.660 3.160 1.00 23.22 C ATOM 369 OG1 THR A 36 33.427 -0.567 2.239 1.00 61.14 O ATOM 370 CG2 THR A 36 34.384 -2.713 2.796 1.00 4.20 C ATOM 0 H THR A 36 30.832 -0.596 3.795 1.00 11.00 H new ATOM 0 HA THR A 36 31.834 -2.925 2.288 1.00 34.11 H new ATOM 0 HB THR A 36 33.557 -1.300 4.168 1.00 23.22 H new ATOM 0 HG1 THR A 36 34.331 -0.190 2.255 1.00 61.14 H new ATOM 0 HG21 THR A 36 35.378 -2.266 2.812 1.00 4.20 H new ATOM 0 HG22 THR A 36 34.341 -3.530 3.517 1.00 4.20 H new ATOM 0 HG23 THR A 36 34.176 -3.098 1.798 1.00 4.20 H new ATOM 378 N CYS A 37 32.078 -4.335 4.392 1.00 14.33 N ATOM 379 CA CYS A 37 31.925 -5.206 5.551 1.00 32.01 C ATOM 380 C CYS A 37 33.162 -6.079 5.742 1.00 34.21 C ATOM 381 O CYS A 37 33.520 -6.866 4.866 1.00 25.30 O ATOM 382 CB CYS A 37 30.684 -6.087 5.393 1.00 63.43 C ATOM 383 SG CYS A 37 30.457 -7.299 6.734 1.00 72.01 S ATOM 0 H CYS A 37 32.481 -4.790 3.573 1.00 14.33 H new ATOM 0 HA CYS A 37 31.806 -4.578 6.434 1.00 32.01 H new ATOM 0 HB2 CYS A 37 29.802 -5.448 5.342 1.00 63.43 H new ATOM 0 HB3 CYS A 37 30.748 -6.619 4.444 1.00 63.43 H new ATOM 388 N PHE A 38 33.809 -5.934 6.893 1.00 23.24 N ATOM 389 CA PHE A 38 35.006 -6.709 7.200 1.00 43.41 C ATOM 390 C PHE A 38 36.024 -6.607 6.068 1.00 64.22 C ATOM 391 O PHE A 38 36.547 -7.616 5.596 1.00 5.13 O ATOM 392 CB PHE A 38 34.643 -8.175 7.444 1.00 55.31 C ATOM 393 CG PHE A 38 34.040 -8.426 8.796 1.00 15.54 C ATOM 394 CD1 PHE A 38 33.660 -7.368 9.607 1.00 2.03 C ATOM 395 CD2 PHE A 38 33.852 -9.719 9.257 1.00 54.23 C ATOM 396 CE1 PHE A 38 33.106 -7.596 10.853 1.00 71.24 C ATOM 397 CE2 PHE A 38 33.297 -9.953 10.501 1.00 23.21 C ATOM 398 CZ PHE A 38 32.923 -8.890 11.300 1.00 60.34 C ATOM 0 H PHE A 38 33.525 -5.287 7.629 1.00 23.24 H new ATOM 0 HA PHE A 38 35.452 -6.298 8.105 1.00 43.41 H new ATOM 0 HB2 PHE A 38 33.941 -8.500 6.676 1.00 55.31 H new ATOM 0 HB3 PHE A 38 35.539 -8.786 7.336 1.00 55.31 H new ATOM 0 HD1 PHE A 38 33.798 -6.354 9.262 1.00 2.03 H new ATOM 0 HD2 PHE A 38 34.143 -10.554 8.637 1.00 54.23 H new ATOM 0 HE1 PHE A 38 32.817 -6.763 11.476 1.00 71.24 H new ATOM 0 HE2 PHE A 38 33.156 -10.966 10.848 1.00 23.21 H new ATOM 0 HZ PHE A 38 32.488 -9.070 12.272 1.00 60.34 H new ATOM 408 N GLY A 39 36.300 -5.380 5.636 1.00 70.23 N ATOM 409 CA GLY A 39 37.253 -5.168 4.562 1.00 23.42 C ATOM 410 C GLY A 39 36.640 -5.380 3.192 1.00 22.32 C ATOM 411 O GLY A 39 36.697 -4.498 2.336 1.00 42.21 O ATOM 0 H GLY A 39 35.881 -4.529 6.011 1.00 70.23 H new ATOM 0 HA2 GLY A 39 37.649 -4.154 4.627 1.00 23.42 H new ATOM 0 HA3 GLY A 39 38.096 -5.848 4.689 1.00 23.42 H new ATOM 415 N SER A 40 36.053 -6.555 2.983 1.00 4.53 N ATOM 416 CA SER A 40 35.432 -6.882 1.705 1.00 11.04 C ATOM 417 C SER A 40 34.198 -6.018 1.464 1.00 33.14 C ATOM 418 O SER A 40 33.242 -6.050 2.240 1.00 54.15 O ATOM 419 CB SER A 40 35.048 -8.362 1.665 1.00 31.35 C ATOM 420 OG SER A 40 35.929 -9.095 0.832 1.00 20.42 O ATOM 0 H SER A 40 35.995 -7.295 3.682 1.00 4.53 H new ATOM 0 HA SER A 40 36.155 -6.680 0.915 1.00 11.04 H new ATOM 0 HB2 SER A 40 35.069 -8.774 2.674 1.00 31.35 H new ATOM 0 HB3 SER A 40 34.026 -8.466 1.300 1.00 31.35 H new ATOM 0 HG SER A 40 35.663 -10.038 0.825 1.00 20.42 H new ATOM 426 N LYS A 41 34.226 -5.246 0.384 1.00 51.25 N ATOM 427 CA LYS A 41 33.111 -4.373 0.037 1.00 55.10 C ATOM 428 C LYS A 41 31.894 -5.188 -0.389 1.00 72.14 C ATOM 429 O LYS A 41 32.025 -6.221 -1.047 1.00 64.22 O ATOM 430 CB LYS A 41 33.515 -3.416 -1.086 1.00 43.52 C ATOM 431 CG LYS A 41 34.795 -2.649 -0.800 1.00 52.32 C ATOM 432 CD LYS A 41 35.297 -1.921 -2.036 1.00 12.10 C ATOM 433 CE LYS A 41 34.316 -0.851 -2.490 1.00 14.02 C ATOM 434 NZ LYS A 41 34.931 0.505 -2.482 1.00 12.12 N ATOM 0 H LYS A 41 35.010 -5.207 -0.267 1.00 51.25 H new ATOM 0 HA LYS A 41 32.847 -3.794 0.922 1.00 55.10 H new ATOM 0 HB2 LYS A 41 33.640 -3.983 -2.008 1.00 43.52 H new ATOM 0 HB3 LYS A 41 32.706 -2.706 -1.256 1.00 43.52 H new ATOM 0 HG2 LYS A 41 34.618 -1.930 0.000 1.00 52.32 H new ATOM 0 HG3 LYS A 41 35.562 -3.338 -0.446 1.00 52.32 H new ATOM 0 HD2 LYS A 41 36.263 -1.463 -1.823 1.00 12.10 H new ATOM 0 HD3 LYS A 41 35.455 -2.637 -2.842 1.00 12.10 H new ATOM 0 HE2 LYS A 41 33.964 -1.084 -3.495 1.00 14.02 H new ATOM 0 HE3 LYS A 41 33.443 -0.858 -1.837 1.00 14.02 H new ATOM 0 HZ1 LYS A 41 34.230 1.206 -2.798 1.00 12.12 H new ATOM 0 HZ2 LYS A 41 35.244 0.738 -1.518 1.00 12.12 H new ATOM 0 HZ3 LYS A 41 35.749 0.519 -3.125 1.00 12.12 H new ATOM 448 N LEU A 42 30.710 -4.717 -0.012 1.00 63.13 N ATOM 449 CA LEU A 42 29.469 -5.402 -0.357 1.00 42.21 C ATOM 450 C LEU A 42 29.079 -5.126 -1.806 1.00 4.23 C ATOM 451 O LEU A 42 29.446 -4.105 -2.389 1.00 73.53 O ATOM 452 CB LEU A 42 28.343 -4.960 0.579 1.00 31.31 C ATOM 453 CG LEU A 42 28.536 -5.283 2.061 1.00 24.50 C ATOM 454 CD1 LEU A 42 29.097 -6.687 2.232 1.00 4.45 C ATOM 455 CD2 LEU A 42 29.451 -4.258 2.716 1.00 74.04 C ATOM 0 H LEU A 42 30.583 -3.864 0.532 1.00 63.13 H new ATOM 0 HA LEU A 42 29.630 -6.474 -0.241 1.00 42.21 H new ATOM 0 HB2 LEU A 42 28.214 -3.882 0.476 1.00 31.31 H new ATOM 0 HB3 LEU A 42 27.416 -5.425 0.244 1.00 31.31 H new ATOM 0 HG LEU A 42 27.564 -5.239 2.552 1.00 24.50 H new ATOM 0 HD11 LEU A 42 29.228 -6.900 3.293 1.00 4.45 H new ATOM 0 HD12 LEU A 42 28.406 -7.410 1.799 1.00 4.45 H new ATOM 0 HD13 LEU A 42 30.060 -6.758 1.726 1.00 4.45 H new ATOM 0 HD21 LEU A 42 29.577 -4.504 3.770 1.00 74.04 H new ATOM 0 HD22 LEU A 42 30.423 -4.270 2.222 1.00 74.04 H new ATOM 0 HD23 LEU A 42 29.010 -3.266 2.625 1.00 74.04 H new ATOM 467 N PRO A 43 28.316 -6.055 -2.401 1.00 5.32 N ATOM 468 CA PRO A 43 27.858 -5.932 -3.788 1.00 33.53 C ATOM 469 C PRO A 43 26.820 -4.829 -3.960 1.00 14.22 C ATOM 470 O PRO A 43 26.429 -4.500 -5.080 1.00 72.11 O ATOM 471 CB PRO A 43 27.236 -7.301 -4.078 1.00 3.03 C ATOM 472 CG PRO A 43 26.829 -7.822 -2.743 1.00 74.40 C ATOM 473 CD PRO A 43 27.843 -7.296 -1.765 1.00 55.34 C ATOM 0 HA PRO A 43 28.671 -5.665 -4.464 1.00 33.53 H new ATOM 0 HB2 PRO A 43 26.380 -7.213 -4.747 1.00 3.03 H new ATOM 0 HB3 PRO A 43 27.951 -7.966 -4.562 1.00 3.03 H new ATOM 0 HG2 PRO A 43 25.825 -7.486 -2.483 1.00 74.40 H new ATOM 0 HG3 PRO A 43 26.812 -8.912 -2.738 1.00 74.40 H new ATOM 0 HD2 PRO A 43 27.398 -7.103 -0.789 1.00 55.34 H new ATOM 0 HD3 PRO A 43 28.657 -8.004 -1.610 1.00 55.34 H new ATOM 481 N TYR A 44 26.377 -4.260 -2.844 1.00 23.11 N ATOM 482 CA TYR A 44 25.383 -3.194 -2.872 1.00 32.24 C ATOM 483 C TYR A 44 25.933 -1.919 -2.239 1.00 72.34 C ATOM 484 O TYR A 44 26.719 -1.972 -1.294 1.00 71.12 O ATOM 485 CB TYR A 44 24.114 -3.633 -2.139 1.00 74.24 C ATOM 486 CG TYR A 44 24.372 -4.599 -1.006 1.00 21.54 C ATOM 487 CD1 TYR A 44 24.811 -4.147 0.233 1.00 73.23 C ATOM 488 CD2 TYR A 44 24.177 -5.965 -1.172 1.00 73.15 C ATOM 489 CE1 TYR A 44 25.049 -5.027 1.271 1.00 51.40 C ATOM 490 CE2 TYR A 44 24.411 -6.852 -0.139 1.00 51.32 C ATOM 491 CZ TYR A 44 24.847 -6.378 1.080 1.00 3.33 C ATOM 492 OH TYR A 44 25.082 -7.257 2.113 1.00 41.24 O ATOM 0 H TYR A 44 26.691 -4.519 -1.909 1.00 23.11 H new ATOM 0 HA TYR A 44 25.140 -2.986 -3.914 1.00 32.24 H new ATOM 0 HB2 TYR A 44 23.609 -2.751 -1.745 1.00 74.24 H new ATOM 0 HB3 TYR A 44 23.434 -4.097 -2.853 1.00 74.24 H new ATOM 0 HD1 TYR A 44 24.969 -3.090 0.387 1.00 73.23 H new ATOM 0 HD2 TYR A 44 23.836 -6.340 -2.126 1.00 73.15 H new ATOM 0 HE1 TYR A 44 25.391 -4.659 2.227 1.00 51.40 H new ATOM 0 HE2 TYR A 44 24.253 -7.910 -0.285 1.00 51.32 H new ATOM 0 HH TYR A 44 24.471 -7.062 2.854 1.00 41.24 H new ATOM 502 N GLU A 45 25.512 -0.775 -2.769 1.00 2.20 N ATOM 503 CA GLU A 45 25.963 0.514 -2.257 1.00 15.10 C ATOM 504 C GLU A 45 24.824 1.249 -1.556 1.00 54.21 C ATOM 505 O GLU A 45 24.982 2.389 -1.117 1.00 25.25 O ATOM 506 CB GLU A 45 26.516 1.375 -3.395 1.00 32.23 C ATOM 507 CG GLU A 45 25.440 1.955 -4.297 1.00 41.05 C ATOM 508 CD GLU A 45 25.810 1.884 -5.766 1.00 63.22 C ATOM 509 OE1 GLU A 45 27.021 1.848 -6.071 1.00 71.32 O ATOM 510 OE2 GLU A 45 24.890 1.865 -6.610 1.00 63.53 O ATOM 0 H GLU A 45 24.860 -0.714 -3.551 1.00 2.20 H new ATOM 0 HA GLU A 45 26.756 0.331 -1.532 1.00 15.10 H new ATOM 0 HB2 GLU A 45 27.101 2.191 -2.971 1.00 32.23 H new ATOM 0 HB3 GLU A 45 27.197 0.773 -3.997 1.00 32.23 H new ATOM 0 HG2 GLU A 45 24.506 1.417 -4.135 1.00 41.05 H new ATOM 0 HG3 GLU A 45 25.261 2.994 -4.021 1.00 41.05 H new ATOM 517 N LEU A 46 23.675 0.590 -1.456 1.00 71.51 N ATOM 518 CA LEU A 46 22.508 1.179 -0.809 1.00 52.23 C ATOM 519 C LEU A 46 22.151 0.421 0.465 1.00 14.33 C ATOM 520 O LEU A 46 22.715 -0.635 0.750 1.00 73.10 O ATOM 521 CB LEU A 46 21.315 1.180 -1.767 1.00 62.32 C ATOM 522 CG LEU A 46 21.488 1.987 -3.054 1.00 64.12 C ATOM 523 CD1 LEU A 46 20.407 1.626 -4.060 1.00 54.03 C ATOM 524 CD2 LEU A 46 21.465 3.479 -2.755 1.00 61.23 C ATOM 0 H LEU A 46 23.526 -0.353 -1.815 1.00 71.51 H new ATOM 0 HA LEU A 46 22.752 2.207 -0.542 1.00 52.23 H new ATOM 0 HB2 LEU A 46 21.090 0.148 -2.036 1.00 62.32 H new ATOM 0 HB3 LEU A 46 20.447 1.567 -1.234 1.00 62.32 H new ATOM 0 HG LEU A 46 22.456 1.739 -3.488 1.00 64.12 H new ATOM 0 HD11 LEU A 46 20.547 2.210 -4.969 1.00 54.03 H new ATOM 0 HD12 LEU A 46 20.471 0.564 -4.298 1.00 54.03 H new ATOM 0 HD13 LEU A 46 19.427 1.844 -3.635 1.00 54.03 H new ATOM 0 HD21 LEU A 46 21.589 4.038 -3.682 1.00 61.23 H new ATOM 0 HD22 LEU A 46 20.512 3.744 -2.297 1.00 61.23 H new ATOM 0 HD23 LEU A 46 22.277 3.726 -2.071 1.00 61.23 H new ATOM 536 N SER A 47 21.209 0.967 1.228 1.00 75.01 N ATOM 537 CA SER A 47 20.777 0.343 2.473 1.00 14.22 C ATOM 538 C SER A 47 19.328 0.705 2.788 1.00 62.40 C ATOM 539 O SER A 47 18.794 1.684 2.268 1.00 41.12 O ATOM 540 CB SER A 47 21.684 0.776 3.626 1.00 22.44 C ATOM 541 OG SER A 47 21.087 0.492 4.880 1.00 71.54 O ATOM 0 H SER A 47 20.731 1.840 1.006 1.00 75.01 H new ATOM 0 HA SER A 47 20.845 -0.738 2.352 1.00 14.22 H new ATOM 0 HB2 SER A 47 22.642 0.262 3.551 1.00 22.44 H new ATOM 0 HB3 SER A 47 21.888 1.844 3.551 1.00 22.44 H new ATOM 0 HG SER A 47 21.062 1.308 5.423 1.00 71.54 H new ATOM 547 N SER A 48 18.698 -0.094 3.643 1.00 22.25 N ATOM 548 CA SER A 48 17.310 0.138 4.026 1.00 62.03 C ATOM 549 C SER A 48 17.171 0.221 5.543 1.00 42.22 C ATOM 550 O SER A 48 17.182 -0.797 6.236 1.00 44.01 O ATOM 551 CB SER A 48 16.416 -0.977 3.481 1.00 73.03 C ATOM 552 OG SER A 48 15.264 -1.148 4.288 1.00 11.44 O ATOM 0 H SER A 48 19.127 -0.908 4.084 1.00 22.25 H new ATOM 0 HA SER A 48 16.995 1.089 3.598 1.00 62.03 H new ATOM 0 HB2 SER A 48 16.117 -0.741 2.460 1.00 73.03 H new ATOM 0 HB3 SER A 48 16.977 -1.910 3.441 1.00 73.03 H new ATOM 0 HG SER A 48 15.186 -2.089 4.551 1.00 11.44 H new ATOM 558 N LEU A 49 17.040 1.441 6.052 1.00 4.03 N ATOM 559 CA LEU A 49 16.899 1.659 7.488 1.00 51.53 C ATOM 560 C LEU A 49 15.678 0.925 8.033 1.00 64.23 C ATOM 561 O LEU A 49 15.643 0.542 9.202 1.00 20.41 O ATOM 562 CB LEU A 49 16.784 3.155 7.787 1.00 53.20 C ATOM 563 CG LEU A 49 17.721 3.698 8.866 1.00 23.11 C ATOM 564 CD1 LEU A 49 17.295 3.205 10.240 1.00 4.04 C ATOM 565 CD2 LEU A 49 19.160 3.295 8.575 1.00 35.10 C ATOM 0 H LEU A 49 17.028 2.294 5.493 1.00 4.03 H new ATOM 0 HA LEU A 49 17.787 1.263 7.980 1.00 51.53 H new ATOM 0 HB2 LEU A 49 16.968 3.705 6.864 1.00 53.20 H new ATOM 0 HB3 LEU A 49 15.757 3.368 8.085 1.00 53.20 H new ATOM 0 HG LEU A 49 17.661 4.786 8.858 1.00 23.11 H new ATOM 0 HD11 LEU A 49 17.973 3.602 10.995 1.00 4.04 H new ATOM 0 HD12 LEU A 49 16.280 3.544 10.450 1.00 4.04 H new ATOM 0 HD13 LEU A 49 17.325 2.116 10.261 1.00 4.04 H new ATOM 0 HD21 LEU A 49 19.813 3.690 9.353 1.00 35.10 H new ATOM 0 HD22 LEU A 49 19.236 2.208 8.555 1.00 35.10 H new ATOM 0 HD23 LEU A 49 19.462 3.698 7.608 1.00 35.10 H new ATOM 577 N ASP A 50 14.681 0.730 7.177 1.00 30.02 N ATOM 578 CA ASP A 50 13.459 0.038 7.572 1.00 65.13 C ATOM 579 C ASP A 50 13.767 -1.378 8.048 1.00 70.40 C ATOM 580 O ASP A 50 13.070 -1.921 8.907 1.00 64.13 O ATOM 581 CB ASP A 50 12.473 -0.006 6.404 1.00 