USER MOD reduce.3.24.130724 H: found=0, std=0, add=1234, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1236 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 144 TYR OH : rot 180:sc=-0.00162 USER MOD Set 1.2: A 183 ASN : amide:sc= -0.0373 K(o=-0.039,f=-0.76) USER MOD Set 2.1: A 161 THR OG1 : rot 145:sc= 1.35 USER MOD Set 2.2: A 189 LYS NZ :NH3+ 176:sc= 1.21 (180deg=-0.00238) USER MOD Set 3.1: A 72 LYS NZ :NH3+ -155:sc= 0.0274 (180deg=0) USER MOD Set 3.2: A 111 SER OG : rot 180:sc= 0.0282 USER MOD Set 4.1: A 89 ASN : amide:sc= 0.508 X(o=0.48,f=0.13) USER MOD Set 4.2: A 93 SER OG : rot 180:sc= -0.0235 USER MOD Set 5.1: A 61 LYS NZ :NH3+ -177:sc= 0.76 (180deg=-0.127) USER MOD Set 5.2: A 119 SER OG : rot -10:sc= 1.93 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -34:sc= 0.904 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot -150:sc= -3.94! USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 42:sc= 0.852 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -153:sc= 0.323 (180deg=0.0963) USER MOD Single : A 59 MET CE :methyl 140:sc= -1.53 (180deg=-4.16!) USER MOD Single : A 63 MET CE :methyl -117:sc= -0.76 (180deg=-2.94!) USER MOD Single : A 64 LYS NZ :NH3+ -155:sc= 1.29 (180deg=0.991) USER MOD Single : A 65 TYR OH : rot 40:sc= 0.86 USER MOD Single : A 69 THR OG1 : rot 88:sc= 0.0439 USER MOD Single : A 70 ASN : amide:sc= -0.377 X(o=-0.38,f=-0.38) USER MOD Single : A 76 MET CE :methyl 164:sc= -0.0568 (180deg=-0.419) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 96 LYS NZ :NH3+ -163:sc= -0.117 (180deg=-0.542) USER MOD Single : A 97 LYS NZ :NH3+ -114:sc= 0.272 (180deg=-0.359) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN :FLIP amide:sc= -0.0233 F(o=-0.85,f=-0.023) USER MOD Single : A 107 GLN :FLIP amide:sc= 0 F(o=-0.91,f=0) USER MOD Single : A 109 GLN :FLIP amide:sc= -0.872! C(o=-3.8!,f=-0.87!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0236) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 30:sc= -0.614 USER MOD Single : A 132 SER OG : rot -80:sc= 0.521 USER MOD Single : A 133 THR OG1 : rot 74:sc= 1.2 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc= -11.3! C(o=-11!,f=-14!) USER MOD Single : A 149 THR OG1 : rot 69:sc= 1.14 USER MOD Single : A 150 GLN : amide:sc= -0.108 K(o=-0.11,f=-1) USER MOD Single : A 153 THR OG1 : rot 72:sc= 0.9 USER MOD Single : A 154 THR OG1 : rot 71:sc= 1.23 USER MOD Single : A 158 THR OG1 : rot -80:sc= 1.17 USER MOD Single : A 162 TYR OH : rot 60:sc= -0.168 USER MOD Single : A 163 GLN : amide:sc= -0.0154 X(o=-0.015,f=-0.2) USER MOD Single : A 167 TYR OH : rot 150:sc=-0.00611 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 CYS SG : rot 73:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 18 -6.821 -12.606 -5.080 1.00 44.04 N ATOM 167 CA TRP A 18 -5.435 -12.297 -5.286 1.00 44.41 C ATOM 168 C TRP A 18 -4.691 -13.602 -5.307 1.00 64.12 C ATOM 169 O TRP A 18 -5.071 -14.550 -4.590 1.00 22.54 O ATOM 170 CB TRP A 18 -4.868 -11.346 -4.212 1.00 70.42 C ATOM 171 CG TRP A 18 -4.797 -11.901 -2.818 1.00 21.23 C ATOM 172 CD1 TRP A 18 -3.716 -12.500 -2.243 1.00 33.02 C ATOM 173 CD2 TRP A 18 -5.829 -11.901 -1.824 1.00 30.33 C ATOM 174 NE1 TRP A 18 -4.009 -12.872 -0.965 1.00 14.10 N ATOM 175 CE2 TRP A 18 -5.296 -12.517 -0.679 1.00 34.44 C ATOM 176 CE3 TRP A 18 -7.147 -11.441 -1.786 1.00 42.23 C ATOM 177 CZ2 TRP A 18 -6.030 -12.689 0.485 1.00 3.12 C ATOM 178 CZ3 TRP A 18 -7.874 -11.613 -0.629 1.00 44.35 C ATOM 179 CH2 TRP A 18 -7.313 -12.231 0.493 1.00 4.51 C ATOM 0 HA TRP A 18 -5.317 -11.763 -6.229 1.00 44.41 H new ATOM 0 HB2 TRP A 18 -3.865 -11.044 -4.514 1.00 70.42 H new ATOM 0 HB3 TRP A 18 -5.480 -10.444 -4.193 1.00 70.42 H new ATOM 0 HD1 TRP A 18 -2.765 -12.657 -2.730 1.00 33.02 H new ATOM 0 HE1 TRP A 18 -3.369 -13.341 -0.324 1.00 14.10 H new ATOM 0 HE3 TRP A 18 -7.587 -10.960 -2.647 1.00 42.23 H new ATOM 0 HZ2 TRP A 18 -5.601 -13.168 1.353 1.00 3.12 H new ATOM 0 HZ3 TRP A 18 -8.895 -11.264 -0.588 1.00 44.35 H new ATOM 0 HH2 TRP A 18 -7.910 -12.348 1.385 1.00 4.51 H new ATOM 190 N GLN A 19 -3.684 -13.703 -6.103 1.00 45.11 N ATOM 191 CA GLN A 19 -3.001 -14.953 -6.197 1.00 43.33 C ATOM 192 C GLN A 19 -1.528 -14.799 -5.968 1.00 40.55 C ATOM 193 O GLN A 19 -0.855 -14.029 -6.660 1.00 31.34 O ATOM 194 CB GLN A 19 -3.270 -15.635 -7.537 1.00 72.24 C ATOM 195 CG GLN A 19 -2.664 -17.028 -7.629 1.00 0.54 C ATOM 196 CD GLN A 19 -2.981 -17.742 -8.917 1.00 74.10 C ATOM 197 OE1 GLN A 19 -3.162 -17.123 -9.962 1.00 33.14 O ATOM 198 NE2 GLN A 19 -3.061 -19.040 -8.852 1.00 21.13 N ATOM 0 H GLN A 19 -3.318 -12.953 -6.689 1.00 45.11 H new ATOM 0 HA GLN A 19 -3.395 -15.591 -5.406 1.00 43.33 H new ATOM 0 HB2 GLN A 19 -4.346 -15.702 -7.694 1.00 72.24 H new ATOM 0 HB3 GLN A 19 -2.869 -15.017 -8.340 1.00 72.24 H new ATOM 0 HG2 GLN A 19 -1.582 -16.952 -7.523 1.00 0.54 H new ATOM 0 HG3 GLN A 19 -3.025 -17.628 -6.793 1.00 0.54 H new ATOM 0 HE21 GLN A 19 -2.904 -19.517 -7.964 1.00 21.13 H new ATOM 0 HE22 GLN A 19 -3.281 -19.580 -9.689 1.00 21.13 H new ATOM 207 N VAL A 20 -1.036 -15.513 -4.992 1.00 14.24 N ATOM 208 CA VAL A 20 0.361 -15.563 -4.713 1.00 0.21 C ATOM 209 C VAL A 20 0.961 -16.585 -5.649 1.00 52.43 C ATOM 210 O VAL A 20 0.552 -17.740 -5.656 1.00 20.54 O ATOM 211 CB VAL A 20 0.633 -15.982 -3.245 1.00 4.10 C ATOM 212 CG1 VAL A 20 2.124 -16.029 -2.964 1.00 51.32 C ATOM 213 CG2 VAL A 20 -0.066 -15.035 -2.276 1.00 44.52 C ATOM 0 H VAL A 20 -1.606 -16.080 -4.365 1.00 14.24 H new ATOM 0 HA VAL A 20 0.802 -14.576 -4.855 1.00 0.21 H new ATOM 0 HB VAL A 20 0.228 -16.983 -3.098 1.00 4.10 H new ATOM 0 HG11 VAL A 20 2.290 -16.325 -1.928 1.00 51.32 H new ATOM 0 HG12 VAL A 20 2.597 -16.752 -3.628 1.00 51.32 H new ATOM 0 HG13 VAL A 20 2.557 -15.043 -3.133 1.00 51.32 H new ATOM 0 HG21 VAL A 20 0.138 -15.347 -1.252 1.00 44.52 H new ATOM 0 HG22 VAL A 20 0.305 -14.021 -2.427 1.00 44.52 H new ATOM 0 HG23 VAL A 20 -1.141 -15.059 -2.455 1.00 44.52 H new ATOM 223 N LEU A 21 1.891 -16.170 -6.445 1.00 41.44 N ATOM 224 CA LEU A 21 2.466 -17.051 -7.415 1.00 50.05 C ATOM 225 C LEU A 21 3.681 -17.775 -6.845 1.00 64.33 C ATOM 226 O LEU A 21 3.928 -18.937 -7.172 1.00 21.31 O ATOM 227 CB LEU A 21 2.741 -16.297 -8.750 1.00 43.34 C ATOM 228 CG LEU A 21 3.772 -15.145 -8.754 1.00 34.23 C ATOM 229 CD1 LEU A 21 5.193 -15.673 -8.823 1.00 41.42 C ATOM 230 CD2 LEU A 21 3.497 -14.177 -9.889 1.00 65.04 C ATOM 0 H LEU A 21 2.272 -15.224 -6.445 1.00 41.44 H new ATOM 0 HA LEU A 21 1.749 -17.835 -7.659 1.00 50.05 H new ATOM 0 HB2 LEU A 21 3.066 -17.034 -9.485 1.00 43.34 H new ATOM 0 HB3 LEU A 21 1.792 -15.892 -9.102 1.00 43.34 H new ATOM 0 HG LEU A 21 3.667 -14.604 -7.813 1.00 34.23 H new ATOM 0 HD11 LEU A 21 5.892 -14.837 -8.824 1.00 41.42 H new ATOM 0 HD12 LEU A 21 5.388 -16.308 -7.959 1.00 41.42 H new ATOM 0 HD13 LEU A 21 5.321 -16.254 -9.736 1.00 41.42 H new ATOM 0 HD21 LEU A 21 4.236 -13.376 -9.871 1.00 65.04 H new ATOM 0 HD22 LEU A 21 3.558 -14.705 -10.841 1.00 65.04 H new ATOM 0 HD23 LEU A 21 2.499 -13.754 -9.773 1.00 65.04 H new ATOM 242 N SER A 22 4.415 -17.101 -5.973 1.00 31.03 N ATOM 243 CA SER A 22 5.579 -17.685 -5.355 1.00 11.45 C ATOM 244 C SER A 22 5.976 -16.910 -4.115 1.00 21.51 C ATOM 245 O SER A 22 5.707 -15.713 -3.992 1.00 33.10 O ATOM 246 CB SER A 22 6.756 -17.748 -6.343 1.00 10.21 C ATOM 247 OG SER A 22 7.920 -18.329 -5.763 1.00 40.12 O ATOM 0 H SER A 22 4.217 -16.144 -5.681 1.00 31.03 H new ATOM 0 HA SER A 22 5.323 -18.703 -5.061 1.00 11.45 H new ATOM 0 HB2 SER A 22 6.462 -18.327 -7.218 1.00 10.21 H new ATOM 0 HB3 SER A 22 6.990 -16.742 -6.690 1.00 10.21 H new ATOM 0 HG SER A 22 8.641 -18.350 -6.427 1.00 40.12 H new ATOM 253 N THR A 23 6.547 -17.624 -3.197 1.00 41.22 N ATOM 254 CA THR A 23 7.105 -17.107 -1.976 1.00 0.32 C ATOM 255 C THR A 23 8.482 -17.725 -1.782 1.00 25.03 C ATOM 256 O THR A 23 8.840 -18.680 -2.500 1.00 24.40 O ATOM 257 CB THR A 23 6.208 -17.391 -0.741 1.00 42.52 C ATOM 258 OG1 THR A 23 5.836 -18.782 -0.699 1.00 14.31 O ATOM 259 CG2 THR A 23 4.966 -16.514 -0.732 1.00 73.41 C ATOM 0 H THR A 23 6.644 -18.636 -3.278 1.00 41.22 H new ATOM 0 HA THR A 23 7.174 -16.023 -2.061 1.00 0.32 H new ATOM 0 HB THR A 23 6.790 -17.150 0.149 1.00 42.52 H new ATOM 0 HG1 THR A 23 5.272 -18.946 0.086 1.00 14.31 H new ATOM 0 HG21 THR A 23 4.365 -16.743 0.148 1.00 73.41 H new ATOM 0 HG22 THR A 23 5.261 -15.465 -0.706 1.00 73.41 H new ATOM 0 HG23 THR A 23 4.380 -16.704 -1.631 1.00 73.41 H new ATOM 267 N GLY A 24 9.262 -17.193 -0.882 1.00 31.51 N ATOM 268 CA GLY A 24 10.533 -17.800 -0.599 1.00 62.50 C ATOM 269 C GLY A 24 11.679 -16.873 -0.809 1.00 73.32 C ATOM 270 O GLY A 24 12.391 -16.970 -1.810 1.00 23.22 O ATOM 0 H GLY A 24 9.046 -16.356 -0.341 1.00 31.51 H new ATOM 0 HA2 GLY A 24 10.540 -18.150 0.433 1.00 62.50 H new ATOM 0 HA3 GLY A 24 10.661 -18.677 -1.234 1.00 62.50 H new ATOM 274 N GLY A 25 11.869 -15.983 0.121 1.00 53.42 N ATOM 275 CA GLY A 25 12.947 -15.044 0.012 1.00 42.31 C ATOM 276 C GLY A 25 14.068 -15.373 0.960 1.00 72.12 C ATOM 277 O GLY A 25 14.154 -16.492 1.465 1.00 74.02 O ATOM 0 H GLY A 25 11.295 -15.887 0.959 1.00 53.42 H new ATOM 0 HA2 GLY A 25 13.324 -15.040 -1.011 1.00 42.31 H new ATOM 0 HA3 GLY A 25 12.578 -14.040 0.219 1.00 42.31 H new ATOM 281 N LYS A 26 14.884 -14.401 1.225 1.00 61.41 N ATOM 282 CA LYS A 26 16.039 -14.540 2.083 1.00 70.11 C ATOM 283 C LYS A 26 15.598 -14.217 3.520 1.00 3.54 C ATOM 284 O LYS A 26 14.443 -13.803 3.730 1.00 73.20 O ATOM 285 CB LYS A 26 17.126 -13.569 1.565 1.00 52.12 C ATOM 286 CG LYS A 26 18.509 -13.687 2.185 1.00 54.35 C ATOM 287 CD LYS A 26 19.480 -12.758 1.469 1.00 13.13 C ATOM 288 CE LYS A 26 20.901 -12.898 1.988 1.00 63.32 C ATOM 289 NZ LYS A 26 21.849 -12.068 1.212 1.00 34.51 N ATOM 0 H LYS A 26 14.770 -13.461 0.845 1.00 61.41 H new ATOM 0 HA LYS A 26 16.453 -15.548 2.076 1.00 70.11 H new ATOM 0 HB2 LYS A 26 17.224 -13.713 0.489 1.00 52.12 H new ATOM 0 HB3 LYS A 26 16.771 -12.550 1.719 1.00 52.12 H new ATOM 0 HG2 LYS A 26 18.465 -13.434 3.244 1.00 54.35 H new ATOM 0 HG3 LYS A 26 18.861 -14.717 2.117 1.00 54.35 H new ATOM 0 HD2 LYS A 26 19.463 -12.972 0.400 1.00 13.13 H new ATOM 0 HD3 LYS A 26 19.150 -11.726 1.593 1.00 13.13 H new ATOM 0 HE2 LYS A 26 20.936 -12.606 3.038 1.00 63.32 H new ATOM 0 HE3 LYS A 26 21.206 -13.943 1.937 1.00 63.32 H new ATOM 0 HZ1 LYS A 26 22.809 -12.188 1.594 1.00 34.51 H new ATOM 0 HZ2 LYS A 26 21.833 -12.363 0.215 1.00 34.51 H new ATOM 0 HZ3 LYS A 26 21.572 -11.068 1.281 1.00 34.51 H new ATOM 303 N GLU A 27 16.442 -14.461 4.507 1.00 51.13 N ATOM 304 CA GLU A 27 16.070 -14.127 5.868 1.00 33.42 C ATOM 305 C GLU A 27 15.997 -12.609 6.030 1.00 22.24 C ATOM 306 O GLU A 27 16.735 -11.866 5.352 1.00 43.31 O ATOM 307 CB GLU A 27 17.018 -14.747 6.898 1.00 1.32 C ATOM 308 CG GLU A 27 16.544 -14.556 8.336 1.00 44.55 C ATOM 309 CD GLU A 27 17.401 -15.254 9.342 1.00 2.21 C ATOM 310 OE1 GLU A 27 17.291 -16.497 9.466 1.00 22.31 O ATOM 311 OE2 GLU A 27 18.182 -14.584 10.034 1.00 63.53 O ATOM 0 H GLU A 27 17.366 -14.878 4.397 1.00 51.13 H new ATOM 0 HA GLU A 27 15.085 -14.553 6.058 1.00 33.42 H new ATOM 0 HB2 GLU A 27 17.121 -15.813 6.694 1.00 1.32 H new ATOM 0 HB3 GLU A 27 18.008 -14.304 6.786 1.00 1.32 H new ATOM 0 HG2 GLU A 27 16.523 -13.491 8.565 1.00 44.55 H new ATOM 0 HG3 GLU A 27 15.521 -14.922 8.425 1.00 44.55 H new ATOM 318 N ASP A 28 15.099 -12.174 6.907 1.00 15.21 N ATOM 319 CA ASP A 28 14.801 -10.765 7.192 1.00 42.11 C ATOM 320 C ASP A 28 13.939 -10.169 6.105 1.00 60.04 C ATOM 321 O ASP A 28 12.801 -9.771 6.365 1.00 2.32 O ATOM 322 CB ASP A 28 16.041 -9.897 7.503 1.00 61.14 C ATOM 323 CG ASP A 28 15.668 -8.463 7.857 1.00 62.42 C ATOM 324 OD1 ASP A 28 15.029 -8.247 8.923 1.00 54.34 O ATOM 325 OD2 ASP A 28 15.990 -7.535 7.084 1.00 1.30 O ATOM 0 H ASP A 28 14.533 -12.815 7.464 1.00 15.21 H new ATOM 0 HA ASP A 28 14.234 -10.761 8.123 1.00 42.11 H new ATOM 0 HB2 ASP A 28 16.594 -10.341 8.330 1.00 61.14 H new ATOM 0 HB3 ASP A 28 16.706 -9.895 6.639 1.00 61.14 H new ATOM 330 N VAL A 29 14.454 -10.129 4.894 1.00 34.11 N ATOM 331 CA VAL A 29 13.677 -9.666 3.769 1.00 41.54 C ATOM 332 C VAL A 29 13.283 -10.878 2.924 1.00 3.42 C ATOM 333 O VAL A 29 14.115 -11.495 2.252 1.00 21.40 O ATOM 334 CB VAL A 29 14.471 -8.638 2.906 1.00 32.42 C ATOM 335 CG1 VAL A 29 13.651 -8.169 1.712 1.00 35.11 C ATOM 336 CG2 VAL A 29 14.888 -7.444 3.753 1.00 60.20 C ATOM 0 H VAL A 29 15.407 -10.412 4.666 1.00 34.11 H new ATOM 0 HA VAL A 29 12.788 -9.154 4.137 1.00 41.54 H new ATOM 0 HB VAL A 29 15.364 -9.138 2.530 1.00 32.42 H new ATOM 0 HG11 VAL A 29 14.232 -7.453 1.130 1.00 35.11 H new ATOM 0 HG12 VAL A 29 13.397 -9.025 1.086 1.00 35.11 H new ATOM 0 HG13 VAL A 29 12.736 -7.693 2.064 1.00 35.11 H new ATOM 0 HG21 VAL A 29 15.441 -6.736 3.136 1.00 60.20 H new ATOM 0 HG22 VAL A 29 14.001 -6.957 4.157 1.00 60.20 H new ATOM 0 HG23 VAL A 29 15.521 -7.783 4.573 1.00 60.20 H new ATOM 346 N SER A 30 12.019 -11.192 2.950 1.00 55.44 N ATOM 347 CA SER A 30 11.492 -12.354 2.276 1.00 22.05 C ATOM 348 C SER A 30 10.489 -11.894 1.242 1.00 1.52 C ATOM 349 O SER A 30 9.925 -10.830 1.399 1.00 40.21 O ATOM 350 CB SER A 30 10.809 -13.232 3.307 1.00 14.13 C ATOM 351 OG SER A 30 11.688 -13.526 4.396 1.00 41.51 O ATOM 0 H SER A 30 11.314 -10.645 3.444 1.00 55.44 H new ATOM 0 HA SER A 30 12.286 -12.917 1.785 1.00 22.05 H new ATOM 0 HB2 SER A 30 9.916 -12.731 3.681 1.00 14.13 H new ATOM 0 HB3 SER A 30 10.482 -14.160 2.839 1.00 14.13 H new ATOM 0 HG SER A 30 12.607 -13.602 4.063 1.00 41.51 H new ATOM 357 N TYR A 31 10.257 -12.658 0.189 1.00 60.34 N ATOM 358 CA TYR A 31 9.337 -12.178 -0.812 1.00 61.22 C ATOM 359 C TYR A 31 8.114 -13.038 -0.977 1.00 71.44 C ATOM 360 O TYR A 31 8.132 -14.251 -0.711 1.00 22.41 O ATOM 361 CB TYR A 31 10.000 -11.923 -2.183 1.00 14.11 C ATOM 362 CG TYR A 31 10.596 -13.124 -2.902 1.00 50.44 C ATOM 363 CD1 TYR A 31 9.790 -14.144 -3.406 1.00 24.32 C ATOM 364 CD2 TYR A 31 11.957 -13.202 -3.122 1.00 54.03 C ATOM 365 CE1 TYR A 31 10.324 -15.201 -4.098 1.00 55.50 C ATOM 366 CE2 TYR A 31 12.505 -14.266 -3.813 1.00 52.42 C ATOM 367 CZ TYR A 31 11.678 -15.263 -4.301 1.00 3.25 C ATOM 368 OH TYR A 31 12.210 -16.319 -5.000 1.00 45.01 O ATOM 0 H TYR A 31 10.674 -13.572 0.013 1.00 60.34 H new ATOM 0 HA TYR A 31 9.006 -11.217 -0.418 1.00 61.22 H new ATOM 0 HB2 TYR A 31 9.256 -11.472 -2.839 1.00 14.11 H new ATOM 0 HB3 TYR A 31 10.791 -11.186 -2.044 1.00 14.11 H new ATOM 0 HD1 TYR A 31 8.722 -14.101 -3.248 1.00 24.32 H new ATOM 0 HD2 TYR A 31 12.602 -12.421 -2.749 1.00 54.03 H new ATOM 0 HE1 TYR A 31 9.681 -15.980 -4.481 1.00 55.50 H new ATOM 0 HE2 TYR A 31 13.572 -14.319 -3.971 1.00 52.42 H new ATOM 0 HH TYR A 31 13.183 -16.216 -5.058 1.00 45.01 H new ATOM 378 N GLU A 32 7.078 -12.389 -1.394 1.00 44.14 N ATOM 379 CA GLU A 32 5.846 -12.982 -1.784 1.00 33.42 C ATOM 380 C GLU A 32 5.451 -12.287 -3.074 1.00 63.44 C ATOM 381 O GLU A 32 5.378 -11.066 -3.120 1.00 60.24 O ATOM 382 CB GLU A 32 4.801 -12.733 -0.692 1.00 54.22 C ATOM 383 CG GLU A 32 3.406 -13.247 -0.997 1.00 72.34 C ATOM 384 CD GLU A 32 2.437 -12.953 0.120 1.00 75.11 C ATOM 385 OE1 GLU A 32 1.818 -11.859 0.121 1.00 20.31 O ATOM 386 OE2 GLU A 32 2.283 -13.796 1.026 1.00 21.24 O ATOM 0 H GLU A 32 7.070 -11.372 -1.476 1.00 44.14 H new ATOM 0 HA GLU A 32 5.925 -14.060 -1.926 1.00 33.42 H new ATOM 0 HB2 GLU A 32 5.147 -13.198 0.231 1.00 54.22 H new ATOM 0 HB3 GLU A 32 4.742 -11.660 -0.507 1.00 54.22 H new ATOM 0 HG2 GLU A 32 3.045 -12.791 -1.919 1.00 72.34 H new ATOM 0 HG3 GLU A 32 3.446 -14.323 -1.168 1.00 72.34 H new ATOM 393 N GLU A 33 5.226 -13.033 -4.103 1.00 11.34 N ATOM 394 CA GLU A 33 4.904 -12.469 -5.378 1.00 61.22 C ATOM 395 C GLU A 33 3.430 -12.700 -5.620 1.00 31.25 C ATOM 396 O GLU A 33 2.990 -13.848 -5.663 1.00 75.20 O ATOM 397 CB GLU A 33 5.738 -13.178 -6.447 1.00 22.31 C ATOM 398 CG GLU A 33 7.245 -13.197 -6.161 1.00 53.30 C ATOM 399 CD GLU A 33 8.032 -13.906 -7.232 1.00 72.12 C ATOM 400 OE1 GLU A 33 8.358 -13.280 -8.252 1.00 12.42 O ATOM 401 OE2 GLU A 33 8.335 -15.099 -7.068 1.00 61.15 O ATOM 0 H GLU A 33 5.259 -14.052 -4.088 1.00 11.34 H new ATOM 0 HA GLU A 33 5.121 -11.401 -5.412 1.00 61.22 H new ATOM 0 HB2 GLU A 33 5.385 -14.205 -6.545 1.00 22.31 H new ATOM 0 HB3 GLU A 33 5.568 -12.690 -7.407 1.00 22.31 H new ATOM 0 HG2 GLU A 33 7.606 -12.173 -6.069 1.00 53.30 H new ATOM 0 HG3 GLU A 33 7.422 -13.685 -5.203 1.00 53.30 H new ATOM 408 N ARG A 34 2.654 -11.646 -5.758 1.00 53.21 N ATOM 409 CA ARG A 34 1.227 -11.817 -5.898 1.00 74.22 C ATOM 410 C ARG A 34 0.609 -10.901 -6.925 1.00 1.12 C ATOM 411 O ARG A 34 1.073 -9.780 -7.155 1.00 12.51 O ATOM 412 CB ARG A 34 0.488 -11.662 -4.549 1.00 43.32 C ATOM 413 CG ARG A 34 0.714 -10.333 -3.820 1.00 72.24 C ATOM 414 CD ARG A 34 -0.213 -10.222 -2.615 1.00 42.21 C ATOM 415 NE ARG A 34 0.045 -9.031 -1.778 1.00 73.42 N ATOM 416 CZ ARG A 34 -0.916 -8.203 -1.292 1.00 11.41 C ATOM 417 NH1 ARG A 34 -2.162 -8.238 -1.790 1.00 73.21 N ATOM 418 NH2 ARG A 34 -0.613 -7.306 -0.347 1.00 24.15 N ATOM 0 H ARG A 34 2.980 -10.680 -5.776 1.00 53.21 H new ATOM 0 HA ARG A 34 1.103 -12.839 -6.255 1.00 74.22 H new ATOM 0 HB2 ARG A 34 -0.581 -11.782 -4.725 1.00 43.32 H new ATOM 0 HB3 ARG A 34 0.796 -12.474 -3.891 1.00 43.32 H new ATOM 0 HG2 ARG A 34 1.752 -10.261 -3.496 1.00 72.24 H new ATOM 0 HG3 ARG A 34 0.535 -9.502 -4.502 1.00 72.24 H new ATOM 0 HD2 ARG A 34 -1.246 -10.195 -2.963 1.00 42.21 H new ATOM 0 HD3 ARG A 34 -0.107 -11.117 -2.002 1.00 42.21 H new ATOM 0 HE ARG A 34 1.015 -8.815 -1.549 1.00 73.42 H new ATOM 0 HH11 ARG A 34 -2.394 -8.890 -2.539 1.00 73.21 H new ATOM 0 HH12 ARG A 