61.54 C ATOM 582 CG ASP A 50 11.037 -0.157 6.864 1.00 14.22 C ATOM 583 OD1 ASP A 50 10.725 -1.178 7.512 1.00 64.25 O ATOM 584 OD2 ASP A 50 10.223 0.747 6.577 1.00 63.53 O ATOM 0 H ASP A 50 14.695 1.041 6.206 1.00 30.02 H new ATOM 0 HA ASP A 50 13.008 0.589 8.397 1.00 65.13 H new ATOM 0 HB2 ASP A 50 12.569 0.907 5.817 1.00 61.54 H new ATOM 0 HB3 ASP A 50 12.730 -0.836 5.746 1.00 61.54 H new ATOM 589 N LEU A 51 14.813 -1.972 7.485 1.00 62.34 N ATOM 590 CA LEU A 51 15.213 -3.327 7.851 1.00 51.33 C ATOM 591 C LEU A 51 15.454 -3.436 9.353 1.00 41.11 C ATOM 592 O LEU A 51 15.348 -4.517 9.933 1.00 14.24 O ATOM 593 CB LEU A 51 16.477 -3.730 7.089 1.00 33.01 C ATOM 594 CG LEU A 51 16.604 -5.213 6.737 1.00 0.34 C ATOM 595 CD1 LEU A 51 16.609 -5.405 5.229 1.00 45.11 C ATOM 596 CD2 LEU A 51 17.863 -5.801 7.357 1.00 63.45 C ATOM 0 H LEU A 51 15.400 -1.537 6.773 1.00 62.34 H new ATOM 0 HA LEU A 51 14.403 -4.004 7.582 1.00 51.33 H new ATOM 0 HB2 LEU A 51 16.520 -3.153 6.165 1.00 33.01 H new ATOM 0 HB3 LEU A 51 17.343 -3.443 7.685 1.00 33.01 H new ATOM 0 HG LEU A 51 15.742 -5.740 7.146 1.00 0.34 H new ATOM 0 HD11 LEU A 51 16.700 -6.466 4.998 1.00 45.11 H new ATOM 0 HD12 LEU A 51 15.679 -5.021 4.810 1.00 45.11 H new ATOM 0 HD13 LEU A 51 17.452 -4.866 4.796 1.00 45.11 H new ATOM 0 HD21 LEU A 51 17.938 -6.857 7.097 1.00 63.45 H new ATOM 0 HD22 LEU A 51 18.737 -5.271 6.978 1.00 63.45 H new ATOM 0 HD23 LEU A 51 17.817 -5.697 8.441 1.00 63.45 H new ATOM 608 N THR A 52 15.778 -2.309 9.979 1.00 50.53 N ATOM 609 CA THR A 52 16.033 -2.277 11.413 1.00 1.23 C ATOM 610 C THR A 52 15.036 -1.373 12.129 1.00 31.12 C ATOM 611 O THR A 52 14.134 -0.812 11.507 1.00 72.32 O ATOM 612 CB THR A 52 17.462 -1.789 11.719 1.00 31.31 C ATOM 613 OG1 THR A 52 17.833 -0.753 10.803 1.00 34.01 O ATOM 614 CG2 THR A 52 18.457 -2.936 11.625 1.00 72.32 C ATOM 0 H THR A 52 15.870 -1.406 9.514 1.00 50.53 H new ATOM 0 HA THR A 52 15.920 -3.298 11.777 1.00 1.23 H new ATOM 0 HB THR A 52 17.478 -1.397 12.736 1.00 31.31 H new ATOM 0 HG1 THR A 52 18.260 -1.150 10.015 1.00 34.01 H new ATOM 0 HG21 THR A 52 19.459 -2.567 11.845 1.00 72.32 H new ATOM 0 HG22 THR A 52 18.189 -3.710 12.344 1.00 72.32 H new ATOM 0 HG23 THR A 52 18.437 -3.354 10.618 1.00 72.32 H new ATOM 622 N ASP A 53 15.204 -1.236 13.440 1.00 43.43 N ATOM 623 CA ASP A 53 14.319 -0.398 14.241 1.00 43.34 C ATOM 624 C ASP A 53 15.059 0.831 14.762 1.00 74.32 C ATOM 625 O ASP A 53 15.198 1.018 15.971 1.00 72.23 O ATOM 626 CB ASP A 53 13.746 -1.198 15.411 1.00 14.21 C ATOM 627 CG ASP A 53 12.484 -0.575 15.975 1.00 75.13 C ATOM 628 OD1 ASP A 53 12.172 0.576 15.602 1.00 33.40 O ATOM 629 OD2 ASP A 53 11.807 -1.239 16.788 1.00 40.43 O ATOM 0 H ASP A 53 15.945 -1.694 13.970 1.00 43.43 H new ATOM 0 HA ASP A 53 13.500 -0.064 13.604 1.00 43.34 H new ATOM 0 HB2 ASP A 53 13.530 -2.214 15.081 1.00 14.21 H new ATOM 0 HB3 ASP A 53 14.495 -1.271 16.199 1.00 14.21 H new ATOM 634 N PHE A 54 15.532 1.665 13.842 1.00 71.32 N ATOM 635 CA PHE A 54 16.259 2.874 14.208 1.00 1.42 C ATOM 636 C PHE A 54 15.629 4.105 13.562 1.00 71.41 C ATOM 637 O PHE A 54 14.553 4.026 12.968 1.00 32.44 O ATOM 638 CB PHE A 54 17.726 2.759 13.790 1.00 43.54 C ATOM 639 CG PHE A 54 18.416 1.549 14.350 1.00 64.44 C ATOM 640 CD1 PHE A 54 18.593 1.406 15.716 1.00 31.43 C ATOM 641 CD2 PHE A 54 18.889 0.554 13.509 1.00 21.30 C ATOM 642 CE1 PHE A 54 19.227 0.292 16.235 1.00 2.40 C ATOM 643 CE2 PHE A 54 19.524 -0.562 14.022 1.00 53.21 C ATOM 644 CZ PHE A 54 19.694 -0.692 15.386 1.00 21.04 C ATOM 0 H PHE A 54 15.425 1.525 12.837 1.00 71.32 H new ATOM 0 HA PHE A 54 16.205 2.986 15.291 1.00 1.42 H new ATOM 0 HB2 PHE A 54 17.784 2.729 12.702 1.00 43.54 H new ATOM 0 HB3 PHE A 54 18.259 3.653 14.113 1.00 43.54 H new ATOM 0 HD1 PHE A 54 18.232 2.174 16.384 1.00 31.43 H new ATOM 0 HD2 PHE A 54 18.760 0.651 12.441 1.00 21.30 H new ATOM 0 HE1 PHE A 54 19.357 0.192 17.302 1.00 2.40 H new ATOM 0 HE2 PHE A 54 19.887 -1.331 13.356 1.00 53.21 H new ATOM 0 HZ PHE A 54 20.192 -1.562 15.788 1.00 21.04 H new ATOM 654 N HIS A 55 16.307 5.242 13.682 1.00 31.30 N ATOM 655 CA HIS A 55 15.814 6.490 13.110 1.00 63.42 C ATOM 656 C HIS A 55 16.924 7.217 12.356 1.00 13.13 C ATOM 657 O HIS A 55 16.781 8.385 11.994 1.00 54.32 O ATOM 658 CB HIS A 55 15.252 7.392 14.208 1.00 35.14 C ATOM 659 CG HIS A 55 13.757 7.361 14.302 1.00 60.20 C ATOM 660 ND1 HIS A 55 13.082 6.976 15.441 1.00 21.21 N ATOM 661 CD2 HIS A 55 12.806 7.671 13.390 1.00 3.50 C ATOM 662 CE1 HIS A 55 11.781 7.049 15.225 1.00 11.32 C ATOM 663 NE2 HIS A 55 11.587 7.469 13.988 1.00 12.41 N ATOM 0 H HIS A 55 17.199 5.325 14.170 1.00 31.30 H new ATOM 0 HA HIS A 55 15.018 6.249 12.406 1.00 63.42 H new ATOM 0 HB2 HIS A 55 15.674 7.090 15.166 1.00 35.14 H new ATOM 0 HB3 HIS A 55 15.575 8.417 14.026 1.00 35.14 H new ATOM 0 HD2 HIS A 55 12.975 8.014 12.380 1.00 3.50 H new ATOM 0 HE1 HIS A 55 11.007 6.806 15.939 1.00 11.32 H new ATOM 0 HE2 HIS A 55 10.679 7.619 13.548 1.00 12.41 H new ATOM 671 N THR A 56 18.031 6.519 12.124 1.00 61.01 N ATOM 672 CA THR A 56 19.165 7.098 11.416 1.00 44.52 C ATOM 673 C THR A 56 20.273 6.070 11.218 1.00 44.44 C ATOM 674 O THR A 56 20.280 5.021 11.860 1.00 73.45 O ATOM 675 CB THR A 56 19.737 8.314 12.170 1.00 23.31 C ATOM 676 OG1 THR A 56 20.990 8.702 11.595 1.00 10.03 O ATOM 677 CG2 THR A 56 19.928 7.994 13.645 1.00 13.42 C ATOM 0 H THR A 56 18.166 5.551 12.416 1.00 61.01 H new ATOM 0 HA THR A 56 18.797 7.423 10.443 1.00 44.52 H new ATOM 0 HB THR A 56 19.027 9.136 12.081 1.00 23.31 H new ATOM 0 HG1 THR A 56 21.268 9.564 11.968 1.00 10.03 H new ATOM 0 HG21 THR A 56 20.333 8.867 14.157 1.00 13.42 H new ATOM 0 HG22 THR A 56 18.968 7.727 14.087 1.00 13.42 H new ATOM 0 HG23 THR A 56 20.620 7.159 13.749 1.00 13.42 H new ATOM 685 N GLU A 57 21.209 6.380 10.326 1.00 61.05 N ATOM 686 CA GLU A 57 22.322 5.481 10.044 1.00 42.12 C ATOM 687 C GLU A 57 23.234 5.347 11.260 1.00 44.02 C ATOM 688 O GLU A 57 23.666 4.248 11.609 1.00 35.10 O ATOM 689 CB GLU A 57 23.125 5.988 8.844 1.00 72.12 C ATOM 690 CG GLU A 57 22.261 6.390 7.660 1.00 64.42 C ATOM 691 CD GLU A 57 22.372 7.866 7.332 1.00 73.15 C ATOM 692 OE1 GLU A 57 22.429 8.681 8.275 1.00 4.43 O ATOM 693 OE2 GLU A 57 22.400 8.205 6.130 1.00 45.21 O ATOM 0 H GLU A 57 21.219 7.246 9.787 1.00 61.05 H new ATOM 0 HA GLU A 57 21.912 4.499 9.809 1.00 42.12 H new ATOM 0 HB2 GLU A 57 23.724 6.845 9.154 1.00 72.12 H new ATOM 0 HB3 GLU A 57 23.821 5.210 8.528 1.00 72.12 H new ATOM 0 HG2 GLU A 57 22.552 5.805 6.788 1.00 64.42 H new ATOM 0 HG3 GLU A 57 21.220 6.147 7.875 1.00 64.42 H new ATOM 700 N LYS A 58 23.525 6.474 11.901 1.00 62.11 N ATOM 701 CA LYS A 58 24.385 6.485 13.078 1.00 23.12 C ATOM 702 C LYS A 58 23.839 5.558 14.160 1.00 52.42 C ATOM 703 O LYS A 58 24.597 4.998 14.950 1.00 64.30 O ATOM 704 CB LYS A 58 24.514 7.907 13.628 1.00 43.33 C ATOM 705 CG LYS A 58 23.180 8.558 13.951 1.00 25.22 C ATOM 706 CD LYS A 58 22.705 8.192 15.347 1.00 24.43 C ATOM 707 CE LYS A 58 22.235 9.417 16.116 1.00 45.35 C ATOM 708 NZ LYS A 58 23.377 10.195 16.671 1.00 23.14 N ATOM 0 H LYS A 58 23.177 7.392 11.625 1.00 62.11 H new ATOM 0 HA LYS A 58 25.370 6.126 12.780 1.00 23.12 H new ATOM 0 HB2 LYS A 58 25.126 7.885 14.530 1.00 43.33 H new ATOM 0 HB3 LYS A 58 25.042 8.523 12.900 1.00 43.33 H new ATOM 0 HG2 LYS A 58 23.273 9.641 13.870 1.00 25.22 H new ATOM 0 HG3 LYS A 58 22.435 8.246 13.219 1.00 25.22 H new ATOM 0 HD2 LYS A 58 21.891 7.470 15.278 1.00 24.43 H new ATOM 0 HD3 LYS A 58 23.515 7.708 15.892 1.00 24.43 H new ATOM 0 HE2 LYS A 58 21.646 10.056 15.457 1.00 45.35 H new ATOM 0 HE3 LYS A 58 21.578 9.106 16.929 1.00 45.35 H new ATOM 0 HZ1 LYS A 58 23.015 11.022 17.188 1.00 23.14 H new ATOM 0 HZ2 LYS A 58 23.924 9.594 17.319 1.00 23.14 H new ATOM 0 HZ3 LYS A 58 23.990 10.514 15.894 1.00 23.14 H new ATOM 722 N GLU A 59 22.519 5.402 14.187 1.00 10.04 N ATOM 723 CA GLU A 59 21.873 4.542 15.172 1.00 13.53 C ATOM 724 C GLU A 59 22.234 3.079 14.937 1.00 32.41 C ATOM 725 O GLU A 59 22.564 2.350 15.874 1.00 14.42 O ATOM 726 CB GLU A 59 20.354 4.720 15.118 1.00 31.40 C ATOM 727 CG GLU A 59 19.812 5.654 16.186 1.00 15.41 C ATOM 728 CD GLU A 59 19.135 4.912 17.322 1.00 1.12 C ATOM 729 OE1 GLU A 59 19.847 4.251 18.107 1.00 51.30 O ATOM 730 OE2 GLU A 59 17.893 4.993 17.426 1.00 21.43 O ATOM 0 H GLU A 59 21.877 5.859 13.539 1.00 10.04 H new ATOM 0 HA GLU A 59 22.231 4.831 16.160 1.00 13.53 H new ATOM 0 HB2 GLU A 59 20.076 5.104 14.136 1.00 31.40 H new ATOM 0 HB3 GLU A 59 19.878 3.745 15.225 1.00 31.40 H new ATOM 0 HG2 GLU A 59 20.629 6.255 16.586 1.00 15.41 H new ATOM 0 HG3 GLU A 59 19.100 6.344 15.733 1.00 15.41 H new ATOM 737 N LEU A 60 22.168 2.654 13.680 1.00 25.01 N ATOM 738 CA LEU A 60 22.488 1.277 13.320 1.00 32.22 C ATOM 739 C LEU A 60 23.967 0.983 13.549 1.00 11.12 C ATOM 740 O LEU A 60 24.322 -0.018 14.170 1.00 41.03 O ATOM 741 CB LEU A 60 22.124 1.014 11.858 1.00 63.32 C ATOM 742 CG LEU A 60 22.045 -0.455 11.440 1.00 51.14 C ATOM 743 CD1 LEU A 60 21.239 -0.602 10.158 1.00 31.34 C ATOM 744 CD2 LEU A 60 23.440 -1.036 11.264 1.00 44.42 C ATOM 0 H LEU A 60 21.896 3.243 12.893 1.00 25.01 H new ATOM 0 HA LEU A 60 21.903 0.615 13.959 1.00 32.22 H new ATOM 0 HB2 LEU A 60 21.160 1.481 11.655 1.00 63.32 H new ATOM 0 HB3 LEU A 60 22.859 1.512 11.226 1.00 63.32 H new ATOM 0 HG LEU A 60 21.539 -1.011 12.230 1.00 51.14 H new ATOM 0 HD11 LEU A 60 21.193 -1.654 9.876 1.00 31.34 H new ATOM 0 HD12 LEU A 60 20.229 -0.225 10.318 1.00 31.34 H new ATOM 0 HD13 LEU A 60 21.717 -0.033 9.361 1.00 31.34 H new ATOM 0 HD21 LEU A 60 23.364 -2.082 10.967 1.00 44.42 H new ATOM 0 HD22 LEU A 60 23.972 -0.478 10.494 1.00 44.42 H new ATOM 0 HD23 LEU A 60 23.985 -0.965 12.205 1.00 44.42 H new ATOM 756 N ASN A 61 24.825 1.864 13.045 1.00 11.43 N ATOM 757 CA ASN A 61 26.266 1.700 13.196 1.00 1.45 C ATOM 758 C ASN A 61 26.665 1.725 14.669 1.00 71.41 C ATOM 759 O ASN A 61 27.585 1.020 15.085 1.00 34.12 O ATOM 760 CB ASN A 61 27.008 2.802 12.437 1.00 1.24 C ATOM 761 CG ASN A 61 27.849 2.255 11.300 1.00 50.30 C ATOM 762 OD1 ASN A 61 29.052 2.508 11.225 1.00 34.22 O ATOM 763 ND2 ASN A 61 27.218 1.502 10.407 1.00 32.42 N ATOM 0 H ASN A 61 24.547 2.699 12.529 1.00 11.43 H new ATOM 0 HA ASN A 61 26.542 0.731 12.779 1.00 1.45 H new ATOM 0 HB2 ASN A 61 26.286 3.516 12.040 1.00 1.24 H new ATOM 0 HB3 ASN A 61 27.649 3.348 13.129 1.00 1.24 H new ATOM 0 HD21 ASN A 61 27.731 1.107 9.619 1.00 32.42 H new ATOM 0 HD22 ASN A 61 26.220 1.318 10.509 1.00 32.42 H new ATOM 770 N ASP A 62 25.967 2.539 15.452 1.00 54.42 N ATOM 771 CA ASP A 62 26.246 2.655 16.878 1.00 20.34 C ATOM 772 C ASP A 62 25.702 1.449 17.638 1.00 63.41 C ATOM 773 O ASP A 62 26.261 1.038 18.656 1.00 52.45 O ATOM 774 CB ASP A 62 25.637 3.942 17.437 1.00 72.31 C ATOM 775 CG ASP A 62 26.436 5.173 17.057 1.00 74.24 C ATOM 776 OD1 ASP A 62 27.556 5.013 16.528 1.00 14.03 O ATOM 777 OD2 ASP A 62 25.941 6.296 17.288 1.00 1.22 O ATOM 0 H ASP A 62 25.203 3.129 15.123 1.00 54.42 H new ATOM 0 HA ASP A 62 27.328 2.688 17.009 1.00 20.34 H new ATOM 0 HB2 ASP A 62 24.616 4.047 17.069 1.00 72.31 H new ATOM 0 HB3 ASP A 62 25.579 3.871 18.523 1.00 72.31 H new ATOM 782 N LYS A 63 24.608 0.885 17.137 1.00 23.32 N ATOM 783 CA LYS A 63 23.988 -0.275 17.767 1.00 13.31 C ATOM 784 C LYS A 63 24.945 -1.462 17.784 1.00 72.23 C ATOM 785 O LYS A 63 24.875 -2.316 18.668 1.00 23.45 O ATOM 786 CB LYS A 63 22.701 -0.653 17.030 1.00 30.43 C ATOM 787 CG LYS A 63 22.777 -1.996 16.324 1.00 41.11 C ATOM 788 CD LYS A 63 22.480 -3.144 17.274 1.00 0.33 C ATOM 789 CE LYS A 63 23.335 -4.362 16.961 1.00 2.05 C ATOM 790 NZ LYS A 63 23.251 -5.390 18.036 1.00 53.41 N ATOM 0 H LYS A 63 24.132 1.213 16.296 1.00 23.32 H new ATOM 0 HA LYS A 63 23.746 -0.012 18.797 1.00 13.31 H new ATOM 0 HB2 LYS A 63 21.876 -0.673 17.743 1.00 30.43 H new ATOM 0 HB3 LYS A 63 22.471 0.121 16.298 1.00 30.43 H new ATOM 0 HG2 