34 -2.877 -7.613 -1.419 1.00 73.21 H new ATOM 0 HH21 ARG A 34 0.341 -7.243 0.009 1.00 24.15 H new ATOM 0 HH22 ARG A 34 -1.336 -6.685 0.017 1.00 24.15 H new ATOM 432 N ALA A 35 -0.429 -11.401 -7.543 1.00 13.40 N ATOM 433 CA ALA A 35 -1.234 -10.633 -8.444 1.00 62.52 C ATOM 434 C ALA A 35 -2.219 -9.846 -7.601 1.00 31.42 C ATOM 435 O ALA A 35 -2.775 -10.391 -6.639 1.00 5.31 O ATOM 436 CB ALA A 35 -1.971 -11.557 -9.406 1.00 32.34 C ATOM 0 H ALA A 35 -0.739 -12.366 -7.430 1.00 13.40 H new ATOM 0 HA ALA A 35 -0.619 -9.960 -9.041 1.00 62.52 H new ATOM 0 HB1 ALA A 35 -2.580 -10.962 -10.087 1.00 32.34 H new ATOM 0 HB2 ALA A 35 -1.248 -12.137 -9.979 1.00 32.34 H new ATOM 0 HB3 ALA A 35 -2.613 -12.233 -8.841 1.00 32.34 H new ATOM 442 N CYS A 36 -2.405 -8.591 -7.927 1.00 70.34 N ATOM 443 CA CYS A 36 -3.264 -7.706 -7.157 1.00 63.15 C ATOM 444 C CYS A 36 -4.728 -8.129 -7.150 1.00 22.10 C ATOM 445 O CYS A 36 -5.242 -8.653 -8.145 1.00 5.13 O ATOM 446 CB CYS A 36 -3.108 -6.279 -7.649 1.00 53.21 C ATOM 447 SG CYS A 36 -1.470 -5.614 -7.350 1.00 3.51 S ATOM 0 H CYS A 36 -1.967 -8.147 -8.734 1.00 70.34 H new ATOM 0 HA CYS A 36 -2.938 -7.772 -6.119 1.00 63.15 H new ATOM 0 HB2 CYS A 36 -3.320 -6.243 -8.718 1.00 53.21 H new ATOM 0 HB3 CYS A 36 -3.847 -5.647 -7.156 1.00 53.21 H new ATOM 0 HG CYS A 36 -1.548 -4.327 -7.182 1.00 3.51 H new ATOM 453 N GLU A 37 -5.366 -7.930 -5.995 1.00 13.11 N ATOM 454 CA GLU A 37 -6.773 -8.214 -5.764 1.00 11.31 C ATOM 455 C GLU A 37 -7.660 -7.658 -6.860 1.00 31.33 C ATOM 456 O GLU A 37 -8.535 -8.346 -7.379 1.00 41.21 O ATOM 457 CB GLU A 37 -7.252 -7.618 -4.416 1.00 54.32 C ATOM 458 CG GLU A 37 -6.599 -8.164 -3.135 1.00 34.01 C ATOM 459 CD GLU A 37 -5.173 -7.721 -2.887 1.00 34.52 C ATOM 460 OE1 GLU A 37 -4.264 -8.164 -3.595 1.00 3.42 O ATOM 461 OE2 GLU A 37 -4.956 -6.944 -1.932 1.00 2.14 O ATOM 0 H GLU A 37 -4.897 -7.554 -5.171 1.00 13.11 H new ATOM 0 HA GLU A 37 -6.857 -9.301 -5.750 1.00 11.31 H new ATOM 0 HB2 GLU A 37 -7.089 -6.541 -4.446 1.00 54.32 H new ATOM 0 HB3 GLU A 37 -8.328 -7.775 -4.340 1.00 54.32 H new ATOM 0 HG2 GLU A 37 -7.207 -7.863 -2.282 1.00 34.01 H new ATOM 0 HG3 GLU A 37 -6.621 -9.253 -3.174 1.00 34.01 H new ATOM 468 N GLY A 38 -7.435 -6.414 -7.188 1.00 24.32 N ATOM 469 CA GLY A 38 -8.265 -5.746 -8.170 1.00 51.11 C ATOM 470 C GLY A 38 -9.462 -5.102 -7.510 1.00 22.30 C ATOM 471 O GLY A 38 -10.389 -4.636 -8.174 1.00 31.03 O ATOM 0 H GLY A 38 -6.689 -5.840 -6.795 1.00 24.32 H new ATOM 0 HA2 GLY A 38 -7.681 -4.989 -8.692 1.00 51.11 H new ATOM 0 HA3 GLY A 38 -8.599 -6.464 -8.919 1.00 51.11 H new ATOM 475 N GLY A 39 -9.439 -5.097 -6.196 1.00 63.33 N ATOM 476 CA GLY A 39 -10.506 -4.544 -5.429 1.00 40.14 C ATOM 477 C GLY A 39 -10.443 -3.044 -5.413 1.00 54.13 C ATOM 478 O GLY A 39 -9.423 -2.456 -5.784 1.00 63.43 O ATOM 0 H GLY A 39 -8.675 -5.479 -5.639 1.00 63.33 H new ATOM 0 HA2 GLY A 39 -11.461 -4.866 -5.844 1.00 40.14 H new ATOM 0 HA3 GLY A 39 -10.458 -4.923 -4.408 1.00 40.14 H new ATOM 482 N LYS A 40 -11.507 -2.423 -4.995 1.00 31.15 N ATOM 483 CA LYS A 40 -11.545 -0.987 -4.925 1.00 51.44 C ATOM 484 C LYS A 40 -11.018 -0.500 -3.590 1.00 21.42 C ATOM 485 O LYS A 40 -11.321 -1.081 -2.544 1.00 70.24 O ATOM 486 CB LYS A 40 -12.949 -0.412 -5.203 1.00 61.35 C ATOM 487 CG LYS A 40 -14.109 -1.024 -4.386 1.00 61.54 C ATOM 488 CD LYS A 40 -14.777 -2.215 -5.085 1.00 70.45 C ATOM 489 CE LYS A 40 -15.454 -1.778 -6.395 1.00 44.40 C ATOM 490 NZ LYS A 40 -16.198 -2.877 -7.057 1.00 5.10 N ATOM 0 H LYS A 40 -12.364 -2.888 -4.696 1.00 31.15 H new ATOM 0 HA LYS A 40 -10.894 -0.617 -5.717 1.00 51.44 H new ATOM 0 HB2 LYS A 40 -12.924 0.661 -5.012 1.00 61.35 H new ATOM 0 HB3 LYS A 40 -13.169 -0.543 -6.262 1.00 61.35 H new ATOM 0 HG2 LYS A 40 -13.731 -1.346 -3.415 1.00 61.54 H new ATOM 0 HG3 LYS A 40 -14.858 -0.255 -4.198 1.00 61.54 H new ATOM 0 HD2 LYS A 40 -14.032 -2.982 -5.295 1.00 70.45 H new ATOM 0 HD3 LYS A 40 -15.517 -2.662 -4.421 1.00 70.45 H new ATOM 0 HE2 LYS A 40 -16.139 -0.956 -6.187 1.00 44.40 H new ATOM 0 HE3 LYS A 40 -14.696 -1.396 -7.079 1.00 44.40 H new ATOM 0 HZ1 LYS A 40 -16.632 -2.524 -7.933 1.00 5.10 H new ATOM 0 HZ2 LYS A 40 -15.543 -3.652 -7.283 1.00 5.10 H new ATOM 0 HZ3 LYS A 40 -16.941 -3.227 -6.419 1.00 5.10 H new ATOM 504 N PHE A 41 -10.216 0.541 -3.643 1.00 64.12 N ATOM 505 CA PHE A 41 -9.565 1.117 -2.482 1.00 44.30 C ATOM 506 C PHE A 41 -9.684 2.634 -2.536 1.00 72.11 C ATOM 507 O PHE A 41 -9.982 3.184 -3.587 1.00 24.35 O ATOM 508 CB PHE A 41 -8.079 0.708 -2.466 1.00 62.14 C ATOM 509 CG PHE A 41 -7.873 -0.780 -2.460 1.00 73.34 C ATOM 510 CD1 PHE A 41 -8.337 -1.526 -1.414 1.00 10.52 C ATOM 511 CD2 PHE A 41 -7.219 -1.427 -3.504 1.00 21.22 C ATOM 512 CE1 PHE A 41 -8.172 -2.884 -1.381 1.00 75.13 C ATOM 513 CE2 PHE A 41 -7.046 -2.798 -3.480 1.00 55.15 C ATOM 514 CZ PHE A 41 -7.525 -3.529 -2.414 1.00 2.25 C ATOM 0 H PHE A 41 -9.992 1.023 -4.514 1.00 64.12 H new ATOM 0 HA PHE A 41 -10.045 0.750 -1.575 1.00 44.30 H new ATOM 0 HB2 PHE A 41 -7.583 1.133 -3.338 1.00 62.14 H new ATOM 0 HB3 PHE A 41 -7.600 1.138 -1.586 1.00 62.14 H new ATOM 0 HD1 PHE A 41 -8.844 -1.034 -0.597 1.00 10.52 H new ATOM 0 HD2 PHE A 41 -6.844 -0.854 -4.339 1.00 21.22 H new ATOM 0 HE1 PHE A 41 -8.549 -3.452 -0.544 1.00 75.13 H new ATOM 0 HE2 PHE A 41 -6.538 -3.295 -4.293 1.00 55.15 H new ATOM 0 HZ PHE A 41 -7.394 -4.601 -2.388 1.00 2.25 H new ATOM 524 N ALA A 42 -9.439 3.310 -1.427 1.00 42.41 N ATOM 525 CA ALA A 42 -9.544 4.768 -1.402 1.00 72.52 C ATOM 526 C ALA A 42 -8.170 5.363 -1.528 1.00 63.43 C ATOM 527 O ALA A 42 -7.327 5.167 -0.681 1.00 54.55 O ATOM 528 CB ALA A 42 -10.209 5.256 -0.117 1.00 40.20 C ATOM 0 H ALA A 42 -9.169 2.885 -0.540 1.00 42.41 H new ATOM 0 HA ALA A 42 -10.166 5.086 -2.239 1.00 72.52 H new ATOM 0 HB1 ALA A 42 -10.272 6.344 -0.130 1.00 40.20 H new ATOM 0 HB2 ALA A 42 -11.212 4.836 -0.044 1.00 40.20 H new ATOM 0 HB3 ALA A 42 -9.619 4.937 0.742 1.00 40.20 H new ATOM 534 N THR A 43 -7.952 6.070 -2.577 1.00 74.13 N ATOM 535 CA THR A 43 -6.664 6.600 -2.863 1.00 32.41 C ATOM 536 C THR A 43 -6.661 8.132 -2.944 1.00 31.01 C ATOM 537 O THR A 43 -7.599 8.752 -3.475 1.00 4.31 O ATOM 538 CB THR A 43 -6.070 5.931 -4.145 1.00 43.24 C ATOM 539 OG1 THR A 43 -4.802 6.490 -4.511 1.00 24.23 O ATOM 540 CG2 THR A 43 -7.035 6.004 -5.300 1.00 61.02 C ATOM 0 H THR A 43 -8.666 6.300 -3.268 1.00 74.13 H new ATOM 0 HA THR A 43 -6.011 6.353 -2.026 1.00 32.41 H new ATOM 0 HB THR A 43 -5.906 4.882 -3.901 1.00 43.24 H new ATOM 0 HG1 THR A 43 -4.260 6.627 -3.706 1.00 24.23 H new ATOM 0 HG21 THR A 43 -6.591 5.530 -6.175 1.00 61.02 H new ATOM 0 HG22 THR A 43 -7.958 5.487 -5.036 1.00 61.02 H new ATOM 0 HG23 THR A 43 -7.255 7.048 -5.525 1.00 61.02 H new ATOM 548 N VAL A 44 -5.616 8.723 -2.379 1.00 20.31 N ATOM 549 CA VAL A 44 -5.403 10.160 -2.347 1.00 33.41 C ATOM 550 C VAL A 44 -3.996 10.497 -2.810 1.00 54.15 C ATOM 551 O VAL A 44 -3.015 9.977 -2.278 1.00 60.03 O ATOM 552 CB VAL A 44 -5.631 10.758 -0.931 1.00 0.53 C ATOM 553 CG1 VAL A 44 -7.085 10.770 -0.576 1.00 60.42 C ATOM 554 CG2 VAL A 44 -4.881 9.968 0.110 1.00 25.44 C ATOM 0 H VAL A 44 -4.873 8.198 -1.918 1.00 20.31 H new ATOM 0 HA VAL A 44 -6.135 10.602 -3.023 1.00 33.41 H new ATOM 0 HB VAL A 44 -5.259 11.782 -0.950 1.00 0.53 H new ATOM 0 HG11 VAL A 44 -7.213 11.194 0.420 1.00 60.42 H new ATOM 0 HG12 VAL A 44 -7.631 11.374 -1.300 1.00 60.42 H new ATOM 0 HG13 VAL A 44 -7.471 9.751 -0.589 1.00 60.42 H new ATOM 0 HG21 VAL A 44 -5.055 10.405 1.093 1.00 25.44 H new ATOM 0 HG22 VAL A 44 -5.230 8.935 0.104 1.00 25.44 H new ATOM 0 HG23 VAL A 44 -3.814 9.992 -0.114 1.00 25.44 H new ATOM 564 N GLU A 45 -3.886 11.335 -3.789 1.00 40.30 N ATOM 565 CA GLU A 45 -2.584 11.701 -4.283 1.00 64.12 C ATOM 566 C GLU A 45 -2.220 13.124 -3.937 1.00 20.45 C ATOM 567 O GLU A 45 -3.056 14.019 -3.973 1.00 11.34 O ATOM 568 CB GLU A 45 -2.443 11.456 -5.784 1.00 5.22 C ATOM 569 CG GLU A 45 -3.417 12.209 -6.658 1.00 2.43 C ATOM 570 CD GLU A 45 -3.141 11.968 -8.108 1.00 45.13 C ATOM 571 OE1 GLU A 45 -3.625 10.969 -8.653 1.00 25.42 O ATOM 572 OE2 GLU A 45 -2.391 12.765 -8.716 1.00 14.31 O ATOM 0 H GLU A 45 -4.671 11.780 -4.264 1.00 40.30 H new ATOM 0 HA GLU A 45 -1.877 11.046 -3.774 1.00 64.12 H new ATOM 0 HB2 GLU A 45 -1.430 11.723 -6.085 1.00 5.22 H new ATOM 0 HB3 GLU A 45 -2.561 10.389 -5.973 1.00 5.22 H new ATOM 0 HG2 GLU A 45 -4.435 11.899 -6.423 1.00 2.43 H new ATOM 0 HG3 GLU A 45 -3.351 13.276 -6.445 1.00 2.43 H new ATOM 579 N VAL A 46 -0.977 13.315 -3.559 1.00 31.42 N ATOM 580 CA VAL A 46 -0.450 14.631 -3.279 1.00 64.31 C ATOM 581 C VAL A 46 0.826 14.836 -4.122 1.00 3.25 C ATOM 582 O VAL A 46 1.600 13.878 -4.353 1.00 51.21 O ATOM 583 CB VAL A 46 -0.132 14.834 -1.750 1.00 51.34 C ATOM 584 CG1 VAL A 46 0.300 16.261 -1.466 1.00 63.03 C ATOM 585 CG2 VAL A 46 -1.330 14.463 -0.883 1.00 22.45 C ATOM 0 H VAL A 46 -0.301 12.561 -3.437 1.00 31.42 H new ATOM 0 HA VAL A 46 -1.207 15.370 -3.542 1.00 64.31 H new ATOM 0 HB VAL A 46 0.693 14.168 -1.498 1.00 51.34 H new ATOM 0 HG11 VAL A 46 0.513 16.372 -0.403 1.00 63.03 H new ATOM 0 HG12 VAL A 46 1.197 16.491 -2.042 1.00 63.03 H new ATOM 0 HG13 VAL A 46 -0.499 16.946 -1.749 1.00 63.03 H new ATOM 0 HG21 VAL A 46 -1.080 14.614 0.167 1.00 22.45 H new ATOM 0 HG22 VAL A 46 -2.179 15.093 -1.148 1.00 22.45 H new ATOM 0 HG23 VAL A 46 -1.588 13.417 -1.048 1.00 22.45 H new ATOM 595 N THR A 47 1.006 16.025 -4.631 1.00 71.35 N ATOM 596 CA THR A 47 2.176 16.379 -5.402 1.00 0.32 C ATOM 597 C THR A 47 2.810 17.644 -4.841 1.00 61.13 C ATOM 598 O THR A 47 2.273 18.226 -3.894 1.00 22.44 O ATOM 599 CB THR A 47 1.829 16.572 -6.892 1.00 51.11 C ATOM 600 OG1 THR A 47 0.668 17.411 -7.041 1.00 20.13 O ATOM 601 CG2 THR A 47 1.610 15.245 -7.592 1.00 4.44 C ATOM 0 H THR A 47 0.338 16.788 -4.523 1.00 71.35 H new ATOM 0 HA THR A 47 2.889 15.558 -5.328 1.00 0.32 H new ATOM 0 HB THR A 47 2.681 17.063 -7.363 1.00 51.11 H new ATOM 0 HG1 THR A 47 0.465 17.523 -7.993 1.00 20.13 H new ATOM 0 HG21 THR A 47 1.368 15.422 -8.640 1.00 4.44 H new ATOM 0 HG22 THR A 47 2.517 14.645 -7.526 1.00 4.44 H new ATOM 0 HG23 THR A 47 0.787 14.713 -7.114 1.00 4.44 H new ATOM 609 N ASP A 48 3.973 18.043 -5.389 1.00 64.22 N ATOM 610 CA ASP A 48 4.714 19.274 -4.979 1.00 31.10 C ATOM 611 C ASP A 48 5.412 19.135 -3.618 1.00 73.33 C ATOM 612 O ASP A 48 6.505 19.679 -3.402 1.00 4.21 O ATOM 613 CB ASP A 48 3.818 20.543 -5.033 1.00 31.22 C ATOM 614 CG ASP A 48 4.509 21.806 -4.529 1.00 71.32 C ATOM 615 OD1 ASP A 48 5.409 22.328 -5.224 1.00 61.22 O ATOM 616 OD2 ASP A 48 4.135 22.311 -3.454 1.00 23.40 O ATOM 0 H ASP A 48 4.437 17.524 -6.135 1.00 64.22 H new ATOM 0 HA ASP A 48 5.505 19.399 -5.718 1.00 31.10 H new ATOM 0 HB2 ASP A 48 3.493 20.703 -6.061 1.00 31.22 H new ATOM 0 HB3 ASP A 48 2.921 20.369 -4.439 1.00 31.22 H new ATOM 621 N LYS A 49 4.802 18.404 -2.723 1.00 32.31 N ATOM 622 CA LYS A 49 5.356 18.198 -1.404 1.00 41.04 C ATOM 623 C LYS A 49 6.050 16.838 -1.275 1.00 52.23 C ATOM 624 O LYS A 49 5.562 15.837 -1.804 1.00 5.41 O ATOM 625 CB LYS A 49 4.302 18.358 -0.274 1.00 51.52 C ATOM 626 CG LYS A 49 3.779 19.784 -0.018 1.00 1.03 C ATOM 627 CD LYS A 49 2.869 20.312 -1.115 1.00 62.45 C ATOM 628 CE LYS A 49 1.578 19.519 -1.194 1.00 4.52 C ATOM 629 NZ LYS A 49 0.668 20.044 -2.227 1.00 34.45 N ATOM 0 H LYS A 49 3.911 17.935 -2.883 1.00 32.31 H new ATOM 0 HA LYS A 49 6.101 18.984 -1.280 1.00 41.04 H new ATOM 0 HB2 LYS A 49 3.450 17.720 -0.509 1.00 51.52 H new ATOM 0 HB3 LYS A 49 4.736 17.982 0.653 1.00 51.52 H new ATOM 0 HG2 LYS A 49 3.237 19.798 0.928 1.00 1.03 H new ATOM 0 HG3 LYS A 49 4.629 20.458 0.092 1.00 1.03 H new ATOM 0 HD2 LYS A 49 2.642 21.361 -0.928 1.00 62.45 H new ATOM 0 HD3 LYS A 49 3.386 20.264 -2.073 1.00 62.45 H new ATOM 0 HE2 LYS A 49 1.807 18.475 -1.409 1.00 4.52 H new ATOM 0 HE3 LYS A 49 1.079 19.543 -0.225 1.00 4.52 H new ATOM 0 HZ1 LYS A 49 -0.315 19.820 -1.970 1.00 34.45 H new ATOM 0 HZ2 LYS A 49 0.781 21.075 -2.297 1.00 34.45 H new ATOM 0 HZ3 LYS A 49 0.895 19.608 -3.143 1.00 34.45 H new ATOM 643 N PRO A 50 7.230 16.817 -0.590 1.00 3.35 N ATOM 644 CA PRO A 50 7.983 15.583 -0.244 1.00 0.53 C ATOM 645 C PRO A 50 7.100 14.560 0.478 1.00 72.05 C ATOM 646 O PRO A 50 6.080 14.928 1.043 1.00 21.03 O ATOM 647 CB PRO A 50 9.073 16.087 0.704 1.00 73.01 C ATOM 648 CG PRO A 50 9.292 17.494 0.301 1.00 63.03 C ATOM 649 CD PRO A 50 7.946 18.020 -0.106 1.00 3.42 C ATOM 0 HA PRO A 50 8.365 15.075 -1.130 1.00 0.53 H new ATOM 0 HB2 PRO A 50 8.757 16.017 1.745 1.00 73.01 H new ATOM 0 HB3 PRO A 50 9.986 15.500 0.607 1.00 73.01 H new ATOM 0 HG2 PRO A 50 9.706 18.076 1.124 1.00 63.03 H new ATOM 0 HG3 PRO A 50 10.002 17.558 -0.524 1.00 63.03 H new ATOM 0 HD2 PRO A 50 7.427 18.484 0.733 1.00 3.42 H new ATOM 0 HD3 PRO A 50 8.031 18.776 -0.886 1.00 3.42 H new ATOM 657 N VAL A 51 7.514 13.296 0.469 1.00 50.41 N ATOM 658 CA VAL A 51 6.743 12.174 1.054 1.00 61.53 C ATOM 659 C VAL A 51 6.188 12.490 2.456 1.00 35.22 C ATOM 660 O VAL A 51 4.999 12.303 2.693 1.00 23.31 O ATOM 661 CB VAL A 51 7.609 10.869 1.085 1.00 72.51 C ATOM 662 CG1 VAL A 51 6.970 9.752 1.917 1.00 13.05 C ATOM 663 CG2 VAL A 51 7.843 10.381 -0.337 1.00 71.20 C ATOM 0 H VAL A 51 8.400 13.007 0.055 1.00 50.41 H new ATOM 0 HA VAL A 51 5.880 12.018 0.407 1.00 61.53 H new ATOM 0 HB VAL A 51 8.556 11.120 1.563 1.00 72.51 H new ATOM 0 HG11 VAL A 51 7.614 8.873 1.902 1.00 13.05 H new ATOM 0 HG12 VAL A 51 6.843 10.091 2.945 1.00 13.05 H new ATOM 0 HG13 VAL A 51 5.998 9.496 1.496 1.00 13.05 H new ATOM 0 HG21 VAL A 51 8.446 9.473 -0.316 1.00 71.20 H new ATOM 0 HG22 VAL A 51 6.885 10.169 -0.811 1.00 71.20 H new ATOM 0 HG23 VAL A 51 8.367 11.151 -0.904 1.00 71.20 H new ATOM 673 N ASP A 52 7.021 13.011 3.350 1.00 54.53 N ATOM 674 CA ASP A 52 6.557 13.378 4.711 1.00 23.11 C ATOM 675 C ASP A 52 5.441 14.401 4.640 1.00 64.15 C ATOM 676 O ASP A 52 4.408 14.276 5.309 1.00 70.41 O ATOM 677 CB ASP A 52 7.680 13.994 5.550 1.00 4.42 C ATOM 678 CG ASP A 52 8.836 13.078 5.802 1.00 62.32 C ATOM 679 OD1 ASP A 52 9.762 13.038 4.967 1.00 11.12 O ATOM 680 OD2 ASP A 52 8.849 12.410 6.850 1.00 44.23 O ATOM 0 H ASP A 52 8.009 13.192 3.175 1.00 54.53 H new ATOM 0 HA ASP A 52 6.212 12.454 5.174 1.00 23.11 H new ATOM 0 HB2 ASP A 52 8.044 14.889 5.046 1.00 4.42 H new ATOM 0 HB3 ASP A 52 7.269 14.312 6.508 1.00 4.42 H new ATOM 685 N GLU A 53 5.648 15.389 3.804 1.00 54.51 N ATOM 686 CA GLU A 53 4.747 16.512 3.667 1.00 74.11 C ATOM 687 C GLU A 53 3.470 16.152 2.899 1.00 25.43 C ATOM 688 O GLU A 53 2.413 16.722 3.143 1.00 23.43 O ATOM 689 CB GLU A 53 5.471 17.688 3.028 1.00 21.23 C ATOM 690 CG GLU A 53 6.680 18.161 3.816 1.00 23.11 C ATOM 691 CD GLU A 53 6.339 18.530 5.240 1.00 71.23 C ATOM 692 OE1 GLU A 53 5.827 19.640 5.472 1.00 25.32 O ATOM 693 OE2 GLU A 53 6.571 17.703 6.141 1.00 63.13 O ATOM 0 H GLU A 53 6.460 15.438 3.189 1.00 54.51 H new ATOM 0 HA GLU A 53 4.425 16.801 4.668 1.00 74.11 H new ATOM 0 HB2 GLU A 53 5.790 17.405 2.025 1.00 21.23 H new ATOM 0 HB3 GLU A 53 4.772 18.517 2.918 1.00 21.23 H new ATOM 0 HG2 GLU A 53 7.436 17.376 3.819 1.00 23.11 H new ATOM 0 HG3 GLU A 53 7.119 19.024 3.316 1.00 23.11 H new ATOM 700 N ALA A 54 3.577 15.237 1.968 1.00 71.12 N ATOM 701 CA ALA A 54 2.446 14.758 1.225 1.00 63.50 C ATOM 702 C ALA A 54 1.589 13.866 2.114 1.00 21.12 C ATOM 703 O ALA A 54 0.360 13.999 2.171 1.00 13.24 O ATOM 704 CB ALA A 54 2.944 13.974 0.022 1.00 51.23 C ATOM 0 H ALA A 54 4.461 14.802 1.705 1.00 71.12 H new ATOM 0 HA ALA A 54 1.841 15.599 0.886 1.00 63.50 H new ATOM 0 HB1 ALA A 54 2.092 13.605 -0.550 1.00 51.23 H new ATOM 0 HB2 ALA A 54 3.551 14.623 -0.609 1.00 51.23 H new ATOM 0 HB3 ALA A 54 3.546 13.131 0.361 1.00 51.23 H new ATOM 710 N LEU A 55 2.253 12.989 2.839 1.00 24.44 N ATOM 711 CA LEU A 55 1.611 12.023 3.684 1.00 2.13 C ATOM 712 C LEU A 55 0.860 12.700 4.831 1.00 62.30 C ATOM 713 O LEU A 55 -0.242 12.280 5.190 1.00 34.52 O ATOM 714 CB LEU A 55 2.660 11.061 4.220 1.00 32.30 C ATOM 715 CG LEU A 55 2.173 9.915 5.071 1.00 22.13 C ATOM 716 CD1 LEU A 55 1.246 9.002 4.276 1.00 41.20 C ATOM 717 CD2 LEU A 55 3.347 9.142 5.624 1.00 0.32 C ATOM 0 H LEU A 55 3.271 12.933 2.852 1.00 24.44 H new ATOM 0 HA LEU A 55 0.875 11.472 3.099 1.00 2.13 H new ATOM 0 HB2 LEU A 55 3.202 10.645 3.371 1.00 32.30 H new ATOM 0 HB3 LEU A 55 3.378 11.636 4.806 1.00 32.30 H new ATOM 0 HG LEU A 55 1.602 10.322 5.906 1.00 22.13 H new ATOM 0 HD11 LEU A 55 0.908 8.183 4.912 1.00 41.20 H new ATOM 0 HD12 LEU A 55 0.384 9.572 3.929 1.00 41.20 H new ATOM 0 HD13 LEU A 55 1.782 8.597 3.418 1.00 41.20 H new ATOM 0 HD21 LEU A 55 2.983 8.317 6.237 1.00 0.32 H new ATOM 0 HD22 LEU A 55 3.943 8.747 4.801 1.00 0.32 H new ATOM 0 HD23 LEU A 55 3.963 9.803 6.234 1.00 0.32 H new ATOM 729 N ARG A 56 1.440 13.774 5.373 1.00 71.20 N ATOM 730 CA ARG A 56 0.832 14.495 6.500 1.00 64.22 C ATOM 731 C ARG A 56 -0.503 15.125 6.111 1.00 71.41 C ATOM 732 O ARG A 56 -1.344 15.355 6.957 1.00 1.12 O ATOM 733 CB ARG A 56 1.779 15.557 7.076 1.00 33.15 C ATOM 734 CG ARG A 56 2.111 16.679 6.124 1.00 11.44 C ATOM 735 CD ARG A 56 3.126 17.645 6.700 1.00 4.02 C ATOM 736 NE ARG A 56 2.648 18.343 7.894 1.00 13.15 N ATOM 737 CZ ARG A 56 3.361 19.265 8.552 1.00 33.40 C ATOM 738 NH1 ARG A 56 4.589 19.597 8.120 1.00 40.01 N ATOM 739 NH2 ARG A 56 2.849 19.865 9.623 1.00 40.33 N ATOM 0 H ARG A 56 2.326 14.164 5.053 1.00 71.20 H new ATOM 0 HA ARG A 56 0.644 13.756 7.279 1.00 64.22 H new ATOM 0 HB2 ARG A 56 1.328 15.980 7.973 1.00 33.15 H new ATOM 0 HB3 ARG A 56 2.705 15.072 7.383 1.00 33.15 H new ATOM 0 HG2 ARG A 56 2.498 16.261 5.195 1.00 11.44 H new ATOM 0 HG3 ARG A 56 1.199 