LYS A 63 22.067 -2.014 15.497 1.00 41.11 H new ATOM 0 HG3 LYS A 63 23.770 -2.126 15.894 1.00 41.11 H new ATOM 0 HD2 LYS A 63 22.662 -2.825 18.300 1.00 0.33 H new ATOM 0 HD3 LYS A 63 21.425 -3.411 17.205 1.00 0.33 H new ATOM 0 HE2 LYS A 63 23.013 -4.798 16.015 1.00 2.05 H new ATOM 0 HE3 LYS A 63 24.373 -4.054 16.833 1.00 2.05 H new ATOM 0 HZ1 LYS A 63 23.645 -6.288 17.689 1.00 53.41 H new ATOM 0 HZ2 LYS A 63 23.793 -5.071 18.865 1.00 53.41 H new ATOM 0 HZ3 LYS A 63 22.256 -5.530 18.306 1.00 53.41 H new ATOM 804 N LEU A 64 25.838 -1.510 16.802 1.00 44.31 N ATOM 805 CA LEU A 64 26.811 -2.592 16.705 1.00 64.34 C ATOM 806 C LEU A 64 27.544 -2.787 18.028 1.00 10.43 C ATOM 807 O LEU A 64 27.957 -3.896 18.363 1.00 0.12 O ATOM 808 CB LEU A 64 27.818 -2.301 15.590 1.00 75.53 C ATOM 809 CG LEU A 64 27.227 -2.038 14.204 1.00 34.51 C ATOM 810 CD1 LEU A 64 28.191 -2.490 13.118 1.00 33.11 C ATOM 811 CD2 LEU A 64 25.885 -2.741 14.054 1.00 11.45 C ATOM 0 H LEU A 64 25.908 -0.812 16.061 1.00 44.31 H new ATOM 0 HA LEU A 64 26.273 -3.510 16.470 1.00 64.34 H new ATOM 0 HB2 LEU A 64 28.411 -1.434 15.881 1.00 75.53 H new ATOM 0 HB3 LEU A 64 28.503 -3.146 15.517 1.00 75.53 H new ATOM 0 HG LEU A 64 27.067 -0.965 14.096 1.00 34.51 H new ATOM 0 HD11 LEU A 64 27.753 -2.295 12.139 1.00 33.11 H new ATOM 0 HD12 LEU A 64 29.128 -1.942 13.212 1.00 33.11 H new ATOM 0 HD13 LEU A 64 28.383 -3.558 13.223 1.00 33.11 H new ATOM 0 HD21 LEU A 64 25.479 -2.543 13.062 1.00 11.45 H new ATOM 0 HD22 LEU A 64 26.020 -3.815 14.183 1.00 11.45 H new ATOM 0 HD23 LEU A 64 25.193 -2.369 14.810 1.00 11.45 H new ATOM 823 N ASN A 65 27.699 -1.700 18.778 1.00 63.12 N ATOM 824 CA ASN A 65 28.381 -1.751 20.066 1.00 34.43 C ATOM 825 C ASN A 65 27.751 -2.804 20.973 1.00 34.22 C ATOM 826 O ASN A 65 28.444 -3.476 21.737 1.00 3.31 O ATOM 827 CB ASN A 65 28.333 -0.382 20.747 1.00 42.24 C ATOM 828 CG ASN A 65 29.489 0.509 20.334 1.00 22.13 C ATOM 829 OD1 ASN A 65 30.503 0.590 21.028 1.00 61.20 O ATOM 830 ND2 ASN A 65 29.341 1.183 19.200 1.00 41.02 N ATOM 0 H ASN A 65 27.362 -0.774 18.516 1.00 63.12 H new ATOM 0 HA ASN A 65 29.421 -2.024 19.888 1.00 34.43 H new ATOM 0 HB2 ASN A 65 27.392 0.110 20.501 1.00 42.24 H new ATOM 0 HB3 ASN A 65 28.349 -0.516 21.829 1.00 42.24 H new ATOM 0 HD21 ASN A 65 30.085 1.799 18.872 1.00 41.02 H new ATOM 0 HD22 ASN A 65 28.483 1.085 18.657 1.00 41.02 H new ATOM 837 N ASP A 66 26.433 -2.943 20.883 1.00 54.25 N ATOM 838 CA ASP A 66 25.708 -3.915 21.693 1.00 4.12 C ATOM 839 C ASP A 66 26.191 -5.332 21.402 1.00 73.54 C ATOM 840 O ASP A 66 26.533 -6.083 22.316 1.00 50.12 O ATOM 841 CB ASP A 66 24.205 -3.810 21.431 1.00 21.34 C ATOM 842 CG ASP A 66 23.506 -2.903 22.425 1.00 62.21 C ATOM 843 OD1 ASP A 66 23.410 -3.284 23.610 1.00 25.21 O ATOM 844 OD2 ASP A 66 23.054 -1.813 22.017 1.00 0.31 O ATOM 0 H ASP A 66 25.844 -2.394 20.256 1.00 54.25 H new ATOM 0 HA ASP A 66 25.901 -3.693 22.743 1.00 4.12 H new ATOM 0 HB2 ASP A 66 24.041 -3.433 20.422 1.00 21.34 H new ATOM 0 HB3 ASP A 66 23.761 -4.804 21.476 1.00 21.34 H new ATOM 849 N TYR A 67 26.214 -5.693 20.123 1.00 10.43 N ATOM 850 CA TYR A 67 26.651 -7.021 19.711 1.00 33.34 C ATOM 851 C TYR A 67 28.159 -7.175 19.879 1.00 23.34 C ATOM 852 O TYR A 67 28.659 -8.273 20.127 1.00 10.02 O ATOM 853 CB TYR A 67 26.259 -7.281 18.256 1.00 63.33 C ATOM 854 CG TYR A 67 27.437 -7.314 17.309 1.00 63.25 C ATOM 855 CD1 TYR A 67 28.186 -8.473 17.140 1.00 52.22 C ATOM 856 CD2 TYR A 67 27.803 -6.187 16.583 1.00 33.01 C ATOM 857 CE1 TYR A 67 29.263 -8.507 16.276 1.00 25.50 C ATOM 858 CE2 TYR A 67 28.878 -6.213 15.716 1.00 32.01 C ATOM 859 CZ TYR A 67 29.605 -7.375 15.566 1.00 21.31 C ATOM 860 OH TYR A 67 30.678 -7.405 14.704 1.00 14.15 O ATOM 0 H TYR A 67 25.935 -5.084 19.354 1.00 10.43 H new ATOM 0 HA TYR A 67 26.156 -7.753 20.350 1.00 33.34 H new ATOM 0 HB2 TYR A 67 25.728 -8.231 18.196 1.00 63.33 H new ATOM 0 HB3 TYR A 67 25.564 -6.506 17.932 1.00 63.33 H new ATOM 0 HD1 TYR A 67 27.921 -9.362 17.694 1.00 52.22 H new ATOM 0 HD2 TYR A 67 27.237 -5.275 16.699 1.00 33.01 H new ATOM 0 HE1 TYR A 67 29.835 -9.416 16.157 1.00 25.50 H new ATOM 0 HE2 TYR A 67 29.148 -5.328 15.159 1.00 32.01 H new ATOM 0 HH TYR A 67 31.265 -6.642 14.886 1.00 14.15 H new ATOM 870 N TYR A 68 28.879 -6.067 19.743 1.00 30.32 N ATOM 871 CA TYR A 68 30.331 -6.078 19.878 1.00 52.52 C ATOM 872 C TYR A 68 30.754 -6.792 21.158 1.00 42.33 C ATOM 873 O TYR A 68 31.747 -7.518 21.177 1.00 64.11 O ATOM 874 CB TYR A 68 30.874 -4.648 19.875 1.00 44.24 C ATOM 875 CG TYR A 68 31.523 -4.250 18.568 1.00 3.42 C ATOM 876 CD1 TYR A 68 32.727 -4.815 18.167 1.00 43.20 C ATOM 877 CD2 TYR A 68 30.931 -3.309 17.735 1.00 44.54 C ATOM 878 CE1 TYR A 68 33.324 -4.453 16.975 1.00 71.23 C ATOM 879 CE2 TYR A 68 31.520 -2.942 16.540 1.00 61.03 C ATOM 880 CZ TYR A 68 32.716 -3.517 16.164 1.00 4.35 C ATOM 881 OH TYR A 68 33.307 -3.155 14.975 1.00 12.03 O ATOM 0 H TYR A 68 28.481 -5.150 19.539 1.00 30.32 H new ATOM 0 HA TYR A 68 30.746 -6.620 19.028 1.00 52.52 H new ATOM 0 HB2 TYR A 68 30.058 -3.958 20.091 1.00 44.24 H new ATOM 0 HB3 TYR A 68 31.602 -4.543 20.679 1.00 44.24 H new ATOM 0 HD1 TYR A 68 33.205 -5.550 18.798 1.00 43.20 H new ATOM 0 HD2 TYR A 68 29.995 -2.857 18.026 1.00 44.54 H new ATOM 0 HE1 TYR A 68 34.262 -4.900 16.680 1.00 71.23 H new ATOM 0 HE2 TYR A 68 31.046 -2.209 15.904 1.00 61.03 H new ATOM 0 HH TYR A 68 32.751 -2.487 14.523 1.00 12.03 H new ATOM 891 N ALA A 69 29.992 -6.580 22.226 1.00 42.44 N ATOM 892 CA ALA A 69 30.285 -7.204 23.510 1.00 63.24 C ATOM 893 C ALA A 69 30.406 -8.718 23.369 1.00 42.21 C ATOM 894 O ALA A 69 31.153 -9.363 24.107 1.00 55.42 O ATOM 895 CB ALA A 69 29.210 -6.851 24.526 1.00 11.12 C ATOM 0 H ALA A 69 29.167 -5.981 22.227 1.00 42.44 H new ATOM 0 HA ALA A 69 31.242 -6.820 23.863 1.00 63.24 H new ATOM 0 HB1 ALA A 69 29.442 -7.324 25.480 1.00 11.12 H new ATOM 0 HB2 ALA A 69 29.174 -5.769 24.656 1.00 11.12 H new ATOM 0 HB3 ALA A 69 28.243 -7.206 24.171 1.00 11.12 H new ATOM 901 N LEU A 70 29.668 -9.280 22.418 1.00 13.43 N ATOM 902 CA LEU A 70 29.692 -10.719 22.181 1.00 14.21 C ATOM 903 C LEU A 70 31.088 -11.181 21.778 1.00 60.15 C ATOM 904 O LEU A 70 31.398 -12.372 21.826 1.00 3.54 O ATOM 905 CB LEU A 70 28.684 -11.093 21.093 1.00 73.10 C ATOM 906 CG LEU A 70 28.540 -12.586 20.797 1.00 74.25 C ATOM 907 CD1 LEU A 70 27.075 -12.995 20.816 1.00 60.41 C ATOM 908 CD2 LEU A 70 29.173 -12.927 19.455 1.00 32.24 C ATOM 0 H LEU A 70 29.046 -8.761 21.799 1.00 13.43 H new ATOM 0 HA LEU A 70 29.418 -11.220 23.109 1.00 14.21 H new ATOM 0 HB2 LEU A 70 27.707 -10.704 21.381 1.00 73.10 H new ATOM 0 HB3 LEU A 70 28.970 -10.586 20.171 1.00 73.10 H new ATOM 0 HG LEU A 70 29.062 -13.143 21.575 1.00 74.25 H new ATOM 0 HD11 LEU A 70 26.992 -14.061 20.603 1.00 60.41 H new ATOM 0 HD12 LEU A 70 26.652 -12.787 21.799 1.00 60.41 H new ATOM 0 HD13 LEU A 70 26.530 -12.431 20.060 1.00 60.41 H new ATOM 0 HD21 LEU A 70 29.061 -13.994 19.261 1.00 32.24 H new ATOM 0 HD22 LEU A 70 28.679 -12.361 18.665 1.00 32.24 H new ATOM 0 HD23 LEU A 70 30.232 -12.671 19.477 1.00 32.24 H new ATOM 920 N LYS A 71 31.928 -10.231 21.381 1.00 62.45 N ATOM 921 CA LYS A 71 33.294 -10.539 20.972 1.00 75.14 C ATOM 922 C LYS A 71 33.978 -11.440 21.994 1.00 32.44 C ATOM 923 O LYS A 71 34.818 -12.269 21.643 1.00 61.03 O ATOM 924 CB LYS A 71 34.098 -9.249 20.794 1.00 34.11 C ATOM 925 CG LYS A 71 34.373 -8.520 22.098 1.00 51.23 C ATOM 926 CD LYS A 71 35.296 -7.331 21.888 1.00 63.45 C ATOM 927 CE LYS A 71 34.513 -6.067 21.568 1.00 65.00 C ATOM 928 NZ LYS A 71 33.976 -5.422 22.798 1.00 53.03 N ATOM 0 H LYS A 71 31.687 -9.241 21.334 1.00 62.45 H new ATOM 0 HA LYS A 71 33.251 -11.067 20.020 1.00 75.14 H new ATOM 0 HB2 LYS A 71 35.047 -9.485 20.312 1.00 34.11 H new ATOM 0 HB3 LYS A 71 33.557 -8.583 20.122 1.00 34.11 H new ATOM 0 HG2 LYS A 71 33.432 -8.180 22.531 1.00 51.23 H new ATOM 0 HG3 LYS A 71 34.822 -9.209 22.813 1.00 51.23 H new ATOM 0 HD2 LYS A 71 35.895 -7.172 22.784 1.00 63.45 H new ATOM 0 HD3 LYS A 71 35.989 -7.546 21.075 1.00 63.45 H new ATOM 0 HE2 LYS A 71 35.158 -5.364 21.041 1.00 65.00 H new ATOM 0 HE3 LYS A 71 33.690 -6.310 20.896 1.00 65.00 H new ATOM 0 HZ1 LYS A 71 33.449 -4.564 22.538 1.00 53.03 H new ATOM 0 HZ2 LYS A 71 33.341 -6.084 23.288 1.00 53.03 H new ATOM 0 HZ3 LYS A 71 34.763 -5.167 23.428 1.00 53.03 H new ATOM 942 N HIS A 72 33.612 -11.274 23.261 1.00 32.45 N ATOM 943 CA HIS A 72 34.189 -12.075 24.335 1.00 23.12 C ATOM 944 C HIS A 72 34.120 -13.562 24.002 1.00 74.32 C ATOM 945 O HIS A 72 35.004 -14.334 24.372 1.00 22.21 O ATOM 946 CB HIS A 72 33.462 -11.801 25.652 1.00 62.10 C ATOM 947 CG HIS A 72 34.265 -10.991 26.622 1.00 3.04 C ATOM 948 ND1 HIS A 72 34.204 -9.615 26.686 1.00 15.14 N ATOM 949 CD2 HIS A 72 35.151 -11.371 27.573 1.00 42.13 C ATOM 950 CE1 HIS A 72 35.018 -9.183 27.633 1.00 71.33 C ATOM 951 NE2 HIS A 72 35.605 -10.229 28.186 1.00 32.23 N ATOM 0 H HIS A 72 32.919 -10.592 23.569 1.00 32.45 H new ATOM 0 HA HIS A 72 35.237 -11.793 24.442 1.00 23.12 H new ATOM 0 HB2 HIS A 72 32.529 -11.279 25.441 1.00 62.10 H new ATOM 0 HB3 HIS A 72 33.198 -12.751 26.116 1.00 62.10 H new ATOM 0 HD2 HIS A 72 35.446 -12.384 27.806 1.00 42.13 H new ATOM 0 HE1 HIS A 72 35.176 -8.151 27.908 1.00 71.33 H new ATOM 0 HE2 HIS A 72 36.285 -10.194 28.945 1.00 32.23 H new ATOM 959 N VAL A 73 33.062 -13.958 23.301 1.00 53.23 N ATOM 960 CA VAL A 73 32.877 -15.352 22.917 1.00 35.20 C ATOM 961 C VAL A 73 33.229 -15.570 21.450 1.00 53.12 C ATOM 962 O VAL A 73 32.543 -15.096 20.544 1.00 12.10 O ATOM 963 CB VAL A 73 31.427 -15.813 23.160 1.00 61.34 C ATOM 964 CG1 VAL A 73 31.265 -17.281 22.794 1.00 2.13 C ATOM 965 CG2 VAL A 73 31.025 -15.568 24.606 1.00 4.02 C ATOM 0 H VAL A 73 32.320 -13.332 22.988 1.00 53.23 H new ATOM 0 HA VAL A 73 33.548 -15.944 23.540 1.00 35.20 H new ATOM 0 HB VAL A 73 30.766 -15.229 22.520 1.00 61.34 H new ATOM 0 HG11 VAL A 73 30.235 -17.589 22.972 1.00 2.13 H new ATOM 0 HG12 VAL A 73 31.509 -17.423 21.741 1.00 2.13 H new ATOM 0 HG13 VAL A 73 31.935 -17.885 23.406 1.00 2.13 H new ATOM 0 HG21 VAL A 73 29.998 -15.900 24.759 1.00 4.02 H new ATOM 0 HG22 VAL A 73 31.689 -16.125 25.267 1.00 4.02 H new ATOM 0 HG23 VAL A 73 31.100 -14.504 24.829 1.00 4.02 H new ATOM 975 N PRO A 74 34.324 -16.305 21.207 1.00 21.01 N ATOM 976 CA PRO A 74 34.792 -16.604 19.851 1.00 44.25 C ATOM 977 C PRO A 74 33.865 -17.565 19.116 1.00 73.43 C ATOM 978 O PRO A 74 33.730 -17.503 17.893 1.00 0.35 O ATOM 979 CB PRO A 74 36.160 -17.252 20.082 1.00 53.21 C ATOM 980 CG PRO A 74 36.079 -17.826 21.454 1.00 5.13 C ATOM 981 CD PRO A 74 35.190 -16.902 22.238 1.00 15.44 C ATOM 0 HA PRO A 74 34.828 -15.711 19.227 1.00 44.25 H new ATOM 0 HB2 PRO A 74 36.362 -18.025 19.341 1.00 53.21 H new ATOM 0 HB3 PRO A 74 36.963 -16.519 20.006 1.00 53.21 H new ATOM 0 HG2 PRO A 74 35.669 -18.836 21.431 1.00 5.13 H new ATOM 0 HG3 PRO A 74 37.068 -17.894 21.907 1.00 5.13 H new ATOM 0 HD2 PRO A 74 34.610 -17.442 22.987 1.00 15.44 H new ATOM 0 HD3 PRO A 74 35.766 -16.143 22.767 1.00 15.44 H new ATOM 989 N LYS A 75 33.226 -18.455 19.868 1.00 11.01 N ATOM 990 CA LYS A 75 32.309 -19.430 19.289 1.00 12.52 C ATOM 991 C LYS A 75 31.148 -18.733 18.586 1.00 32.42 C ATOM 992 O LYS A 75 30.815 -19.057 17.446 1.00 61.53 O ATOM 993 CB LYS A 75 31.774 -20.365 20.376 1.00 73.13 C ATOM 994 CG LYS A 75 32.732 -21.486 20.740 1.00 44.43 C ATOM 995 CD LYS A 75 33.629 -21.097 21.903 1.00 13.34 C ATOM 996 CE LYS A 75 34.901 -21.929 21.929 1.00 22.44 C ATOM 997 NZ LYS A 75 34.705 -23.220 22.646 1.00 2.35 N ATOM 0 H LYS A 75 33.326 -18.521 20.881 1.00 11.01 H new ATOM 0 HA LYS A 75 32.858 -20.016 18.552 1.00 12.52 H new ATOM 0 HB2 LYS A 75 31.555 -19.781 21.270 1.00 73.13 H new ATOM 0 HB3 LYS A 75 30.832 -20.798 20.039 1.00 73.13 H new ATOM 0 HG2 LYS A 75 32.165 -22.380 21.000 1.00 44.43 H new ATOM 0 HG3 LYS A 75 33.345 -21.737 19.875 1.00 44.43 H new ATOM 0 HD2 LYS A 75 33.886 -20.040 21.828 1.00 13.34 H new ATOM 0 HD3 LYS A 75 33.088 -21.228 22.840 1.00 13.34 H new ATOM 0 HE2 LYS A 75 35.227 -22.127 20.908 1.00 22.44 H new ATOM 0 HE3 LYS A 75 35.696 -21.362 22.413 1.00 22.44 H new ATOM 0 HZ1 LYS A 75 35.595 -23.758 22.642 1.00 2.35 H new ATOM 0 HZ2 LYS A 75 34.419 -23.032 23.628 1.00 2.35 H new ATOM 0 HZ3 LYS A 75 33.964 -23.773 22.169 1.00 2.35 H new ATOM 1011 N CYS A 76 30.536 -17.774 19.273 1.00 74.53 N ATOM 1012 CA CYS A 76 29.413 -17.031 18.714 1.00 35.33 C ATOM 1013 C CYS A 76 29.903 -15.875 17.847 1.00 14.05 C ATOM 1014 O CYS A 76 29.228 -15.465 16.903 1.00 11.41 O ATOM 1015 CB CYS A 76 28.518 -16.499 19.836 1.00 61.03 C ATOM 1016 SG CYS A 76 26.775 -17.012 19.704 1.00 62.44 S ATOM 0 H CYS A 76 30.799 -17.493 20.218 1.00 74.53 H new ATOM 0 HA CYS A 76 28.835 -17.711 18.088 1.00 35.33 H new ATOM 0 HB2 CYS A 76 28.914 -16.838 20.793 1.00 61.03 H new ATOM 0 HB3 CYS A 76 28.566 -15.410 19.839 1.00 61.03 H new ATOM 1021 N TRP A 77 31.080 -15.355 18.175 1.00 32.24 N ATOM 1022 CA TRP A 77 31.661 -14.246 17.427 1.00 73.33 C ATOM 1023 C TRP A 77 31.859 -14.623 15.963 1.00 50.44 C ATOM 1024 O TRP A 77 31.348 -13.953 15.066 1.00 44.45 O ATOM 1025 CB TRP A 77 32.997 -13.831 18.045 1.00 73.01 C ATOM 1026 CG TRP A 77 33.917 -13.158 17.072 1.00 4.05 C ATOM 1027 CD1 TRP A 77 35.204 -13.512 16.782 1.00 21.15 C ATOM 1028 CD2 TRP A 77 33.622 -12.014 16.264 1.00 2.32 C ATOM 1029 NE1 TRP A 77 35.727 -12.657 15.843 1.00 54.35 N ATOM 1030 CE2 TRP A 77 34.776 -11.729 15.508 1.00 71.34 C ATOM 1031 CE3 TRP A 77 32.495 -11.203 16.104 1.00 22.12 C ATOM 1032 CZ2 TRP A 77 34.833 -10.668 14.608 1.00 74.54 C ATOM 1033 CZ3 TRP A 77 32.553 -10.150 15.211 1.00 63.52 C ATOM 1034 CH2 TRP A 77 33.715 -9.891 14.471 1.00 32.12 C ATOM 0 H TRP A 77 31.651 -15.683 18.954 1.00 32.24 H new ATOM 0 HA TRP A 77 30.970 -13.405 17.476 1.00 73.33 H new ATOM 0 HB2 TRP A 77 32.809 -13.158 18.882 1.00 73.01 H new ATOM 0 HB3 TRP A 77 33.491 -14.714 18.451 1.00 73.01 H new ATOM 0 HD1 TRP A 77 35.733 -14.342 17.226 1.00 21.15 H new ATOM 0 HE1 TRP A 77 36.670 -12.705 15.458 1.00 54.35 H new ATOM 0 HE3 TRP A 77 31.595 -11.396 16.668 1.00 22.12 H new ATOM 0 HZ2 TRP A 77 35.728 -10.466 14.038 1.00 74.54 H new ATOM 0 HZ3 TRP A 77 31.688 -9.516 15.081 1.00 63.52 H new ATOM 0 HH2 TRP A 77 33.728 -9.062 13.779 1.00 32.12 H new ATOM 1045 N ALA A 78 32.603 -15.698 15.728 1.00 21.41 N ATOM 1046 CA ALA A 78 32.866 -16.164 14.372 1.00 24.53 C ATOM 1047 C ALA A 78 31.584 -16.639 13.696 1.00 5.23 C ATOM 1048 O ALA A 78 31.554 -16.858 12.486 1.00 44.23 O ATOM 1049 CB ALA A 78 33.900 -17.280 14.389 1.00 25.43 C ATOM 0 H ALA A 78 33.035 -16.263 16.459 1.00 21.41 H new ATOM 0 HA ALA A 78 33.260 -15.326 13.797 1.00 24.53 H new ATOM 0 HB1 ALA A 78 34.087 -17.619 13.370 1.00 25.43 H new ATOM 0 HB2 ALA A 78 34.828 -16.909 14.824 1.00 25.43 H new ATOM 0 HB3 ALA A 78 33.527 -18.113 14.985 1.00 25.43 H new ATOM 1055 N ALA A 79 30.528 -16.796 14.487 1.00 74.35 N ATOM 1056 CA ALA A 79 29.243 -17.244 13.964 1.00 54.54 C ATOM 1057 C ALA A 79 28.523 -16.114 13.235 1.00 42.33 C ATOM 1058 O ALA A 79 27.840 -16.343 12.236 1.00 45.41 O ATOM 1059 CB ALA A 79 28.374 -17.785 15.089 1.00 23.15 C ATOM 0 H ALA A 79 30.537 -16.620 15.492 1.00 74.35 H new ATOM 0 HA ALA A 79 29.430 -18.044 13.247 1.00 54.54 H new ATOM 0 HB1 ALA A 79 27.418 -18.116 14.683 1.00 23.15 H new ATOM 0 HB2 ALA A 79 28.877 -18.627 15.565 1.00 23.15 H new ATOM 0 HB3 ALA A 79 28.203 -17.001 15.826 1.00 23.15 H new ATOM 1065 N ILE A 80 28.680 -14.895 13.741 1.00 61.22 N ATOM 1066 CA ILE A 80 28.045 -13.730 13.137 1.00 64.20 C ATOM 1067 C ILE A 80 28.994 -13.025 12.173 1.00 32.23 C ATOM 1068 O ILE A 80 28.734 -11.902 11.743 1.00 4.44 O ATOM 1069 CB ILE A 80 27.578 -12.726 14.207 1.00 43.31 C ATOM 1070 CG1 ILE A 80 26.488 -11.814 13.640 1.00 1.23 C ATOM 1071 CG2 ILE A 80 28.755 -11.903 14.711 1.00 60.51 C ATOM 1072 CD1 ILE A 80 26.091 -10.694 14.576 1.00 54.30 C ATOM 0 H ILE A 80 29.241 -14.689 14.567 1.00 61.22 H new ATOM 0 HA ILE A 80 27.176 -14.093 12.587 1.00 64.20 H new ATOM 0 HB ILE A 80 27.161 -13.281 15.048 1.00 43.31 H new ATOM 0 HG12 ILE A 80 26.837 -11.385 12.700 1.00 1.23 H new ATOM 0 HG13 ILE A 80 25.607 -12.414 13.409 1.00 1.23 H new ATOM 0 HG21 ILE A 80 28.409 -11.198 15.467 1.00 60.51 H new ATOM 0 HG22 ILE A 80 29.502 -12.566 15.148 1.00 60.51 H new ATOM 0 HG23 ILE A 80 29.198 -11.355 13.880 1.00 60.51 H new ATOM 0 HD11 ILE A 80 25.315 -10.088 14.109 1.00 54.30 H new ATOM 0 HD12 ILE A 80 25.712 -11.115 15.507 1.00 54.30 H new ATOM 0 HD13 ILE A 80 26.960 -10.071 14.787 1.00 54.30 H new ATOM 1084 N GLN A 81 30.092 -13.694 11.837 1.00 2.13 N ATOM 1085 CA GLN A 81 31.079 -13.131 10.923 1.00 31.20 C ATOM 1086 C GLN A 81 30.460 -12.854 9.557 1.00 34.30 C ATOM 1087 O GLN A 81 30.432 -11.720 9.079 1.00 65.10 O ATOM 1088 CB GLN A 81 32.268 -14.082 10.774 1.00 72.00 C ATOM 1089 CG GLN A 81 33.593 -13.471 11.199 1.00 11.45 C ATOM 1090 CD GLN A 81 34.601 -14.513 11.641 1.00 45.30 C ATOM 1091 OE1 GLN A 81 34.821 -15.511 10.954 1.00 33.25 O ATOM 1092 NE2 GLN A 81 35.222 -14.286 12.793 1.00 43.44 N ATOM 0 H GLN A 81 30.321 -14.626 12.184 1.00 2.13 H new ATOM 0 HA GLN A 81 31.428 -12.187 11.342 1.00 31.20 H new ATOM 0 HB2 GLN A 81 32.083 -14.977 11.368 1.00 72.00 H new ATOM 0 HB3 GLN A 81 32.341 -14.399 9.734 1.00 72.00 H new ATOM 0 HG2 GLN A 81 34.008 -12.899 10.369 1.00 11.45 H new ATOM 0 HG3 GLN A 81 33.420 -12.769 12.015 1.00 11.45 H new ATOM 0 HE21 GLN A 81 35.009 -13.446 13.330 1.00 43.44 H new ATOM 0 HE22 GLN A 81 35.912 -14.952 13.140 1.00 43.44 H new ATOM 1101 N PRO A 82 29.950 -13.914 8.912 1.00 61.30 N ATOM 1102 CA PRO A 82 29.322 -13.810 7.592 1.00 74.43 C ATOM 1103 C PRO A 82 27.986 -13.075 7.642 1.00 65.45 C ATOM 1104 O PRO A 82 27.573 -12.452 6.664 1.00 74.45 O ATOM 1105 CB PRO A 82 29.113 -15.271 7.182 1.00 2.53 C ATOM 1106 CG PRO A 82 29.036 -16.017 8.469 1.00 60.51 C ATOM 1107 CD PRO A 82 29.948 -15.296 9.422 1.00 12.41 C ATOM 0 HA PRO A 82 29.934 -13.240 6.893 1.00 74.43 H new ATOM 0 HB2 PRO A 82 28.200 -15.392 6.599 1.00 2.53 H new ATOM 0 HB3 PRO A 82 29.936 -15.631 6.564 1.00 2.53 H new ATOM 0 HG2 PRO A 82 28.014 -16.038 8.847 1.00 60.51 H new ATOM 0 HG3 PRO A 82 29.348 -17.053 8.339 1.00 60.51 H new ATOM 0 HD2 PRO A 82 29.579 -15.346 10.447 1.00 12.41 H new ATOM 0 HD3 PRO A 82 30.950 -15.726 9.423 1.00 12.41 H new ATOM 1115 N PHE A 83 27.317 -13.152 8.787 1.00 53.43 N ATOM 1116 CA PHE A 83 26.027 -12.494 8.964 1.00 44.55 C ATOM 1117 C PHE A 83 26.213 -11.025 9.333 1.00 54.44 C ATOM 1118 O PHE A 83 25.287 -10.221 9.213 1.00 12.10 O ATOM 1119 CB PHE A 83 25.212 -13.204 10.046 1.00 24.21 C ATOM 1120 CG PHE A 83 23.850 -12.609 10.258 1.00 11.25 C ATOM 1121 CD1 PHE A 83 23.073 -12.220 9.179 1.00 61.30 C ATOM 1122 CD2 PHE A 83 23.346 -12.437 11.538 1.00 62.12 C ATOM 1123 CE1 PHE A 83 21.819 -11.672 9.371 1.00 73.41 C ATOM 1124 CE2 PHE A 83 22.092 -11.890 11.736 1.00 65.22 C ATOM 1125 CZ PHE A 83 21.328 -11.506 10.651 1.00 23.22 C ATOM 0 H PHE A 83 27.646 -13.663 9.606 1.00 53.43 H new ATOM 0 HA PHE A 83 25.487 -12.548 8.019 1.00 44.55 H new ATOM 0 HB2 PHE A 83 25.103 -14.255 9.777 1.00 24.21 H new ATOM 0 HB3 PHE A 83 25.764 -13.172 10.985 1.00 24.21 H new ATOM 0 HD1 PHE A 83 23.452 -12.347 8.176 1.00 61.30 H new ATOM 0 HD2 PHE A 83 23.940 -12.734 12.390 1.00 62.12 H new ATOM 0 HE1 PHE A 83 21.224 -11.374 8.521 1.00 73.41 H new ATOM 0 HE2 PHE A 83 21.710 -11.763 12.738 1.00 65.22 H new ATOM 0 HZ PHE A 83 20.349 -11.077 10.803 1.00 23.22 H new ATOM 1135 N LEU A 84 27.414 -10.681 9.782 1.00 5.03 N ATOM 1136 CA LEU A 84 27.723 -9.309 10.170 1.00 52.20 C ATOM 1137 C LEU A 84 27.380 -8.336 9.047 1.00 44.55 C ATOM 1138 O LEU A 84 27.163 -7.147 9.285 1.00 61.12 O ATOM 1139 CB LEU A 84 29.202 -9.182 10.537 1.00 3.10 C ATOM 1140 CG LEU A 84 29.510 -8.440 11.838 1.00 12.30 C ATOM 1141 CD1 LEU A 84 29.256 -6.949 11.675 1.00 64.01 C ATOM 1142 CD2 LEU A 84 28.679 -9.002 12.982 1.00 14.20 C ATOM 0 H LEU A 84 28.191 -11.333 9.887 1.00 5.03 H new ATOM 0 HA LEU A 84 27.117 -9.058 11.041 1.00 52.20 H new ATOM 0 HB2 LEU A 84 29.626 -10.184 10.605 1.00 3.10 H new ATOM 0 HB3 LEU A 84 29.716 -8.673 9.722 1.00 3.10 H new ATOM 0 HG LEU A 84 30.564 -8.585 12.076 1.00 12.30 H new ATOM 0 HD11 LEU A 84 29.481 -6.437 12.611 1.00 64.01 H new ATOM 0 HD12 LEU A 84 29.894 -6.555 10.884 1.00 64.01 H new ATOM 0 HD13 LEU A 84 28.211 -6.784 11.413 1.00 64.01 H new ATOM 0 HD21 LEU A 84 28.911 -8.462 13.900 1.00 14.20 H new ATOM 0 HD22 LEU A 84 27.620 -8.888 12.752 1.00 14.20 H new ATOM 0 HD23 LEU A 84 28.910 -10.059 13.115 1.00 14.20 H new ATOM 1154 N CYS A 85 27.332 -8.848 7.821 1.00 1.43 N ATOM 1155 CA CYS A 85 27.014 -8.025 6.660 1.00 23.23 C ATOM 1156 C CYS A 85 25.534 -8.134 6.305 1.00 63.51 C ATOM 1157 O CYS A 85 24.908 -7.155 5.902 1.00 2.44 O ATOM 1158 CB CYS A 85 27.870 -8.444 5.463 1.00 72.10 C ATOM 1159 SG CYS A 85 29.599 -8.834 5.884 1.00 13.25 S ATOM 0 H CYS A 85 27.509 -9.829 7.606 1.00 1.43 H new ATOM 0 HA CYS A 85 27.234 -6.987 6.910 1.00 23.23 H new ATOM 0 HB2 CYS A 85 27.416 -9.317 4.993 1.00 72.10 H new ATOM 0 HB3 CYS A 85 27.859 -7.643 4.724 1.00 72.10 H new ATOM 1164 N ALA A 86 24.982 -9.334 6.457 1.00 12.54 N ATOM 1165 CA ALA A 86 23.576 -9.571 6.155 1.00 12.22 C ATOM 1166 C ALA A 86 22.691 -9.220 7.347 1.00 44.22 C ATOM 1167 O ALA A 86 21.480 -9.439 7.320 1.00 63.40 O ATOM 1168 CB ALA A 86 23.361 -11.020 5.745 1.00 24.31 C ATOM 0 H ALA A 86 25.487 -10.156 6.787 1.00 12.54 H new ATOM 0 HA ALA A 86 23.295 -8.924 5.324 1.00 12.22 H new ATOM 0 HB1 ALA A 86 22.306 -11.183 5.522 1.00 24.31 H new ATOM 0 HB2 ALA A 86 23.957 -11.240 4.859 1.00 24.31 H new ATOM 0 HB3 ALA A 86 23.665 -11.678 6.559 1.00 24.31 H new ATOM 1174 N VAL A 87 23.304 -8.674 8.392 1.00 3.34 N ATOM 1175 CA VAL A 87 22.572 -8.292 9.594 1.00 2.11 C ATOM 1176 C VAL A 87 22.464 -6.776 9.713 1.00 54.11 C ATOM 1177 O VAL A 87 21.442 -6.249 10.153 1.00 11.44 O ATOM 1178 CB VAL A 87 23.246 -8.848 10.862 1.00 22.34 C ATOM 1179 CG1 VAL A 87 24.605 -8.198 11.075 1.00 54.43 C ATOM 1180 CG2 VAL A 87 22.351 -8.641 12.075 1.00 24.51 C ATOM 0 H VAL A 87 24.306 -8.486 8.431 1.00 3.34 H new ATOM 0 HA VAL A 87 21.573 -8.719 9.505 1.00 2.11 H new ATOM 0 HB VAL A 87 23.400 -9.919 10.730 1.00 22.34 H new ATOM 0 HG11 VAL A 87 25.065 -8.604 11.976 1.00 54.43 H new ATOM 0 HG12 VAL A 87 25.245 -8.403 10.217 1.00 54.43 H new ATOM 0 HG13 VAL A 87 24.480 -7.121 11.185 1.00 54.43 H new ATOM 0 HG21 VAL A 87 22.843 -9.040 12.962 1.00 24.51 H new ATOM 0 HG22 VAL A 87 22.164 -7.576 12.212 1.00 24.51 H new ATOM 0 HG23 VAL A 87 21.404 -9.159 11.921 1.00 24.51 H new ATOM 1190 N PHE A 88 23.524 -6.079 9.317 1.00 73.43 N ATOM 1191 CA PHE A 88 23.548 -4.623 9.379 1.00 2.31 C ATOM 1192 C PHE A 88 23.546 -4.018 7.978 1.00 75.20 C ATOM 1193 O PHE A 88 23.020 -2.926 7.761 1.00 33.30 O ATOM 1194 CB PHE A 88 24.780 -4.145 10.151 1.00 50.34 C ATOM 1195 CG PHE A 88 24.969 -4.840 11.469 1.00 52.14 C ATOM 1196 CD1 PHE A 88 23.917 -4.956 12.363 1.00 72.04 C ATOM 1197 CD2 PHE A 88 26.199 -5.377 11.814 1.00 53.24 C ATOM 1198 CE1 PHE A 88 24.087 -5.595 13.576 1.00 20.52 C ATOM 1199 CE2 PHE A 88 26.375 -6.018 13.025 1.00 12.34 C ATOM 1200 CZ PHE A 88 25.318 -6.126 13.908 1.00 21.13 C ATOM 0 H PHE A 88 24.378 -6.500 8.950 1.00 73.43 H new ATOM 0 HA PHE A 88 22.649 -4.292 9.900 1.00 2.31 H new ATOM 0 HB2 PHE A 88 25.667 -4.301 9.537 1.00 50.34 H new ATOM 0 HB3 PHE A 88 24.697 -3.072 10.324 1.00 50.34 H new ATOM 0 HD1 PHE A 88 22.953 -4.542 12.109 1.00 72.04 H new ATOM 0 HD2 PHE A 88 27.029 -5.293 11.128 1.00 53.24 H new ATOM 0 HE1 PHE A 88 23.258 -5.679 14.264 1.00 20.52 H new ATOM 0 HE2 PHE A 88 27.338 -6.434 13.281 1.00 12.34 H new ATOM 0 HZ PHE A 88 25.454 -6.625 14.856 1.00 21.13 H new ATOM 1210 N LYS A 89 24.138 -4.736 7.029 1.00 14.05 N ATOM 1211 CA LYS A 89 24.204 -4.273 5.648 1.00 23.14 C ATOM 1212 C LYS A 89 23.348 -5.149 4.739 1.00 12.42 C ATOM 1213 O LYS A 89 23.849 -6.000 4.005 1.00 64.01 O ATOM 1214 CB LYS A 89 25.654 -4.275 5.158 1.00 51.22 C ATOM 1215 CG LYS A 89 26.659 -3.886 6.228 1.00 12.13 C ATOM 1216 CD LYS A 89 26.411 -2.477 6.740 1.00 44.32 C ATOM 1217 CE LYS A 89 27.338 -2.133 7.896 1.00 14.12 C ATOM 1218 NZ LYS A 89 28.769 -2.338 7.540 1.00 30.44 N ATOM 0 H LYS A 89 24.579 -5.641 7.191 1.00 14.05 H new ATOM 0 HA LYS A 89 23.816 -3.255 5.613 1.00 23.14 H new ATOM 0 HB2 LYS A 89 25.901 -5.269 4.784 1.00 51.22 H new ATOM 0 HB3 LYS A 89 25.746 -3.586 4.318 1.00 51.22 H new ATOM 0 HG2 LYS A 89 26.600 -4.591 7.057 1.00 12.13 H new ATOM 0 HG3 LYS A 89 27.668 -3.954 5.822 1.00 12.13 H new ATOM 0 HD2 LYS A 89 26.558 -1.763 5.930 1.00 44.32 H new ATOM 0 HD3 LYS A 89 25.374 -2.383 7.063 1.00 44.32 H new ATOM 0 HE2 LYS A 89 27.182 -1.095 8.190 1.00 14.12 H new ATOM 0 HE3 LYS A 89 27.087 -2.750 8.759 1.00 14.12 H new ATOM 0 HZ1 LYS A 89 29.359 -1.669 8.075 1.00 30.44 H new ATOM 0 HZ2 LYS A 89 29.049 -3.312 7.775 1.00 30.44 H new ATOM 0 HZ3 LYS A 89 28.900 -2.177 6.521 1.00 30.44 H new ATOM 1232 N PRO A 90 22.024 -4.936 4.787 1.00 43.44 N ATOM 1233 CA PRO A 90 21.071 -5.694 3.972 1.00 72.32 C ATOM 1234 C PRO A 90 21.172 -5.350 2.490 1.00 61.13 C ATOM 1235 O PRO A 90 21.425 -4.202 2.124 1.00 23.10 O ATOM 1236 CB PRO A 90 19.710 -5.267 4.528 1.00 22.21 C ATOM 1237 CG PRO A 90 19.947 -3.919 5.115 1.00 5.32 C ATOM 1238 CD PRO A 90 21.357 -3.937 5.639 1.00 70.23 C ATOM 0 HA PRO A 90 21.252 -6.767 4.027 1.00 72.32 H new ATOM 0 HB2 PRO A 90 18.955 -5.230 3.742 1.00 22.21 H new ATOM 0 HB3 PRO A 90 19.352 -5.969 5.281 1.00 22.21 H new ATOM 0 HG2 PRO A 90 19.820 -3.139 4.365 1.00 5.32 H new ATOM 0 HG3 PRO A 90 19.236 -3.711 5.915 1.00 5.32 H new ATOM 0 HD2 PRO A 90 21.829 -2.958 5.556 1.00 70.23 H new ATOM 0 HD3 PRO A 90 21.391 -4.219 6.691 1.00 70.23 H new ATOM 1246 N LYS A 91 20.973 -6.352 1.640 1.00 55.55 N ATOM 1247 CA LYS A 91 21.039 -6.155 0.196 1.00 24.43 C ATOM 1248 C LYS A 91 19.783 -5.459 -0.317 1.00 60.20 C ATOM 1249 O LYS A 91 18.729 -6.081 -0.455 1.00 10.30 O ATOM 1250 CB LYS A 91 21.217 -7.499 -0.514 1.00 61.21 C ATOM 1251 CG LYS A 91 21.303 -7.381 -2.026 1.00 31.30 C ATOM 1252 CD LYS A 91 22.008 -8.579 -2.640 1.00 31.45 C ATOM 1253 CE LYS A 91 21.480 -8.883 -4.033 1.00 72.32 C ATOM 1254 NZ LYS A 91 22.103 -10.107 -4.608 1.00 25.41 N ATOM 0 H LYS A 91 20.765 -7.309 1.926 1.00 55.55 H new ATOM 0 HA LYS A 91 21.898 -5.520 -0.020 1.00 24.43 H new ATOM 0 HB2 LYS A 91 22.123 -7.979 -0.143 1.00 61.21 H new ATOM 0 HB3 LYS A 91 20.382 -8.150 -0.256 1.00 61.21 H new ATOM 0 HG2 LYS A 91 20.299 -7.295 -2.443 1.00 31.30 H new ATOM 0 HG3 LYS A 91 21.837 -6.468 -2.291 1.00 31.30 H new ATOM 0 HD2 LYS A 91 23.080 -8.385 -2.690 1.00 31.45 H new ATOM 0 HD3 LYS A 91 21.871 -9.450 -2.000 1.00 31.45 H new ATOM 0 HE2 LYS A 91 20.398 -9.012 -3.991 1.00 72.32 H new ATOM 0 HE3 LYS A 91 21.675 -8.034 -4.688 1.00 72.32 H new ATOM 0 HZ1 LYS A 91 21.716 -10.280 -5.558 1.00 25.41 H new ATOM 0 HZ2 LYS A 91 23.133 -9.975 -4.672 1.00 25.41 H new ATOM 0 HZ3 LYS A 91 21.896 -10.922 -3.996 1.00 25.41 H new ATOM 1268 N CYS A 92 19.902 -4.166 -0.600 1.00 22.31 N ATOM 1269 CA CYS A 92 18.777 -3.385 -1.099 1.00 71.41 C ATOM 1270 C CYS A 92 18.956 -3.058 -2.579 1.00 11.02 C ATOM 1271 O CYS A 92 19.890 -2.354 -2.960 1.00 3.33 O ATOM 1272 CB CYS A 92 18.629 -2.093 -0.294 1.00 33.02 C ATOM 1273 SG CYS A 92 17.180 -1.091 -0.757 1.00 12.44 S ATOM 0 H CYS A 92 20.767 -3.637 -0.492 1.00 22.31 H new ATOM 0 HA CYS A 92 17.873 -3.982 -0.984 1.00 71.41 H new ATOM 0 HB2 CYS A 92 18.561 -2.343 0.765 1.00 33.02 H new ATOM 0 HB3 CYS A 92 19.529 -1.492 -0.423 1.00 33.02 H new ATOM 1278 N GLU A 93 18.053 -3.574 -3.407 1.00 23.40 N ATOM 1279 CA GLU A 93 18.112 -3.337 -4.844 1.00 64.15 C ATOM 1280 C GLU A 93 16.733 -2.988 -5.396 1.00 33.44 C ATOM 1281 O GLU A 93 15.710 -3.327 -4.800 1.00 13.31 O ATOM 1282 CB GLU A 93 18.665 -4.569 -5.565 1.00 0.31 C ATOM 1283 CG GLU A 93 20.145 -4.807 -5.315 1.00 34.34 C ATOM 1284 CD GLU A 93 20.980 -3.559 -5.523 1.00 63.31 C ATOM 1285 OE1 GLU A 93 20.827 -2.913 -6.581 1.00 35.12 O ATOM 1286 OE2 GLU A 93 21.788 -3.229 -4.630 1.00 34.13 O ATOM 0 H GLU A 93 17.273 -4.158 -3.107 1.00 23.40 H new ATOM 0 HA GLU A 93 18.779 -2.493 -5.019 1.00 64.15 H new ATOM 0 HB2 GLU A 93 18.105 -5.448 -5.246 1.00 0.31 H new ATOM 0 HB3 GLU A 93 18.499 -4.457 -6.637 1.00 0.31 H new ATOM 0 HG2 GLU A 93 20.284 -5.167 -4.296 1.00 34.34 H new ATOM 0 HG3 GLU A 93 20.500 -5.593 -5.982 1.00 34.34 H new ATOM 1293 N LYS A 94 16.713 -2.309 -6.537 1.00 53.12 N ATOM 1294 CA LYS A 94 15.460 -1.914 -7.171 1.00 4.30 C ATOM 1295 C LYS A 94 15.046 -2.926 -8.234 1.00 51.55 C ATOM 1296 O LYS A 94 15.675 -3.025 -9.289 1.00 15.53 O ATOM 1297 CB LYS A 94 15.599 -0.525 -7.799 1.00 70.24 C ATOM 1298 CG LYS A 94 14.803 0.550 -7.080 1.00 52.05 C ATOM 1299 CD LYS A 94 14.800 1.855 -7.858 1.00 51.50 C ATOM 1300 CE LYS A 94 16.208 2.401 -8.036 1.00 43.40 C ATOM 1301 NZ LYS A 94 16.871 2.663 -6.728 1.00 62.34 N ATOM 0 H LYS A 94 17.550 -2.020 -7.043 1.00 53.12 H new ATOM 0 HA LYS A 94 14.686 -1.883 -6.404 1.00 4.30 H new ATOM 0 HB2 LYS A 94 16.652 -0.242 -7.806 1.00 70.24 H new ATOM 0 HB3 LYS A 94 15.275 -0.571 -8.839 1.00 70.24 H new ATOM 0 HG2 LYS A 94 13.778 0.209 -6.935 1.00 52.05 H new ATOM 0 HG3 LYS A 94 15.227 0.717 -6.090 1.00 52.05 H new ATOM 0 HD2 LYS A 94 14.344 1.696 -8.835 1.00 51.50 H new ATOM 0 HD3 LYS A 94 14.187 2.590 -7.336 1.00 51.50 H new ATOM 0 HE2 LYS A 94 16.803 1.690 -8.609 1.00 43.40 H new ATOM 0 HE3 LYS A 94 16.169 3.324 -8.615 1.00 43.40 H new ATOM 0 HZ1 LYS A 94 17.284 3.617 -6.733 1.00 62.34 H new ATOM 0 HZ2 LYS A 94 16.170 2.594 -5.963 1.00 62.34 H new ATOM 0 HZ3 LYS A 94 17.622 1.961 -6.573 1.00 62.34 H new ATOM 1315 N ILE A 95 13.985 -3.673 -7.951 1.00 75.25 N ATOM 1316 CA ILE A 95 13.485 -4.675 -8.885 1.00 45.13 C ATOM 1317 C ILE A 95 12.439 -4.081 -9.822 1.00 12.44 C ATOM 1318 O ILE A 95 11.386 -3.622 -9.381 1.00 1.34 O ATOM 1319 CB ILE A 95 12.872 -5.878 -8.145 1.00 72.23 C ATOM 1320 CG1 ILE A 95 13.957 -6.646 -7.388 1.00 71.40 C ATOM 1321 CG2 ILE A 95 12.154 -6.793 -9.126 1.00 71.21 C ATOM 1322 CD1 ILE A 95 14.249 -6.084 -6.014 1.00 53.15 C ATOM 0 H ILE A 95 13.455 -3.604 -7.083 1.00 75.25 H new ATOM 0 HA ILE A 95 14.340 -5.016 -9.469 1.00 45.13 H new ATOM 0 HB ILE A 95 12.144 -5.509 -7.423 1.00 72.23 H new ATOM 0 HG12 ILE A 95 13.651 -7.687 -7.288 1.00 71.40 H new ATOM 0 HG13 ILE A 95 14.874 -6.638 -7.977 1.00 71.40 H new ATOM 0 HG21 ILE A 95 11.726 -7.639 -8.588 1.00 71.21 H new ATOM 0 HG22 ILE A 95 11.358 -6.239 -9.624 1.00 71.21 H new ATOM 0 HG23 ILE A 95 12.863 -7.157 -9.870 1.00 71.21 H new ATOM 0 HD11 ILE A 95 15.028 -6.678 -5.536 1.00 53.15 H new ATOM 0 HD12 ILE A 95 14.586 -5.052 -6.107 1.00 53.15 H new ATOM 0 HD13 ILE A 95 13.344 -6.117 -5.408 1.00 53.15 H new ATOM 1334 N ASN A 96 12.736 -4.094 -11.117 1.00 73.30 N ATOM 1335 CA ASN A 96 11.820 -3.558 -12.117 1.00 14.32 C ATOM 1336 C ASN A 96 11.478 -2.102 -11.816 1.00 11.43 C ATOM 1337 O ASN A 96 10.431 -1.601 -12.224 1.00 33.50 O ATOM 1338 CB ASN A 96 10.539 -4.394 -12.167 1.00 2.14 C ATOM 1339 CG ASN A 96 9.770 -4.198 -13.459 1.00 45.30 C ATOM 1340 OD1 ASN A 96 10.122 -4.762 -14.495 1.00 42.32 O ATOM 1341 ND2 ASN A 96 8.715 -3.394 -13.403 1.00 74.40 N ATOM 0 H ASN A 96 13.604 -4.470 -11.499 1.00 73.30 H new ATOM 0 HA ASN A 96 12.314 -3.604 -13.087 1.00 14.32 H new ATOM 0 HB2 ASN A 96 10.792 -5.448 -12.054 1.00 2.14 H new ATOM 0 HB3 ASN A 96 9.901 -4.127 -11.324 1.00 2.14 H new ATOM 0 HD21 ASN A 96 8.159 -3.223 -14.241 1.00 74.40 H new ATOM 0 HD22 ASN A 96 8.460 -2.948 -12.522 1.00 74.40 H new ATOM 1348 N GLY A 97 12.370 -1.426 -11.098 1.00 45.11 N ATOM 1349 CA GLY A 97 12.146 -0.034 -10.755 1.00 12.13 C ATOM 1350 C GLY A 97 11.440 0.128 -9.423 1.00 2.10 C ATOM 1351 O GLY A 97 10.905 1.195 -9.123 1.00 73.35 O ATOM 0 H GLY A 97 13.244 -1.818 -10.748 1.00 45.11 H new ATOM 0 HA2 GLY A 97 13.103 0.487 -10.722 1.00 12.13 H new ATOM 0 HA3 GLY A 97 11.552 0.439 -11.537 1.00 12.13 H new ATOM 1355 N GLU A 98 11.438 -0.934 -8.623 1.00 2.41 N ATOM 1356 CA GLU A 98 10.790 -0.904 -7.317 1.00 2.20 C ATOM 1357 C GLU A 98 11.810 -1.103 -6.199 1.00 74.41 C ATOM 1358 O GLU A 98 12.443 -2.155 -6.103 1.00 0.34 O ATOM 1359 CB GLU A 98 9.709 -1.983 -7.235 1.00 31.32 C ATOM 1360 CG GLU A 98 8.651 -1.869 -8.320 1.00 23.33 C ATOM 1361 CD GLU A 98 7.722 -3.067 -8.356 1.00 55.43 C ATOM 1362 OE1 GLU A 98 7.857 -3.949 -7.483 1.00 12.24 O ATOM 1363 OE2 GLU A 98 6.859 -3.122 -9.258 1.00 5.21 O ATOM 0 H GLU A 98 11.877 -1.825 -8.856 1.00 2.41 H new ATOM 0 HA GLU A 98 10.326 0.074 -7.192 1.00 2.20 H new ATOM 0 HB2 GLU A 98 10.181 -2.963 -7.301 1.00 31.32 H new ATOM 0 HB3 GLU A 98 9.225 -1.927 -6.260 1.00 31.32 H new ATOM 0 HG2 GLU A 98 8.065 -0.964 -8.158 1.00 23.33 H new ATOM 0 HG3 GLU A 98 9.139 -1.763 -9.289 1.00 23.33 H new ATOM 1370 N ASP A 99 11.962 -0.087 -5.358 1.00 4.04 N ATOM 1371 CA ASP A 99 12.904 -0.150 -4.246 1.00 1.32 C ATOM 1372 C ASP A 99 12.521 -1.259 -3.271 1.00 62.24 C ATOM 1373 O ASP A 99 11.572 -1.121 -2.500 1.00 43.01 O ATOM 1374 CB ASP A 99 12.954 1.193 -3.515 1.00 54.12 C ATOM 1375 CG ASP A 99 13.815 2.212 -4.235 1.00 4.15 C ATOM 1376 OD1 ASP A 99 15.056 2.126 -4.122 1.00 23.43 O ATOM 1377 OD2 ASP A 99 13.249 3.096 -4.911 1.00 30.40 O ATOM 0 H ASP A 99 11.446 0.790 -5.424 1.00 4.04 H new ATOM 0 HA ASP A 99 13.891 -0.372 -4.651 1.00 1.32 H new ATOM 0 HB2 ASP A 99 11.942 1.585 -3.411 1.00 54.12 H new ATOM 0 HB3 ASP A 99 13.342 1.041 -2.508 1.00 54.12 H new ATOM 1382 N MET A 100 13.265 -2.359 -3.313 1.00 65.53 N ATOM 1383 CA MET A 100 13.004 -3.493 -2.434 1.00 14.23 C ATOM 1384 C MET A 100 14.224 -3.807 -1.574 1.00 70.33 C ATOM 1385 O MET A 100 15.324 -3.321 -1.838 1.00 54.04 O ATOM 1386 CB MET A 100 12.612 -4.723 -3.255 1.00 25.25 C ATOM 1387 CG MET A 100 11.585 -4.431 -4.336 1.00 0.30 C ATOM 1388 SD MET A 100 10.146 -5.513 -4.238 1.00 64.22 S ATOM 1389 CE MET A 100 10.817 -7.029 -4.917 1.00 34.20 C ATOM 0 H MET A 100 14.054 -2.489 -3.946 1.00 65.53 H new ATOM 0 HA MET A 100 12.177 -3.227 -1.775 1.00 14.23 H new ATOM 0 HB2 MET A 100 13.506 -5.140 -3.718 1.00 25.25 H new ATOM 0 HB3 MET A 100 12.215 -5.485 -2.585 1.00 25.25 H new ATOM 0 HG2 MET A 100 11.261 -3.394 -4.253 1.00 0.30 H new ATOM 0 HG3 MET A 100 12.052 -4.542 -5.315 1.00 0.30 H new ATOM 0 HE1 MET A 100 10.373 -7.884 -4.407 1.00 34.20 H new ATOM 0 HE2 MET A 100 10.589 -7.083 -5.982 1.00 34.20 H new ATOM 0 HE3 MET A 100 11.898 -7.044 -4.776 1.00 34.20 H new ATOM 1399 N VAL A 101 14.023 -4.623 -0.545 1.00 33.55 N ATOM 1400 CA VAL A 101 15.107 -5.003 0.353 1.00 30.31 C ATOM 1401 C VAL A 101 15.158 -6.515 0.545 1.00 54.11 C ATOM 1402 O VAL A 101 14.138 -7.198 0.445 1.00 23.32 O ATOM 1403 CB VAL A 101 14.960 -4.327 1.729 1.00 15.01 C ATOM 1404 CG1 VAL A 101 14.705 -2.836 1.567 1.00 71.21 C ATOM 1405 CG2 VAL A 101 13.843 -4.983 2.528 1.00 65.11 C ATOM 0 H VAL A 101 13.119 -5.034 -0.312 1.00 33.55 H new ATOM 0 HA VAL A 101 16.034 -4.667 -0.111 1.00 30.31 H new ATOM 0 HB VAL A 101 15.893 -4.454 2.279 1.00 15.01 H new ATOM 0 HG11 VAL A 101 14.604 -2.375 2.550 1.00 71.21 H new ATOM 0 HG12 VAL A 101 15.541 -2.379 1.036 1.00 71.21 H new ATOM 0 HG13 VAL A 101 13.788 -2.683 0.999 1.00 71.21 H new ATOM 0 HG21 VAL A 101 13.753 -4.493 3.497 1.00 65.11 H new ATOM 0 HG22 VAL A 101 12.903 -4.888 1.985 1.00 65.11 H new ATOM 0 HG23 VAL A 101 14.072 -6.038 2.675 1.00 65.11 H new ATOM 1415 N TYR A 102 16.350 -7.031 0.821 1.00 0.11 N ATOM 1416 CA TYR A 102 16.535 -8.463 1.025 1.00 15.32 C ATOM 1417 C TYR A 102 16.866 -8.767 2.483 1.00 1.10 C ATOM 1418 O TYR A 102 17.639 -8.049 3.119 1.00 31.14 O