17.221 5.874 1.00 11.44 H new ATOM 0 HD2 ARG A 56 4.037 17.100 6.947 1.00 4.02 H new ATOM 0 HD3 ARG A 56 3.390 18.380 5.939 1.00 4.02 H new ATOM 0 HE ARG A 56 1.718 18.114 8.245 1.00 13.15 H new ATOM 0 HH11 ARG A 56 4.977 19.147 7.291 1.00 40.01 H new ATOM 0 HH12 ARG A 56 5.133 20.300 8.621 1.00 40.01 H new ATOM 0 HH21 ARG A 56 1.912 19.623 9.944 1.00 40.33 H new ATOM 0 HH22 ARG A 56 3.394 20.567 10.123 1.00 40.33 H new ATOM 753 N GLU A 57 -0.673 15.429 4.837 1.00 51.20 N ATOM 754 CA GLU A 57 -1.947 15.944 4.344 1.00 63.41 C ATOM 755 C GLU A 57 -2.907 14.815 4.023 1.00 11.22 C ATOM 756 O GLU A 57 -4.089 14.883 4.339 1.00 20.24 O ATOM 757 CB GLU A 57 -1.784 16.818 3.098 1.00 13.52 C ATOM 758 CG GLU A 57 -1.072 18.133 3.313 1.00 21.10 C ATOM 759 CD GLU A 57 -1.035 18.961 2.046 1.00 34.34 C ATOM 760 OE1 GLU A 57 -2.111 19.198 1.459 1.00 60.14 O ATOM 761 OE2 GLU A 57 0.050 19.415 1.642 1.00 72.11 O ATOM 0 H GLU A 57 0.049 15.330 4.124 1.00 51.20 H new ATOM 0 HA GLU A 57 -2.351 16.559 5.148 1.00 63.41 H new ATOM 0 HB2 GLU A 57 -1.239 16.249 2.345 1.00 13.52 H new ATOM 0 HB3 GLU A 57 -2.773 17.023 2.688 1.00 13.52 H new ATOM 0 HG2 GLU A 57 -1.574 18.695 4.101 1.00 21.10 H new ATOM 0 HG3 GLU A 57 -0.054 17.945 3.655 1.00 21.10 H new ATOM 768 N ALA A 58 -2.392 13.773 3.412 1.00 74.10 N ATOM 769 CA ALA A 58 -3.217 12.676 2.936 1.00 5.33 C ATOM 770 C ALA A 58 -3.772 11.802 4.065 1.00 31.53 C ATOM 771 O ALA A 58 -4.899 11.310 3.957 1.00 35.15 O ATOM 772 CB ALA A 58 -2.468 11.853 1.910 1.00 44.00 C ATOM 0 H ALA A 58 -1.395 13.658 3.229 1.00 74.10 H new ATOM 0 HA ALA A 58 -4.087 13.122 2.455 1.00 5.33 H new ATOM 0 HB1 ALA A 58 -3.102 11.036 1.565 1.00 44.00 H new ATOM 0 HB2 ALA A 58 -2.198 12.485 1.064 1.00 44.00 H new ATOM 0 HB3 ALA A 58 -1.564 11.445 2.361 1.00 44.00 H new ATOM 778 N MET A 59 -3.000 11.608 5.137 1.00 24.12 N ATOM 779 CA MET A 59 -3.486 10.813 6.283 1.00 22.42 C ATOM 780 C MET A 59 -4.817 11.374 6.847 1.00 10.35 C ATOM 781 O MET A 59 -5.789 10.628 6.944 1.00 70.43 O ATOM 782 CB MET A 59 -2.426 10.622 7.401 1.00 2.03 C ATOM 783 CG MET A 59 -1.164 9.797 7.059 1.00 10.34 C ATOM 784 SD MET A 59 -1.404 7.984 6.840 1.00 71.32 S ATOM 785 CE MET A 59 -2.313 7.845 5.300 1.00 42.20 C ATOM 0 H MET A 59 -2.055 11.978 5.242 1.00 24.12 H new ATOM 0 HA MET A 59 -3.683 9.816 5.888 1.00 22.42 H new ATOM 0 HB2 MET A 59 -2.103 11.610 7.729 1.00 2.03 H new ATOM 0 HB3 MET A 59 -2.917 10.148 8.251 1.00 2.03 H new ATOM 0 HG2 MET A 59 -0.732 10.198 6.142 1.00 10.34 H new ATOM 0 HG3 MET A 59 -0.430 9.951 7.850 1.00 10.34 H new ATOM 0 HE1 MET A 59 -1.933 6.998 4.729 1.00 42.20 H new ATOM 0 HE2 MET A 59 -3.371 7.693 5.514 1.00 42.20 H new ATOM 0 HE3 MET A 59 -2.188 8.759 4.720 1.00 42.20 H new ATOM 795 N PRO A 60 -4.900 12.707 7.208 1.00 33.02 N ATOM 796 CA PRO A 60 -6.155 13.323 7.654 1.00 14.12 C ATOM 797 C PRO A 60 -7.277 13.154 6.627 1.00 64.44 C ATOM 798 O PRO A 60 -8.451 13.042 6.997 1.00 35.23 O ATOM 799 CB PRO A 60 -5.824 14.810 7.794 1.00 74.35 C ATOM 800 CG PRO A 60 -4.354 14.878 7.947 1.00 11.21 C ATOM 801 CD PRO A 60 -3.787 13.670 7.260 1.00 11.12 C ATOM 0 HA PRO A 60 -6.508 12.862 8.576 1.00 14.12 H new ATOM 0 HB2 PRO A 60 -6.153 15.369 6.918 1.00 74.35 H new ATOM 0 HB3 PRO A 60 -6.328 15.244 8.657 1.00 74.35 H new ATOM 0 HG2 PRO A 60 -3.962 15.794 7.504 1.00 11.21 H new ATOM 0 HG3 PRO A 60 -4.076 14.889 9.001 1.00 11.21 H new ATOM 0 HD2 PRO A 60 -3.430 13.915 6.260 1.00 11.12 H new ATOM 0 HD3 PRO A 60 -2.939 13.264 7.811 1.00 11.12 H new ATOM 809 N LYS A 61 -6.917 13.125 5.342 1.00 2.31 N ATOM 810 CA LYS A 61 -7.915 12.996 4.298 1.00 33.22 C ATOM 811 C LYS A 61 -8.488 11.587 4.242 1.00 11.14 C ATOM 812 O LYS A 61 -9.654 11.395 3.900 1.00 44.13 O ATOM 813 CB LYS A 61 -7.422 13.495 2.929 1.00 35.44 C ATOM 814 CG LYS A 61 -6.910 14.927 2.997 1.00 4.32 C ATOM 815 CD LYS A 61 -6.886 15.634 1.650 1.00 24.20 C ATOM 816 CE LYS A 61 -5.962 14.991 0.643 1.00 24.05 C ATOM 817 NZ LYS A 61 -5.998 15.741 -0.625 1.00 54.55 N ATOM 0 H LYS A 61 -5.954 13.189 5.010 1.00 2.31 H new ATOM 0 HA LYS A 61 -8.736 13.661 4.566 1.00 33.22 H new ATOM 0 HB2 LYS A 61 -6.627 12.842 2.570 1.00 35.44 H new ATOM 0 HB3 LYS A 61 -8.236 13.434 2.206 1.00 35.44 H new ATOM 0 HG2 LYS A 61 -7.537 15.495 3.684 1.00 4.32 H new ATOM 0 HG3 LYS A 61 -5.903 14.924 3.413 1.00 4.32 H new ATOM 0 HD2 LYS A 61 -7.897 15.654 1.242 1.00 24.20 H new ATOM 0 HD3 LYS A 61 -6.582 16.670 1.799 1.00 24.20 H new ATOM 0 HE2 LYS A 61 -4.944 14.969 1.033 1.00 24.05 H new ATOM 0 HE3 LYS A 61 -6.260 13.957 0.472 1.00 24.05 H new ATOM 0 HZ1 LYS A 61 -5.399 15.263 -1.328 1.00 54.55 H new ATOM 0 HZ2 LYS A 61 -6.976 15.784 -0.975 1.00 54.55 H new ATOM 0 HZ3 LYS A 61 -5.644 16.706 -0.468 1.00 54.55 H new ATOM 831 N ILE A 62 -7.685 10.604 4.592 1.00 64.22 N ATOM 832 CA ILE A 62 -8.208 9.262 4.734 1.00 72.43 C ATOM 833 C ILE A 62 -9.019 9.194 6.030 1.00 62.23 C ATOM 834 O ILE A 62 -10.134 8.667 6.050 1.00 30.03 O ATOM 835 CB ILE A 62 -7.094 8.154 4.722 1.00 32.21 C ATOM 836 CG1 ILE A 62 -6.380 8.077 3.350 1.00 24.24 C ATOM 837 CG2 ILE A 62 -7.660 6.787 5.108 1.00 3.14 C ATOM 838 CD1 ILE A 62 -7.312 7.808 2.172 1.00 74.22 C ATOM 0 H ILE A 62 -6.688 10.705 4.780 1.00 64.22 H new ATOM 0 HA ILE A 62 -8.838 9.055 3.869 1.00 72.43 H new ATOM 0 HB ILE A 62 -6.355 8.439 5.471 1.00 32.21 H new ATOM 0 HG12 ILE A 62 -5.853 9.015 3.175 1.00 24.24 H new ATOM 0 HG13 ILE A 62 -5.626 7.290 3.389 1.00 24.24 H new ATOM 0 HG21 ILE A 62 -6.862 6.044 5.089 1.00 3.14 H new ATOM 0 HG22 ILE A 62 -8.084 6.839 6.111 1.00 3.14 H new ATOM 0 HG23 ILE A 62 -8.438 6.502 4.399 1.00 3.14 H new ATOM 0 HD11 ILE A 62 -6.732 7.770 1.250 1.00 74.22 H new ATOM 0 HD12 ILE A 62 -7.821 6.855 2.321 1.00 74.22 H new ATOM 0 HD13 ILE A 62 -8.051 8.607 2.103 1.00 74.22 H new ATOM 850 N MET A 63 -8.464 9.792 7.098 1.00 71.13 N ATOM 851 CA MET A 63 -9.094 9.809 8.432 1.00 11.43 C ATOM 852 C MET A 63 -10.499 10.402 8.416 1.00 42.21 C ATOM 853 O MET A 63 -11.368 9.923 9.134 1.00 64.42 O ATOM 854 CB MET A 63 -8.243 10.561 9.466 1.00 62.24 C ATOM 855 CG MET A 63 -6.860 9.972 9.823 1.00 22.42 C ATOM 856 SD MET A 63 -6.885 8.323 10.609 1.00 74.01 S ATOM 857 CE MET A 63 -7.128 7.200 9.222 1.00 15.44 C ATOM 0 H MET A 63 -7.567 10.277 7.062 1.00 71.13 H new ATOM 0 HA MET A 63 -9.166 8.761 8.724 1.00 11.43 H new ATOM 0 HB2 MET A 63 -8.091 11.576 9.100 1.00 62.24 H new ATOM 0 HB3 MET A 63 -8.823 10.637 10.386 1.00 62.24 H new ATOM 0 HG2 MET A 63 -6.264 9.912 8.912 1.00 22.42 H new ATOM 0 HG3 MET A 63 -6.351 10.666 10.492 1.00 22.42 H new ATOM 0 HE1 MET A 63 -8.076 6.675 9.341 1.00 15.44 H new ATOM 0 HE2 MET A 63 -7.142 7.768 8.292 1.00 15.44 H new ATOM 0 HE3 MET A 63 -6.313 6.477 9.193 1.00 15.44 H new ATOM 867 N LYS A 64 -10.722 11.440 7.611 1.00 33.42 N ATOM 868 CA LYS A 64 -12.045 12.052 7.543 1.00 13.34 C ATOM 869 C LYS A 64 -13.062 11.080 6.935 1.00 30.11 C ATOM 870 O LYS A 64 -14.140 10.865 7.498 1.00 54.11 O ATOM 871 CB LYS A 64 -12.020 13.404 6.774 1.00 3.52 C ATOM 872 CG LYS A 64 -11.544 13.300 5.330 1.00 43.44 C ATOM 873 CD LYS A 64 -11.462 14.646 4.617 1.00 72.10 C ATOM 874 CE LYS A 64 -12.822 15.322 4.469 1.00 61.12 C ATOM 875 NZ LYS A 64 -12.712 16.597 3.722 1.00 15.34 N ATOM 0 H LYS A 64 -10.018 11.867 7.009 1.00 33.42 H new ATOM 0 HA LYS A 64 -12.358 12.275 8.563 1.00 13.34 H new ATOM 0 HB2 LYS A 64 -13.023 13.831 6.783 1.00 3.52 H new ATOM 0 HB3 LYS A 64 -11.372 14.099 7.308 1.00 3.52 H new ATOM 0 HG2 LYS A 64 -10.561 12.829 5.313 1.00 43.44 H new ATOM 0 HG3 LYS A 64 -12.221 12.647 4.779 1.00 43.44 H new ATOM 0 HD2 LYS A 64 -10.793 15.305 5.170 1.00 72.10 H new ATOM 0 HD3 LYS A 64 -11.024 14.502 3.629 1.00 72.10 H new ATOM 0 HE2 LYS A 64 -13.509 14.653 3.951 1.00 61.12 H new ATOM 0 HE3 LYS A 64 -13.245 15.511 5.455 1.00 61.12 H new ATOM 0 HZ1 LYS A 64 -13.500 17.223 3.985 1.00 15.34 H new ATOM 0 HZ2 LYS A 64 -11.810 17.059 3.955 1.00 15.34 H new ATOM 0 HZ3 LYS A 64 -12.749 16.405 2.701 1.00 15.34 H new ATOM 889 N TYR A 65 -12.689 10.466 5.820 1.00 41.44 N ATOM 890 CA TYR A 65 -13.548 9.537 5.115 1.00 63.13 C ATOM 891 C TYR A 65 -13.814 8.283 5.933 1.00 50.24 C ATOM 892 O TYR A 65 -14.958 7.995 6.264 1.00 31.24 O ATOM 893 CB TYR A 65 -12.968 9.204 3.720 1.00 74.52 C ATOM 894 CG TYR A 65 -13.652 8.042 3.015 1.00 31.21 C ATOM 895 CD1 TYR A 65 -14.996 8.096 2.651 1.00 1.43 C ATOM 896 CD2 TYR A 65 -12.946 6.879 2.747 1.00 64.15 C ATOM 897 CE1 TYR A 65 -15.611 7.018 2.034 1.00 42.34 C ATOM 898 CE2 TYR A 65 -13.544 5.804 2.137 1.00 3.55 C ATOM 899 CZ TYR A 65 -14.870 5.867 1.783 1.00 51.01 C ATOM 900 OH TYR A 65 -15.446 4.779 1.182 1.00 13.41 O ATOM 0 H TYR A 65 -11.778 10.602 5.381 1.00 41.44 H new ATOM 0 HA TYR A 65 -14.513 10.022 4.965 1.00 63.13 H new ATOM 0 HB2 TYR A 65 -13.041 10.090 3.089 1.00 74.52 H new ATOM 0 HB3 TYR A 65 -11.908 8.975 3.826 1.00 74.52 H new ATOM 0 HD1 TYR A 65 -15.567 8.991 2.853 1.00 1.43 H new ATOM 0 HD2 TYR A 65 -11.904 6.817 3.024 1.00 64.15 H new ATOM 0 HE1 TYR A 65 -16.652 7.071 1.752 1.00 42.34 H new ATOM 0 HE2 TYR A 65 -12.973 4.910 1.936 1.00 3.55 H new ATOM 0 HH TYR A 65 -16.045 5.079 0.467 1.00 13.41 H new ATOM 910 N VAL A 66 -12.757 7.583 6.308 1.00 60.31 N ATOM 911 CA VAL A 66 -12.887 6.330 7.021 1.00 43.32 C ATOM 912 C VAL A 66 -13.430 6.562 8.448 1.00 10.34 C ATOM 913 O VAL A 66 -13.921 5.643 9.102 1.00 64.34 O ATOM 914 CB VAL A 66 -11.524 5.583 7.078 1.00 34.24 C ATOM 915 CG1 VAL A 66 -10.514 6.281 7.976 1.00 5.31 C ATOM 916 CG2 VAL A 66 -11.702 4.156 7.471 1.00 54.34 C ATOM 0 H VAL A 66 -11.794 7.866 6.127 1.00 60.31 H new ATOM 0 HA VAL A 66 -13.600 5.709 6.478 1.00 43.32 H new ATOM 0 HB VAL A 66 -11.114 5.605 6.068 1.00 34.24 H new ATOM 0 HG11 VAL A 66 -9.581 5.718 7.980 1.00 5.31 H new ATOM 0 HG12 VAL A 66 -10.329 7.288 7.602 1.00 5.31 H new ATOM 0 HG13 VAL A 66 -10.908 6.338 8.991 1.00 5.31 H new ATOM 0 HG21 VAL A 66 -10.730 3.663 7.501 1.00 54.34 H new ATOM 0 HG22 VAL A 66 -12.166 4.105 8.456 1.00 54.34 H new ATOM 0 HG23 VAL A 66 -12.340 3.655 6.743 1.00 54.34 H new ATOM 926 N GLY A 67 -13.344 7.797 8.903 1.00 11.54 N ATOM 927 CA GLY A 67 -13.801 8.142 10.218 1.00 22.34 C ATOM 928 C GLY A 67 -15.295 8.364 10.280 1.00 25.13 C ATOM 929 O GLY A 67 -15.890 8.290 11.363 1.00 32.34 O ATOM 0 H GLY A 67 -12.958 8.577 8.371 1.00 11.54 H new ATOM 0 HA2 GLY A 67 -13.527 7.348 10.913 1.00 22.34 H new ATOM 0 HA3 GLY A 67 -13.290 9.046 10.550 1.00 22.34 H new ATOM 933 N GLY A 68 -15.916 8.618 9.140 1.00 34.22 N ATOM 934 CA GLY A 68 -17.335 8.855 9.154 1.00 51.04 C ATOM 935 C GLY A 68 -17.839 9.631 7.961 1.00 15.42 C ATOM 936 O GLY A 68 -19.018 9.530 7.618 1.00 50.32 O ATOM 0 H GLY A 68 -15.470 8.663 8.224 1.00 34.22 H new ATOM 0 HA2 GLY A 68 -17.853 7.897 9.196 1.00 51.04 H new ATOM 0 HA3 GLY A 68 -17.594 9.398 10.063 1.00 51.04 H new ATOM 940 N THR A 69 -16.964 10.380 7.304 1.00 24.32 N ATOM 941 CA THR A 69 -17.359 11.208 6.167 1.00 40.01 C ATOM 942 C THR A 69 -17.499 10.355 4.863 1.00 73.01 C ATOM 943 O THR A 69 -16.797 10.553 3.860 1.00 61.31 O ATOM 944 CB THR A 69 -16.357 12.383 5.990 1.00 60.23 C ATOM 945 OG1 THR A 69 -16.234 13.075 7.252 1.00 13.32 O ATOM 946 CG2 THR A 69 -16.824 13.382 4.934 1.00 60.15 C ATOM 0 H THR A 69 -15.973 10.433 7.538 1.00 24.32 H new ATOM 0 HA THR A 69 -18.343 11.632 6.369 1.00 40.01 H new ATOM 0 HB THR A 69 -15.404 11.967 5.664 1.00 60.23 H new ATOM 0 HG1 THR A 69 -15.530 12.654 7.788 1.00 13.32 H new ATOM 0 HG21 THR A 69 -16.093 14.185 4.845 1.00 60.15 H new ATOM 0 HG22 THR A 69 -16.926 12.876 3.974 1.00 60.15 H new ATOM 0 HG23 THR A 69 -17.787 13.799 5.228 1.00 60.15 H new ATOM 954 N ASN A 70 -18.361 9.367 4.942 1.00 10.10 N ATOM 955 CA ASN A 70 -18.692 8.493 3.829 1.00 74.35 C ATOM 956 C ASN A 70 -20.008 8.984 3.243 1.00 65.25 C ATOM 957 O ASN A 70 -20.757 9.662 3.938 1.00 52.24 O ATOM 958 CB ASN A 70 -18.861 7.046 4.311 1.00 64.14 C ATOM 959 CG ASN A 70 -17.656 6.483 5.056 1.00 21.30 C ATOM 960 OD1 ASN A 70 -16.779 5.904 4.471 1.00 65.14 O ATOM 961 ND2 ASN A 70 -17.635 6.624 6.364 1.00 30.42 N ATOM 0 H ASN A 70 -18.865 9.140 5.799 1.00 10.10 H new ATOM 0 HA ASN A 70 -17.894 8.513 3.087 1.00 74.35 H new ATOM 0 HB2 ASN A 70 -19.733 6.993 4.963 1.00 64.14 H new ATOM 0 HB3 ASN A 70 -19.069 6.411 3.449 1.00 64.14 H new ATOM 0 HD21 ASN A 70 -16.862 6.238 6.906 1.00 30.42 H new ATOM 0 HD22 ASN A 70 -18.391 7.120 6.836 1.00 30.42 H new ATOM 968 N ASP A 71 -20.327 8.623 2.002 1.00 70.21 N ATOM 969 CA ASP A 71 -21.589 9.104 1.369 1.00 54.11 C ATOM 970 C ASP A 71 -22.801 8.461 2.047 1.00 13.02 C ATOM 971 O ASP A 71 -23.853 9.071 2.181 1.00 53.50 O ATOM 972 CB ASP A 71 -21.643 8.742 -0.129 1.00 13.24 C ATOM 973 CG ASP A 71 -22.049 7.289 -0.378 1.00 25.33 C ATOM 974 OD1 ASP A 71 -21.348 6.372 0.085 1.00 34.42 O ATOM 975 OD2 ASP A 71 -23.078 7.051 -1.030 1.00 50.41 O ATOM 0 H ASP A 71 -19.757 8.015 1.414 1.00 70.21 H new ATOM 0 HA ASP A 71 -21.610 10.188 1.484 1.00 54.11 H new ATOM 0 HB2 ASP A 71 -22.350 9.402 -0.631 1.00 13.24 H new ATOM 0 HB3 ASP A 71 -20.665 8.922 -0.576 1.00 13.24 H new ATOM 980 N LYS A 72 -22.622 7.224 2.483 1.00 50.22 N ATOM 981 CA LYS A 72 -23.686 6.443 3.082 1.00 73.52 C ATOM 982 C LYS A 72 -23.876 6.839 4.544 1.00 1.33 C ATOM 983 O LYS A 72 -24.850 6.455 5.192 1.00 42.40 O ATOM 984 CB LYS A 72 -23.364 4.934 2.932 1.00 64.01 C ATOM 985 CG LYS A 72 -24.456 3.988 3.429 1.00 42.11 C ATOM 986 CD LYS A 72 -24.093 2.510 3.249 1.00 50.10 C ATOM 987 CE LYS A 72 -23.904 2.132 1.783 1.00 23.54 C ATOM 988 NZ LYS A 72 -23.613 0.690 1.616 1.00 43.54 N ATOM 0 H LYS A 72 -21.729 6.734 2.430 1.00 50.22 H new ATOM 0 HA LYS A 72 -24.626 6.644 2.567 1.00 73.52 H new ATOM 0 HB2 LYS A 72 -23.172 4.722 1.880 1.00 64.01 H new ATOM 0 HB3 LYS A 72 -22.443 4.719 3.474 1.00 64.01 H new ATOM 0 HG2 LYS A 72 -24.647 4.184 4.484 1.00 42.11 H new ATOM 0 HG3 LYS A 72 -25.382 4.197 2.893 1.00 42.11 H new ATOM 0 HD2 LYS A 72 -23.176 2.294 3.798 1.00 50.10 H new ATOM 0 HD3 LYS A 72 -24.878 1.890 3.683 1.00 50.10 H new ATOM 0 HE2 LYS A 72 -24.804 2.388 1.224 1.00 23.54 H new ATOM 0 HE3 LYS A 72 -23.088 2.718 1.360 1.00 23.54 H new ATOM 0 HZ1 LYS A 72 -23.091 0.542 0.729 1.00 43.54 H new ATOM 0 HZ2 LYS A 72 -23.038 0.357 2.416 1.00 43.54 H new ATOM 0 HZ3 LYS A 72 -24.506 0.157 1.586 1.00 43.54 H new ATOM 1002 N GLY A 73 -22.954 7.634 5.043 1.00 54.44 N ATOM 1003 CA GLY A 73 -23.022 8.073 6.405 1.00 60.31 C ATOM 1004 C GLY A 73 -22.704 6.976 7.386 1.00 30.33 C ATOM 1005 O GLY A 73 -23.266 6.935 8.474 1.00 1.32 O ATOM 0 H GLY A 73 -22.152 7.985 4.520 1.00 54.44 H new ATOM 0 HA2 GLY A 73 -22.326 8.899 6.551 1.00 60.31 H new ATOM 0 HA3 GLY A 73 -24.021 8.459 6.609 1.00 60.31 H new ATOM 1009 N VAL A 74 -21.822 6.068 7.006 1.00 73.31 N ATOM 1010 CA VAL A 74 -21.410 5.030 7.925 1.00 71.45 C ATOM 1011 C VAL A 74 -20.325 5.592 8.812 1.00 34.14 C ATOM 1012 O VAL A 74 -19.682 6.599 8.448 1.00 51.43 O ATOM 1013 CB VAL A 74 -20.909 3.727 7.225 1.00 3.24 C ATOM 1014 CG1 VAL A 74 -21.967 3.164 6.297 1.00 63.10 C ATOM 1015 CG2 VAL A 74 -19.596 3.943 6.495 1.00 3.13 C ATOM 0 H VAL A 74 -21.386 6.030 6.085 1.00 73.31 H new ATOM 0 HA VAL A 74 -22.286 4.733 8.501 1.00 71.45 H new ATOM 0 HB VAL A 74 -20.722 2.992 8.008 1.00 3.24 H new ATOM 0 HG11 VAL A 74 -21.590 2.257 5.824 1.00 63.10 H new ATOM 0 HG12 VAL A 74 -22.865 2.929 6.869 1.00 63.10 H new ATOM 0 HG13 VAL A 74 -22.208 3.900 5.530 1.00 63.10 H new ATOM 0 HG21 VAL A 74 -19.285 3.011 6.023 1.00 3.13 H new ATOM 0 HG22 VAL A 74 -19.726 4.711 5.732 1.00 3.13 H new ATOM 0 HG23 VAL A 74 -18.833 4.263 7.205 1.00 3.13 H new ATOM 1025 N GLY A 75 -20.113 4.993 9.936 1.00 44.25 N ATOM 1026 CA GLY A 75 -19.145 5.528 10.834 1.00 44.12 C ATOM 1027 C GLY A 75 -18.328 4.490 11.523 1.00 12.14 C ATOM 1028 O GLY A 75 -18.410 3.298 11.196 1.00 62.45 O ATOM 0 H GLY A 75 -20.588 4.147 10.251 1.00 44.25 H new ATOM 0 HA2 GLY A 75 -18.481 6.194 10.283 1.00 44.12 H new ATOM 0 HA3 GLY A 75 -19.654 6.134 11.584 1.00 44.12 H new ATOM 1032 N MET A 76 -17.563 4.959 12.492 1.00 72.24 N ATOM 1033 CA MET A 76 -16.631 4.166 13.295 1.00 44.41 C ATOM 1034 C MET A 76 -15.446 3.741 12.462 1.00 65.22 C ATOM 1035 O MET A 76 -15.534 2.815 11.649 1.00 24.12 O ATOM 1036 CB MET A 76 -17.303 2.978 14.018 1.00 52.13 C ATOM 1037 CG MET A 76 -18.418 3.399 14.973 1.00 62.13 C ATOM 1038 SD MET A 76 -19.177 2.016 15.861 1.00 51.24 S ATOM 1039 CE MET A 76 -17.791 1.432 16.847 1.00 21.21 C ATOM 0 H MET A 76 -17.570 5.944 12.757 1.00 72.24 H new ATOM 0 HA MET A 76 -16.268 4.810 14.096 1.00 44.41 H new ATOM 0 HB2 MET A 76 -17.711 2.294 13.274 1.00 52.13 H new ATOM 0 HB3 MET A 76 -16.546 2.427 14.576 1.00 52.13 H new ATOM 0 HG2 MET A 76 -18.016 4.107 15.697 1.00 62.13 H new ATOM 0 HG3 MET A 76 -19.189 3.924 14.409 1.00 62.13 H new ATOM 0 HE1 MET A 76 -18.158 0.784 17.643 1.00 21.21 H new ATOM 0 HE2 MET A 76 -17.103 0.874 16.212 1.00 21.21 H new ATOM 0 HE3 MET A 76 -17.271 2.284 17.284 1.00 21.21 H new ATOM 1049 N GLY A 77 -14.346 4.447 12.661 1.00 1.10 N ATOM 1050 CA GLY A 77 -13.141 4.266 11.883 1.00 1.51 C ATOM 1051 C GLY A 77 -12.624 2.851 11.857 1.00 33.44 C ATOM 1052 O GLY A 77 -12.337 2.258 12.900 1.00 4.13 O ATOM 0 H GLY A 77 -14.268 5.169 13.377 1.00 1.10 H new ATOM 0 HA2 GLY A 77 -13.332 4.589 10.860 1.00 1.51 H new ATOM 0 HA3 GLY A 77 -12.363 4.917 12.283 1.00 1.51 H new ATOM 1056 N MET A 78 -12.508 2.320 10.673 1.00 43.40 N ATOM 1057 CA MET A 78 -11.980 0.991 10.459 1.00 41.51 C ATOM 1058 C MET A 78 -10.504 1.104 10.117 1.00 33.22 C ATOM 1059 O MET A 78 -10.120 1.877 9.245 1.00 72.31 O ATOM 1060 CB MET A 78 -12.785 