ATOM 1419 CB TYR A 102 17.647 -8.990 0.117 1.00 51.50 C ATOM 1420 CG TYR A 102 17.205 -9.218 -1.311 1.00 44.20 C ATOM 1421 CD1 TYR A 102 16.323 -10.242 -1.630 1.00 75.24 C ATOM 1422 CD2 TYR A 102 17.672 -8.410 -2.341 1.00 34.12 C ATOM 1423 CE1 TYR A 102 15.917 -10.455 -2.934 1.00 31.02 C ATOM 1424 CE2 TYR A 102 17.270 -8.615 -3.647 1.00 2.43 C ATOM 1425 CZ TYR A 102 16.393 -9.638 -3.938 1.00 60.42 C ATOM 1426 OH TYR A 102 15.992 -9.846 -5.238 1.00 31.30 O ATOM 0 H TYR A 102 17.203 -6.479 0.909 1.00 0.11 H new ATOM 0 HA TYR A 102 15.601 -8.964 0.771 1.00 15.32 H new ATOM 0 HB2 TYR A 102 18.476 -8.282 0.123 1.00 51.50 H new ATOM 0 HB3 TYR A 102 18.025 -9.927 0.526 1.00 51.50 H new ATOM 0 HD1 TYR A 102 15.948 -10.883 -0.846 1.00 75.24 H new ATOM 0 HD2 TYR A 102 18.360 -7.609 -2.117 1.00 34.12 H new ATOM 0 HE1 TYR A 102 15.231 -11.256 -3.165 1.00 31.02 H new ATOM 0 HE2 TYR A 102 17.641 -7.977 -4.436 1.00 2.43 H new ATOM 0 HH TYR A 102 16.418 -9.184 -5.822 1.00 31.30 H new ATOM 1436 N LEU A 103 16.277 -9.836 3.006 1.00 72.40 N ATOM 1437 CA LEU A 103 16.509 -10.238 4.389 1.00 32.30 C ATOM 1438 C LEU A 103 17.301 -11.540 4.452 1.00 21.22 C ATOM 1439 O LEU A 103 17.353 -12.311 3.493 1.00 5.24 O ATOM 1440 CB LEU A 103 15.177 -10.402 5.123 1.00 21.35 C ATOM 1441 CG LEU A 103 14.065 -11.108 4.347 1.00 53.42 C ATOM 1442 CD1 LEU A 103 13.431 -10.158 3.342 1.00 73.41 C ATOM 1443 CD2 LEU A 103 14.606 -12.345 3.646 1.00 35.53 C ATOM 0 H LEU A 103 15.635 -10.440 2.493 1.00 72.40 H new ATOM 0 HA LEU A 103 17.092 -9.456 4.876 1.00 32.30 H new ATOM 0 HB2 LEU A 103 15.358 -10.956 6.044 1.00 21.35 H new ATOM 0 HB3 LEU A 103 14.820 -9.413 5.411 1.00 21.35 H new ATOM 0 HG LEU A 103 13.297 -11.423 5.054 1.00 53.42 H new ATOM 0 HD11 LEU A 103 12.642 -10.677 2.799 1.00 73.41 H new ATOM 0 HD12 LEU A 103 13.007 -9.302 3.867 1.00 73.41 H new ATOM 0 HD13 LEU A 103 14.189 -9.813 2.639 1.00 73.41 H new ATOM 0 HD21 LEU A 103 13.800 -12.835 3.099 1.00 35.53 H new ATOM 0 HD22 LEU A 103 15.393 -12.054 2.950 1.00 35.53 H new ATOM 0 HD23 LEU A 103 15.013 -13.034 4.386 1.00 35.53 H new ATOM 1455 N PRO A 104 17.931 -11.794 5.609 1.00 64.24 N ATOM 1456 CA PRO A 104 18.730 -13.004 5.826 1.00 61.13 C ATOM 1457 C PRO A 104 17.869 -14.260 5.906 1.00 63.33 C ATOM 1458 O PRO A 104 16.722 -14.211 6.348 1.00 12.32 O ATOM 1459 CB PRO A 104 19.417 -12.740 7.168 1.00 15.21 C ATOM 1460 CG PRO A 104 18.521 -11.777 7.869 1.00 72.34 C ATOM 1461 CD PRO A 104 17.912 -10.920 6.793 1.00 24.04 C ATOM 0 HA PRO A 104 19.424 -13.187 5.006 1.00 61.13 H new ATOM 0 HB2 PRO A 104 19.535 -13.660 7.740 1.00 15.21 H new ATOM 0 HB3 PRO A 104 20.414 -12.323 7.027 1.00 15.21 H new ATOM 0 HG2 PRO A 104 17.750 -12.301 8.434 1.00 72.34 H new ATOM 0 HG3 PRO A 104 19.081 -11.170 8.581 1.00 72.34 H new ATOM 0 HD2 PRO A 104 16.898 -10.613 7.050 1.00 24.04 H new ATOM 0 HD3 PRO A 104 18.489 -10.010 6.630 1.00 24.04 H new ATOM 1469 N SER A 105 18.431 -15.385 5.475 1.00 21.43 N ATOM 1470 CA SER A 105 17.713 -16.654 5.495 1.00 22.53 C ATOM 1471 C SER A 105 17.934 -17.383 6.817 1.00 4.15 C ATOM 1472 O SER A 105 18.835 -17.041 7.584 1.00 21.23 O ATOM 1473 CB SER A 105 18.165 -17.539 4.331 1.00 13.52 C ATOM 1474 OG SER A 105 17.824 -16.955 3.086 1.00 44.34 O ATOM 0 H SER A 105 19.381 -15.443 5.108 1.00 21.43 H new ATOM 0 HA SER A 105 16.649 -16.442 5.390 1.00 22.53 H new ATOM 0 HB2 SER A 105 19.243 -17.691 4.382 1.00 13.52 H new ATOM 0 HB3 SER A 105 17.701 -18.522 4.415 1.00 13.52 H new ATOM 0 HG SER A 105 18.125 -17.538 2.358 1.00 44.34 H new ATOM 1480 N TYR A 106 17.106 -18.388 7.077 1.00 22.43 N ATOM 1481 CA TYR A 106 17.208 -19.165 8.307 1.00 4.54 C ATOM 1482 C TYR A 106 18.633 -19.670 8.516 1.00 12.40 C ATOM 1483 O TYR A 106 19.105 -19.775 9.647 1.00 25.12 O ATOM 1484 CB TYR A 106 16.237 -20.345 8.272 1.00 33.34 C ATOM 1485 CG TYR A 106 16.641 -21.434 7.304 1.00 52.55 C ATOM 1486 CD1 TYR A 106 16.496 -21.259 5.933 1.00 41.24 C ATOM 1487 CD2 TYR A 106 17.166 -22.636 7.759 1.00 62.44 C ATOM 1488 CE1 TYR A 106 16.863 -22.250 5.044 1.00 62.55 C ATOM 1489 CE2 TYR A 106 17.537 -23.633 6.877 1.00 44.11 C ATOM 1490 CZ TYR A 106 17.384 -23.435 5.520 1.00 32.45 C ATOM 1491 OH TYR A 106 17.751 -24.426 4.639 1.00 60.11 O ATOM 0 H TYR A 106 16.356 -18.684 6.452 1.00 22.43 H new ATOM 0 HA TYR A 106 16.947 -18.513 9.141 1.00 4.54 H new ATOM 0 HB2 TYR A 106 16.159 -20.770 9.273 1.00 33.34 H new ATOM 0 HB3 TYR A 106 15.246 -19.981 8.003 1.00 33.34 H new ATOM 0 HD1 TYR A 106 16.089 -20.332 5.556 1.00 41.24 H new ATOM 0 HD2 TYR A 106 17.287 -22.795 8.820 1.00 62.44 H new ATOM 0 HE1 TYR A 106 16.743 -22.098 3.982 1.00 62.55 H new ATOM 0 HE2 TYR A 106 17.944 -24.562 7.248 1.00 44.11 H new ATOM 0 HH TYR A 106 18.100 -25.194 5.138 1.00 60.11 H new ATOM 1501 N GLU A 107 19.311 -19.980 7.415 1.00 0.45 N ATOM 1502 CA GLU A 107 20.682 -20.474 7.477 1.00 15.33 C ATOM 1503 C GLU A 107 21.612 -19.425 8.080 1.00 55.41 C ATOM 1504 O GLU A 107 22.283 -19.676 9.080 1.00 60.41 O ATOM 1505 CB GLU A 107 21.170 -20.863 6.081 1.00 45.44 C ATOM 1506 CG GLU A 107 21.812 -22.239 6.022 1.00 41.35 C ATOM 1507 CD GLU A 107 22.816 -22.366 4.892 1.00 21.33 C ATOM 1508 OE1 GLU A 107 22.427 -22.153 3.725 1.00 5.51 O ATOM 1509 OE2 GLU A 107 23.991 -22.680 5.177 1.00 41.23 O ATOM 0 H GLU A 107 18.934 -19.898 6.471 1.00 0.45 H new ATOM 0 HA GLU A 107 20.695 -21.356 8.117 1.00 15.33 H new ATOM 0 HB2 GLU A 107 20.328 -20.834 5.390 1.00 45.44 H new ATOM 0 HB3 GLU A 107 21.890 -20.120 5.737 1.00 45.44 H new ATOM 0 HG2 GLU A 107 22.309 -22.445 6.970 1.00 41.35 H new ATOM 0 HG3 GLU A 107 21.035 -22.994 5.899 1.00 41.35 H new ATOM 1516 N MET A 108 21.645 -18.248 7.463 1.00 10.11 N ATOM 1517 CA MET A 108 22.492 -17.160 7.939 1.00 72.14 C ATOM 1518 C MET A 108 22.244 -16.885 9.418 1.00 31.14 C ATOM 1519 O MET A 108 23.184 -16.693 10.191 1.00 73.44 O ATOM 1520 CB MET A 108 22.236 -15.892 7.122 1.00 12.33 C ATOM 1521 CG MET A 108 22.998 -15.851 5.808 1.00 40.12 C ATOM 1522 SD MET A 108 22.499 -14.472 4.758 1.00 31.41 S ATOM 1523 CE MET A 108 24.093 -13.777 4.331 1.00 24.23 C ATOM 0 H MET A 108 21.096 -18.023 6.633 1.00 10.11 H new ATOM 0 HA MET A 108 23.532 -17.461 7.814 1.00 72.14 H new ATOM 0 HB2 MET A 108 21.169 -15.812 6.916 1.00 12.33 H new ATOM 0 HB3 MET A 108 22.512 -15.023 7.719 1.00 12.33 H new ATOM 0 HG2 MET A 108 24.066 -15.778 6.014 1.00 40.12 H new ATOM 0 HG3 MET A 108 22.840 -16.787 5.272 1.00 40.12 H new ATOM 0 HE1 MET A 108 23.958 -12.980 3.599 1.00 24.23 H new ATOM 0 HE2 MET A 108 24.565 -13.372 5.226 1.00 24.23 H new ATOM 0 HE3 MET A 108 24.728 -14.555 3.907 1.00 24.23 H new ATOM 1533 N CYS A 109 20.973 -16.867 9.807 1.00 4.25 N ATOM 1534 CA CYS A 109 20.601 -16.615 11.194 1.00 4.43 C ATOM 1535 C CYS A 109 20.901 -17.830 12.067 1.00 15.14 C ATOM 1536 O CYS A 109 21.068 -17.709 13.281 1.00 1.00 O ATOM 1537 CB CYS A 109 19.117 -16.258 11.289 1.00 13.32 C ATOM 1538 SG CYS A 109 18.527 -15.975 12.989 1.00 21.04 S ATOM 0 H CYS A 109 20.183 -17.024 9.181 1.00 4.25 H new ATOM 0 HA CYS A 109 21.193 -15.775 11.556 1.00 4.43 H new ATOM 0 HB2 CYS A 109 18.932 -15.361 10.698 1.00 13.32 H new ATOM 0 HB3 CYS A 109 18.532 -17.062 10.842 1.00 13.32 H new ATOM 1543 N ARG A 110 20.966 -19.000 11.441 1.00 41.04 N ATOM 1544 CA ARG A 110 21.244 -20.237 12.160 1.00 71.42 C ATOM 1545 C ARG A 110 22.706 -20.299 12.591 1.00 64.12 C ATOM 1546 O ARG A 110 23.036 -20.891 13.619 1.00 0.21 O ATOM 1547 CB ARG A 110 20.907 -21.447 11.286 1.00 42.13 C ATOM 1548 CG ARG A 110 21.226 -22.780 11.942 1.00 34.32 C ATOM 1549 CD ARG A 110 19.988 -23.657 12.052 1.00 51.21 C ATOM 1550 NE ARG A 110 19.740 -24.410 10.825 1.00 11.33 N ATOM 1551 CZ ARG A 110 20.363 -25.542 10.520 1.00 61.35 C ATOM 1552 NH1 ARG A 110 21.266 -26.050 11.347 1.00 61.21 N ATOM 1553 NH2 ARG A 110 20.083 -26.169 9.384 1.00 30.53 N ATOM 0 H ARG A 110 20.830 -19.117 10.437 1.00 41.04 H new ATOM 0 HA ARG A 110 20.619 -20.257 13.053 1.00 71.42 H new ATOM 0 HB2 ARG A 110 19.847 -21.420 11.036 1.00 42.13 H new ATOM 0 HB3 ARG A 110 21.458 -21.372 10.348 1.00 42.13 H new ATOM 0 HG2 ARG A 110 21.990 -23.298 11.363 1.00 34.32 H new ATOM 0 HG3 ARG A 110 21.641 -22.608 12.935 1.00 34.32 H new ATOM 0 HD2 ARG A 110 20.108 -24.350 12.885 1.00 51.21 H new ATOM 0 HD3 ARG A 110 19.122 -23.035 12.277 1.00 51.21 H new ATOM 0 HE ARG A 110 19.051 -24.046 10.167 1.00 11.33 H new ATOM 0 HH11 ARG A 110 21.484 -25.571 12.221 1.00 61.21 H new ATOM 0 HH12 ARG A 110 21.743 -26.920 11.110 1.00 61.21 H new ATOM 0 HH21 ARG A 110 19.389 -25.781 8.745 1.00 30.53 H new ATOM 0 HH22 ARG A 110 20.562 -27.039 9.150 1.00 30.53 H new ATOM 1567 N ILE A 111 23.578 -19.685 11.798 1.00 72.13 N ATOM 1568 CA ILE A 111 25.004 -19.670 12.098 1.00 42.02 C ATOM 1569 C ILE A 111 25.263 -19.159 13.511 1.00 63.20 C ATOM 1570 O ILE A 111 26.278 -19.489 14.127 1.00 53.44 O ATOM 1571 CB ILE A 111 25.781 -18.794 11.097 1.00 73.11 C ATOM 1572 CG1 ILE A 111 25.402 -19.164 9.661 1.00 25.23 C ATOM 1573 CG2 ILE A 111 27.279 -18.946 11.312 1.00 62.14 C ATOM 1574 CD1 ILE A 111 25.673 -20.613 9.319 1.00 11.35 C ATOM 0 H ILE A 111 23.322 -19.191 10.943 1.00 72.13 H new ATOM 0 HA ILE A 111 25.354 -20.699 12.016 1.00 42.02 H new ATOM 0 HB ILE A 111 25.514 -17.751 11.266 1.00 73.11 H new ATOM 0 HG12 ILE A 111 24.343 -18.955 9.508 1.00 25.23 H new ATOM 0 HG13 ILE A 111 25.956 -18.527 8.972 1.00 25.23 H new ATOM 0 HG21 ILE A 111 27.814 -18.321 10.597 1.00 62.14 H new ATOM 0 HG22 ILE A 111 27.534 -18.638 12.326 1.00 62.14 H new ATOM 0 HG23 ILE A 111 27.563 -19.988 11.167 1.00 62.14 H new ATOM 0 HD11 ILE A 111 25.381 -20.804 8.286 1.00 11.35 H new ATOM 0 HD12 ILE A 111 26.736 -20.823 9.440 1.00 11.35 H new ATOM 0 HD13 ILE A 111 25.098 -21.257 9.984 1.00 11.35 H new ATOM 1586 N THR A 112 24.338 -18.353 14.022 1.00 51.20 N ATOM 1587 CA THR A 112 24.465 -17.797 15.363 1.00 1.50 C ATOM 1588 C THR A 112 23.794 -18.694 16.396 1.00 23.15 C ATOM 1589 O THR A 112 24.277 -18.831 17.520 1.00 2.11 O ATOM 1590 CB THR A 112 23.850 -16.387 15.447 1.00 14.02 C ATOM 1591 OG1 THR A 112 22.422 -16.470 15.370 1.00 21.42 O ATOM 1592 CG2 THR A 112 24.372 -15.501 14.327 1.00 41.52 C ATOM 0 H THR A 112 23.492 -18.071 13.527 1.00 51.20 H new ATOM 0 HA THR A 112 25.531 -17.734 15.579 1.00 1.50 H new ATOM 0 HB THR A 112 24.137 -15.946 16.401 1.00 14.02 H new ATOM 0 HG1 THR A 112 22.166 -16.946 14.552 1.00 21.42 H new ATOM 0 HG21 THR A 112 23.924 -14.511 14.407 1.00 41.52 H new ATOM 0 HG22 THR A 112 25.456 -15.416 14.405 1.00 41.52 H new ATOM 0 HG23 THR A 112 24.111 -15.940 13.364 1.00 41.52 H new ATOM 1600 N MET A 113 22.679 -19.304 16.009 1.00 63.43 N ATOM 1601 CA MET A 113 21.943 -20.191 16.902 1.00 24.24 C ATOM 1602 C MET A 113 22.715 -21.485 17.141 1.00 4.04 C ATOM 1603 O MET A 113 22.627 -22.081 18.214 1.00 74.41 O ATOM 1604 CB MET A 113 20.564 -20.507 16.321 1.00 41.33 C ATOM 1605 CG MET A 113 20.552 -21.725 15.411 1.00 1.33 C ATOM 1606 SD MET A 113 18.886 -22.208 14.919 1.00 2.21 S ATOM 1607 CE MET A 113 18.179 -20.614 14.509 1.00 32.11 C ATOM 0 H MET A 113 22.265 -19.200 15.083 1.00 63.43 H new ATOM 0 HA MET A 113 21.818 -19.681 17.857 1.00 24.24 H new ATOM 0 HB2 MET A 113 19.862 -20.668 17.139 1.00 41.33 H new ATOM 0 HB3 MET A 113 20.208 -19.642 15.761 1.00 41.33 H new ATOM 0 HG2 MET A 113 21.143 -21.514 14.520 1.00 1.33 H new ATOM 0 HG3 MET A 113 21.032 -22.560 15.921 1.00 1.33 H new ATOM 0 HE1 MET A 113 17.388 -20.746 13.771 1.00 32.11 H new ATOM 0 HE2 MET A 113 17.764 -20.158 15.408 1.00 32.11 H new ATOM 0 HE3 MET A 113 18.954 -19.967 14.098 1.00 32.11 H new ATOM 1617 N GLU A 114 23.471 -21.912 16.135 1.00 65.41 N ATOM 1618 CA GLU A 114 24.257 -23.136 16.237 1.00 24.31 C ATOM 1619 C GLU A 114 25.082 -23.148 17.521 1.00 43.31 C ATOM 1620 O GLU A 114 24.932 -24.019 18.378 1.00 61.15 O ATOM 1621 CB GLU A 114 25.179 -23.280 15.024 1.00 3.43 C ATOM 1622 