0.256 9.346 1.00 3.40 C ATOM 1061 CG MET A 78 -12.840 0.982 7.997 1.00 12.31 C ATOM 1062 SD MET A 78 -13.875 0.147 6.773 1.00 40.51 S ATOM 1063 CE MET A 78 -13.747 1.262 5.363 1.00 12.52 C ATOM 0 H MET A 78 -12.779 2.799 9.814 1.00 43.40 H new ATOM 0 HA MET A 78 -12.083 0.394 11.365 1.00 41.51 H new ATOM 0 HB2 MET A 78 -12.346 -0.730 9.193 1.00 3.40 H new ATOM 0 HB3 MET A 78 -13.804 0.100 9.699 1.00 3.40 H new ATOM 0 HG2 MET A 78 -13.218 1.993 8.152 1.00 12.31 H new ATOM 0 HG3 MET A 78 -11.828 1.077 7.602 1.00 12.31 H new ATOM 0 HE1 MET A 78 -14.337 0.870 4.535 1.00 12.52 H new ATOM 0 HE2 MET A 78 -14.122 2.246 5.642 1.00 12.52 H new ATOM 0 HE3 MET A 78 -12.704 1.345 5.058 1.00 12.52 H new ATOM 1073 N THR A 79 -9.681 0.391 10.834 1.00 20.42 N ATOM 1074 CA THR A 79 -8.265 0.479 10.648 1.00 4.34 C ATOM 1075 C THR A 79 -7.647 -0.882 10.344 1.00 53.22 C ATOM 1076 O THR A 79 -7.816 -1.851 11.097 1.00 72.34 O ATOM 1077 CB THR A 79 -7.578 1.092 11.892 1.00 11.42 C ATOM 1078 OG1 THR A 79 -8.172 2.372 12.178 1.00 60.41 O ATOM 1079 CG2 THR A 79 -6.082 1.282 11.649 1.00 53.12 C ATOM 0 H THR A 79 -9.974 -0.264 11.560 1.00 20.42 H new ATOM 0 HA THR A 79 -8.101 1.131 9.790 1.00 4.34 H new ATOM 0 HB THR A 79 -7.713 0.412 12.733 1.00 11.42 H new ATOM 0 HG1 THR A 79 -7.741 2.764 12.966 1.00 60.41 H new ATOM 0 HG21 THR A 79 -5.621 1.714 12.537 1.00 53.12 H new ATOM 0 HG22 THR A 79 -5.623 0.317 11.435 1.00 53.12 H new ATOM 0 HG23 THR A 79 -5.933 1.951 10.801 1.00 53.12 H new ATOM 1087 N VAL A 80 -6.970 -0.926 9.239 1.00 21.32 N ATOM 1088 CA VAL A 80 -6.197 -2.047 8.760 1.00 25.54 C ATOM 1089 C VAL A 80 -4.952 -1.408 8.143 1.00 42.01 C ATOM 1090 O VAL A 80 -4.878 -0.171 8.141 1.00 61.24 O ATOM 1091 CB VAL A 80 -6.983 -2.888 7.690 1.00 33.05 C ATOM 1092 CG1 VAL A 80 -8.198 -3.571 8.300 1.00 24.31 C ATOM 1093 CG2 VAL A 80 -7.408 -2.014 6.531 1.00 70.01 C ATOM 0 H VAL A 80 -6.936 -0.131 8.600 1.00 21.32 H new ATOM 0 HA VAL A 80 -5.961 -2.748 9.560 1.00 25.54 H new ATOM 0 HB VAL A 80 -6.308 -3.661 7.323 1.00 33.05 H new ATOM 0 HG11 VAL A 80 -8.718 -4.144 7.532 1.00 24.31 H new ATOM 0 HG12 VAL A 80 -7.877 -4.241 9.097 1.00 24.31 H new ATOM 0 HG13 VAL A 80 -8.872 -2.818 8.709 1.00 24.31 H new ATOM 0 HG21 VAL A 80 -7.951 -2.615 5.802 1.00 70.01 H new ATOM 0 HG22 VAL A 80 -8.054 -1.215 6.895 1.00 70.01 H new ATOM 0 HG23 VAL A 80 -6.526 -1.580 6.060 1.00 70.01 H new ATOM 1103 N PRO A 81 -3.948 -2.160 7.640 1.00 4.41 N ATOM 1104 CA PRO A 81 -2.773 -1.528 7.060 1.00 23.22 C ATOM 1105 C PRO A 81 -3.115 -0.683 5.835 1.00 5.21 C ATOM 1106 O PRO A 81 -3.922 -1.080 4.981 1.00 24.03 O ATOM 1107 CB PRO A 81 -1.868 -2.702 6.668 1.00 23.41 C ATOM 1108 CG PRO A 81 -2.385 -3.865 7.432 1.00 14.55 C ATOM 1109 CD PRO A 81 -3.857 -3.628 7.603 1.00 33.52 C ATOM 0 HA PRO A 81 -2.303 -0.839 7.762 1.00 23.22 H new ATOM 0 HB2 PRO A 81 -1.907 -2.888 5.595 1.00 23.41 H new ATOM 0 HB3 PRO A 81 -0.827 -2.497 6.919 1.00 23.41 H new ATOM 0 HG2 PRO A 81 -2.200 -4.796 6.897 1.00 14.55 H new ATOM 0 HG3 PRO A 81 -1.889 -3.948 8.399 1.00 14.55 H new ATOM 0 HD2 PRO A 81 -4.433 -4.048 6.779 1.00 33.52 H new ATOM 0 HD3 PRO A 81 -4.236 -4.080 8.520 1.00 33.52 H new ATOM 1117 N VAL A 82 -2.488 0.451 5.755 1.00 54.22 N ATOM 1118 CA VAL A 82 -2.670 1.371 4.674 1.00 31.34 C ATOM 1119 C VAL A 82 -1.390 1.382 3.852 1.00 25.03 C ATOM 1120 O VAL A 82 -0.301 1.150 4.396 1.00 14.01 O ATOM 1121 CB VAL A 82 -3.021 2.812 5.211 1.00 35.51 C ATOM 1122 CG1 VAL A 82 -1.926 3.377 6.101 1.00 31.14 C ATOM 1123 CG2 VAL A 82 -3.342 3.778 4.081 1.00 3.24 C ATOM 0 H VAL A 82 -1.820 0.770 6.456 1.00 54.22 H new ATOM 0 HA VAL A 82 -3.508 1.059 4.050 1.00 31.34 H new ATOM 0 HB VAL A 82 -3.917 2.698 5.821 1.00 35.51 H new ATOM 0 HG11 VAL A 82 -2.214 4.370 6.446 1.00 31.14 H new ATOM 0 HG12 VAL A 82 -1.782 2.722 6.960 1.00 31.14 H new ATOM 0 HG13 VAL A 82 -0.996 3.444 5.536 1.00 31.14 H new ATOM 0 HG21 VAL A 82 -3.578 4.758 4.496 1.00 3.24 H new ATOM 0 HG22 VAL A 82 -2.480 3.862 3.419 1.00 3.24 H new ATOM 0 HG23 VAL A 82 -4.198 3.407 3.517 1.00 3.24 H new ATOM 1133 N SER A 83 -1.505 1.610 2.579 1.00 53.22 N ATOM 1134 CA SER A 83 -0.363 1.590 1.717 1.00 33.33 C ATOM 1135 C SER A 83 -0.261 2.882 0.936 1.00 62.52 C ATOM 1136 O SER A 83 -1.257 3.473 0.597 1.00 33.02 O ATOM 1137 CB SER A 83 -0.477 0.390 0.771 1.00 4.42 C ATOM 1138 OG SER A 83 -1.722 0.411 0.074 1.00 23.02 O ATOM 0 H SER A 83 -2.388 1.814 2.111 1.00 53.22 H new ATOM 0 HA SER A 83 0.543 1.495 2.315 1.00 33.33 H new ATOM 0 HB2 SER A 83 0.346 0.405 0.056 1.00 4.42 H new ATOM 0 HB3 SER A 83 -0.388 -0.536 1.339 1.00 4.42 H new ATOM 0 HG SER A 83 -1.774 -0.362 -0.526 1.00 23.02 H new ATOM 1144 N PHE A 84 0.918 3.330 0.681 1.00 14.42 N ATOM 1145 CA PHE A 84 1.096 4.499 -0.136 1.00 22.11 C ATOM 1146 C PHE A 84 2.264 4.323 -1.064 1.00 63.42 C ATOM 1147 O PHE A 84 3.226 3.631 -0.725 1.00 3.33 O ATOM 1148 CB PHE A 84 1.169 5.804 0.700 1.00 51.32 C ATOM 1149 CG PHE A 84 2.256 5.882 1.739 1.00 30.44 C ATOM 1150 CD1 PHE A 84 2.053 5.374 3.015 1.00 53.42 C ATOM 1151 CD2 PHE A 84 3.464 6.482 1.450 1.00 71.41 C ATOM 1152 CE1 PHE A 84 3.042 5.462 3.974 1.00 35.14 C ATOM 1153 CE2 PHE A 84 4.454 6.577 2.406 1.00 61.04 C ATOM 1154 CZ PHE A 84 4.246 6.069 3.665 1.00 63.53 C ATOM 0 H PHE A 84 1.782 2.910 1.023 1.00 14.42 H new ATOM 0 HA PHE A 84 0.207 4.612 -0.757 1.00 22.11 H new ATOM 0 HB2 PHE A 84 1.294 6.641 0.013 1.00 51.32 H new ATOM 0 HB3 PHE A 84 0.210 5.942 1.200 1.00 51.32 H new ATOM 0 HD1 PHE A 84 1.111 4.905 3.260 1.00 53.42 H new ATOM 0 HD2 PHE A 84 3.637 6.883 0.462 1.00 71.41 H new ATOM 0 HE1 PHE A 84 2.876 5.058 4.962 1.00 35.14 H new ATOM 0 HE2 PHE A 84 5.394 7.051 2.164 1.00 61.04 H new ATOM 0 HZ PHE A 84 5.022 6.143 4.413 1.00 63.53 H new ATOM 1164 N ALA A 85 2.176 4.923 -2.222 1.00 54.04 N ATOM 1165 CA ALA A 85 3.188 4.778 -3.239 1.00 55.32 C ATOM 1166 C ALA A 85 4.207 5.869 -3.108 1.00 23.22 C ATOM 1167 O ALA A 85 3.859 7.048 -2.924 1.00 73.12 O ATOM 1168 CB ALA A 85 2.555 4.813 -4.625 1.00 21.40 C ATOM 0 H ALA A 85 1.399 5.528 -2.489 1.00 54.04 H new ATOM 0 HA ALA A 85 3.682 3.815 -3.107 1.00 55.32 H new ATOM 0 HB1 ALA A 85 3.331 4.702 -5.382 1.00 21.40 H new ATOM 0 HB2 ALA A 85 1.838 3.997 -4.718 1.00 21.40 H new ATOM 0 HB3 ALA A 85 2.042 5.764 -4.767 1.00 21.40 H new ATOM 1174 N VAL A 86 5.451 5.478 -3.206 1.00 44.41 N ATOM 1175 CA VAL A 86 6.578 6.363 -3.042 1.00 61.30 C ATOM 1176 C VAL A 86 7.595 6.100 -4.138 1.00 62.30 C ATOM 1177 O VAL A 86 7.700 4.973 -4.646 1.00 73.23 O ATOM 1178 CB VAL A 86 7.252 6.149 -1.656 1.00 10.34 C ATOM 1179 CG1 VAL A 86 6.351 6.602 -0.534 1.00 25.25 C ATOM 1180 CG2 VAL A 86 7.552 4.691 -1.462 1.00 23.42 C ATOM 0 H VAL A 86 5.716 4.514 -3.407 1.00 44.41 H new ATOM 0 HA VAL A 86 6.220 7.391 -3.103 1.00 61.30 H new ATOM 0 HB VAL A 86 8.169 6.738 -1.636 1.00 10.34 H new ATOM 0 HG11 VAL A 86 6.850 6.440 0.421 1.00 25.25 H new ATOM 0 HG12 VAL A 86 6.129 7.663 -0.652 1.00 25.25 H new ATOM 0 HG13 VAL A 86 5.423 6.032 -0.560 1.00 25.25 H new ATOM 0 HG21 VAL A 86 8.024 4.543 -0.491 1.00 23.42 H new ATOM 0 HG22 VAL A 86 6.625 4.120 -1.506 1.00 23.42 H new ATOM 0 HG23 VAL A 86 8.225 4.350 -2.248 1.00 23.42 H new ATOM 1190 N PHE A 87 8.337 7.111 -4.502 1.00 43.35 N ATOM 1191 CA PHE A 87 9.300 6.990 -5.573 1.00 1.51 C ATOM 1192 C PHE A 87 10.699 7.242 -5.051 1.00 61.23 C ATOM 1193 O PHE A 87 11.018 8.363 -4.646 1.00 11.10 O ATOM 1194 CB PHE A 87 8.983 7.997 -6.692 1.00 2.53 C ATOM 1195 CG PHE A 87 7.614 7.841 -7.289 1.00 62.54 C ATOM 1196 CD1 PHE A 87 6.517 8.433 -6.688 1.00 75.43 C ATOM 1197 CD2 PHE A 87 7.423 7.100 -8.440 1.00 44.44 C ATOM 1198 CE1 PHE A 87 5.264 8.295 -7.215 1.00 74.41 C ATOM 1199 CE2 PHE A 87 6.161 6.954 -8.981 1.00 3.41 C ATOM 1200 CZ PHE A 87 5.080 7.552 -8.367 1.00 41.35 C ATOM 0 H PHE A 87 8.295 8.035 -4.072 1.00 43.35 H new ATOM 0 HA PHE A 87 9.242 5.978 -5.974 1.00 1.51 H new ATOM 0 HB2 PHE A 87 9.081 9.007 -6.295 1.00 2.53 H new ATOM 0 HB3 PHE A 87 9.726 7.891 -7.482 1.00 2.53 H new ATOM 0 HD1 PHE A 87 6.654 9.014 -5.788 1.00 75.43 H new ATOM 0 HD2 PHE A 87 8.269 6.631 -8.921 1.00 44.44 H new ATOM 0 HE1 PHE A 87 4.419 8.765 -6.733 1.00 74.41 H new ATOM 0 HE2 PHE A 87 6.021 6.374 -9.881 1.00 3.41 H new ATOM 0 HZ PHE A 87 4.091 7.440 -8.786 1.00 41.35 H new ATOM 1210 N PRO A 88 11.544 6.213 -4.989 1.00 22.00 N ATOM 1211 CA PRO A 88 12.923 6.393 -4.613 1.00 34.45 C ATOM 1212 C PRO A 88 13.762 6.864 -5.809 1.00 51.41 C ATOM 1213 O PRO A 88 13.592 6.381 -6.938 1.00 34.42 O ATOM 1214 CB PRO A 88 13.356 4.997 -4.163 1.00 54.34 C ATOM 1215 CG PRO A 88 12.513 4.062 -4.960 1.00 40.13 C ATOM 1216 CD PRO A 88 11.218 4.782 -5.253 1.00 64.33 C ATOM 0 HA PRO A 88 13.055 7.150 -3.840 1.00 34.45 H new ATOM 0 HB2 PRO A 88 14.417 4.832 -4.352 1.00 54.34 H new ATOM 0 HB3 PRO A 88 13.197 4.859 -3.093 1.00 54.34 H new ATOM 0 HG2 PRO A 88 13.017 3.781 -5.885 1.00 40.13 H new ATOM 0 HG3 PRO A 88 12.327 3.142 -4.406 1.00 40.13 H new ATOM 0 HD2 PRO A 88 10.898 4.627 -6.283 1.00 64.33 H new ATOM 0 HD3 PRO A 88 10.410 4.430 -4.612 1.00 64.33 H new ATOM 1224 N ASN A 89 14.628 7.816 -5.576 1.00 65.31 N ATOM 1225 CA ASN A 89 15.529 8.300 -6.604 1.00 44.40 C ATOM 1226 C ASN A 89 16.725 7.373 -6.679 1.00 1.04 C ATOM 1227 O ASN A 89 16.810 6.408 -5.904 1.00 63.41 O ATOM 1228 CB ASN A 89 16.007 9.745 -6.333 1.00 75.25 C ATOM 1229 CG ASN A 89 14.891 10.783 -6.319 1.00 32.25 C ATOM 1230 OD1 ASN A 89 14.516 11.319 -7.348 1.00 24.24 O ATOM 1231 ND2 ASN A 89 14.392 11.099 -5.158 1.00 73.33 N ATOM 0 H ASN A 89 14.733 8.280 -4.674 1.00 65.31 H new ATOM 0 HA ASN A 89 14.988 8.312 -7.550 1.00 44.40 H new ATOM 0 HB2 ASN A 89 16.523 9.770 -5.373 1.00 75.25 H new ATOM 0 HB3 ASN A 89 16.736 10.023 -7.094 1.00 75.25 H new ATOM 0 HD21 ASN A 89 13.667 11.813 -5.092 1.00 73.33 H new ATOM 0 HD22 ASN A 89 14.727 10.632 -4.315 1.00 73.33 H new ATOM 1238 N GLU A 90 17.652 7.656 -7.581 1.00 33.23 N ATOM 1239 CA GLU A 90 18.863 6.827 -7.760 1.00 2.03 C ATOM 1240 C GLU A 90 19.661 6.801 -6.475 1.00 64.35 C ATOM 1241 O GLU A 90 20.239 5.783 -6.091 1.00 14.32 O ATOM 1242 CB GLU A 90 19.740 7.488 -8.790 1.00 72.44 C ATOM 1243 CG GLU A 90 19.084 7.738 -10.110 1.00 5.15 C ATOM 1244 CD GLU A 90 18.766 6.478 -10.874 1.00 14.22 C ATOM 1245 OE1 GLU A 90 19.631 5.992 -11.621 1.00 72.12 O ATOM 1246 OE2 GLU A 90 17.640 5.956 -10.753 1.00 43.43 O ATOM 0 H GLU A 90 17.600 8.457 -8.211 1.00 33.23 H new ATOM 0 HA GLU A 90 18.565 5.820 -8.053 1.00 2.03 H new ATOM 0 HB2 GLU A 90 20.092 8.439 -8.390 1.00 72.44 H new ATOM 0 HB3 GLU A 90 20.620 6.865 -8.950 1.00 72.44 H new ATOM 0 HG2 GLU A 90 18.162 8.297 -9.948 1.00 5.15 H new ATOM 0 HG3 GLU A 90 19.736 8.366 -10.717 1.00 5.15 H new ATOM 1253 N ASP A 91 19.650 7.932 -5.810 1.00 71.41 N ATOM 1254 CA ASP A 91 20.374 8.115 -4.538 1.00 24.21 C ATOM 1255 C ASP A 91 19.645 7.502 -3.352 1.00 22.31 C ATOM 1256 O ASP A 91 20.162 7.490 -2.240 1.00 41.30 O ATOM 1257 CB ASP A 91 20.650 9.598 -4.263 1.00 34.41 C ATOM 1258 CG ASP A 91 21.523 10.232 -5.313 1.00 44.52 C ATOM 1259 OD1 ASP A 91 22.752 10.059 -5.262 1.00 62.23 O ATOM 1260 OD2 ASP A 91 20.990 10.905 -6.220 1.00 41.22 O ATOM 0 H ASP A 91 19.144 8.761 -6.121 1.00 71.41 H new ATOM 0 HA ASP A 91 21.321 7.588 -4.654 1.00 24.21 H new ATOM 0 HB2 ASP A 91 19.703 10.136 -4.211 1.00 34.41 H new ATOM 0 HB3 ASP A 91 21.129 9.700 -3.289 1.00 34.41 H new ATOM 1265 N GLY A 92 18.450 7.003 -3.580 1.00 41.23 N ATOM 1266 CA GLY A 92 17.689 6.399 -2.502 1.00 65.45 C ATOM 1267 C GLY A 92 16.825 7.389 -1.777 1.00 63.41 C ATOM 1268 O GLY A 92 16.069 7.025 -0.890 1.00 75.33 O ATOM 0 H GLY A 92 17.987 7.001 -4.489 1.00 41.23 H new ATOM 0 HA2 GLY A 92 17.063 5.604 -2.906 1.00 65.45 H new ATOM 0 HA3 GLY A 92 18.376 5.935 -1.794 1.00 65.45 H new ATOM 1272 N SER A 93 16.932 8.624 -2.143 1.00 44.40 N ATOM 1273 CA SER A 93 16.130 9.647 -1.560 1.00 62.14 C ATOM 1274 C SER A 93 14.713 9.539 -2.108 1.00 14.43 C ATOM 1275 O SER A 93 14.520 9.113 -3.243 1.00 5.22 O ATOM 1276 CB SER A 93 16.751 10.989 -1.898 1.00 72.41 C ATOM 1277 OG SER A 93 16.990 11.076 -3.300 1.00 33.52 O ATOM 0 H SER A 93 17.581 8.953 -2.858 1.00 44.40 H new ATOM 0 HA SER A 93 16.084 9.542 -0.476 1.00 62.14 H new ATOM 0 HB2 SER A 93 16.089 11.795 -1.583 1.00 72.41 H new ATOM 0 HB3 SER A 93 17.687 11.114 -1.353 1.00 72.41 H new ATOM 0 HG SER A 93 17.389 11.946 -3.510 1.00 33.52 H new ATOM 1283 N LEU A 94 13.745 9.864 -1.318 1.00 30.41 N ATOM 1284 CA LEU A 94 12.373 9.831 -1.773 1.00 54.23 C ATOM 1285 C LEU A 94 12.022 11.102 -2.527 1.00 73.52 C ATOM 1286 O LEU A 94 12.334 12.214 -2.086 1.00 20.40 O ATOM 1287 CB LEU A 94 11.410 9.577 -0.614 1.00 24.03 C ATOM 1288 CG LEU A 94 11.573 8.227 0.096 1.00 44.24 C ATOM 1289 CD1 LEU A 94 10.598 8.097 1.252 1.00 23.23 C ATOM 1290 CD2 LEU A 94 11.380 7.085 -0.888 1.00 61.10 C ATOM 0 H LEU A 94 13.867 10.158 -0.349 1.00 30.41 H new ATOM 0 HA LEU A 94 12.268 8.997 -2.467 1.00 54.23 H new ATOM 0 HB2 LEU A 94 11.536 10.372 0.121 1.00 24.03 H new ATOM 0 HB3 LEU A 94 10.389 9.649 -0.990 1.00 24.03 H new ATOM 0 HG LEU A 94 12.585 8.177 0.499 1.00 44.24 H new ATOM 0 HD11 LEU A 94 10.736 7.131 1.737 1.00 23.23 H new ATOM 0 HD12 LEU A 94 10.780 8.894 1.973 1.00 23.23 H new ATOM 0 HD13 LEU A 94 9.577 8.173 0.877 1.00 23.23 H new ATOM 0 HD21 LEU A 94 11.499 6.134 -0.369 1.00 61.10 H new ATOM 0 HD22 LEU A 94 10.380 7.141 -1.319 1.00 61.10 H new ATOM 0 HD23 LEU A 94 12.122 7.160 -1.683 1.00 61.10 H new ATOM 1302 N GLN A 95 11.404 10.927 -3.672 1.00 33.41 N ATOM 1303 CA GLN A 95 11.023 12.028 -4.515 1.00 23.31 C ATOM 1304 C GLN A 95 9.646 12.545 -4.105 1.00 10.33 C ATOM 1305 O GLN A 95 8.814 11.789 -3.585 1.00 33.43 O ATOM 1306 CB GLN A 95 11.040 11.586 -5.987 1.00 2.20 C ATOM 1307 CG GLN A 95 10.750 12.693 -6.987 1.00 24.23 C ATOM 1308 CD GLN A 95 10.813 12.216 -8.420 1.00 75.44 C ATOM 1309 OE1 GLN A 95 10.534 11.054 -8.718 1.00 11.20 O ATOM 1310 NE2 GLN A 95 11.169 13.096 -9.313 1.00 14.44 N ATOM 0 H GLN A 95 11.152 10.011 -4.043 1.00 33.41 H new ATOM 0 HA GLN A 95 11.737 12.843 -4.398 1.00 23.31 H new ATOM 0 HB2 GLN A 95 12.017 11.159 -6.212 1.00 2.20 H new ATOM 0 HB3 GLN A 95 10.306 10.792 -6.122 1.00 2.20 H new ATOM 0 HG2 GLN A 95 9.761 13.106 -6.789 1.00 24.23 H new ATOM 0 HG3 GLN A 95 11.467 13.502 -6.846 1.00 24.23 H new ATOM 0 HE21 GLN A 95 11.393 14.050 -9.028 1.00 14.44 H new ATOM 0 HE22 GLN A 95 11.224 12.831 -10.296 1.00 14.44 H new ATOM 1319 N LYS A 96 9.425 13.815 -4.329 1.00 70.25 N ATOM 1320 CA LYS A 96 8.201 14.485 -3.958 1.00 5.04 C ATOM 1321 C LYS A 96 7.001 14.148 -4.870 1.00 61.21 C ATOM 1322 O LYS A 96 6.657 14.900 -5.781 1.00 64.01 O ATOM 1323 CB LYS A 96 8.438 16.002 -3.857 1.00 0.51 C ATOM 1324 CG LYS A 96 9.020 16.609 -5.126 1.00 61.30 C ATOM 1325 CD LYS A 96 9.373 18.065 -4.959 1.00 23.43 C ATOM 1326 CE LYS A 96 10.021 18.610 -6.223 1.00 23.44 C ATOM 1327 NZ LYS A 96 11.253 17.859 -6.583 1.00 54.13 N ATOM 0 H LYS A 96 10.103 14.426 -4.783 1.00 70.25 H new ATOM 0 HA LYS A 96 7.919 14.104 -2.977 1.00 5.04 H new ATOM 0 HB2 LYS A 96 7.494 16.495 -3.627 1.00 0.51 H new ATOM 0 HB3 LYS A 96 9.113 16.202 -3.025 1.00 0.51 H new ATOM 0 HG2 LYS A 96 9.912 16.053 -5.415 1.00 61.30 H new ATOM 0 HG3 LYS A 96 8.301 16.503 -5.938 1.00 61.30 H new ATOM 0 HD2 LYS A 96 8.475 18.638 -4.729 1.00 23.43 H new ATOM 0 HD3 LYS A 96 10.053 18.185 -4.115 1.00 23.43 H new ATOM 0 HE2 LYS A 96 9.310 18.557 -7.047 1.00 23.44 H new ATOM 0 HE3 LYS A 96 10.266 19.662 -6.080 1.00 23.44 H new ATOM 0 HZ1 LYS A 96 11.815 18.417 -7.257 1.00 54.13 H new ATOM 0 HZ2 LYS A 96 11.815 17.683 -5.726 1.00 54.13 H new ATOM 0 HZ3 LYS A 96 10.992 16.951 -7.018 1.00 54.13 H new ATOM 1341 N LYS A 97 6.431 12.982 -4.660 1.00 20.31 N ATOM 1342 CA LYS A 97 5.206 12.568 -5.325 1.00 12.13 C ATOM 1343 C LYS A 97 4.740 11.373 -4.532 1.00 34.40 C ATOM 1344 O LYS A 97 5.474 10.414 -4.372 1.00 1.32 O ATOM 1345 CB LYS A 97 5.530 12.183 -6.817 1.00 73.22 C ATOM 1346 CG LYS A 97 4.382 12.240 -7.896 1.00 65.41 C ATOM 1347 CD LYS A 97 3.438 11.016 -7.982 1.00 32.01 C ATOM 1348 CE LYS A 97 2.465 10.877 -6.835 1.00 22.11 C ATOM 1349 NZ LYS A 97 1.469 11.982 -6.792 1.00 40.11 N ATOM 0 H LYS A 97 6.805 12.284 -4.017 1.00 20.31 H new ATOM 0 HA LYS A 97 4.442 13.345 -5.362 1.00 12.13 H new ATOM 0 HB2 LYS A 97 6.332 12.838 -7.157 1.00 73.22 H new ATOM 0 HB3 LYS A 97 5.927 11.168 -6.814 1.00 73.22 H new ATOM 0 HG2 LYS A 97 3.775 13.123 -7.698 1.00 65.41 H new ATOM 0 HG3 LYS A 97 4.843 12.382 -8.874 1.00 65.41 H new ATOM 0 HD2 LYS A 97 2.873 11.077 -8.912 1.00 32.01 H new ATOM 0 HD3 LYS A 97 4.044 10.112 -8.036 1.00 32.01 H new ATOM 0 HE2 LYS A 97 1.942 9.925 -6.921 1.00 22.11 H new ATOM 0 HE3 LYS A 97 3.017 10.854 -5.896 1.00 22.11 H new ATOM 0 HZ1 LYS A 97 1.619 12.552 -5.935 1.00 40.11 H new ATOM 0 HZ2 LYS A 97 1.582 12.584 -7.632 1.00 40.11 H new ATOM 0 HZ3 LYS A 97 0.509 11.583 -6.779 1.00 40.11 H new ATOM 1363 N LEU A 98 3.542 11.438 -4.021 1.00 4.34 N ATOM 1364 CA LEU A 98 3.023 10.371 -3.205 1.00 1.43 C ATOM 1365 C LEU A 98 1.543 10.185 -3.452 1.00 33.20 C ATOM 1366 O LEU A 98 0.830 11.151 -3.768 1.00 44.30 O ATOM 1367 CB LEU A 98 3.337 10.701 -1.712 1.00 63.21 C ATOM 1368 CG LEU A 98 2.840 9.748 -0.594 1.00 23.40 C ATOM 1369 CD1 LEU A 98 3.583 10.058 0.668 1.00 2.33 C ATOM 1370 CD2 LEU A 98 1.362 9.956 -0.308 1.00 70.12 C ATOM 0 H LEU A 98 2.903 12.221 -4.155 1.00 4.34 H new ATOM 0 HA LEU A 98 3.499 9.425 -3.463 1.00 1.43 H new ATOM 0 HB2 LEU A 98 4.420 10.778 -1.616 1.00 63.21 H new ATOM 0 HB3 LEU A 98 2.927 11.689 -1.504 1.00 63.21 H new ATOM 0 HG LEU A 98 3.007 