CG GLU A 114 24.913 -24.529 14.201 1.00 10.15 C ATOM 1623 CD GLU A 114 23.566 -24.493 13.506 1.00 32.44 C ATOM 1624 OE1 GLU A 114 22.549 -24.270 14.196 1.00 32.11 O ATOM 1625 OE2 GLU A 114 23.528 -24.689 12.274 1.00 62.03 O ATOM 0 H GLU A 114 23.556 -21.429 15.241 1.00 65.41 H new ATOM 0 HA GLU A 114 23.567 -23.979 16.261 1.00 24.31 H new ATOM 0 HB2 GLU A 114 25.065 -22.404 14.386 1.00 3.43 H new ATOM 0 HB3 GLU A 114 26.214 -23.294 15.365 1.00 3.43 H new ATOM 0 HG2 GLU A 114 25.700 -24.643 13.455 1.00 10.15 H new ATOM 0 HG3 GLU A 114 24.960 -25.404 14.849 1.00 10.15 H new ATOM 1632 N PRO A 115 25.976 -22.157 17.658 1.00 10.12 N ATOM 1633 CA PRO A 115 26.843 -22.030 18.834 1.00 52.05 C ATOM 1634 C PRO A 115 26.067 -21.636 20.086 1.00 62.11 C ATOM 1635 O PRO A 115 26.212 -22.257 21.139 1.00 4.04 O ATOM 1636 CB PRO A 115 27.818 -20.919 18.437 1.00 52.32 C ATOM 1637 CG PRO A 115 27.082 -20.113 17.423 1.00 73.14 C ATOM 1638 CD PRO A 115 26.209 -21.084 16.677 1.00 53.02 C ATOM 0 HA PRO A 115 27.329 -22.972 19.086 1.00 52.05 H new ATOM 0 HB2 PRO A 115 28.098 -20.312 19.298 1.00 52.32 H new ATOM 0 HB3 PRO A 115 28.739 -21.330 18.023 1.00 52.32 H new ATOM 0 HG2 PRO A 115 26.483 -19.337 17.901 1.00 73.14 H new ATOM 0 HG3 PRO A 115 27.774 -19.611 16.747 1.00 73.14 H new ATOM 0 HD2 PRO A 115 25.275 -20.621 16.358 1.00 53.02 H new ATOM 0 HD3 PRO A 115 26.701 -21.460 15.780 1.00 53.02 H new ATOM 1646 N CYS A 116 25.243 -20.601 19.965 1.00 72.03 N ATOM 1647 CA CYS A 116 24.444 -20.124 21.087 1.00 53.23 C ATOM 1648 C CYS A 116 23.007 -20.626 20.984 1.00 75.44 C ATOM 1649 O CYS A 116 22.096 -19.869 20.649 1.00 53.22 O ATOM 1650 CB CYS A 116 24.458 -18.595 21.137 1.00 45.35 C ATOM 1651 SG CYS A 116 26.118 -17.874 21.344 1.00 4.44 S ATOM 0 H CYS A 116 25.111 -20.076 19.100 1.00 72.03 H new ATOM 0 HA CYS A 116 24.883 -20.515 22.005 1.00 53.23 H new ATOM 0 HB2 CYS A 116 24.017 -18.208 20.218 1.00 45.35 H new ATOM 0 HB3 CYS A 116 23.824 -18.263 21.959 1.00 45.35 H new ATOM 1656 N ARG A 117 22.812 -21.909 21.274 1.00 13.50 N ATOM 1657 CA ARG A 117 21.486 -22.513 21.213 1.00 3.23 C ATOM 1658 C ARG A 117 20.536 -21.838 22.198 1.00 74.12 C ATOM 1659 O ARG A 117 19.317 -21.882 22.028 1.00 52.45 O ATOM 1660 CB ARG A 117 21.571 -24.010 21.514 1.00 30.34 C ATOM 1661 CG ARG A 117 20.224 -24.650 21.807 1.00 14.23 C ATOM 1662 CD ARG A 117 20.316 -26.168 21.809 1.00 10.44 C ATOM 1663 NE ARG A 117 19.260 -26.779 22.612 1.00 72.25 N ATOM 1664 CZ ARG A 117 19.170 -28.085 22.836 1.00 63.42 C ATOM 1665 NH1 ARG A 117 20.069 -28.913 22.321 1.00 4.13 N ATOM 1666 NH2 ARG A 117 18.180 -28.566 23.577 1.00 71.35 N ATOM 0 H ARG A 117 23.555 -22.550 21.553 1.00 13.50 H new ATOM 0 HA ARG A 117 21.096 -22.374 20.205 1.00 3.23 H new ATOM 0 HB2 ARG A 117 22.028 -24.517 20.664 1.00 30.34 H new ATOM 0 HB3 ARG A 117 22.230 -24.163 22.369 1.00 30.34 H new ATOM 0 HG2 ARG A 117 19.859 -24.305 22.775 1.00 14.23 H new ATOM 0 HG3 ARG A 117 19.498 -24.330 21.060 1.00 14.23 H new ATOM 0 HD2 ARG A 117 20.252 -26.536 20.785 1.00 10.44 H new ATOM 0 HD3 ARG A 117 21.288 -26.472 22.197 1.00 10.44 H new ATOM 0 HE ARG A 117 18.553 -26.169 23.023 1.00 72.25 H new ATOM 0 HH11 ARG A 117 20.832 -28.547 21.751 1.00 4.13 H new ATOM 0 HH12 ARG A 117 19.997 -29.916 22.495 1.00 4.13 H new ATOM 0 HH21 ARG A 117 17.487 -27.933 23.975 1.00 71.35 H new ATOM 0 HH22 ARG A 117 18.112 -29.569 23.748 1.00 71.35 H new ATOM 1680 N ILE A 118 21.101 -21.216 23.227 1.00 62.13 N ATOM 1681 CA ILE A 118 20.304 -20.532 24.237 1.00 30.34 C ATOM 1682 C ILE A 118 19.382 -19.497 23.602 1.00 33.24 C ATOM 1683 O ILE A 118 18.371 -19.108 24.188 1.00 14.33 O ATOM 1684 CB ILE A 118 21.196 -19.836 25.282 1.00 22.31 C ATOM 1685 CG1 ILE A 118 22.108 -20.856 25.967 1.00 33.52 C ATOM 1686 CG2 ILE A 118 20.341 -19.109 26.309 1.00 51.35 C ATOM 1687 CD1 ILE A 118 21.356 -21.989 26.631 1.00 52.11 C ATOM 0 H ILE A 118 22.108 -21.172 23.383 1.00 62.13 H new ATOM 0 HA ILE A 118 19.703 -21.294 24.734 1.00 30.34 H new ATOM 0 HB ILE A 118 21.821 -19.102 24.773 1.00 22.31 H new ATOM 0 HG12 ILE A 118 22.795 -21.270 25.229 1.00 33.52 H new ATOM 0 HG13 ILE A 118 22.714 -20.345 26.715 1.00 33.52 H new ATOM 0 HG21 ILE A 118 20.986 -18.622 27.041 1.00 51.35 H new ATOM 0 HG22 ILE A 118 19.730 -18.358 25.808 1.00 51.35 H new ATOM 0 HG23 ILE A 118 19.694 -19.825 26.816 1.00 51.35 H new ATOM 0 HD11 ILE A 118 22.066 -22.673 27.096 1.00 52.11 H new ATOM 0 HD12 ILE A 118 20.689 -21.586 27.393 1.00 52.11 H new ATOM 0 HD13 ILE A 118 20.771 -22.525 25.883 1.00 52.11 H new ATOM 1699 N LEU A 119 19.736 -19.056 22.400 1.00 35.23 N ATOM 1700 CA LEU A 119 18.939 -18.067 21.683 1.00 14.22 C ATOM 1701 C LEU A 119 17.961 -18.744 20.728 1.00 41.23 C ATOM 1702 O LEU A 119 17.621 -18.195 19.679 1.00 2.13 O ATOM 1703 CB LEU A 119 19.850 -17.114 20.908 1.00 51.31 C ATOM 1704 CG LEU A 119 19.639 -15.622 21.169 1.00 14.01 C ATOM 1705 CD1 LEU A 119 20.635 -14.794 20.373 1.00 60.25 C ATOM 1706 CD2 LEU A 119 18.212 -15.217 20.827 1.00 61.42 C ATOM 0 H LEU A 119 20.570 -19.368 21.901 1.00 35.23 H new ATOM 0 HA LEU A 119 18.367 -17.497 22.415 1.00 14.22 H new ATOM 0 HB2 LEU A 119 20.885 -17.361 21.144 1.00 51.31 H new ATOM 0 HB3 LEU A 119 19.713 -17.299 19.843 1.00 51.31 H new ATOM 0 HG LEU A 119 19.805 -15.432 22.229 1.00 14.01 H new ATOM 0 HD11 LEU A 119 20.469 -13.735 20.572 1.00 60.25 H new ATOM 0 HD12 LEU A 119 21.649 -15.064 20.667 1.00 60.25 H new ATOM 0 HD13 LEU A 119 20.502 -14.989 19.309 1.00 60.25 H new ATOM 0 HD21 LEU A 119 18.080 -14.152 21.019 1.00 61.42 H new ATOM 0 HD22 LEU A 119 18.018 -15.423 19.774 1.00 61.42 H new ATOM 0 HD23 LEU A 119 17.515 -15.786 21.443 1.00 61.42 H new ATOM 1718 N TYR A 120 17.511 -19.938 21.098 1.00 43.42 N ATOM 1719 CA TYR A 120 16.573 -20.690 20.274 1.00 53.23 C ATOM 1720 C TYR A 120 15.433 -19.797 19.792 1.00 4.41 C ATOM 1721 O TYR A 120 14.904 -19.983 18.697 1.00 31.35 O ATOM 1722 CB TYR A 120 16.009 -21.876 21.059 1.00 41.54 C ATOM 1723 CG TYR A 120 15.966 -21.647 22.553 1.00 61.24 C ATOM 1724 CD1 TYR A 120 15.054 -20.763 23.114 1.00 14.13 C ATOM 1725 CD2 TYR A 120 16.838 -22.317 23.403 1.00 53.13 C ATOM 1726 CE1 TYR A 120 15.011 -20.551 24.479 1.00 44.23 C ATOM 1727 CE2 TYR A 120 16.802 -22.112 24.769 1.00 73.25 C ATOM 1728 CZ TYR A 120 15.887 -21.228 25.302 1.00 42.24 C ATOM 1729 OH TYR A 120 15.847 -21.020 26.661 1.00 24.43 O ATOM 0 H TYR A 120 17.781 -20.406 21.963 1.00 43.42 H new ATOM 0 HA TYR A 120 17.112 -21.062 19.403 1.00 53.23 H new ATOM 0 HB2 TYR A 120 15.001 -22.090 20.703 1.00 41.54 H new ATOM 0 HB3 TYR A 120 16.614 -22.759 20.852 1.00 41.54 H new ATOM 0 HD1 TYR A 120 14.366 -20.232 22.473 1.00 14.13 H new ATOM 0 HD2 TYR A 120 17.556 -23.010 22.989 1.00 53.13 H new ATOM 0 HE1 TYR A 120 14.296 -19.859 24.899 1.00 44.23 H new ATOM 0 HE2 TYR A 120 17.486 -22.641 25.416 1.00 73.25 H new ATOM 0 HH TYR A 120 16.528 -21.574 27.097 1.00 24.43 H new ATOM 1739 N ASN A 121 15.062 -18.825 20.619 1.00 2.31 N ATOM 1740 CA ASN A 121 13.986 -17.901 20.279 1.00 71.21 C ATOM 1741 C ASN A 121 13.764 -16.889 21.399 1.00 55.15 C ATOM 1742 O ASN A 121 13.389 -15.742 21.149 1.00 22.34 O ATOM 1743 CB ASN A 121 12.692 -18.671 20.008 1.00 72.21 C ATOM 1744 CG ASN A 121 12.466 -19.791 21.005 1.00 33.11 C ATOM 1745 OD1 ASN A 121 12.639 -20.967 20.685 1.00 43.03 O ATOM 1746 ND2 ASN A 121 12.076 -19.430 22.222 1.00 11.31 N ATOM 0 H ASN A 121 15.490 -18.657 21.529 1.00 2.31 H new ATOM 0 HA ASN A 121 14.275 -17.361 19.378 1.00 71.21 H new ATOM 0 HB2 ASN A 121 11.848 -17.982 20.043 1.00 72.21 H new ATOM 0 HB3 ASN A 121 12.724 -19.086 19.001 1.00 72.21 H new ATOM 0 HD21 ASN A 121 11.908 -20.140 22.935 1.00 11.31 H new ATOM 0 HD22 ASN A 121 11.945 -18.443 22.444 1.00 11.31 H new ATOM 1753 N THR A 122 13.997 -17.320 22.634 1.00 22.32 N ATOM 1754 CA THR A 122 13.822 -16.453 23.792 1.00 23.13 C ATOM 1755 C THR A 122 14.489 -15.100 23.572 1.00 52.03 C ATOM 1756 O THR A 122 15.442 -14.984 22.801 1.00 3.51 O ATOM 1757 CB THR A 122 14.400 -17.095 25.068 1.00 62.45 C ATOM 1758 OG1 THR A 122 14.307 -16.179 26.163 1.00 11.54 O ATOM 1759 CG2 THR A 122 15.852 -17.499 24.860 1.00 61.12 C ATOM 0 H THR A 122 14.308 -18.265 22.858 1.00 22.32 H new ATOM 0 HA THR A 122 12.749 -16.310 23.920 1.00 23.13 H new ATOM 0 HB THR A 122 13.819 -17.989 25.293 1.00 62.45 H new ATOM 0 HG1 THR A 122 14.675 -16.596 26.970 1.00 11.54 H new ATOM 0 HG21 THR A 122 16.239 -17.950 25.774 1.00 61.12 H new ATOM 0 HG22 THR A 122 15.916 -18.220 24.045 1.00 61.12 H new ATOM 0 HG23 THR A 122 16.443 -16.617 24.612 1.00 61.12 H new ATOM 1767 N THR A 123 13.982 -14.077 24.253 1.00 33.45 N ATOM 1768 CA THR A 123 14.528 -12.732 24.132 1.00 52.45 C ATOM 1769 C THR A 123 15.823 -12.590 24.922 1.00 22.24 C ATOM 1770 O THR A 123 15.921 -11.765 25.831 1.00 51.34 O ATOM 1771 CB THR A 123 13.523 -11.671 24.620 1.00 30.31 C ATOM 1772 OG1 THR A 123 14.127 -10.373 24.589 1.00 74.23 O ATOM 1773 CG2 THR A 123 13.051 -11.983 26.032 1.00 4.24 C ATOM 0 H THR A 123 13.193 -14.155 24.895 1.00 33.45 H new ATOM 0 HA THR A 123 14.732 -12.569 23.074 1.00 52.45 H new ATOM 0 HB THR A 123 12.660 -11.685 23.954 1.00 30.31 H new ATOM 0 HG1 THR A 123 14.841 -10.328 25.259 1.00 74.23 H new ATOM 0 HG21 THR A 123 12.342 -11.221 26.356 1.00 4.24 H new ATOM 0 HG22 THR A 123 12.566 -12.959 26.046 1.00 4.24 H new ATOM 0 HG23 THR A 123 13.906 -11.993 26.708 1.00 4.24 H new ATOM 1781 N PHE A 124 16.817 -13.400 24.571 1.00 13.04 N ATOM 1782 CA PHE A 124 18.107 -13.365 25.249 1.00 4.12 C ATOM 1783 C PHE A 124 19.040 -12.352 24.591 1.00 31.04 C ATOM 1784 O PHE A 124 19.819 -11.679 25.266 1.00 23.03 O ATOM 1785 CB PHE A 124 18.752 -14.752 25.236 1.00 62.52 C ATOM 1786 CG PHE A 124 19.972 -14.855 26.106 1.00 42.10 C ATOM 1787 CD1 PHE A 124 19.948 -14.395 27.413 1.00 51.23 C ATOM 1788 CD2 PHE A 124 21.143 -15.412 25.617 1.00 0.24 C ATOM 1789 CE1 PHE A 124 21.069 -14.487 28.215 1.00 24.21 C ATOM 1790 CE2 PHE A 124 22.268 -15.507 26.415 1.00 33.33 C ATOM 1791 CZ PHE A 124 22.230 -15.045 27.716 1.00 23.33 C ATOM 0 H PHE A 124 16.753 -14.088 23.821 1.00 13.04 H new ATOM 0 HA PHE A 124 17.938 -13.060 26.282 1.00 4.12 H new ATOM 0 HB2 PHE A 124 18.018 -15.488 25.565 1.00 62.52 H new ATOM 0 HB3 PHE A 124 19.023 -15.008 24.212 1.00 62.52 H new ATOM 0 HD1 PHE A 124 19.043 -13.960 27.809 1.00 51.23 H new ATOM 0 HD2 PHE A 124 21.177 -15.776 24.601 1.00 0.24 H new ATOM 0 HE1 PHE A 124 21.038 -14.123 29.231 1.00 24.21 H new ATOM 0 HE2 PHE A 124 23.175 -15.942 26.022 1.00 33.33 H new ATOM 0 HZ PHE A 124 23.107 -15.120 28.342 1.00 23.33 H new ATOM 1801 N PHE A 125 18.954 -12.250 23.269 1.00 4.22 N ATOM 1802 CA PHE A 125 19.791 -11.321 22.519 1.00 50.34 C ATOM 1803 C PHE A 125 19.164 -10.995 21.166 1.00 30.20 C ATOM 1804 O PHE A 125 19.679 -11.362 20.110 1.00 63.41 O ATOM 1805 CB PHE A 125 21.189 -11.909 22.317 1.00 41.20 C ATOM 1806 CG PHE A 125 22.105 -11.694 23.488 1.00 15.51 C ATOM 1807 CD1 PHE A 125 22.337 -10.418 23.977 1.00 21.11 C ATOM 1808 CD2 PHE A 125 22.732 -12.766 24.100 1.00 20.42 C ATOM 1809 CE1 PHE A 125 23.180 -10.217 25.054 1.00 33.31 C ATOM 1810 CE2 PHE A 125 23.575 -12.572 25.178 1.00 44.21 C ATOM 1811 CZ PHE A 125 23.799 -11.295 25.656 1.00 34.50 C ATOM 0 H PHE A 125 18.314 -12.799 22.695 1.00 4.22 H new ATOM 0 HA PHE A 125 19.872 -10.399 23.094 1.00 50.34 H new ATOM 0 HB2 PHE A 125 21.101 -12.979 22.127 1.00 41.20 H new ATOM 0 HB3 PHE A 125 21.637 -11.463 21.429 1.00 41.20 H new ATOM 0 HD1 PHE A 125 21.854 -9.572 23.512 1.00 21.11 H new ATOM 0 HD2 PHE A 125 22.560 -13.766 23.730 1.00 20.42 H new ATOM 0 HE1 PHE A 125 23.354 -9.218 25.424 1.00 33.31 H new ATOM 0 HE2 PHE A 125 24.058 -13.417 25.646 1.00 44.21 H new ATOM 0 HZ PHE A 125 24.457 -11.140 26.499 1.00 34.50 H new ATOM 1821 N PRO A 126 18.024 -10.289 21.198 1.00 72.55 N ATOM 1822 CA PRO A 126 17.301 -9.899 19.984 1.00 