8.723 -0.926 1.00 23.40 H new ATOM 0 HD11 LEU A 98 3.243 9.394 1.463 1.00 2.33 H new ATOM 0 HD12 LEU A 98 4.651 9.913 0.506 1.00 2.33 H new ATOM 0 HD13 LEU A 98 3.397 11.093 0.955 1.00 2.33 H new ATOM 0 HD21 LEU A 98 1.044 9.273 0.480 1.00 70.12 H new ATOM 0 HD22 LEU A 98 1.195 10.984 0.013 1.00 70.12 H new ATOM 0 HD23 LEU A 98 0.785 9.760 -1.212 1.00 70.12 H new ATOM 1382 N LYS A 99 1.092 8.958 -3.391 1.00 5.52 N ATOM 1383 CA LYS A 99 -0.327 8.702 -3.375 1.00 54.33 C ATOM 1384 C LYS A 99 -0.652 7.556 -2.451 1.00 72.54 C ATOM 1385 O LYS A 99 -0.028 6.499 -2.506 1.00 13.30 O ATOM 1386 CB LYS A 99 -0.968 8.527 -4.758 1.00 42.20 C ATOM 1387 CG LYS A 99 -0.574 7.316 -5.560 1.00 70.12 C ATOM 1388 CD LYS A 99 -1.371 7.311 -6.849 1.00 73.24 C ATOM 1389 CE LYS A 99 -1.096 6.097 -7.695 1.00 32.22 C ATOM 1390 NZ LYS A 99 -1.895 6.104 -8.936 1.00 72.12 N ATOM 0 H LYS A 99 1.681 8.126 -3.352 1.00 5.52 H new ATOM 0 HA LYS A 99 -0.785 9.611 -2.984 1.00 54.33 H new ATOM 0 HB2 LYS A 99 -2.050 8.506 -4.627 1.00 42.20 H new ATOM 0 HB3 LYS A 99 -0.736 9.412 -5.350 1.00 42.20 H new ATOM 0 HG2 LYS A 99 0.494 7.336 -5.776 1.00 70.12 H new ATOM 0 HG3 LYS A 99 -0.768 6.406 -4.992 1.00 70.12 H new ATOM 0 HD2 LYS A 99 -2.435 7.352 -6.614 1.00 73.24 H new ATOM 0 HD3 LYS A 99 -1.136 8.209 -7.421 1.00 73.24 H new ATOM 0 HE2 LYS A 99 -0.036 6.060 -7.945 1.00 32.22 H new ATOM 0 HE3 LYS A 99 -1.320 5.197 -7.123 1.00 32.22 H new ATOM 0 HZ1 LYS A 99 -1.679 5.253 -9.493 1.00 72.12 H new ATOM 0 HZ2 LYS A 99 -2.907 6.114 -8.697 1.00 72.12 H new ATOM 0 HZ3 LYS A 99 -1.663 6.951 -9.494 1.00 72.12 H new ATOM 1404 N VAL A 100 -1.602 7.785 -1.600 1.00 52.10 N ATOM 1405 CA VAL A 100 -2.014 6.833 -0.604 1.00 51.13 C ATOM 1406 C VAL A 100 -3.140 5.978 -1.142 1.00 14.41 C ATOM 1407 O VAL A 100 -4.002 6.475 -1.837 1.00 51.21 O ATOM 1408 CB VAL A 100 -2.501 7.568 0.692 1.00 5.41 C ATOM 1409 CG1 VAL A 100 -2.975 6.585 1.752 1.00 35.33 C ATOM 1410 CG2 VAL A 100 -1.404 8.446 1.262 1.00 5.51 C ATOM 0 H VAL A 100 -2.128 8.658 -1.574 1.00 52.10 H new ATOM 0 HA VAL A 100 -1.159 6.204 -0.358 1.00 51.13 H new ATOM 0 HB VAL A 100 -3.345 8.194 0.405 1.00 5.41 H new ATOM 0 HG11 VAL A 100 -3.304 7.133 2.635 1.00 35.33 H new ATOM 0 HG12 VAL A 100 -3.805 5.998 1.359 1.00 35.33 H new ATOM 0 HG13 VAL A 100 -2.156 5.919 2.023 1.00 35.33 H new ATOM 0 HG21 VAL A 100 -1.767 8.945 2.161 1.00 5.51 H new ATOM 0 HG22 VAL A 100 -0.539 7.831 1.512 1.00 5.51 H new ATOM 0 HG23 VAL A 100 -1.116 9.194 0.523 1.00 5.51 H new ATOM 1420 N TRP A 101 -3.089 4.715 -0.848 1.00 43.02 N ATOM 1421 CA TRP A 101 -4.128 3.767 -1.148 1.00 33.21 C ATOM 1422 C TRP A 101 -4.605 3.186 0.175 1.00 75.15 C ATOM 1423 O TRP A 101 -3.809 2.623 0.940 1.00 24.10 O ATOM 1424 CB TRP A 101 -3.597 2.605 -2.012 1.00 33.42 C ATOM 1425 CG TRP A 101 -3.193 2.953 -3.412 1.00 21.13 C ATOM 1426 CD1 TRP A 101 -1.969 3.385 -3.842 1.00 32.44 C ATOM 1427 CD2 TRP A 101 -4.021 2.858 -4.575 1.00 2.25 C ATOM 1428 NE1 TRP A 101 -1.992 3.568 -5.207 1.00 65.30 N ATOM 1429 CE2 TRP A 101 -3.244 3.251 -5.677 1.00 1.33 C ATOM 1430 CE3 TRP A 101 -5.351 2.477 -4.787 1.00 14.32 C ATOM 1431 CZ2 TRP A 101 -3.755 3.275 -6.974 1.00 23.13 C ATOM 1432 CZ3 TRP A 101 -5.857 2.500 -6.070 1.00 64.34 C ATOM 1433 CH2 TRP A 101 -5.064 2.895 -7.150 1.00 44.34 C ATOM 0 H TRP A 101 -2.290 4.295 -0.372 1.00 43.02 H new ATOM 0 HA TRP A 101 -4.925 4.270 -1.696 1.00 33.21 H new ATOM 0 HB2 TRP A 101 -2.737 2.167 -1.506 1.00 33.42 H new ATOM 0 HB3 TRP A 101 -4.366 1.834 -2.059 1.00 33.42 H new ATOM 0 HD1 TRP A 101 -1.113 3.557 -3.207 1.00 32.44 H new ATOM 0 HE1 TRP A 101 -1.208 3.887 -5.776 1.00 65.30 H new ATOM 0 HE3 TRP A 101 -5.972 2.170 -3.958 1.00 14.32 H new ATOM 0 HZ2 TRP A 101 -3.144 3.581 -7.810 1.00 23.13 H new ATOM 0 HZ3 TRP A 101 -6.882 2.208 -6.242 1.00 64.34 H new ATOM 0 HH2 TRP A 101 -5.488 2.902 -8.143 1.00 44.34 H new ATOM 1444 N PHE A 102 -5.858 3.286 0.450 1.00 25.40 N ATOM 1445 CA PHE A 102 -6.358 2.758 1.676 1.00 72.41 C ATOM 1446 C PHE A 102 -7.033 1.456 1.391 1.00 24.53 C ATOM 1447 O PHE A 102 -8.044 1.399 0.681 1.00 13.45 O ATOM 1448 CB PHE A 102 -7.325 3.722 2.376 1.00 45.41 C ATOM 1449 CG PHE A 102 -7.826 3.192 3.702 1.00 4.53 C ATOM 1450 CD1 PHE A 102 -7.013 3.235 4.834 1.00 44.22 C ATOM 1451 CD2 PHE A 102 -9.098 2.650 3.818 1.00 73.21 C ATOM 1452 CE1 PHE A 102 -7.462 2.747 6.044 1.00 32.50 C ATOM 1453 CE2 PHE A 102 -9.550 2.161 5.030 1.00 43.33 C ATOM 1454 CZ PHE A 102 -8.733 2.210 6.142 1.00 4.45 C ATOM 0 H PHE A 102 -6.555 3.725 -0.152 1.00 25.40 H new ATOM 0 HA PHE A 102 -5.520 2.612 2.358 1.00 72.41 H new ATOM 0 HB2 PHE A 102 -6.825 4.677 2.537 1.00 45.41 H new ATOM 0 HB3 PHE A 102 -8.176 3.914 1.722 1.00 45.41 H new ATOM 0 HD1 PHE A 102 -6.021 3.655 4.763 1.00 44.22 H new ATOM 0 HD2 PHE A 102 -9.742 2.610 2.952 1.00 73.21 H new ATOM 0 HE1 PHE A 102 -6.822 2.784 6.913 1.00 32.50 H new ATOM 0 HE2 PHE A 102 -10.542 1.741 5.107 1.00 43.33 H new ATOM 0 HZ PHE A 102 -9.086 1.829 7.089 1.00 4.45 H new ATOM 1464 N ARG A 103 -6.445 0.421 1.922 1.00 34.12 N ATOM 1465 CA ARG A 103 -6.869 -0.928 1.709 1.00 31.14 C ATOM 1466 C ARG A 103 -8.125 -1.142 2.550 1.00 51.34 C ATOM 1467 O ARG A 103 -8.073 -1.076 3.753 1.00 24.31 O ATOM 1468 CB ARG A 103 -5.709 -1.835 2.164 1.00 4.32 C ATOM 1469 CG ARG A 103 -5.541 -3.157 1.425 1.00 71.32 C ATOM 1470 CD ARG A 103 -6.639 -4.173 1.658 1.00 43.15 C ATOM 1471 NE ARG A 103 -6.356 -5.370 0.853 1.00 14.44 N ATOM 1472 CZ ARG A 103 -6.174 -6.607 1.326 1.00 0.32 C ATOM 1473 NH1 ARG A 103 -6.303 -6.871 2.619 1.00 23.21 N ATOM 1474 NH2 ARG A 103 -5.829 -7.578 0.497 1.00 34.31 N ATOM 0 H ARG A 103 -5.632 0.499 2.534 1.00 34.12 H new ATOM 0 HA ARG A 103 -7.106 -1.152 0.669 1.00 31.14 H new ATOM 0 HB2 ARG A 103 -4.780 -1.272 2.069 1.00 4.32 H new ATOM 0 HB3 ARG A 103 -5.843 -2.053 3.224 1.00 4.32 H new ATOM 0 HG2 ARG A 103 -5.480 -2.952 0.356 1.00 71.32 H new ATOM 0 HG3 ARG A 103 -4.590 -3.601 1.719 1.00 71.32 H new ATOM 0 HD2 ARG A 103 -6.694 -4.433 2.715 1.00 43.15 H new ATOM 0 HD3 ARG A 103 -7.606 -3.753 1.382 1.00 43.15 H new ATOM 0 HE ARG A 103 -6.293 -5.246 -0.157 1.00 14.44 H new ATOM 0 HH11 ARG A 103 -6.545 -6.124 3.270 1.00 23.21 H new ATOM 0 HH12 ARG A 103 -6.160 -7.821 2.962 1.00 23.21 H new ATOM 0 HH21 ARG A 103 -5.704 -7.380 -0.496 1.00 34.31 H new ATOM 0 HH22 ARG A 103 -5.688 -8.524 0.850 1.00 34.31 H new ATOM 1488 N ILE A 104 -9.240 -1.336 1.900 1.00 12.11 N ATOM 1489 CA ILE A 104 -10.507 -1.463 2.572 1.00 14.25 C ATOM 1490 C ILE A 104 -10.703 -2.865 3.193 1.00 61.14 C ATOM 1491 O ILE A 104 -10.356 -3.881 2.581 1.00 30.40 O ATOM 1492 CB ILE A 104 -11.650 -1.159 1.573 1.00 22.32 C ATOM 1493 CG1 ILE A 104 -11.476 0.248 0.997 1.00 43.02 C ATOM 1494 CG2 ILE A 104 -13.012 -1.297 2.233 1.00 1.23 C ATOM 1495 CD1 ILE A 104 -12.504 0.608 -0.036 1.00 52.42 C ATOM 0 H ILE A 104 -9.297 -1.411 0.884 1.00 12.11 H new ATOM 0 HA ILE A 104 -10.524 -0.745 3.392 1.00 14.25 H new ATOM 0 HB ILE A 104 -11.599 -1.887 0.763 1.00 22.32 H new ATOM 0 HG12 ILE A 104 -11.522 0.972 1.810 1.00 43.02 H new ATOM 0 HG13 ILE A 104 -10.484 0.329 0.553 1.00 43.02 H new ATOM 0 HG21 ILE A 104 -13.793 -1.077 1.505 1.00 1.23 H new ATOM 0 HG22 ILE A 104 -13.136 -2.315 2.602 1.00 1.23 H new ATOM 0 HG23 ILE A 104 -13.085 -0.598 3.066 1.00 1.23 H new ATOM 0 HD11 ILE A 104 -12.317 1.619 -0.399 1.00 52.42 H new ATOM 0 HD12 ILE A 104 -12.444 -0.093 -0.869 1.00 52.42 H new ATOM 0 HD13 ILE A 104 -13.498 0.560 0.408 1.00 52.42 H new ATOM 1507 N PRO A 105 -11.196 -2.921 4.455 1.00 41.21 N ATOM 1508 CA PRO A 105 -11.582 -4.174 5.118 1.00 4.15 C ATOM 1509 C PRO A 105 -12.614 -4.977 4.291 1.00 73.20 C ATOM 1510 O PRO A 105 -13.356 -4.413 3.471 1.00 3.11 O ATOM 1511 CB PRO A 105 -12.201 -3.697 6.430 1.00 30.55 C ATOM 1512 CG PRO A 105 -11.533 -2.405 6.695 1.00 11.24 C ATOM 1513 CD PRO A 105 -11.351 -1.766 5.354 1.00 30.51 C ATOM 0 HA PRO A 105 -10.736 -4.849 5.250 1.00 4.15 H new ATOM 0 HB2 PRO A 105 -13.281 -3.577 6.341 1.00 30.55 H new ATOM 0 HB3 PRO A 105 -12.025 -4.409 7.236 1.00 30.55 H new ATOM 0 HG2 PRO A 105 -12.138 -1.778 7.350 1.00 11.24 H new ATOM 0 HG3 PRO A 105 -10.574 -2.554 7.192 1.00 11.24 H new ATOM 0 HD2 PRO A 105 -12.209 -1.153 5.079 1.00 30.51 H new ATOM 0 HD3 PRO A 105 -10.476 -1.117 5.332 1.00 30.51 H new ATOM 1521 N ASN A 106 -12.674 -6.271 4.553 1.00 52.44 N ATOM 1522 CA ASN A 106 -13.454 -7.238 3.756 1.00 41.33 C ATOM 1523 C ASN A 106 -14.927 -6.874 3.600 1.00 53.30 C ATOM 1524 O ASN A 106 -15.462 -6.932 2.489 1.00 62.52 O ATOM 1525 CB ASN A 106 -13.336 -8.658 4.327 1.00 24.22 C ATOM 1526 CG ASN A 106 -11.908 -9.166 4.448 1.00 53.14 C ATOM 1527 OD1 ASN A 106 -11.010 -8.641 3.647 1.00 61.35 O flip ATOM 1528 ND2 ASN A 106 -11.611 -10.013 5.294 1.00 55.43 N flip ATOM 0 H ASN A 106 -12.179 -6.699 5.335 1.00 52.44 H new ATOM 0 HA ASN A 106 -13.011 -7.200 2.761 1.00 41.33 H new ATOM 0 HB2 ASN A 106 -13.802 -8.681 5.312 1.00 24.22 H new ATOM 0 HB3 ASN A 106 -13.900 -9.341 3.691 1.00 24.22 H new ATOM 0 HD21 ASN A 106 -12.332 -10.402 5.902 1.00 55.43 H new ATOM 0 HD22 ASN A 106 -10.644 -10.325 5.386 1.00 55.43 H new ATOM 1535 N GLN A 107 -15.572 -6.487 4.693 1.00 44.34 N ATOM 1536 CA GLN A 107 -17.004 -6.156 4.684 1.00 21.24 C ATOM 1537 C GLN A 107 -17.310 -5.017 3.741 1.00 42.22 C ATOM 1538 O GLN A 107 -18.319 -5.023 3.043 1.00 71.30 O ATOM 1539 CB GLN A 107 -17.499 -5.789 6.086 1.00 24.54 C ATOM 1540 CG GLN A 107 -17.443 -6.921 7.092 1.00 10.31 C ATOM 1541 CD GLN A 107 -17.941 -6.518 8.474 1.00 10.24 C ATOM 1542 OE1 GLN A 107 -18.867 -5.595 8.537 1.00 42.13 O flip ATOM 1543 NE2 GLN A 107 -17.494 -7.053 9.488 1.00 64.25 N flip ATOM 0 H GLN A 107 -15.128 -6.392 5.607 1.00 44.34 H new ATOM 0 HA GLN A 107 -17.525 -7.049 4.339 1.00 21.24 H new ATOM 0 HB2 GLN A 107 -16.903 -4.957 6.461 1.00 24.54 H new ATOM 0 HB3 GLN A 107 -18.528 -5.436 6.013 1.00 24.54 H new ATOM 0 HG2 GLN A 107 -18.042 -7.755 6.725 1.00 10.31 H new ATOM 0 HG3 GLN A 107 -16.416 -7.277 7.172 1.00 10.31 H new ATOM 0 HE21 GLN A 107 -16.772 -7.770 9.411 1.00 64.25 H new ATOM 0 HE22 GLN A 107 -17.845 -6.780 10.406 1.00 64.25 H new ATOM 1552 N PHE A 108 -16.431 -4.060 3.690 1.00 12.12 N ATOM 1553 CA PHE A 108 -16.663 -2.896 2.884 1.00 22.23 C ATOM 1554 C PHE A 108 -16.128 -3.045 1.474 1.00 40.22 C ATOM 1555 O PHE A 108 -16.286 -2.162 0.668 1.00 22.42 O ATOM 1556 CB PHE A 108 -16.159 -1.628 3.572 1.00 25.41 C ATOM 1557 CG PHE A 108 -16.904 -1.303 4.842 1.00 14.24 C ATOM 1558 CD1 PHE A 108 -16.523 -1.857 6.054 1.00 4.54 C ATOM 1559 CD2 PHE A 108 -17.989 -0.442 4.816 1.00 22.31 C ATOM 1560 CE1 PHE A 108 -17.210 -1.559 7.214 1.00 42.33 C ATOM 1561 CE2 PHE A 108 -18.681 -0.140 5.974 1.00 43.55 C ATOM 1562 CZ PHE A 108 -18.290 -0.699 7.175 1.00 71.44 C ATOM 0 H PHE A 108 -15.546 -4.062 4.197 1.00 12.12 H new ATOM 0 HA PHE A 108 -17.743 -2.794 2.780 1.00 22.23 H new ATOM 0 HB2 PHE A 108 -15.099 -1.743 3.800 1.00 25.41 H new ATOM 0 HB3 PHE A 108 -16.247 -0.789 2.882 1.00 25.41 H new ATOM 0 HD1 PHE A 108 -15.679 -2.530 6.091 1.00 4.54 H new ATOM 0 HD2 PHE A 108 -18.298 -0.001 3.880 1.00 22.31 H new ATOM 0 HE1 PHE A 108 -16.903 -1.998 8.152 1.00 42.33 H new ATOM 0 HE2 PHE A 108 -19.526 0.532 5.940 1.00 43.55 H new ATOM 0 HZ PHE A 108 -18.828 -0.464 8.082 1.00 71.44 H new ATOM 1572 N GLN A 109 -15.475 -4.158 1.173 1.00 52.32 N ATOM 1573 CA GLN A 109 -15.086 -4.402 -0.211 1.00 62.54 C ATOM 1574 C GLN A 109 -16.323 -4.729 -1.050 1.00 2.50 C ATOM 1575 O GLN A 109 -16.384 -4.394 -2.232 1.00 22.22 O ATOM 1576 CB GLN A 109 -14.065 -5.527 -0.347 1.00 75.53 C ATOM 1577 CG GLN A 109 -12.707 -5.315 0.330 1.00 14.31 C ATOM 1578 CD GLN A 109 -11.749 -4.344 -0.381 1.00 13.32 C ATOM 1579 OE1 GLN A 109 -12.258 -3.338 -1.066 1.00 22.35 O flip ATOM 1580 NE2 GLN A 109 -10.540 -4.516 -0.297 1.00 15.12 N flip ATOM 0 H GLN A 109 -15.210 -4.883 1.839 1.00 52.32 H new ATOM 0 HA GLN A 109 -14.613 -3.489 -0.574 1.00 62.54 H new ATOM 0 HB2 GLN A 109 -14.507 -6.437 0.057 1.00 75.53 H new ATOM 0 HB3 GLN A 109 -13.891 -5.701 -1.409 1.00 75.53 H new ATOM 0 HG2 GLN A 109 -12.880 -4.949 1.342 1.00 14.31 H new ATOM 0 HG3 GLN A 109 -12.213 -6.282 0.421 1.00 14.31 H new ATOM 0 HE21 GLN A 109 -10.173 -5.302 0.239 1.00 15.12 H new ATOM 0 HE22 GLN A 109 -9.900 -3.873 -0.763 1.00 15.12 H new ATOM 1589 N GLY A 110 -17.293 -5.401 -0.426 1.00 61.31 N ATOM 1590 CA GLY A 110 -18.519 -5.784 -1.120 1.00 43.32 C ATOM 1591 C GLY A 110 -19.429 -4.613 -1.351 1.00 22.30 C ATOM 1592 O GLY A 110 -20.127 -4.543 -2.364 1.00 21.41 O ATOM 0 H GLY A 110 -17.252 -5.688 0.552 1.00 61.31 H new ATOM 0 HA2 GLY A 110 -18.265 -6.239 -2.077 1.00 43.32 H new ATOM 0 HA3 GLY A 110 -19.044 -6.540 -0.536 1.00 43.32 H new ATOM 1596 N SER A 111 -19.433 -3.709 -0.418 1.00 50.35 N ATOM 1597 CA SER A 111 -20.190 -2.510 -0.536 1.00 33.24 C ATOM 1598 C SER A 111 -19.386 -1.377 0.076 1.00 30.51 C ATOM 1599 O SER A 111 -19.439 -1.148 1.290 1.00 11.04 O ATOM 1600 CB SER A 111 -21.562 -2.652 0.149 1.00 12.35 C ATOM 1601 OG SER A 111 -22.400 -1.511 -0.073 1.00 5.13 O ATOM 0 H SER A 111 -18.905 -3.788 0.451 1.00 50.35 H new ATOM 0 HA SER A 111 -20.383 -2.297 -1.587 1.00 33.24 H new ATOM 0 HB2 SER A 111 -22.062 -3.546 -0.225 1.00 12.35 H new ATOM 0 HB3 SER A 111 -21.418 -2.792 1.220 1.00 12.35 H new ATOM 0 HG SER A 111 -23.260 -1.644 0.378 1.00 5.13 H new ATOM 1607 N PRO A 112 -18.551 -0.724 -0.725 1.00 34.23 N ATOM 1608 CA PRO A 112 -17.768 0.388 -0.262 1.00 63.24 C ATOM 1609 C PRO A 112 -18.543 1.689 -0.388 1.00 55.20 C ATOM 1610 O PRO A 112 -19.291 1.888 -1.367 1.00 63.52 O ATOM 1611 CB PRO A 112 -16.568 0.385 -1.211 1.00 63.54 C ATOM 1612 CG PRO A 112 -17.076 -0.208 -2.486 1.00 35.24 C ATOM 1613 CD PRO A 112 -18.288 -1.040 -2.142 1.00 73.13 C ATOM 0 HA PRO A 112 -17.491 0.306 0.789 1.00 63.24 H new ATOM 0 HB2 PRO A 112 -16.190 1.395 -1.370 1.00 63.54 H new ATOM 0 HB3 PRO A 112 -15.746 -0.203 -0.804 1.00 63.54 H new ATOM 0 HG2 PRO A 112 -17.337 0.576 -3.197 1.00 35.24 H new ATOM 0 HG3 PRO A 112 -16.309 -0.823 -2.957 1.00 35.24 H new ATOM 0 HD2 PRO A 112 -19.140 -0.784 -2.772 1.00 73.13 H new ATOM 0 HD3 PRO A 112 -18.095 -2.103 -2.284 1.00 73.13 H new ATOM 1621 N PRO A 113 -18.417 2.586 0.582 1.00 33.13 N ATOM 1622 CA PRO A 113 -19.063 3.871 0.513 1.00 23.51 C ATOM 1623 C PRO A 113 -18.394 4.746 -0.534 1.00 64.53 C ATOM 1624 O PRO A 113 -17.212 4.565 -0.860 1.00 42.42 O ATOM 1625 CB PRO A 113 -18.868 4.469 1.912 1.00 0.02 C ATOM 1626 CG PRO A 113 -18.363 3.348 2.758 1.00 52.11 C ATOM 1627 CD PRO A 113 -17.656 2.421 1.829 1.00 32.11 C ATOM 0 HA PRO A 113 -20.114 3.795 0.233 1.00 23.51 H new ATOM 0 HB2 PRO A 113 -18.157 5.295 1.890 1.00 0.02 H new ATOM 0 HB3 PRO A 113 -19.805 4.865 2.304 1.00 0.02 H new ATOM 0 HG2 PRO A 113 -17.688 3.716 3.531 1.00 52.11 H new ATOM 0 HG3 PRO A 113 -19.184 2.841 3.266 1.00 52.11 H new ATOM 0 HD2 PRO A 113 -16.608 2.692 1.704 1.00 32.11 H new ATOM 0 HD3 PRO A 113 -17.679 1.391 2.186 1.00 32.11 H new ATOM 1635 N ALA A 114 -19.122 5.669 -1.055 1.00 54.24 N ATOM 1636 CA ALA A 114 -18.596 6.556 -2.036 1.00 14.54 C ATOM 1637 C ALA A 114 -17.807 7.635 -1.329 1.00 3.15 C ATOM 1638 O ALA A 114 -18.179 8.062 -0.216 1.00 72.12 O ATOM 1639 CB ALA A 114 -19.705 7.154 -2.891 1.00 14.54 C ATOM 0 H ALA A 114 -20.100 5.832 -0.815 1.00 54.24 H new ATOM 0 HA ALA A 114 -17.941 6.007 -2.713 1.00 14.54 H new ATOM 0 HB1 ALA A 114 -19.271 7.827 -3.631 1.00 14.54 H new ATOM 0 HB2 ALA A 114 -20.244 6.354 -3.400 1.00 14.54 H new ATOM 0 HB3 ALA A 114 -20.395 7.709 -2.256 1.00 14.54 H new ATOM 1645 N PRO A 115 -16.703 8.069 -1.919 1.00 5.31 N ATOM 1646 CA PRO A 115 -15.867 9.077 -1.326 1.00 2.15 C ATOM 1647 C PRO A 115 -16.534 10.446 -1.351 1.00 71.12 C ATOM 1648 O PRO A 115 -16.735 11.043 -2.412 1.00 71.01 O ATOM 1649 CB PRO A 115 -14.614 9.054 -2.184 1.00 20.34 C ATOM 1650 CG PRO A 115 -15.061 8.543 -3.510 1.00 1.05 C ATOM 1651 CD PRO A 115 -16.190 7.606 -3.229 1.00 63.11 C ATOM 0 HA PRO A 115 -15.661 8.884 -0.273 1.00 2.15 H new ATOM 0 HB2 PRO A 115 -14.178 10.049 -2.272 1.00 20.34 H new ATOM 0 HB3 PRO A 115 -13.851 8.409 -1.750 1.00 20.34 H new ATOM 0 HG2 PRO A 115 -15.383 9.360 -4.155 1.00 1.05 H new ATOM 0 HG3 PRO A 115 -14.248 8.032 -4.026 1.00 1.05 H new ATOM 0 HD2 PRO A 115 -16.957 7.658 -4.002 1.00 63.11 H new ATOM 0 HD3 PRO A 115 -15.851 6.571 -3.185 1.00 63.11 H new ATOM 1659 N SER A 116 -16.903 10.918 -0.183 1.00 33.13 N ATOM 1660 CA SER A 116 -17.566 12.188 -0.053 1.00 21.12 C ATOM 1661 C SER A 116 -16.572 13.346 -0.295 1.00 35.24 C ATOM 1662 O SER A 116 -16.970 14.448 -0.648 1.00 44.10 O ATOM 1663 CB SER A 116 -18.253 12.281 1.330 1.00 33.13 C ATOM 1664 OG SER A 116 -19.029 13.467 1.475 1.00 1.32 O ATOM 0 H SER A 116 -16.751 10.431 0.700 1.00 33.13 H new ATOM 0 HA SER A 116 -18.342 12.274 -0.814 1.00 21.12 H new ATOM 0 HB2 SER A 116 -18.894 11.411 1.473 1.00 33.13 H new ATOM 0 HB3 SER A 116 -17.494 12.249 2.112 1.00 33.13 H new ATOM 0 HG SER A 116 -19.444 13.480 2.363 1.00 1.32 H new ATOM 1670 N ASP A 117 -15.281 13.080 -0.124 1.00 1.10 N ATOM 1671 CA ASP A 117 -14.266 14.100 -0.386 1.00 54.40 C ATOM 1672 C ASP A 117 -13.828 13.988 -1.838 1.00 51.15 C ATOM 1673 O ASP A 117 -13.748 12.884 -2.381 1.00 65.43 O ATOM 1674 CB ASP A 117 -13.050 13.952 0.549 1.00 25.41 C ATOM 1675 CG ASP A 117 -12.017 15.068 0.361 1.00 41.25 C ATOM 1676 OD1 ASP A 117 -11.184 14.986 -0.564 1.00 63.14 O ATOM 1677 OD2 ASP A 117 -12.038 16.050 1.151 1.00 42.43 O ATOM 0 H ASP A 117 -14.914 12.181 0.190 1.00 1.10 H new ATOM 0 HA ASP A 117 -14.700 15.082 -0.195 1.00 54.40 H new ATOM 0 HB2 ASP A 117 -13.392 13.950 1.584 1.00 25.41 H new ATOM 0 HB3 ASP A 117 -12.574 12.988 0.369 1.00 25.41 H new ATOM 1682 N GLU A 118 -13.546 15.115 -2.452 1.00 32.42 N ATOM 1683 CA GLU A 118 -13.188 15.171 -3.864 1.00 31.42 C ATOM 1684 C GLU A 118 -11.828 14.522 -4.171 1.00 45.23 C ATOM 1685 O GLU A 118 -11.651 13.923 -5.244 1.00 45.22 O ATOM 1686 CB GLU A 118 -13.177 16.619 -4.354 1.00 0.40 C ATOM 1687 CG GLU A 118 -12.176 17.501 -3.627 1.00 52.43 C ATOM 1688 CD GLU A 118 -12.135 18.891 -4.164 1.00 70.40 C ATOM 1689 OE1 GLU A 118 -11.543 19.099 -5.237 1.00 51.23 O ATOM 1690 OE2 GLU A 118 -12.664 19.813 -3.505 1.00 71.15 O ATOM 0 H GLU A 118 -13.557 16.025 -1.991 1.00 32.42 H new ATOM 0 HA GLU A 118 -13.949 14.597 -4.393 1.00 31.42 H new ATOM 0 HB2 GLU A 118 -12.951 16.631 -5.420 1.00 0.40 H new ATOM 0 HB3 GLU A 118 -14.175 17.042 -4.234 1.00 0.40 H new ATOM 0 HG2 GLU A 118 -12.429 17.533 -2.567 1.00 52.43 H new ATOM 0 HG3 GLU A 118 -11.184 17.057 -3.704 1.00 52.43 H new ATOM 1697 N SER A 119 -10.887 14.612 -3.239 1.00 53.23 N ATOM 1698 CA SER A 119 -9.538 14.144 -3.494 1.00 11.42 C ATOM 1699 C SER A 119 -9.360 12.685 -3.106 1.00 25.12 C ATOM 1700 O SER A 119 -8.367 12.046 -3.471 1.00 45.50 O ATOM 1701 CB SER A 119 -8.499 15.052 -2.810 1.00 72.21 C ATOM 1702 OG SER A 119 -8.683 15.132 -1.390 1.00 21.32 O ATOM 0 H SER A 119 -11.035 15.002 -2.308 1.00 53.23 H new ATOM 0 HA SER A 119 -9.368 14.202 -4.569 1.00 11.42 H new ATOM 0 HB2 SER A 119 -7.498 14.676 -3.022 1.00 72.21 H new ATOM 0 HB3 SER A 119 -8.560 16.053 -3.237 1.00 72.21 H new ATOM 0 HG SER A 119 -9.537 14.718 -1.147 1.00 21.32 H new ATOM 1708 N VAL A 120 -10.329 12.167 -2.396 1.00 73.11 N ATOM 1709 CA VAL A 120 -10.326 10.786 -1.984 1.00 44.51 C ATOM 1710 C VAL A 120 -11.127 10.066 -3.007 1.00 12.21 C ATOM 1711 O VAL A 120 -12.248 10.447 -3.273 1.00 74.11 O ATOM 1712 CB VAL A 120 -10.987 10.572 -0.585 1.00 73.40 C ATOM 1713 CG1 VAL A 120 -10.872 9.117 -0.144 1.00 20.22 C ATOM 1714 CG2 VAL A 120 -10.390 11.502 0.462 1.00 74.44 C ATOM 0 H VAL A 120 -11.146 12.693 -2.086 1.00 73.11 H new ATOM 0 HA VAL A 120 -9.300 10.428 -1.900 1.00 44.51 H new ATOM 0 HB VAL A 120 -12.045 10.817 -0.682 1.00 73.40 H new ATOM 0 HG11 VAL A 120 -11.340 8.995 0.833 1.00 20.22 H new ATOM 0 HG12 VAL A 120 -11.374 8.476 -0.869 1.00 20.22 H new ATOM 0 HG13 VAL A 120 -9.820 8.838 -0.080 1.00 20.22 H new ATOM 0 HG21 VAL A 120 -10.873 11.326 1.423 1.00 74.44 H new ATOM 0 HG22 VAL A 120 -9.321 11.309 0.553 1.00 74.44 H new ATOM 0 HG23 VAL A 120 -10.548 12.538 0.161 1.00 74.44 H new ATOM 1724 N LYS A 121 -10.564 9.092 -3.623 1.00 75.23 N ATOM 1725 CA LYS A 121 -11.260 8.400 -4.671 1.00 74.51 C ATOM 1726 C LYS A 121 -11.237 6.915 -4.430 1.00 71.03 C ATOM 1727 O LYS A 121 -10.217 6.376 -4.021 1.00 12.44 O ATOM 1728 CB LYS A 121 -10.602 8.742 -6.014 1.00 24.41 C ATOM 1729 CG LYS A 121 -10.619 10.238 -6.331 1.00 74.12 C ATOM 1730 CD LYS A 121 -9.818 10.582 -7.571 1.00 2.33 C ATOM 1731 CE LYS A 121 -10.382 9.944 -8.845 1.00 1.34 C ATOM 1732 NZ LYS A 121 -11.734 10.460 -9.196 1.00 64.04 N ATOM 0 H LYS A 121 -9.624 8.748 -3.428 1.00 75.23 H new ATOM 0 HA LYS A 121 -12.303 8.717 -4.687 1.00 74.51 H new ATOM 0 HB2 LYS A 121 -9.570 8.391 -6.005 1.00 24.41 H new ATOM 0 HB3 LYS A 121 -11.115 8.203 -6.810 1.00 24.41 H new ATOM 0 HG2 LYS A 121 -11.650 10.565 -6.467 1.00 74.12 H new ATOM 0 HG3 LYS A 121 -10.219 10.790 -5.480 1.00 74.12 H new ATOM 0 HD2 LYS A 121 -9.795 11.665 -7.693 1.00 2.33 H new ATOM 0 HD3 LYS A 121 -8.787 10.255 -7.433 1.00 2.33 H new ATOM 0 HE2 LYS A 121 -9.699 10.132 -9.674 1.00 1.34 H new ATOM 0 HE3 LYS A 121 -10.433 8.863 -8.713 1.00 1.34 H new ATOM 0 HZ1 LYS A 121 -12.032 10.060 -10.108 1.00 64.04 H new ATOM 0 HZ2 LYS A 121 -12.413 10.184 -8.458 1.00 64.04 H new ATOM 0 HZ3 LYS A 121 -11.702 11.497 -9.267 1.00 64.04 H new ATOM 1746 N ILE A 122 -12.347 6.260 -4.664 1.00 31.13 N ATOM 1747 CA ILE A 122 -12.399 4.827 -4.570 1.00 53.25 C ATOM 1748 C ILE A 122 -12.108 4.296 -5.949 1.00 10.14 C ATOM 1749 O ILE A 122 -12.927 4.410 -6.872 1.00 32.40 O ATOM 1750 CB ILE A 122 -13.805 4.323 -4.072 1.00 25.11 C ATOM 1751 CG1 ILE A 122 -14.048 4.689 -2.593 1.00 62.22 C ATOM 1752 CG2 ILE A 122 -13.976 2.820 -4.281 1.00 13.42 C ATOM 1753 CD1 ILE A 122 -13.129 3.972 -1.611 1.00 54.21 C ATOM 0 H ILE A 122 -13.230 6.701 -4.922 1.00 31.13 H new ATOM 0 HA ILE A 122 -11.671 4.471 -3.841 1.00 53.25 H new ATOM 0 HB ILE A 122 -14.553 4.835 -4.678 1.00 25.11 H new ATOM 0 HG12 ILE A 122 -13.922 5.765 -2.472 1.00 62.22 H new ATOM 0 HG13 ILE A 122 -15.083 4.459 -2.339 1.00 62.22 H new ATOM 0 HG21 ILE A 122 -14.959 2.513 -3.924 1.00 13.42 H new ATOM 0 HG22 ILE A 122 -13.886 2.588 -5.342 1.00 13.42 H new ATOM 0 HG23 ILE A 122 -13.205 2.285 -3.726 1.00 13.42 H new ATOM 0 HD11 ILE A 122 -13.366 4.286 -0.595 1.00 54.21 H new ATOM 0 HD12 ILE A 122 -13.271 2.895 -1.700 1.00 54.21 H new ATOM 0 HD13 ILE A 122 -12.092 4.221 -1.835 1.00 54.21 H new ATOM 1765 N GLU A 123 -10.964 3.713 -6.088 1.00 50.23 N ATOM 1766 CA GLU A 123 -10.498 3.253 -7.351 1.00 32.22 C ATOM 1767 C GLU A 123 -10.044 1.832 -7.220 1.00 63.05 C ATOM 1768 O GLU A 123 -9.643 1.403 -6.146 1.00 43.34 O ATOM 1769 CB GLU A 123 -9.332 4.122 -7.859 1.00 61.14 C ATOM 1770 CG GLU A 123 -9.651 5.612 -8.030 1.00 51.15 C ATOM 1771 CD GLU A 123 -10.808 5.871 -8.969 1.00 31.05 C ATOM 1772 OE1 GLU A 123 -10.724 5.490 -10.144 1.00 14.41 O ATOM 1773 OE2 GLU A 123 -11.815 6.486 -8.544 1.00 34.23 O ATOM 0 H GLU A 123 -10.319 3.541 -5.317 1.00 50.23 H new ATOM 0 HA GLU A 123 -11.314 3.321 -8.070 1.00 32.22 H new ATOM 0 HB2 GLU A 123 -8.498 4.023 -7.165 1.00 61.14 H new ATOM 0 HB3 GLU A 123 -8.997 3.727 -8.818 1.00 61.14 H new ATOM 0 HG2 GLU A 123 -9.880 6.042 -7.055 1.00 51.15 H new ATOM 0 HG3 GLU A 123 -8.766 6.126 -8.405 1.00 51.15 H new ATOM 1780 N GLU A 124 -10.104 1.117 -8.286 1.00 33.33 N ATOM 1781 CA GLU A 124 -9.686 -0.251 -8.305 1.00 51.02 C ATOM 1782 C GLU A 124 -8.611 -0.432 -9.336 1.00 43.44 C ATOM 1783 O GLU A 124 -8.688 0.134 -10.442 1.00 25.23 O ATOM 1784 CB GLU A 124 -10.870 -1.182 -8.551 1.00 31.21 C ATOM 1785 CG GLU A 124 -11.697 -0.848 -9.770 1.00 12.20 C ATOM 1786 CD GLU A 124 -12.823 -1.811 -9.957 1.00 73.10 C ATOM 1787 OE1 GLU A 124 -13.793 -1.767 -9.170 1.00 5.30 O ATOM 1788 OE2 GLU A 124 -12.758 -2.636 -10.873 1.00 72.11 O ATOM 0 H GLU A 124 -10.447 1.463 -9.182 1.00 33.33 H new ATOM 0 HA GLU A 124 -9.276 -0.514 -7.330 1.00 51.02 H new ATOM 0 HB2 GLU A 124 -10.498 -2.202 -8.650 1.00 31.21 H new ATOM 0 HB3 GLU A 124 -11.517 -1.163 -7.674 1.00 31.21 H new ATOM 0 HG2 GLU A 124 -12.095 0.162 -9.674 1.00 12.20 H new ATOM 0 HG3 GLU A 124 -11.060 -0.857 -10.655 1.00 12.20 H new ATOM 1795 N ARG A 125 -7.603 -1.177 -8.995 1.00 14.24 N ATOM 1796 CA ARG A 125 -6.508 -1.368 -9.888 1.00 34.12 C ATOM 1797 C ARG A 125 -6.078 -2.822 -9.934 1.00 3.55 C ATOM 1798 O ARG A 125 -5.836 -3.441 -8.895 1.00 1.51 O ATOM 1799 CB ARG A 125 -5.332 -0.467 -9.505 1.00 43.42 C ATOM 1800 CG ARG A 125 -4.176 -0.580 -10.465 1.00 4.54 C ATOM 1801 CD ARG A 125 -3.045 0.355 -10.126 1.00 61.34 C ATOM 1802 NE ARG A 125 -1.976 0.227 -11.111 1.00 14.01 N ATOM 1803 CZ ARG A 125 -0.877 0.961 -11.169 1.00 23.11 C ATOM 1804 NH1 ARG A 125 -0.652 1.928 -10.282 1.00 51.52 N ATOM 1805 NH2 ARG A 125 0.000 0.739 -12.131 1.00 60.24 N ATOM 0 H ARG A 125 -7.519 -1.662 -8.102 1.00 14.24 H new ATOM 0 HA ARG A 125 -6.843 -1.090 -10.887 1.00 34.12 H new ATOM 0 HB2 ARG A 125 -5.670 0.569 -9.470 1.00 43.42 H new ATOM 0 HB3 ARG A 125 -4.993 -0.726 -8.502 1.00 43.42 H new ATOM 0 HG2 ARG A 125 -3.807 -1.606 -10.464 1.00 4.54 H new ATOM 0 HG3 ARG A 125 -4.526 -0.369 -11.475 1.00 4.54 H new ATOM 0 HD2 ARG A 125 -3.407 1.383 -10.102 1.00 61.34 H new ATOM 0 HD3 ARG A 125 -2.662 0.129 -9.131 1.00 61.34 H new ATOM 0 HE ARG A 125 -2.087 -0.496 -11.822 1.00 14.01 H new ATOM 0 HH11 ARG A 125 -1.332 2.112 -9.544 1.00 51.52 H new ATOM 0 HH12 ARG A 125 0.200 2.485 -10.340 1.00 51.52 H new ATOM 0 HH21 ARG A 125 -0.173 0.007 -12.820 1.00 60.24 H new ATOM 0 HH22 ARG A 125 0.851 1.299 -12.185 1.00 60.24 H new ATOM 1819 N GLU A 126 -6.004 -3.356 -11.130 1.00 73.12 N ATOM 1820 CA GLU A 126 -5.546 -4.705 -11.356 1.00 61.43 C ATOM 1821 C GLU A 126 -4.659 -4.710 -12.590 1.00 40.43 C ATOM 1822 O GLU A 126 -4.512 -3.672 -13.260 1.00 25.22 O ATOM 1823 CB GLU A 126 -6.733 -5.659 -11.548 1.00 12.35 C ATOM 1824 CG GLU A 126 -7.601 -5.338 -12.751 1.00 13.44 C ATOM 1825 CD GLU A 126 -8.773 -6.265 -12.876 1.00 72.33 C ATOM 1826 OE1 GLU A 126 -8.600 -7.400 -13.356 1.00 2.43 O ATOM 1827 OE2 GLU A 126 -9.898 -5.871 -12.513 1.00 54.15 O ATOM 0 H GLU A 126 -6.263 -2.860 -11.983 1.00 73.12 H new ATOM 0 HA GLU A 126 -4.983 -5.050 -10.489 1.00 61.43 H new ATOM 0 HB2 GLU A 126 -6.355 -6.676 -11.648 1.00 12.35 H new ATOM 0 HB3 GLU A 126 -7.352 -5.636 -10.651 1.00 12.35 H new ATOM 0 HG2 GLU A 126 -7.960 -4.312 -12.673 1.00 13.44 H new ATOM 0 HG3 GLU A 126 -6.997 -5.396 -13.657 1.00 13.44 H new ATOM 1834 N GLY A 127 -4.079 -5.840 -12.896 1.00 3.34 N ATOM 1835 CA GLY A 127 -3.217 -5.941 -14.051 1.00 32.11 C ATOM 1836 C GLY A 127 -1.775 -5.705 -13.693 1.00 72.10 C ATOM 1837 O GLY A 127 -0.938 -5.431 -14.564 1.00 64.30 O ATOM 0 H GLY A 127 -4.185 -6.704 -12.365 1.00 3.34 H new ATOM 0 HA2 GLY A 127 -3.323 -6.929 -14.499 1.00 32.11 H new ATOM 0 HA3 GLY A 127 -3.529 -5.215 -14.802 1.00 32.11 H new ATOM 1841 N ILE A 128 -1.474 -5.791 -12.408 1.00 20.52 N ATOM 1842 CA ILE A 128 -0.130 -5.621 -11.935 1.00 70.53 C ATOM 1843 C ILE A 128 0.239 -6.717 -10.960 1.00 62.33 C ATOM 1844 O ILE A 128 -0.616 -7.236 -10.226 1.00 75.34 O ATOM 1845 CB ILE A 128 0.121 -4.237 -11.268 1.00 34.02 C ATOM 1846 CG1 ILE A 128 -0.854 -3.976 -10.130 1.00 73.53 C ATOM 1847 CG2 ILE A 128 0.086 -3.113 -12.292 1.00 14.25 C ATOM 1848 CD1 ILE A 128 -0.558 -2.711 -9.367 1.00 44.33 C ATOM 0 H ILE A 128 -2.158 -5.980 -11.675 1.00 20.52 H new ATOM 0 HA ILE A 128 0.503 -5.676 -12.821 1.00 70.53 H new ATOM 0 HB ILE A 128 1.123 -4.263 -10.839 1.00 34.02 H new ATOM 0 HG12 ILE A 128 -1.865 -3.920 -10.533 1.00 73.53 H new ATOM 0 HG13 ILE A 128 -0.832 -4.821 -9.441 1.00 73.53 H new ATOM 0 HG21 ILE A 128 0.265 -2.161 -11.793 1.00 14.25 H new ATOM 0 HG22 ILE A 128 0.859 -3.280 -13.042 1.00 14.25 H new ATOM 0 HG23 ILE A 128 -0.891 -3.092 -12.775 1.00 14.25 H new ATOM 0 HD11 ILE A 128 -1.291 -2.587 -8.570 1.00 44.33 H new ATOM 0 HD12 ILE A 128 0.441 -2.772 -8.935 1.00 44.33 H new ATOM 0 HD13 ILE A 128 -0.609 -1.858 -10.043 1.00 44.33 H new ATOM 1860 N THR A 129 1.479 -7.091 -10.983 1.00 21.03 N ATOM 1861 CA THR A 129 2.004 -8.029 -10.051 1.00 4.13 C ATOM 1862 C THR A 129 2.815 -7.245 -9.045 1.00 52.32 C ATOM 1863 O THR A 129 3.583 -6.347 -9.421 1.00 61.31 O ATOM 1864 CB THR A 129 2.916 -9.061 -10.761 1.00 15.53 C ATOM 1865 OG1 THR A 129 2.188 -9.698 -11.827 1.00 11.04 O ATOM 1866 CG2 THR A 129 3.397 -10.131 -9.785 1.00 31.55 C ATOM 0 H THR A 129 2.161 -6.747 -11.659 1.00 21.03 H new ATOM 0 HA THR A 129 1.194 -8.578 -9.571 1.00 4.13 H new ATOM 0 HB THR A 129 3.782 -8.530 -11.158 1.00 15.53 H new ATOM 0 HG1 THR A 129 2.767 -10.349 -12.275 1.00 11.04 H new ATOM 0 HG21 THR A 129 4.035 -10.842 -10.310 1.00 31.55 H new ATOM 0 HG22 THR A 129 3.963 -9.662 -8.980 1.00 31.55 H new ATOM 0 HG23 THR A 129 2.537 -10.655 -9.367 1.00 31.55 H new ATOM 1874 N VAL A 130 2.647 -7.546 -7.800 1.00 41.01 N ATOM 1875 CA VAL A 130 3.376 -6.874 -6.778 1.00 41.11 C ATOM 1876 C VAL A 130 4.118 -7.872 -5.965 1.00 11.00 C ATOM 1877 O VAL A 130 3.661 -9.007 -5.770 1.00 71.52 O ATOM 1878 CB VAL A 130 2.490 -5.977 -5.855 1.00 21.43 C ATOM 1879 CG1 VAL A 130 1.886 -4.819 -6.636 1.00 32.25 C ATOM 1880 CG2 VAL A 130 1.389 -6.789 -5.174 1.00 51.02 C ATOM 0 H VAL A 130 2.003 -8.262 -7.464 1.00 41.01 H new ATOM 0 HA VAL A 130 4.067 -6.195 -7.279 1.00 41.11 H new ATOM 0 HB VAL A 130 3.139 -5.571 -5.079 1.00 21.43 H new ATOM 0 HG11 VAL A 130 1.274 -4.211 -5.970 1.00 32.25 H new ATOM 0 HG12 VAL A 130 2.685 -4.207 -7.055 1.00 32.25 H new ATOM 0 HG13 VAL A 130 1.266 -5.209 -7.443 1.00 32.25 H new ATOM 0 HG21 VAL A 130 0.792 -6.133 -4.540 1.00 51.02 H new ATOM 0 HG22 VAL A 130 0.749 -7.242 -5.932 1.00 51.02 H new ATOM 0 HG23 VAL A 130 1.839 -7.572 -4.564 1.00 51.02 H new ATOM 1890 N TYR A 131 5.252 -7.482 -5.517 1.00 12.35 N ATOM 1891 CA TYR A 131 6.072 -8.340 -4.752 1.00 25.53 C ATOM 1892 C TYR A 131 6.119 -7.749 -3.385 1.00 2.54 C ATOM 1893 O TYR A 131 6.496 -6.600 -3.218 1.00 61.53 O ATOM 1894 CB TYR A 131 7.468 -8.383 -5.387 1.00 22.20 C ATOM 1895 CG TYR A 131 7.413 -8.624 -6.892 1.00 45.42 C ATOM 1896 CD1 TYR A 131 7.058 -9.853 -7.399 1.00 52.12 C ATOM 1897 CD2 TYR A 131 7.696 -7.600 -7.796 1.00 24.12 C ATOM 1898 CE1 TYR A 131 6.981 -10.076 -8.755 1.00 4.11 C ATOM 1899 CE2 TYR A 131 7.625 -7.813 -9.158 1.00 4.54 C ATOM 1900 CZ TYR A 131 7.264 -9.055 -9.630 1.00 41.33 C ATOM 1901 OH TYR A 131 7.177 -9.278 -10.990 1.00 53.33 O ATOM 0 H TYR A 131 5.640 -6.551 -5.672 1.00 12.35 H new ATOM 0 HA TYR A 131 5.694 -9.362 -4.712 1.00 25.53 H new ATOM 0 HB2 TYR A 131 7.983 -7.443 -5.191 1.00 22.20 H new ATOM 0 HB3 TYR A 131 8.055 -9.172 -4.916 1.00 22.20 H new ATOM 0 HD1 TYR A 131 6.835 -10.661 -6.718 1.00 52.12 H new ATOM 0 HD2 TYR A 131 7.975 -6.625 -7.424 1.00 24.12 H new ATOM 0 HE1 TYR A 131 6.699 -11.049 -9.130 1.00 4.11 H new ATOM 0 HE2 TYR A 131 7.851 -7.013 -9.847 1.00 4.54 H new ATOM 0 HH TYR A 131 6.496 -9.960 -11.167 1.00 53.33 H new ATOM 1911 N SER A 132 5.726 -8.508 -2.436 1.00 73.11 N ATOM 1912 CA SER A 132 5.580 -8.041 -1.107 1.00 3.32 C ATOM 1913 C SER A 132 6.639 -8.638 -0.205 1.00 72.05 C ATOM 1914 O SER A 132 7.091 -9.766 -0.424 1.00 60.44 O ATOM 1915 CB SER A 132 4.184 -8.417 -0.614 1.00 51.41 C ATOM 1916 OG SER A 132 3.184 -7.927 -1.511 1.00 52.23 O ATOM 0 H SER A 132 5.491 -9.493 -2.560 1.00 73.11 H new ATOM 0 HA SER A 132 5.704 -6.958 -1.085 1.00 3.32 H new ATOM 0 HB2 SER A 132 4.103 -9.501 -0.527 1.00 51.41 H new ATOM 0 HB3 SER A 132 4.021 -8.004 0.382 1.00 51.41 H new ATOM 0 HG SER A 132 3.029 -6.975 -1.339 1.00 52.23 H new ATOM 1922 N THR A 133 7.060 -7.877 0.762 1.00 2.52 N ATOM 1923 CA THR A 133 7.976 -8.348 1.742 1.00 41.54 C ATOM 1924 C THR A 133 7.487 -7.942 3.125 1.00 13.44 C ATOM 1925 O THR A 133 7.185 -6.761 3.368 1.00 22.23 O ATOM 1926 CB THR A 133 9.446 -7.845 1.491 1.00 2.32 C ATOM 1927 OG1 THR A 133 10.337 -8.417 2.445 1.00 71.34 O ATOM 1928 CG2 THR A 133 9.570 -6.323 1.530 1.00 51.15 C ATOM 0 H THR A 133 6.772 -6.907 0.888 1.00 2.52 H new ATOM 0 HA THR A 133 8.013 -9.435 1.671 1.00 41.54 H new ATOM 0 HB THR A 133 9.714 -8.169 0.485 1.00 2.32 H new ATOM 0 HG1 THR A 133 10.482 -9.362 2.231 1.00 71.34 H new ATOM 0 HG21 THR A 133 10.607 -6.038 1.350 1.00 51.15 H new ATOM 0 HG22 THR A 133 8.935 -5.886 0.760 1.00 51.15 H new ATOM 0 HG23 THR A 133 9.258 -5.957 2.508 1.00 51.15 H new ATOM 1936 N GLN A 134 7.339 -8.911 3.999 1.00 1.42 N ATOM 1937 CA GLN A 134 6.982 -8.640 5.362 1.00 74.15 C ATOM 1938 C GLN A 134 8.138 -8.955 6.252 1.00 14.42 C ATOM 1939 O GLN A 134 8.698 -10.067 6.220 1.00 31.22 O ATOM 1940 CB GLN A 134 5.718 -9.370 5.812 1.00 44.20 C ATOM 1941 CG GLN A 134 4.467 -8.911 5.096 1.00 73.43 C ATOM 1942 CD GLN A 134 3.210 -9.563 5.628 1.00 33.15 C ATOM 1943 OE1 GLN A 134 2.787 -10.612 5.160 1.00 4.41 O ATOM 1944 NE2 GLN A 134 2.606 -8.948 6.613 1.00 33.13 N ATOM 0 H GLN A 134 7.463 -9.900 3.782 1.00 1.42 H new ATOM 0 HA GLN A 134 6.745 -7.578 5.433 1.00 74.15 H new ATOM 0 HB2 GLN A 134 5.848 -10.440 5.649 1.00 44.20 H new ATOM 0 HB3 GLN A 134 5.587 -9.225 6.884 1.00 44.20 H new ATOM 0 HG2 GLN A 134 4.377 -7.829 5.191 1.00 73.43 H new ATOM 0 HG3 GLN A 134 4.562 -9.131 4.033 1.00 73.43 H new ATOM 0 HE21 GLN A 134 2.986 -8.075 6.979 1.00 33.13 H new ATOM 0 HE22 GLN A 134 1.755 -9.342 7.015 1.00 33.13 H new ATOM 1953 N PHE A 135 8.496 -8.005 7.028 1.00 62.42 N ATOM 1954 CA PHE A 135 9.634 -8.107 7.883 1.00 20.34 C ATOM 1955 C PHE A 135 9.294 -7.540 9.233 1.00 23.55 C ATOM 1956 O PHE A 135 8.259 -6.872 9.393 1.00 24.31 O ATOM 1957 CB PHE A 135 10.821 -7.333 7.267 1.00 34.33 C ATOM 1958 CG PHE A 135 10.568 -5.858 7.094 1.00 3.52 C ATOM 1959 CD1 PHE A 135 9.839 -5.387 6.016 1.00 15.43 C ATOM 1960 CD2 PHE A 135 11.055 -4.945 8.019 1.00 1.14 C ATOM 1961 CE1 PHE A 135 9.601 -4.047 5.867 1.00 30.22 C ATOM 1962 CE2 PHE A 135 10.817 -3.602 7.870 1.00 72.02 C ATOM 1963 CZ PHE A 135 10.089 -3.157 6.797 1.00 64.45 C ATOM 0 H PHE A 135 8.003 -7.114 7.095 1.00 62.42 H new ATOM 0 HA PHE A 135 9.916 -9.154 7.993 1.00 20.34 H new ATOM 0 HB2 PHE A 135 11.698 -7.469 7.900 1.00 34.33 H new ATOM 0 HB3 PHE A 135 11.059 -7.767 6.296 1.00 34.33 H new ATOM 0 HD1 PHE A 135 9.454 -6.083 5.285 1.00 15.43 H new ATOM 0 HD2 PHE A 135 11.627 -5.295 8.865 1.00 1.14 H new ATOM 0 HE1 PHE A 135 9.032 -3.689 5.022 1.00 30.22 H new ATOM 0 HE2 PHE A 135 11.201 -2.899 8.594 1.00 72.02 H new ATOM 0 HZ PHE A 135 9.897 -2.101 6.680 1.00 64.45 H new ATOM 1973 N GLY A 136 10.145 -7.795 10.183 1.00 11.15 N ATOM 1974 CA GLY A 136 9.969 -7.267 11.487 1.00 22.31 C ATOM 1975 C GLY A 136 11.147 -6.421 11.863 1.00 2.24 C ATOM 1976 O GLY A 136 12.292 -6.892 11.818 1.00 11.23 O ATOM 0 H GLY A 136 10.976 -8.375 10.068 1.00 11.15 H new ATOM 0 HA2 GLY A 136 9.057 -6.672 11.527 1.00 22.31 H new ATOM 0 HA3 GLY A 136 9.851 -8.080 12.204 1.00 22.31 H new ATOM 1980 N GLY A 137 10.895 -5.191 12.198 1.00 32.31 N ATOM 1981 CA GLY A 137 11.944 -4.295 12.560 1.00 14.31 C ATOM 1982 C GLY A 137 11.462 -2.881 12.600 1.00 62.30 C ATOM 1983 O GLY A 137 10.345 -2.593 12.187 1.00 42.31 O ATOM 0 H GLY A 137 9.960 -4.785 12.227 1.00 32.31 H new ATOM 0 HA2 GLY A 137 12.342 -4.573 13.536 1.00 14.31 H new ATOM 0 HA3 GLY A 137 12.762 -4.382 11.845 1.00 14.31 H new ATOM 1987 N TYR A 138 12.282 -2.008 13.094 1.00 31.50 N ATOM 1988 CA TYR A 138 11.929 -0.619 13.209 1.00 31.15 C ATOM 1989 C TYR A 138 12.410 0.108 11.969 1.00 51.23 C ATOM 1990 O TYR A 138 13.600 0.421 11.836 1.00 54.14 O ATOM 1991 CB TYR A 138 12.556 -0.027 14.475 1.00 30.44 C ATOM 1992 CG TYR A 138 12.173 -0.774 15.739 1.00 63.21 C ATOM 1993 CD1 TYR A 138 11.010 -0.470 16.414 1.00 11.22 C ATOM 1994 CD2 TYR A 138 12.975 -1.789 16.245 1.00 34.42 C ATOM 1995 CE1 TYR A 138 10.643 -1.145 17.557 1.00 3.34 C ATOM 1996 CE2 TYR A 138 12.621 -2.472 17.389 1.00 4.44 C ATOM 1997 CZ TYR A 138 11.452 -2.145 18.042 1.00 63.00 C ATOM 1998 OH TYR A 138 11.087 -2.828 19.182 1.00 53.31 O ATOM 0 H TYR A 138 13.218 -2.234 13.431 1.00 31.50 H new ATOM 0 HA TYR A 138 10.848 -0.508 13.289 1.00 31.15 H new ATOM 0 HB2 TYR A 138 13.641 -0.033 14.372 1.00 30.44 H new ATOM 0 HB3 TYR A 138 12.251 1.015 14.570 1.00 30.44 H new ATOM 0 HD1 TYR A 138 10.372 0.316 16.038 1.00 11.22 H new ATOM 0 HD2 TYR A 138 13.891 -2.047 15.734 1.00 34.42 H new ATOM 0 HE1 TYR A 138 9.726 -0.891 18.068 1.00 3.34 H new ATOM 0 HE2 TYR A 138 13.255 -3.258 17.771 1.00 4.44 H new ATOM 0 HH TYR A 138 11.766 -3.503 19.390 1.00 53.31 H new ATOM 2008 N ALA A 139 11.508 0.349 11.058 1.00 55.33 N ATOM 2009 CA ALA A 139 11.859 0.912 9.777 1.00 43.14 C ATOM 2010 C ALA A 139 11.650 2.412 9.703 1.00 41.31 C ATOM 2011 O ALA A 139 10.613 2.937 10.109 1.00 11.04 O ATOM 2012 CB ALA A 139 11.076 0.221 8.673 1.00 31.40 C ATOM 0 H ALA A 139 10.512 0.163 11.178 1.00 55.33 H new ATOM 0 HA ALA A 139 12.927 0.740 9.643 1.00 43.14 H new ATOM 0 HB1 ALA A 139 11.347 0.653 7.710 1.00 31.40 H new ATOM 0 HB2 ALA A 139 11.310 -0.844 8.673 1.00 31.40 H new ATOM 0 HB3 ALA A 139 10.008 0.358 8.844 1.00 31.40 H new ATOM 2018 N LYS A 140 12.656 3.091 9.203 1.00 41.04 N ATOM 2019 CA LYS A 140 12.590 4.501 8.903 1.00 23.14 C ATOM 2020 C LYS A 140 12.382 4.625 7.402 1.00 61.13 C ATOM 2021 O LYS A 140 12.376 3.606 6.698 1.00 64.10 O ATOM 2022 CB LYS A 140 13.912 5.174 9.277 1.00 74.41 C ATOM 2023 CG LYS A 140 14.281 5.065 10.749 1.00 42.43 C ATOM 2024 CD LYS A 140 15.681 5.609 11.014 1.00 10.24 C ATOM 2025 CE LYS A 140 15.808 7.074 10.627 1.00 42.54 C ATOM 2026 NZ LYS A 140 17.173 7.591 10.852 1.00 53.15 N ATOM 0 H LYS A 140 13.560 2.670 8.990 1.00 41.04 H new ATOM 0 HA LYS A 140 11.783 4.976 9.461 1.00 23.14 H new ATOM 0 HB2 LYS A 140 14.711 4.733 8.681 1.00 74.41 H new ATOM 0 HB3 LYS A 140 13.858 6.228 9.006 1.00 74.41 H new ATOM 0 HG2 LYS A 140 13.556 5.615 11.349 1.00 42.43 H new ATOM 0 HG3 LYS A 140 14.229 4.022 11.062 1.00 42.43 H new ATOM 0 HD2 LYS A 140 15.921 5.492 12.071 1.00 10.24 H new ATOM 0 HD3 LYS A 140 16.409 5.022 10.454 1.00 10.24 H new ATOM 0 HE2 LYS A 140 15.543 7.195 9.577 1.00 42.54 H new ATOM 0 HE3 LYS A 140 15.097 7.664 11.205 1.00 42.54 H new ATOM 0 HZ1 LYS A 140 17.215 8.593 10.575 1.00 53.15 H new ATOM 0 HZ2 LYS A 140 17.417 7.500 11.859 1.00 53.15 H new ATOM 0 HZ3 LYS A 140 17.849 7.045 10.281 1.00 53.15 H new ATOM 2040 N GLU A 141 12.233 5.840 6.901 1.00 60.43 N ATOM 2041 CA GLU A 141 12.057 6.059 5.459 1.00 63.52 C ATOM 2042 C GLU A 141 13.247 5.490 4.657 1.00 54.25 C ATOM 2043 O GLU A 141 13.068 4.943 3.568 1.00 65.25 O ATOM 2044 CB GLU A 141 11.849 7.546 5.155 1.00 64.50 C ATOM 2045 CG GLU A 141 13.003 8.431 5.575 1.00 64.34 C ATOM 2046 CD GLU A 141 12.763 9.878 5.282 1.00 43.21 C ATOM 2047 OE1 GLU A 141 12.918 10.294 4.118 1.00 11.15 O ATOM 2048 OE2 GLU A 141 12.418 10.622 6.211 1.00 52.31 O ATOM 0 H GLU A 141 12.229 6.692 7.462 1.00 60.43 H new ATOM 0 HA GLU A 141 11.162 5.522 5.146 1.00 63.52 H new ATOM 0 HB2 GLU A 141 11.683 7.667 4.084 1.00 64.50 H new ATOM 0 HB3 GLU A 141 10.943 7.885 5.658 1.00 64.50 H new ATOM 0 HG2 GLU A 141 13.180 8.306 6.643 1.00 64.34 H new ATOM 0 HG3 GLU A 141 13.908 8.107 5.062 1.00 64.34 H new ATOM 2055 N ALA A 142 14.452 5.605 5.222 1.00 23.32 N ATOM 2056 CA ALA A 142 15.652 5.071 4.594 1.00 4.05 C ATOM 2057 C ALA A 142 15.596 3.550 4.556 1.00 32.22 C ATOM 2058 O ALA A 142 16.033 2.931 3.590 1.00 3.52 O ATOM 2059 CB ALA A 142 16.899 5.551 5.324 1.00 63.53 C ATOM 0 H ALA A 142 14.617 6.066 6.117 1.00 23.32 H new ATOM 0 HA ALA A 142 15.701 5.438 3.569 1.00 4.05 H new ATOM 0 HB1 ALA A 142 17.785 5.141 4.839 1.00 63.53 H new ATOM 0 HB2 ALA A 142 16.941 6.640 5.295 1.00 63.53 H new ATOM 0 HB3 ALA A 142 16.865 5.216 6.361 1.00 63.53 H new ATOM 2065 N ASP A 143 15.029 2.951 5.611 1.00 10.23 N ATOM 2066 CA ASP A 143 14.856 1.502 5.662 1.00 31.55 C ATOM 2067 C ASP A 143 13.946 1.064 4.566 1.00 33.13 C ATOM 2068 O ASP A 143 14.215 0.068 3.899 1.00 60.43 O ATOM 2069 CB ASP A 143 14.296 1.008 7.007 1.00 23.44 C ATOM 2070 CG ASP A 143 15.248 1.181 8.150 1.00 12.02 C ATOM 2071 OD1 ASP A 143 15.278 2.270 8.754 1.00 61.54 O ATOM 2072 OD2 ASP A 143 15.971 0.228 8.481 1.00 25.44 O ATOM 0 H ASP A 143 14.686 3.447 6.433 1.00 10.23 H new ATOM 0 HA ASP A 143 15.847 1.065 5.542 1.00 31.55 H new ATOM 0 HB2 ASP A 143 13.374 1.546 7.228 1.00 23.44 H new ATOM 0 HB3 ASP A 143 14.036 -0.047 6.918 1.00 23.44 H new ATOM 2077 N TYR A 144 12.858 1.825 4.353 1.00 43.24 N ATOM 2078 CA TYR A 144 11.908 1.505 3.302 1.00 54.31 C ATOM 2079 C TYR A 144 12.561 1.434 1.953 1.00 44.44 C ATOM 2080 O TYR A 144 12.325 0.485 1.207 1.00 24.55 O ATOM 2081 CB TYR A 144 10.670 2.410 3.288 1.00 31.21 C ATOM 2082 CG TYR A 144 9.658 2.119 4.384 1.00 40.12 C ATOM 2083 CD1 TYR A 144 8.699 1.107 4.220 1.00 21.24 C ATOM 2084 CD2 TYR A 144 9.641 2.848 5.556 1.00 3.02 C ATOM 2085 CE1 TYR A 144 7.761 0.841 5.205 1.00 52.35 C ATOM 2086 CE2 TYR A 144 8.716 2.592 6.544 1.00 2.42 C ATOM 2087 CZ TYR A 144 7.782 1.594 6.370 1.00 20.43 C ATOM 2088 OH TYR A 144 6.864 1.361 7.354 1.00 73.44 O ATOM 0 H TYR A 144 12.626 2.657 4.896 1.00 43.24 H new ATOM 0 HA TYR A 144 11.540 0.508 3.543 1.00 54.31 H new ATOM 0 HB2 TYR A 144 10.994 3.447 3.377 1.00 31.21 H new ATOM 0 HB3 TYR A 144 10.176 2.312 2.321 1.00 31.21 H new ATOM 0 HD1 TYR A 144 8.692 0.525 3.310 1.00 21.24 H new ATOM 0 HD2 TYR A 144 10.367 3.634 5.701 1.00 3.02 H new ATOM 0 HE1 TYR A 144 7.027 0.061 5.068 1.00 52.35 H new ATOM 0 HE2 TYR A 144 8.723 3.173 7.454 1.00 2.42 H new ATOM 0 HH TYR A 144 7.021 1.976 8.101 1.00 73.44 H new ATOM 2098 N VAL A 145 13.411 2.381 1.673 1.00 52.23 N ATOM 2099 CA VAL A 145 14.141 2.399 0.426 1.00 52.20 C ATOM 2100 C VAL A 145 15.106 1.215 0.359 1.00 24.21 C ATOM 2101 O VAL A 145 15.115 0.457 -0.628 1.00 41.31 O ATOM 2102 CB VAL A 145 14.930 3.713 0.270 1.00 64.13 C ATOM 2103 CG1 VAL A 145 15.698 3.735 -1.037 1.00 15.13 C ATOM 2104 CG2 VAL A 145 13.996 4.904 0.359 1.00 3.25 C ATOM 0 H VAL A 145 13.621 3.161 2.296 1.00 52.23 H new ATOM 0 HA VAL A 145 13.419 2.324 -0.387 1.00 52.20 H new ATOM 0 HB VAL A 145 15.651 3.774 1.085 1.00 64.13 H new ATOM 0 HG11 VAL A 145 16.246 4.674 -1.121 1.00 15.13 H new ATOM 0 HG12 VAL A 145 16.400 2.902 -1.061 1.00 15.13 H new ATOM 0 HG13 VAL A 145 15.001 3.646 -1.870 1.00 15.13 H new ATOM 0 HG21 VAL A 145 14.569 5.825 0.247 1.00 3.25 H new ATOM 0 HG22 VAL A 145 13.250 4.842 -0.434 1.00 3.25 H new ATOM 0 HG23 VAL A 145 13.497 4.903 1.328 1.00 3.25 H new ATOM 2114 N ALA A 146 15.883 1.038 1.430 1.00 30.41 N ATOM 2115 CA ALA A 146 16.887 -0.016 1.500 1.00 54.13 C ATOM 2116 C ALA A 146 16.283 -1.399 1.273 1.00 55.21 C ATOM 2117 O ALA A 146 16.775 -2.147 0.444 1.00 50.40 O ATOM 2118 CB ALA A 146 17.624 0.033 2.835 1.00 74.32 C ATOM 0 H ALA A 146 15.832 1.620 2.266 1.00 30.41 H new ATOM 0 HA ALA A 146 17.601 0.163 0.696 1.00 54.13 H new ATOM 0 HB1 ALA A 146 18.369 -0.762 2.868 1.00 74.32 H new ATOM 0 HB2 ALA A 146 18.118 0.999 2.943 1.00 74.32 H new ATOM 0 HB3 ALA A 146 16.912 -0.103 3.649 1.00 74.32 H new ATOM 2124 N HIS A 147 15.184 -1.712 1.960 1.00 60.20 N ATOM 2125 CA HIS A 147 14.541 -3.026 1.779 1.00 1.20 C ATOM 2126 C HIS A 147 13.830 -3.157 0.462 1.00 53.43 C ATOM 2127 O HIS A 147 13.743 -4.236 -0.067 1.00 44.14 O ATOM 2128 CB HIS A 147 13.646 -3.510 2.957 1.00 60.30 C ATOM 2129 CG HIS A 147 12.608 -2.580 3.411 1.00 25.03 C ATOM 2130 ND1 HIS A 147 12.592 -2.056 4.667 1.00 4.45 N ATOM 2131 CD2 HIS A 147 11.521 -2.113 2.802 1.00 34.13 C ATOM 2132 CE1 HIS A 147 11.542 -1.307 4.819 1.00 45.32 C ATOM 2133 NE2 HIS A 147 10.868 -1.320 3.700 1.00 24.02 N ATOM 0 H HIS A 147 14.725 -1.096 2.631 1.00 60.20 H new ATOM 0 HA HIS A 147 15.390 -3.710 1.775 1.00 1.20 H new ATOM 0 HB2 HIS A 147 13.164 -4.441 2.660 1.00 60.30 H new ATOM 0 HB3 HIS A 147 14.292 -3.741 3.804 1.00 60.30 H new ATOM 0 HD2 HIS A 147 11.214 -2.322 1.788 1.00 34.13 H new ATOM 0 HE1 HIS A 147 11.273 -0.767 5.715 1.00 45.32 H new ATOM 0 HE2 HIS A 147 9.996 -0.819 3.526 1.00 24.02 H new ATOM 2142 N ALA A 148 13.294 -2.067 -0.049 1.00 2.53 N ATOM 2143 CA ALA A 148 12.586 -2.112 -1.329 1.00 64.44 C ATOM 2144 C ALA A 148 13.529 -2.528 -2.450 1.00 31.10 C ATOM 2145 O ALA A 148 13.241 -3.448 -3.216 1.00 33.02 O ATOM 2146 CB ALA A 148 11.971 -0.770 -1.644 1.00 33.31 C ATOM 0 H ALA A 148 13.330 -1.147 0.389 1.00 2.53 H new ATOM 0 HA ALA A 148 11.790 -2.852 -1.249 1.00 64.44 H new ATOM 0 HB1 ALA A 148 11.449 -0.824 -2.599 1.00 33.31 H new ATOM 0 HB2 ALA A 148 11.264 -0.501 -0.859 1.00 33.31 H new ATOM 0 HB3 ALA A 148 12.755 -0.015 -1.701 1.00 33.31 H new ATOM 2152 N THR A 149 14.678 -1.899 -2.505 1.00 41.13 N ATOM 2153 CA THR A 149 15.624 -2.220 -3.529 1.00 71.21 C ATOM 2154 C THR A 149 16.337 -3.557 -3.185 1.00 33.40 C ATOM 2155 O THR A 149 16.703 -4.346 -4.078 1.00 11.31 O ATOM 2156 CB THR A 149 16.625 -1.051 -3.803 1.00 33.35 C ATOM 2157 OG1 THR A 149 17.337 -1.303 -5.013 1.00 3.04 O ATOM 2158 CG2 THR A 149 17.618 -0.861 -2.658 1.00 2.44 C ATOM 0 H THR A 149 14.973 -1.169 -1.856 1.00 41.13 H new ATOM 0 HA THR A 149 15.085 -2.357 -4.466 1.00 71.21 H new ATOM 0 HB THR A 149 16.042 -0.134 -3.891 1.00 33.35 H new ATOM 0 HG1 THR A 149 16.723 -1.235 -5.774 1.00 3.04 H new ATOM 0 HG21 THR A 149 18.293 -0.038 -2.894 1.00 2.44 H new ATOM 0 HG22 THR A 149 17.076 -0.634 -1.740 1.00 2.44 H new ATOM 0 HG23 THR A 149 18.195 -1.775 -2.521 1.00 2.44 H new ATOM 2166 N GLN A 150 16.513 -3.820 -1.883 1.00 1.34 N ATOM 2167 CA GLN A 150 17.095 -5.076 -1.429 1.00 75.40 C ATOM 2168 C GLN A 150 16.182 -6.240 -1.785 1.00 12.31 C ATOM 2169 O GLN A 150 16.651 -7.320 -2.094 1.00 1.13 O ATOM 2170 CB GLN A 150 17.362 -5.059 0.075 1.00 63.45 C ATOM 2171 CG GLN A 150 17.968 -6.337 0.603 1.00 33.32 C ATOM 2172 CD GLN A 150 18.271 -6.293 2.080 1.00 70.22 C ATOM 2173 OE1 GLN A 150 17.608 -5.605 2.857 1.00 73.03 O ATOM 2174 NE2 GLN A 150 19.255 -7.038 2.475 1.00 55.23 N ATOM 0 H GLN A 150 16.259 -3.177 -1.133 1.00 1.34 H new ATOM 0 HA GLN A 150 18.051 -5.201 -1.938 1.00 75.40 H new ATOM 0 HB2 GLN A 150 18.030 -4.229 0.306 1.00 63.45 H new ATOM 0 HB3 GLN A 150 16.425 -4.869 0.598 1.00 63.45 H new ATOM 0 HG2 GLN A 150 17.285 -7.163 0.405 1.00 33.32 H new ATOM 0 HG3 GLN A 150 18.888 -6.546 0.057 1.00 33.32 H new ATOM 0 HE21 GLN A 150 19.779 -7.593 1.798 1.00 55.23 H new ATOM 0 HE22 GLN A 150 19.506 -7.070 3.463 1.00 55.23 H new ATOM 2183 N LEU A 151 14.877 -6.012 -1.750 1.00 14.34 N ATOM 2184 CA LEU A 151 13.910 -7.035 -2.116 1.00 35.03 C ATOM 2185 C LEU A 151 14.100 -7.414 -3.567 1.00 32.32 C ATOM 2186 O LEU A 151 14.083 -8.582 -3.912 1.00 0.45 O ATOM 2187 CB LEU A 151 12.472 -6.566 -1.881 1.00 55.43 C ATOM 2188 CG LEU A 151 11.385 -7.605 -2.178 1.00 51.21 C ATOM 2189 CD1 LEU A 151 11.532 -8.808 -1.272 1.00 43.34 C ATOM 2190 CD2 LEU A 151 9.997 -7.009 -2.058 1.00 74.23 C ATOM 0 H LEU A 151 14.463 -5.123 -1.470 1.00 14.34 H new ATOM 0 HA LEU A 151 14.081 -7.904 -1.481 1.00 35.03 H new ATOM 0 HB2 LEU A 151 12.376 -6.251 -0.842 1.00 55.43 H new ATOM 0 HB3 LEU A 151 12.289 -5.687 -2.499 1.00 55.43 H new ATOM 0 HG LEU A 151 11.515 -7.932 -3.210 1.00 51.21 H new ATOM 0 HD11 LEU A 151 10.750 -9.533 -1.500 1.00 43.34 H new ATOM 0 HD12 LEU A 151 12.509 -9.266 -1.430 1.00 43.34 H new ATOM 0 HD13 LEU A 151 11.443 -8.493 -0.232 1.00 43.34 H new ATOM 0 HD21 LEU A 151 9.252 -7.775 -2.275 1.00 74.23 H new ATOM 0 HD22 LEU A 151 9.848 -6.635 -1.045 1.00 74.23 H new ATOM 0 HD23 LEU A 151 9.891 -6.188 -2.767 1.00 74.23 H new ATOM 2202 N ARG A 152 14.324 -6.413 -4.407 1.00 14.23 N ATOM 2203 CA ARG A 152 14.591 -6.630 -5.815 1.00 5.25 C ATOM 2204 C ARG A 152 15.883 -7.444 -5.990 1.00 33.23 C ATOM 2205 O ARG A 152 15.977 -8.323 -6.846 1.00 35.15 O ATOM 2206 CB ARG A 152 14.667 -5.284 -6.556 1.00 40.34 C ATOM 2207 CG ARG A 152 15.014 -5.426 -8.014 1.00 65.32 C ATOM 2208 CD ARG A 152 14.906 -4.122 -8.794 1.00 3.25 C ATOM 2209 NE ARG A 152 15.738 -3.020 -8.289 1.00 41.22 N ATOM 2210 CZ ARG A 152 16.900 -2.627 -8.833 1.00 24.03 C ATOM 2211 NH1 ARG A 152 17.531 -3.398 -9.710 1.00 42.44 N ATOM 2212 NH2 ARG A 152 17.422 -1.468 -8.489 1.00 52.23 N ATOM 0 H ARG A 152 14.325 -5.432 -4.129 1.00 14.23 H new ATOM 0 HA ARG A 152 13.773 -7.204 -6.251 1.00 5.25 H new ATOM 0 HB2 ARG A 152 13.709 -4.773 -6.466 1.00 40.34 H new ATOM 0 HB3 ARG A 152 15.412 -4.652 -6.072 1.00 40.34 H new ATOM 0 HG2 ARG A 152 16.031 -5.809 -8.102 1.00 65.32 H new ATOM 0 HG3 ARG A 152 14.354 -6.166 -8.466 1.00 65.32 H new ATOM 0 HD2 ARG A 152 15.177 -4.315 -9.832 1.00 3.25 H new ATOM 0 HD3 ARG A 152 13.864 -3.801 -8.791 1.00 3.25 H new ATOM 0 HE ARG A 152 15.408 -2.518 -7.465 1.00 41.22 H new ATOM 0 HH11 ARG A 152 17.133 -4.299 -9.976 1.00 42.44 H new ATOM 0 HH12 ARG A 152 18.414 -3.090 -10.118 1.00 42.44 H new ATOM 0 HH21 ARG A 152 16.943 -0.874 -7.812 1.00 52.23 H new ATOM 0 HH22 ARG A 152 18.305 -1.164 -8.899 1.00 52.23 H new ATOM 2226 N THR A 153 16.837 -7.167 -5.133 1.00 53.21 N ATOM 2227 CA THR A 153 18.121 -7.852 -5.114 1.00 31.03 C ATOM 2228 C THR A 153 17.948 -9.300 -4.561 1.00 43.34 C ATOM 2229 O THR A 153 18.679 -10.215 -4.920 1.00 23.52 O ATOM 2230 CB THR A 153 19.101 -7.043 -4.231 1.00 34.14 C ATOM 2231 OG1 THR A 153 19.153 -5.677 -4.709 1.00 32.13 O ATOM 2232 CG2 THR A 153 20.495 -7.638 -4.267 1.00 4.24 C ATOM 0 H THR A 153 16.748 -6.448 -4.415 1.00 53.21 H new ATOM 0 HA THR A 153 18.520 -7.924 -6.126 1.00 31.03 H new ATOM 0 HB THR A 153 18.743 -7.074 -3.202 1.00 34.14 H new ATOM 0 HG1 THR A 153 18.318 -5.218 -4.479 1.00 32.13 H new ATOM 0 HG21 THR A 153 21.159 -7.047 -3.637 1.00 4.24 H new ATOM 0 HG22 THR A 153 20.463 -8.663 -3.899 1.00 4.24 H new ATOM 0 HG23 THR A 153 20.867 -7.632 -5.292 1.00 4.24 H new ATOM 2240 N THR A 154 16.984 -9.467 -3.691 1.00 22.13 N ATOM 2241 CA THR A 154 16.637 -10.757 -3.116 1.00 32.44 C ATOM 2242 C THR A 154 15.875 -11.607 -4.157 1.00 11.21 C ATOM 2243 O THR A 154 16.002 -12.828 -4.208 1.00 21.41 O ATOM 2244 CB THR A 154 15.818 -10.552 -1.822 1.00 72.02 C ATOM 2245 OG1 THR A 154 16.609 -9.771 -0.895 1.00 51.33 O ATOM 2246 CG2 THR A 154 15.456 -11.879 -1.178 1.00 4.43 C ATOM 0 H THR A 154 16.403 -8.700 -3.351 1.00 22.13 H new ATOM 0 HA THR A 154 17.544 -11.299 -2.848 1.00 32.44 H new ATOM 0 HB THR A 154 14.891 -10.036 -2.073 1.00 72.02 H new ATOM 0 HG1 THR A 154 16.681 -8.850 -1.222 1.00 51.33 H new ATOM 0 HG21 THR A 154 14.880 -11.698 -0.270 1.00 4.43 H new ATOM 0 HG22 THR A 154 14.860 -12.470 -1.873 1.00 4.43 H new ATOM 0 HG23 THR A 154 16.367 -12.422 -0.927 1.00 4.43 H new ATOM 2254 N LEU A 155 15.101 -10.919 -4.987 1.00 61.34 N ATOM 2255 CA LEU A 155 14.374 -11.484 -6.142 1.00 25.41 C ATOM 2256 C LEU A 155 15.326 -11.837 -7.298 1.00 43.31 C ATOM 2257 O LEU A 155 14.896 -12.063 -8.423 1.00 71.31 O ATOM 2258 CB LEU A 155 13.303 -10.492 -6.600 1.00 75.23 C ATOM 2259 CG LEU A 155 12.060 -10.394 -5.717 1.00 13.12 C ATOM 2260 CD1 LEU A 155 11.295 -9.131 -6.018 1.00 61.03 C ATOM 2261 CD2 LEU A 155 11.157 -11.581 -5.990 1.00 35.44 C ATOM 0 H LEU A 155 14.950 -9.916 -4.880 1.00 61.34 H new ATOM 0 HA LEU A 155 13.897 -12.413 -5.830 1.00 25.41 H new ATOM 0 HB2 LEU A 155 13.756 -9.503 -6.666 1.00 75.23 H new ATOM 0 HB3 LEU A 155 12.988 -10.766 -7.607 1.00 75.23 H new ATOM 0 HG LEU A 155 12.376 -10.384 -4.674 1.00 13.12 H new ATOM 0 HD11 LEU A 155 10.413 -9.079 -5.379 1.00 61.03 H new ATOM 0 HD12 LEU A 155 11.931 -8.266 -5.829 1.00 61.03 H new ATOM 0 HD13 LEU A 155 10.986 -9.133 -7.063 1.00 61.03 H new ATOM 0 HD21 LEU A 155 10.269 -11.515 -5.362 1.00 35.44 H new ATOM 0 HD22 LEU A 155 10.860 -11.579 -7.039 1.00 35.44 H new ATOM 0 HD23 LEU A 155 11.692 -12.504 -5.766 1.00 35.44 H new ATOM 2273 N GLU A 156 16.599 -11.848 -7.001 1.00 73.31 N ATOM 2274 CA GLU A 156 17.656 -12.200 -7.930 1.00 44.03 C ATOM 2275 C GLU A 156 17.347 -13.546 -8.607 1.00 44.02 C ATOM 2276 O GLU A 156 17.114 -14.559 -7.926 1.00 0.11 O ATOM 2277 CB GLU A 156 18.966 -12.310 -7.145 1.00 62.42 C ATOM 2278 CG GLU A 156 20.183 -12.649 -7.969 1.00 44.13 C ATOM 2279 CD GLU A 156 21.427 -12.784 -7.126 1.00 44.12 C ATOM 2280 OE1 GLU A 156 21.565 -13.786 -6.398 1.00 2.32 O ATOM 2281 OE2 GLU A 156 22.281 -11.884 -7.163 1.00 13.33 O ATOM 0 H GLU A 156 16.947 -11.604 -6.074 1.00 73.31 H new ATOM 0 HA GLU A 156 17.736 -11.436 -8.703 1.00 44.03 H new ATOM 0 HB2 GLU A 156 19.145 -11.364 -6.634 1.00 62.42 H new ATOM 0 HB3 GLU A 156 18.846 -13.071 -6.374 1.00 62.42 H new ATOM 0 HG2 GLU A 156 20.007 -13.582 -8.505 1.00 44.13 H new ATOM 0 HG3 GLU A 156 20.338 -11.874 -8.720 1.00 44.13 H new ATOM 2288 N GLY A 157 17.323 -13.546 -9.924 1.00 14.12 N ATOM 2289 CA GLY A 157 17.066 -14.764 -10.658 1.00 24.45 C ATOM 2290 C GLY A 157 15.618 -14.920 -11.097 1.00 32.42 C ATOM 2291 O GLY A 157 15.265 -15.916 -11.735 1.00 