50.54 C ATOM 1823 C PRO A 126 18.048 -8.840 19.179 1.00 25.52 C ATOM 1824 O PRO A 126 18.221 -8.974 17.968 1.00 41.35 O ATOM 1825 CB PRO A 126 15.985 -9.331 20.522 1.00 42.34 C ATOM 1826 CG PRO A 126 16.307 -8.870 21.901 1.00 23.33 C ATOM 1827 CD PRO A 126 17.353 -9.818 22.421 1.00 73.33 C ATOM 0 HA PRO A 126 17.172 -10.738 19.300 1.00 50.54 H new ATOM 0 HB2 PRO A 126 15.627 -8.508 19.903 1.00 42.34 H new ATOM 0 HB3 PRO A 126 15.201 -10.088 20.531 1.00 42.34 H new ATOM 0 HG2 PRO A 126 16.678 -7.845 21.893 1.00 23.33 H new ATOM 0 HG3 PRO A 126 15.420 -8.883 22.534 1.00 23.33 H new ATOM 0 HD2 PRO A 126 18.049 -9.318 23.094 1.00 73.33 H new ATOM 0 HD3 PRO A 126 16.907 -10.642 22.978 1.00 73.33 H new ATOM 1835 N LYS A 127 18.491 -7.789 19.861 1.00 70.14 N ATOM 1836 CA LYS A 127 19.222 -6.708 19.211 1.00 40.05 C ATOM 1837 C LYS A 127 20.487 -7.233 18.539 1.00 22.15 C ATOM 1838 O LYS A 127 20.880 -6.758 17.474 1.00 53.32 O ATOM 1839 CB LYS A 127 19.584 -5.625 20.229 1.00 3.12 C ATOM 1840 CG LYS A 127 20.186 -6.173 21.512 1.00 73.02 C ATOM 1841 CD LYS A 127 21.134 -5.175 22.154 1.00 44.21 C ATOM 1842 CE LYS A 127 20.377 -4.052 22.846 1.00 1.02 C ATOM 1843 NZ LYS A 127 20.417 -4.188 24.329 1.00 54.14 N ATOM 0 H LYS A 127 18.356 -7.663 20.864 1.00 70.14 H new ATOM 0 HA LYS A 127 18.578 -6.277 18.445 1.00 40.05 H new ATOM 0 HB2 LYS A 127 20.291 -4.931 19.773 1.00 3.12 H new ATOM 0 HB3 LYS A 127 18.688 -5.053 20.473 1.00 3.12 H new ATOM 0 HG2 LYS A 127 19.388 -6.421 22.212 1.00 73.02 H new ATOM 0 HG3 LYS A 127 20.721 -7.098 21.298 1.00 73.02 H new ATOM 0 HD2 LYS A 127 21.768 -5.688 22.878 1.00 44.21 H new ATOM 0 HD3 LYS A 127 21.793 -4.756 21.393 1.00 44.21 H new ATOM 0 HE2 LYS A 127 20.807 -3.093 22.557 1.00 1.02 H new ATOM 0 HE3 LYS A 127 19.340 -4.051 22.509 1.00 1.02 H new ATOM 0 HZ1 LYS A 127 19.731 -3.533 24.756 1.00 54.14 H new ATOM 0 HZ2 LYS A 127 20.176 -5.164 24.595 1.00 54.14 H new ATOM 0 HZ3 LYS A 127 21.372 -3.962 24.673 1.00 54.14 H new ATOM 1857 N PHE A 128 21.121 -8.217 19.169 1.00 34.12 N ATOM 1858 CA PHE A 128 22.341 -8.807 18.632 1.00 23.24 C ATOM 1859 C PHE A 128 22.037 -9.672 17.413 1.00 54.14 C ATOM 1860 O PHE A 128 22.817 -9.721 16.461 1.00 4.31 O ATOM 1861 CB PHE A 128 23.042 -9.646 19.704 1.00 54.32 C ATOM 1862 CG PHE A 128 23.588 -10.945 19.186 1.00 62.23 C ATOM 1863 CD1 PHE A 128 22.805 -12.088 19.179 1.00 30.15 C ATOM 1864 CD2 PHE A 128 24.885 -11.024 18.705 1.00 5.13 C ATOM 1865 CE1 PHE A 128 23.305 -13.286 18.703 1.00 13.50 C ATOM 1866 CE2 PHE A 128 25.390 -12.218 18.227 1.00 24.33 C ATOM 1867 CZ PHE A 128 24.600 -13.351 18.227 1.00 14.23 C ATOM 0 H PHE A 128 20.810 -8.622 20.052 1.00 34.12 H new ATOM 0 HA PHE A 128 23.001 -7.996 18.325 1.00 23.24 H new ATOM 0 HB2 PHE A 128 23.857 -9.064 20.134 1.00 54.32 H new ATOM 0 HB3 PHE A 128 22.338 -9.853 20.510 1.00 54.32 H new ATOM 0 HD1 PHE A 128 21.792 -12.043 19.550 1.00 30.15 H new ATOM 0 HD2 PHE A 128 25.508 -10.142 18.704 1.00 5.13 H new ATOM 0 HE1 PHE A 128 22.684 -14.170 18.703 1.00 13.50 H new ATOM 0 HE2 PHE A 128 26.402 -12.265 17.853 1.00 24.33 H new ATOM 0 HZ PHE A 128 24.994 -14.286 17.856 1.00 14.23 H new ATOM 1877 N LEU A 129 20.897 -10.353 17.448 1.00 72.21 N ATOM 1878 CA LEU A 129 20.488 -11.217 16.346 1.00 35.31 C ATOM 1879 C LEU A 129 19.942 -10.395 15.183 1.00 71.01 C ATOM 1880 O LEU A 129 20.550 -10.334 14.114 1.00 12.32 O ATOM 1881 CB LEU A 129 19.430 -12.215 16.820 1.00 32.34 C ATOM 1882 CG LEU A 129 19.955 -13.555 17.337 1.00 70.33 C ATOM 1883 CD1 LEU A 129 18.804 -14.443 17.783 1.00 21.45 C ATOM 1884 CD2 LEU A 129 20.784 -14.251 16.267 1.00 71.21 C ATOM 0 H LEU A 129 20.240 -10.324 18.227 1.00 72.21 H new ATOM 0 HA LEU A 129 21.366 -11.763 16.001 1.00 35.31 H new ATOM 0 HB2 LEU A 129 18.846 -11.746 17.612 1.00 32.34 H new ATOM 0 HB3 LEU A 129 18.747 -12.410 15.993 1.00 32.34 H new ATOM 0 HG LEU A 129 20.595 -13.365 18.199 1.00 70.33 H new ATOM 0 HD11 LEU A 129 19.197 -15.392 18.148 1.00 21.45 H new ATOM 0 HD12 LEU A 129 18.251 -13.948 18.582 1.00 21.45 H new ATOM 0 HD13 LEU A 129 18.138 -14.626 16.940 1.00 21.45 H new ATOM 0 HD21 LEU A 129 21.150 -15.203 16.652 1.00 71.21 H new ATOM 0 HD22 LEU A 129 20.166 -14.429 15.387 1.00 71.21 H new ATOM 0 HD23 LEU A 129 21.630 -13.620 15.995 1.00 71.21 H new ATOM 1896 N ARG A 130 18.793 -9.763 15.399 1.00 1.15 N ATOM 1897 CA ARG A 130 18.166 -8.943 14.370 1.00 61.24 C ATOM 1898 C ARG A 130 17.773 -9.792 13.164 1.00 41.21 C ATOM 1899 O ARG A 130 17.651 -9.285 12.048 1.00 20.50 O ATOM 1900 CB ARG A 130 19.113 -7.824 13.932 1.00 13.12 C ATOM 1901 CG ARG A 130 18.468 -6.447 13.931 1.00 64.33 C ATOM 1902 CD ARG A 130 19.006 -5.579 15.058 1.00 62.25 C ATOM 1903 NE ARG A 130 18.192 -4.384 15.264 1.00 23.30 N ATOM 1904 CZ ARG A 130 18.212 -3.666 16.381 1.00 33.03 C ATOM 1905 NH1 ARG A 130 19.000 -4.020 17.387 1.00 12.31 N ATOM 1906 NH2 ARG A 130 17.442 -2.591 16.494 1.00 41.03 N ATOM 0 H ARG A 130 18.277 -9.803 16.278 1.00 1.15 H new ATOM 0 HA ARG A 130 17.263 -8.501 14.792 1.00 61.24 H new ATOM 0 HB2 ARG A 130 19.978 -7.811 14.595 1.00 13.12 H new ATOM 0 HB3 ARG A 130 19.483 -8.044 12.931 1.00 13.12 H new ATOM 0 HG2 ARG A 130 18.652 -5.958 12.974 1.00 64.33 H new ATOM 0 HG3 ARG A 130 17.388 -6.550 14.033 1.00 64.33 H new ATOM 0 HD2 ARG A 130 19.037 -6.160 15.980 1.00 62.25 H new ATOM 0 HD3 ARG A 130 20.031 -5.285 14.832 1.00 62.25 H new ATOM 0 HE ARG A 130 17.575 -4.085 14.509 1.00 23.30 H new ATOM 0 HH11 ARG A 130 19.593 -4.846 17.304 1.00 12.31 H new ATOM 0 HH12 ARG A 130 19.013 -3.467 18.244 1.00 12.31 H new ATOM 0 HH21 ARG A 130 16.834 -2.316 15.723 1.00 41.03 H new ATOM 0 HH22 ARG A 130 17.458 -2.040 17.352 1.00 41.03 H new ATOM 1920 N CYS A 131 17.577 -11.085 13.396 1.00 71.40 N ATOM 1921 CA CYS A 131 17.199 -12.005 12.330 1.00 31.31 C ATOM 1922 C CYS A 131 15.915 -12.750 12.684 1.00 54.40 C ATOM 1923 O CYS A 131 15.685 -13.097 13.842 1.00 44.04 O ATOM 1924 CB CYS A 131 18.326 -13.006 12.068 1.00 31.44 C ATOM 1925 SG CYS A 131 18.715 -14.077 13.490 1.00 13.33 S ATOM 0 H CYS A 131 17.674 -11.520 14.313 1.00 71.40 H new ATOM 0 HA CYS A 131 17.023 -11.421 11.426 1.00 31.31 H new ATOM 0 HB2 CYS A 131 18.051 -13.632 11.219 1.00 31.44 H new ATOM 0 HB3 CYS A 131 19.224 -12.459 11.782 1.00 31.44 H new ATOM 1930 N ASN A 132 15.081 -12.991 11.678 1.00 54.24 N ATOM 1931 CA ASN A 132 13.819 -13.693 11.882 1.00 21.50 C ATOM 1932 C ASN A 132 14.044 -15.015 12.610 1.00 24.11 C ATOM 1933 O ASN A 132 14.771 -15.884 12.129 1.00 51.33 O ATOM 1934 CB ASN A 132 13.130 -13.949 10.540 1.00 41.40 C ATOM 1935 CG ASN A 132 14.111 -14.343 9.452 1.00 12.34 C ATOM 1936 OD1 ASN A 132 14.872 -15.299 9.604 1.00 54.43 O ATOM 1937 ND2 ASN A 132 14.097 -13.605 8.348 1.00 20.21 N ATOM 0 H ASN A 132 15.256 -12.711 10.713 1.00 54.24 H new ATOM 0 HA ASN A 132 13.177 -13.063 12.498 1.00 21.50 H new ATOM 0 HB2 ASN A 132 12.389 -14.739 10.660 1.00 41.40 H new ATOM 0 HB3 ASN A 132 12.593 -13.051 10.233 1.00 41.40 H new ATOM 0 HD21 ASN A 132 14.735 -13.821 7.582 1.00 20.21 H new ATOM 0 HD22 ASN A 132 13.449 -12.822 8.266 1.00 20.21 H new ATOM 1944 N GLU A 133 13.415 -15.159 13.772 1.00 4.05 N ATOM 1945 CA GLU A 133 13.548 -16.375 14.567 1.00 52.24 C ATOM 1946 C GLU A 133 12.239 -17.159 14.583 1.00 31.03 C ATOM 1947 O GLU A 133 12.108 -18.186 13.917 1.00 70.24 O ATOM 1948 CB GLU A 133 13.968 -16.033 15.997 1.00 4.44 C ATOM 1949 CG GLU A 133 15.405 -16.410 16.316 1.00 21.34 C ATOM 1950 CD GLU A 133 15.715 -17.858 15.987 1.00 52.42 C ATOM 1951 OE1 GLU A 133 14.842 -18.719 16.224 1.00 61.12 O ATOM 1952 OE2 GLU A 133 16.829 -18.129 15.493 1.00 51.04 O ATOM 0 H GLU A 133 12.809 -14.450 14.184 1.00 4.05 H new ATOM 0 HA GLU A 133 14.318 -16.996 14.109 1.00 52.24 H new ATOM 0 HB2 GLU A 133 13.837 -14.963 16.159 1.00 4.44 H new ATOM 0 HB3 GLU A 133 13.304 -16.544 16.694 1.00 4.44 H new ATOM 0 HG2 GLU A 133 16.080 -15.762 15.757 1.00 21.34 H new ATOM 0 HG3 GLU A 133 15.597 -16.233 17.374 1.00 21.34 H new ATOM 1959 N THR A 134 11.271 -16.668 15.351 1.00 1.31 N ATOM 1960 CA THR A 134 9.973 -17.322 15.457 1.00 1.11 C ATOM 1961 C THR A 134 9.193 -17.211 14.152 1.00 65.42 C ATOM 1962 O THR A 134 8.265 -17.982 13.904 1.00 15.44 O ATOM 1963 CB THR A 134 9.131 -16.719 16.597 1.00 3.53 C ATOM 1964 OG1 THR A 134 8.683 -15.408 16.234 1.00 33.04 O ATOM 1965 CG2 THR A 134 9.938 -16.645 17.885 1.00 32.50 C ATOM 0 H THR A 134 11.362 -15.819 15.909 1.00 1.31 H new ATOM 0 HA THR A 134 10.166 -18.373 15.674 1.00 1.11 H new ATOM 0 HB THR A 134 8.269 -17.365 16.763 1.00 3.53 H new ATOM 0 HG1 THR A 134 8.147 -15.032 16.963 1.00 33.04 H new ATOM 0 HG21 THR A 134 9.323 -16.216 18.676 1.00 32.50 H new ATOM 0 HG22 THR A 134 10.254 -17.647 18.175 1.00 32.50 H new ATOM 0 HG23 THR A 134 10.816 -16.019 17.729 1.00 32.50 H new ATOM 1973 N LEU A 135 9.577 -16.250 13.319 1.00 73.11 N ATOM 1974 CA LEU A 135 8.913 -16.039 12.037 1.00 65.32 C ATOM 1975 C LEU A 135 9.027 -17.278 11.155 1.00 70.53 C ATOM 1976 O LEU A 135 9.470 -18.335 11.605 1.00 62.32 O ATOM 1977 CB LEU A 135 9.519 -14.831 11.320 1.00 60.55 C ATOM 1978 CG LEU A 135 9.779 -13.598 12.185 1.00 51.22 C ATOM 1979 CD1 LEU A 135 10.306 -12.452 11.336 1.00 41.34 C ATOM 1980 CD2 LEU A 135 8.511 -13.183 12.916 1.00 14.32 C ATOM 0 H LEU A 135 10.344 -15.605 13.508 1.00 73.11 H new ATOM 0 HA LEU A 135 7.857 -15.848 12.229 1.00 65.32 H new ATOM 0 HB2 LEU A 135 10.462 -15.138 10.867 1.00 60.55 H new ATOM 0 HB3 LEU A 135 8.853 -14.545 10.506 1.00 60.55 H new ATOM 0 HG LEU A 135 10.536 -13.851 12.927 1.00 51.22 H new ATOM 0 HD11 LEU A 135 10.485 -11.583 11.969 1.00 41.34 H new ATOM 0 HD12 LEU A 135 11.239 -12.752 10.859 1.00 41.34 H new ATOM 0 HD13 LEU A 135 9.572 -12.199 10.571 1.00 41.34 H new ATOM 0 HD21 LEU A 135 8.715 -12.304 13.527 1.00 14.32 H new ATOM 0 HD22 LEU A 135 7.733 -12.948 12.190 1.00 14.32 H new ATOM 0 HD23 LEU A 135 8.176 -14.000 13.556 1.00 14.32 H new ATOM 1992 N PHE A 136 8.625 -17.141 9.895 1.00 5.24 N ATOM 1993 CA PHE A 136 8.683 -18.249 8.949 1.00 2.21 C ATOM 1994 C PHE A 136 9.664 -17.949 7.819 1.00 11.43 C ATOM 1995 O PHE A 136 9.277 -17.706 6.676 1.00 64.23 O ATOM 1996 CB PHE A 136 7.294 -18.528 8.373 1.00 54.03 C ATOM 1997 CG PHE A 136 6.461 -19.438 9.230 1.00 60.35 C ATOM 1998 CD1 PHE A 136 6.283 -19.171 10.577 1.00 31.44 C ATOM 1999 CD2 PHE A 136 5.856 -20.561 8.687 1.00 2.40 C ATOM 2000 CE1 PHE A 136 5.518 -20.008 11.368 1.00 11.11 C ATOM 2001 CE2 PHE A 136 5.090 -21.401 9.473 1.00 53.43 C ATOM 2002 CZ PHE A 136 4.920 -21.123 10.815 1.00 74.21 C ATOM 0 H PHE A 136 8.256 -16.273 9.506 1.00 5.24 H new ATOM 0 HA PHE A 136 9.031 -19.133 9.484 1.00 2.21 H new ATOM 0 HB2 PHE A 136 6.767 -17.583 8.242 1.00 54.03 H new ATOM 0 HB3 PHE A 136 7.402 -18.972 7.384 1.00 54.03 H new ATOM 0 HD1 PHE A 136 6.747 -18.299 11.015 1.00 31.44 H new ATOM 0 HD2 PHE A 136 5.985 -20.782 7.638 1.00 2.40 H new ATOM 0 HE1 PHE A 136 5.388 -19.790 12.418 1.00 11.11 H new ATOM 0 HE2 PHE A 136 4.625 -22.274 9.038 1.00 53.43 H new ATOM 0 HZ PHE A 136 4.320 -21.777 11.431 1.00 74.21 H new ATOM 2012 N PRO A 137 10.965 -17.964 8.146 1.00 73.11 N ATOM 2013 CA PRO A 137 12.028 -17.696 7.173 1.00 3.25 C ATOM 2014 C PRO A 137 12.172 -18.815 6.148 1.00 51.12 C ATOM 2015 O PRO A 137 12.219 -18.565 4.943 1.00 65.22 O ATOM 2016 CB PRO A 137 13.286 -17.601 8.041 1.00 41.43 C ATOM 2017 CG PRO A 137 12.973 -18.410 9.252 1.00 41.51 C ATOM 2018 CD PRO A 137 11.497 -18.245 9.490 1.00 64.44 C ATOM 0 HA PRO A 137 11.828 -16.799 6.587 1.00 3.25 H new ATOM 0 HB2 PRO A 137 14.158 -17.993 7.518 1.00 41.43 H new ATOM 0 HB3 PRO A 137 13.509 -16.567 8.303 1.00 41.43 H new ATOM 0 HG2 PRO A 137 13.229 -19.458 9.098 1.00 41.51 H new ATOM 0 HG3 PRO A 137 13.548 -18.065 10.111 1.00 41.51 H new ATOM 0 HD2 PRO A 137 11.056 -19.146 9.917 1.00 64.44 H new ATOM 0 HD3 PRO A 137 11.290 -17.429 10.183 1.00 64.44 H new