62.31 O ATOM 0 H GLY A 157 17.477 -12.721 -10.503 1.00 14.12 H new ATOM 0 HA2 GLY A 157 17.708 -14.789 -11.539 1.00 24.45 H new ATOM 0 HA3 GLY A 157 17.342 -15.617 -10.038 1.00 24.45 H new ATOM 2295 N THR A 158 14.777 -13.969 -10.765 1.00 14.24 N ATOM 2296 CA THR A 158 13.389 -14.035 -11.183 1.00 53.50 C ATOM 2297 C THR A 158 13.209 -13.276 -12.500 1.00 3.31 C ATOM 2298 O THR A 158 13.990 -12.371 -12.805 1.00 65.14 O ATOM 2299 CB THR A 158 12.432 -13.429 -10.115 1.00 61.30 C ATOM 2300 OG1 THR A 158 12.747 -12.047 -9.914 1.00 51.44 O ATOM 2301 CG2 THR A 158 12.547 -14.172 -8.792 1.00 35.32 C ATOM 0 H THR A 158 15.022 -13.147 -10.213 1.00 14.24 H new ATOM 0 HA THR A 158 13.135 -15.087 -11.312 1.00 53.50 H new ATOM 0 HB THR A 158 11.409 -13.528 -10.479 1.00 61.30 H new ATOM 0 HG1 THR A 158 13.521 -11.971 -9.318 1.00 51.44 H new ATOM 0 HG21 THR A 158 11.868 -13.727 -8.065 1.00 35.32 H new ATOM 0 HG22 THR A 158 12.286 -15.220 -8.939 1.00 35.32 H new ATOM 0 HG23 THR A 158 13.570 -14.102 -8.423 1.00 35.32 H new ATOM 2309 N PRO A 159 12.195 -13.627 -13.308 1.00 42.43 N ATOM 2310 CA PRO A 159 11.885 -12.908 -14.546 1.00 63.22 C ATOM 2311 C PRO A 159 10.988 -11.688 -14.263 1.00 12.12 C ATOM 2312 O PRO A 159 10.237 -11.221 -15.134 1.00 11.44 O ATOM 2313 CB PRO A 159 11.118 -13.958 -15.348 1.00 32.31 C ATOM 2314 CG PRO A 159 10.381 -14.735 -14.315 1.00 64.33 C ATOM 2315 CD PRO A 159 11.275 -14.772 -13.098 1.00 34.42 C ATOM 0 HA PRO A 159 12.766 -12.518 -15.055 1.00 63.22 H new ATOM 0 HB2 PRO A 159 10.436 -13.495 -16.061 1.00 32.31 H new ATOM 0 HB3 PRO A 159 11.793 -14.595 -15.920 1.00 32.31 H new ATOM 0 HG2 PRO A 159 9.426 -14.265 -14.082 1.00 64.33 H new ATOM 0 HG3 PRO A 159 10.162 -15.743 -14.668 1.00 64.33 H new ATOM 0 HD2 PRO A 159 10.703 -14.663 -12.177 1.00 34.42 H new ATOM 0 HD3 PRO A 159 11.817 -15.715 -13.027 1.00 34.42 H new ATOM 2323 N ALA A 160 11.076 -11.181 -13.055 1.00 34.14 N ATOM 2324 CA ALA A 160 10.282 -10.066 -12.625 1.00 44.23 C ATOM 2325 C ALA A 160 10.830 -8.767 -13.187 1.00 71.32 C ATOM 2326 O ALA A 160 12.039 -8.565 -13.235 1.00 51.54 O ATOM 2327 CB ALA A 160 10.249 -10.017 -11.116 1.00 13.34 C ATOM 0 H ALA A 160 11.709 -11.539 -12.340 1.00 34.14 H new ATOM 0 HA ALA A 160 9.266 -10.193 -13.000 1.00 44.23 H new ATOM 0 HB1 ALA A 160 9.645 -9.169 -10.793 1.00 13.34 H new ATOM 0 HB2 ALA A 160 9.814 -10.940 -10.731 1.00 13.34 H new ATOM 0 HB3 ALA A 160 11.264 -9.907 -10.733 1.00 13.34 H new ATOM 2333 N THR A 161 9.956 -7.907 -13.616 1.00 4.02 N ATOM 2334 CA THR A 161 10.350 -6.640 -14.163 1.00 34.31 C ATOM 2335 C THR A 161 9.939 -5.534 -13.214 1.00 61.10 C ATOM 2336 O THR A 161 8.972 -5.680 -12.490 1.00 54.50 O ATOM 2337 CB THR A 161 9.774 -6.442 -15.576 1.00 50.21 C ATOM 2338 OG1 THR A 161 8.357 -6.685 -15.574 1.00 71.05 O ATOM 2339 CG2 THR A 161 10.452 -7.372 -16.567 1.00 5.24 C ATOM 0 H THR A 161 8.948 -8.062 -13.597 1.00 4.02 H new ATOM 0 HA THR A 161 11.435 -6.612 -14.269 1.00 34.31 H new ATOM 0 HB THR A 161 9.961 -5.412 -15.879 1.00 50.21 H new ATOM 0 HG1 THR A 161 7.920 -6.079 -16.208 1.00 71.05 H new ATOM 0 HG21 THR A 161 10.030 -7.216 -17.560 1.00 5.24 H new ATOM 0 HG22 THR A 161 11.521 -7.162 -16.590 1.00 5.24 H new ATOM 0 HG23 THR A 161 10.292 -8.407 -16.263 1.00 5.24 H new ATOM 2347 N TYR A 162 10.675 -4.448 -13.185 1.00 20.52 N ATOM 2348 CA TYR A 162 10.441 -3.407 -12.189 1.00 72.43 C ATOM 2349 C TYR A 162 10.687 -2.057 -12.825 1.00 3.52 C ATOM 2350 O TYR A 162 11.338 -1.975 -13.868 1.00 13.11 O ATOM 2351 CB TYR A 162 11.445 -3.522 -11.071 1.00 34.01 C ATOM 2352 CG TYR A 162 11.700 -4.906 -10.518 1.00 40.10 C ATOM 2353 CD1 TYR A 162 12.697 -5.695 -11.074 1.00 31.12 C ATOM 2354 CD2 TYR A 162 10.979 -5.413 -9.451 1.00 45.21 C ATOM 2355 CE1 TYR A 162 12.972 -6.942 -10.591 1.00 42.15 C ATOM 2356 CE2 TYR A 162 11.250 -6.680 -8.956 1.00 50.02 C ATOM 2357 CZ TYR A 162 12.257 -7.437 -9.540 1.00 64.31 C ATOM 2358 OH TYR A 162 12.550 -8.690 -9.066 1.00 13.51 O ATOM 0 H TYR A 162 11.439 -4.255 -13.832 1.00 20.52 H new ATOM 0 HA TYR A 162 9.422 -3.513 -11.817 1.00 72.43 H new ATOM 0 HB2 TYR A 162 12.394 -3.118 -11.425 1.00 34.01 H new ATOM 0 HB3 TYR A 162 11.113 -2.885 -10.251 1.00 34.01 H new ATOM 0 HD1 TYR A 162 13.268 -5.314 -11.908 1.00 31.12 H new ATOM 0 HD2 TYR A 162 10.199 -4.817 -9.000 1.00 45.21 H new ATOM 0 HE1 TYR A 162 13.754 -7.536 -11.040 1.00 42.15 H new ATOM 0 HE2 TYR A 162 10.684 -7.074 -8.125 1.00 50.02 H new ATOM 0 HH TYR A 162 13.482 -8.716 -8.763 1.00 13.51 H new ATOM 2368 N GLN A 163 10.179 -1.006 -12.220 1.00 4.11 N ATOM 2369 CA GLN A 163 10.429 0.334 -12.741 1.00 12.41 C ATOM 2370 C GLN A 163 10.883 1.304 -11.633 1.00 75.52 C ATOM 2371 O GLN A 163 10.123 1.629 -10.724 1.00 44.12 O ATOM 2372 CB GLN A 163 9.173 0.864 -13.433 1.00 43.42 C ATOM 2373 CG GLN A 163 8.006 0.952 -12.505 1.00 43.41 C ATOM 2374 CD GLN A 163 6.720 1.244 -13.150 1.00 14.43 C ATOM 2375 OE1 GLN A 163 6.632 1.896 -14.193 1.00 30.25 O ATOM 2376 NE2 GLN A 163 5.715 0.786 -12.514 1.00 3.51 N ATOM 0 H GLN A 163 9.600 -1.043 -11.381 1.00 4.11 H new ATOM 0 HA GLN A 163 11.241 0.267 -13.466 1.00 12.41 H new ATOM 0 HB2 GLN A 163 9.379 1.851 -13.848 1.00 43.42 H new ATOM 0 HB3 GLN A 163 8.920 0.213 -14.270 1.00 43.42 H new ATOM 0 HG2 GLN A 163 7.919 0.009 -11.965 1.00 43.41 H new ATOM 0 HG3 GLN A 163 8.208 1.726 -11.764 1.00 43.41 H new ATOM 0 HE21 GLN A 163 5.854 0.253 -11.656 1.00 3.51 H new ATOM 0 HE22 GLN A 163 4.771 0.952 -12.864 1.00 3.51 H new ATOM 2385 N GLY A 164 12.138 1.694 -11.669 1.00 23.33 N ATOM 2386 CA GLY A 164 12.613 2.753 -10.784 1.00 24.13 C ATOM 2387 C GLY A 164 12.636 2.370 -9.312 1.00 30.24 C ATOM 2388 O GLY A 164 12.778 3.244 -8.458 1.00 54.25 O ATOM 0 H GLY A 164 12.846 1.304 -12.291 1.00 23.33 H new ATOM 0 HA2 GLY A 164 13.619 3.042 -11.089 1.00 24.13 H new ATOM 0 HA3 GLY A 164 11.977 3.629 -10.910 1.00 24.13 H new ATOM 2392 N ASP A 165 12.481 1.074 -9.022 1.00 0.12 N ATOM 2393 CA ASP A 165 12.365 0.564 -7.633 1.00 32.21 C ATOM 2394 C ASP A 165 11.142 1.155 -6.927 1.00 65.11 C ATOM 2395 O ASP A 165 11.100 1.174 -5.698 1.00 51.13 O ATOM 2396 CB ASP A 165 13.627 0.854 -6.767 1.00 61.31 C ATOM 2397 CG ASP A 165 14.879 0.092 -7.159 1.00 41.04 C ATOM 2398 OD1 ASP A 165 15.653 0.591 -7.997 1.00 25.43 O ATOM 2399 OD2 ASP A 165 15.137 -1.009 -6.611 1.00 0.23 O ATOM 0 H ASP A 165 12.431 0.344 -9.733 1.00 0.12 H new ATOM 0 HA ASP A 165 12.260 -0.517 -7.729 1.00 32.21 H new ATOM 0 HB2 ASP A 165 13.842 1.921 -6.816 1.00 61.31 H new ATOM 0 HB3 ASP A 165 13.393 0.624 -5.728 1.00 61.31 H new ATOM 2404 N VAL A 166 10.118 1.614 -7.698 1.00 21.12 N ATOM 2405 CA VAL A 166 8.945 2.217 -7.084 1.00 5.42 C ATOM 2406 C VAL A 166 8.236 1.182 -6.239 1.00 11.41 C ATOM 2407 O VAL A 166 8.085 0.008 -6.645 1.00 20.15 O ATOM 2408 CB VAL A 166 7.969 2.854 -8.139 1.00 42.43 C ATOM 2409 CG1 VAL A 166 7.444 1.825 -9.116 1.00 40.13 C ATOM 2410 CG2 VAL A 166 6.814 3.583 -7.464 1.00 10.53 C ATOM 0 H VAL A 166 10.097 1.572 -8.717 1.00 21.12 H new ATOM 0 HA VAL A 166 9.281 3.038 -6.451 1.00 5.42 H new ATOM 0 HB VAL A 166 8.551 3.583 -8.702 1.00 42.43 H new ATOM 0 HG11 VAL A 166 6.774 2.307 -9.827 1.00 40.13 H new ATOM 0 HG12 VAL A 166 8.279 1.374 -9.653 1.00 40.13 H new ATOM 0 HG13 VAL A 166 6.901 1.051 -8.573 1.00 40.13 H new ATOM 0 HG21 VAL A 166 6.160 4.011 -8.224 1.00 10.53 H new ATOM 0 HG22 VAL A 166 6.248 2.880 -6.852 1.00 10.53 H new ATOM 0 HG23 VAL A 166 7.206 4.380 -6.833 1.00 10.53 H new ATOM 2420 N TYR A 167 7.802 1.592 -5.094 1.00 61.34 N ATOM 2421 CA TYR A 167 7.243 0.677 -4.174 1.00 63.33 C ATOM 2422 C TYR A 167 6.161 1.317 -3.365 1.00 22.24 C ATOM 2423 O TYR A 167 5.908 2.527 -3.465 1.00 62.04 O ATOM 2424 CB TYR A 167 8.335 0.103 -3.246 1.00 63.25 C ATOM 2425 CG TYR A 167 9.000 1.105 -2.318 1.00 41.43 C ATOM 2426 CD1 TYR A 167 10.033 1.937 -2.755 1.00 45.32 C ATOM 2427 CD2 TYR A 167 8.596 1.207 -0.995 1.00 63.04 C ATOM 2428 CE1 TYR A 167 10.632 2.829 -1.892 1.00 23.03 C ATOM 2429 CE2 TYR A 167 9.190 2.088 -0.136 1.00 74.31 C ATOM 2430 CZ TYR A 167 10.207 2.897 -0.582 1.00 23.12 C ATOM 2431 OH TYR A 167 10.795 3.776 0.281 1.00 25.35 O ATOM 0 H TYR A 167 7.827 2.561 -4.778 1.00 61.34 H new ATOM 0 HA TYR A 167 6.802 -0.141 -4.744 1.00 63.33 H new ATOM 0 HB2 TYR A 167 7.893 -0.688 -2.641 1.00 63.25 H new ATOM 0 HB3 TYR A 167 9.105 -0.360 -3.863 1.00 63.25 H new ATOM 0 HD1 TYR A 167 10.366 1.881 -3.781 1.00 45.32 H new ATOM 0 HD2 TYR A 167 7.795 0.577 -0.636 1.00 63.04 H new ATOM 0 HE1 TYR A 167 11.429 3.470 -2.239 1.00 23.03 H new ATOM 0 HE2 TYR A 167 8.861 2.148 0.891 1.00 74.31 H new ATOM 0 HH TYR A 167 10.143 4.058 0.956 1.00 25.35 H new ATOM 2441 N TYR A 168 5.529 0.514 -2.579 1.00 72.25 N ATOM 2442 CA TYR A 168 4.503 0.950 -1.701 1.00 1.13 C ATOM 2443 C TYR A 168 4.932 0.704 -0.278 1.00 25.04 C ATOM 2444 O TYR A 168 5.681 -0.240 0.003 1.00 52.45 O ATOM 2445 CB TYR A 168 3.203 0.207 -1.976 1.00 4.12 C ATOM 2446 CG TYR A 168 2.639 0.400 -3.370 1.00 21.11 C ATOM 2447 CD1 TYR A 168 3.126 -0.327 -4.453 1.00 21.44 C ATOM 2448 CD2 TYR A 168 1.610 1.294 -3.597 1.00 65.30 C ATOM 2449 CE1 TYR A 168 2.605 -0.167 -5.707 1.00 25.22 C ATOM 2450 CE2 TYR A 168 1.076 1.456 -4.861 1.00 74.52 C ATOM 2451 CZ TYR A 168 1.582 0.718 -5.912 1.00 3.13 C ATOM 2452 OH TYR A 168 1.057 0.864 -7.176 1.00 74.44 O ATOM 0 H TYR A 168 5.717 -0.487 -2.530 1.00 72.25 H new ATOM 0 HA TYR A 168 4.332 2.014 -1.862 1.00 1.13 H new ATOM 0 HB2 TYR A 168 3.368 -0.858 -1.811 1.00 4.12 H new ATOM 0 HB3 TYR A 168 2.457 0.530 -1.250 1.00 4.12 H new ATOM 0 HD1 TYR A 168 3.931 -1.031 -4.300 1.00 21.44 H new ATOM 0 HD2 TYR A 168 1.218 1.874 -2.775 1.00 65.30 H new ATOM 0 HE1 TYR A 168 3.000 -0.738 -6.534 1.00 25.22 H new ATOM 0 HE2 TYR A 168 0.269 2.155 -5.025 1.00 74.52 H new ATOM 0 HH TYR A 168 0.337 1.529 -7.156 1.00 74.44 H new ATOM 2462 N CYS A 169 4.455 1.523 0.594 1.00 73.13 N ATOM 2463 CA CYS A 169 4.742 1.435 1.995 1.00 21.22 C ATOM 2464 C CYS A 169 3.467 1.076 2.718 1.00 71.12 C ATOM 2465 O CYS A 169 2.477 1.798 2.622 1.00 34.24 O ATOM 2466 CB CYS A 169 5.270 2.786 2.480 1.00 13.33 C ATOM 2467 SG CYS A 169 5.515 2.920 4.258 1.00 42.34 S ATOM 0 H CYS A 169 3.836 2.297 0.351 1.00 73.13 H new ATOM 0 HA CYS A 169 5.497 0.673 2.191 1.00 21.22 H new ATOM 0 HB2 CYS A 169 6.219 2.987 1.983 1.00 13.33 H new ATOM 0 HB3 CYS A 169 4.574 3.564 2.166 1.00 13.33 H new ATOM 0 HG CYS A 169 6.560 2.230 4.605 1.00 42.34 H new ATOM 2473 N ALA A 170 3.484 -0.044 3.410 1.00 64.40 N ATOM 2474 CA ALA A 170 2.318 -0.543 4.095 1.00 32.44 C ATOM 2475 C ALA A 170 2.563 -0.683 5.585 1.00 24.15 C ATOM 2476 O ALA A 170 3.571 -1.263 6.014 1.00 41.15 O ATOM 2477 CB ALA A 170 1.944 -1.876 3.521 1.00 74.20 C ATOM 0 H ALA A 170 4.311 -0.633 3.511 1.00 64.40 H new ATOM 0 HA ALA A 170 1.507 0.172 3.955 1.00 32.44 H new ATOM 0 HB1 ALA A 170 1.062 -2.259 4.035 1.00 74.20 H new ATOM 0 HB2 ALA A 170 1.726 -1.766 2.459 1.00 74.20 H new ATOM 0 HB3 ALA A 170 2.772 -2.573 3.651 1.00 74.20 H new ATOM 2483 N GLY A 171 1.635 -0.172 6.349 1.00 5.24 N ATOM 2484 CA GLY A 171 1.682 -0.214 7.782 1.00 41.32 C ATOM 2485 C GLY A 171 0.360 0.251 8.304 1.00 74.22 C ATOM 2486 O GLY A 171 -0.419 0.801 7.530 1.00 55.01 O ATOM 0 H GLY A 171 0.807 0.296 5.981 1.00 5.24 H new ATOM 0 HA2 GLY A 171 1.892 -1.227 8.126 1.00 41.32 H new ATOM 0 HA3 GLY A 171 2.484 0.423 8.155 1.00 41.32 H new ATOM 2632 N ARG A 181 6.060 -2.436 13.848 1.00 1.12 N ATOM 2633 CA ARG A 181 7.208 -3.337 13.919 1.00 1.34 C ATOM 2634 C ARG A 181 7.206 -4.258 12.688 1.00 30.14 C ATOM 2635 O ARG A 181 8.246 -4.672 12.210 1.00 4.21 O ATOM 2636 CB ARG A 181 7.161 -4.122 15.267 1.00 10.25 C ATOM 2637 CG ARG A 181 8.412 -4.948 15.673 1.00 72.34 C ATOM 2638 CD ARG A 181 8.640 -6.191 14.826 1.00 22.42 C ATOM 2639 NE ARG A 181 7.506 -7.118 14.889 1.00 22.34 N ATOM 2640 CZ ARG A 181 7.516 -8.387 14.468 1.00 44.02 C ATOM 2641 NH1 ARG A 181 8.640 -8.944 14.031 1.00 13.34 N ATOM 2642 NH2 ARG A 181 6.406 -9.103 14.522 1.00 72.13 N ATOM 0 HA ARG A 181 8.145 -2.780 13.902 1.00 1.34 H new ATOM 0 HB2 ARG A 181 6.961 -3.406 16.064 1.00 10.25 H new ATOM 0 HB3 ARG A 181 6.310 -4.802 15.228 1.00 10.25 H new ATOM 0 HG2 ARG A 181 9.293 -4.309 15.606 1.00 72.34 H new ATOM 0 HG3 ARG A 181 8.314 -5.246 16.717 1.00 72.34 H new ATOM 0 HD2 ARG A 181 8.810 -5.897 13.790 1.00 22.42 H new ATOM 0 HD3 ARG A 181 9.542 -6.700 15.165 1.00 22.42 H new ATOM 0 HE ARG A 181 6.636 -6.765 15.288 1.00 22.34 H new ATOM 0 HH11 ARG A 181 9.505 -8.403 14.015 1.00 13.34 H new ATOM 0 HH12 ARG A 181 8.639 -9.913 13.712 1.00 13.34 H new ATOM 0 HH21 ARG A 181 5.548 -8.687 14.883 1.00 72.13 H new ATOM 0 HH22 ARG A 181 6.408 -10.072 14.202 1.00 72.13 H new ATOM 2656 N ARG A 182 6.039 -4.568 12.186 1.00 53.44 N ATOM 2657 CA ARG A 182 5.946 -5.340 10.968 1.00 30.32 C ATOM 2658 C ARG A 182 5.367 -4.500 9.862 1.00 63.04 C ATOM 2659 O ARG A 182 4.343 -3.820 10.044 1.00 25.24 O ATOM 2660 CB ARG A 182 5.161 -6.653 11.128 1.00 71.31 C ATOM 2661 CG ARG A 182 3.787 -6.515 11.757 1.00 61.40 C ATOM 2662 CD ARG A 182 2.964 -7.781 11.567 1.00 41.32 C ATOM 2663 NE ARG A 182 3.671 -9.009 11.971 1.00 11.11 N ATOM 2664 CZ ARG A 182 3.164 -10.244 11.830 1.00 2.21 C ATOM 2665 NH1 ARG A 182 1.929 -10.404 11.376 1.00 1.24 N ATOM 2666 NH2 ARG A 182 3.897 -11.309 12.142 1.00 73.31 N ATOM 0 H ARG A 182 5.144 -4.301 12.596 1.00 53.44 H new ATOM 0 HA ARG A 182 6.963 -5.633 10.709 1.00 30.32 H new ATOM 0 HB2 ARG A 182 5.048 -7.112 10.146 1.00 71.31 H new ATOM 0 HB3 ARG A 182 5.753 -7.339 11.734 1.00 71.31 H new ATOM 0 HG2 ARG A 182 3.891 -6.302 12.821 1.00 61.40 H new ATOM 0 HG3 ARG A 182 3.264 -5.668 11.312 1.00 61.40 H new ATOM 0 HD2 ARG A 182 2.043 -7.696 12.143 1.00 41.32 H new ATOM 0 HD3 ARG A 182 2.678 -7.865 10.519 1.00 41.32 H new ATOM 0 HE ARG A 182 4.600 -8.915 12.382 1.00 11.11 H new ATOM 0 HH11 ARG A 182 1.365 -9.589 11.134 1.00 1.24 H new ATOM 0 HH12 ARG A 182 1.543 -11.342 11.268 1.00 1.24 H new ATOM 0 HH21 ARG A 182 4.848 -11.189 12.490 1.00 73.31 H new ATOM 0 HH22 ARG A 182 3.508 -12.246 12.033 1.00 73.31 H new ATOM 2680 N ASN A 183 6.012 -4.518 8.733 1.00 1.20 N ATOM 2681 CA ASN A 183 5.571 -3.740 7.598 1.00 32.11 C ATOM 2682 C ASN A 183 5.553 -4.621 6.385 1.00 74.24 C ATOM 2683 O ASN A 183 6.190 -5.683 6.374 1.00 43.31 O ATOM 2684 CB ASN A 183 6.530 -2.564 7.297 1.00 30.31 C ATOM 2685 CG ASN A 183 6.788 -1.587 8.441 1.00 34.21 C ATOM 2686 OD1 ASN A 183 7.851 -0.987 8.499 1.00 73.33 O ATOM 2687 ND2 ASN A 183 5.846 -1.402 9.328 1.00 44.44 N ATOM 0 H ASN A 183 6.855 -5.067 8.567 1.00 1.20 H new ATOM 0 HA ASN A 183 4.583 -3.344 7.834 1.00 32.11 H new ATOM 0 HB2 ASN A 183 7.487 -2.977 6.978 1.00 30.31 H new ATOM 0 HB3 ASN A 183 6.128 -2.003 6.453 1.00 30.31 H new ATOM 0 HD21 ASN A 183 5.988 -0.743 10.093 1.00 44.44 H new ATOM 0 HD22 ASN A 183 4.968 -1.917 9.255 1.00 44.44 H new ATOM 2694 N GLU A 184 4.842 -4.193 5.374 1.00 4.13 N ATOM 2695 CA GLU A 184 4.824 -4.879 4.114 1.00 41.33 C ATOM 2696 C GLU A 184 5.205 -3.871 3.043 1.00 52.53 C ATOM 2697 O GLU A 184 4.833 -2.706 3.120 1.00 64.41 O ATOM 2698 CB GLU A 184 3.450 -5.532 3.830 1.00 21.14 C ATOM 2699 CG GLU A 184 3.410 -6.358 2.537 1.00 35.14 C ATOM 2700 CD GLU A 184 2.085 -7.065 2.308 1.00 72.54 C ATOM 2701 OE1 GLU A 184 1.127 -6.416 1.848 1.00 52.30 O ATOM 2702 OE2 GLU A 184 1.992 -8.285 2.560 1.00 22.30 O ATOM 0 H GLU A 184 4.259 -3.357 5.404 1.00 4.13 H new ATOM 0 HA GLU A 184 5.538 -5.702 4.126 1.00 41.33 H new ATOM 0 HB2 GLU A 184 3.184 -6.175 4.669 1.00 21.14 H new ATOM 0 HB3 GLU A 184 2.692 -4.751 3.774 1.00 21.14 H new ATOM 0 HG2 GLU A 184 3.614 -5.702 1.690 1.00 35.14 H new ATOM 0 HG3 GLU A 184 4.208 -7.100 2.565 1.00 35.14 H new ATOM 2709 N VAL A 185 5.998 -4.287 2.109 1.00 32.54 N ATOM 2710 CA VAL A 185 6.461 -3.413 1.042 1.00 71.52 C ATOM 2711 C VAL A 185 6.161 -4.057 -0.278 1.00 4.31 C ATOM 2712 O VAL A 185 6.434 -5.238 -0.454 1.00 71.45 O ATOM 2713 CB VAL A 185 7.980 -3.185 1.182 1.00 3.11 C ATOM 2714 CG1 VAL A 185 8.520 -2.246 0.121 1.00 71.11 C ATOM 2715 CG2 VAL A 185 8.292 -2.670 2.563 1.00 31.51 C ATOM 0 H VAL A 185 6.352 -5.242 2.051 1.00 32.54 H new ATOM 0 HA VAL A 185 5.952 -2.451 1.103 1.00 71.52 H new ATOM 0 HB VAL A 185 8.477 -4.144 1.033 1.00 3.11 H new ATOM 0 HG11 VAL A 185 9.593 -2.117 0.261 1.00 71.11 H new ATOM 0 HG12 VAL A 185 8.331 -2.666 -0.867 1.00 71.11 H new ATOM 0 HG13 VAL A 185 8.024 -1.279 0.205 1.00 71.11 H new ATOM 0 HG21 VAL A 185 9.366 -2.510 2.658 1.00 31.51 H new ATOM 0 HG22 VAL A 185 7.769 -1.728 2.727 1.00 31.51 H new ATOM 0 HG23 VAL A 185 7.967 -3.399 3.305 1.00 31.51 H new ATOM 2725 N TRP A 186 5.581 -3.305 -1.190 1.00 63.41 N ATOM 2726 CA TRP A 186 5.209 -3.857 -2.482 1.00 62.40 C ATOM 2727 C TRP A 186 6.073 -3.276 -3.571 1.00 54.23 C ATOM 2728 O TRP A 186 6.119 -2.069 -3.731 1.00 20.22 O ATOM 2729 CB TRP A 186 3.754 -3.515 -2.860 1.00 73.13 C ATOM 2730 CG TRP A 186 2.682 -3.902 -1.893 1.00 45.24 C ATOM 2731 CD1 TRP A 186 2.796 -4.673 -0.779 1.00 14.11 C ATOM 2732 CD2 TRP A 186 1.300 -3.521 -1.978 1.00 42.44 C ATOM 2733 NE1 TRP A 186 1.582 -4.779 -0.159 1.00 3.01 N ATOM 2734 CE2 TRP A 186 0.646 -4.087 -0.876 1.00 11.00 C ATOM 2735 CE3 TRP A 186 0.553 -2.749 -2.887 1.00 72.51 C ATOM 2736 CZ2 TRP A 186 -0.718 -3.910 -0.642 1.00 74.03 C ATOM 2737 CZ3 TRP A 186 -0.797 -2.576 -2.654 1.00 72.13 C ATOM 2738 CH2 TRP A 186 -1.419 -3.154 -1.541 1.00 73.15 C ATOM 0 H TRP A 186 5.357 -2.318 -1.066 1.00 63.41 H new ATOM 0 HA TRP A 186 5.334 -4.936 -2.396 1.00 62.40 H new ATOM 0 HB2 TRP A 186 3.692 -2.438 -3.019 1.00 73.13 H new ATOM 0 HB3 TRP A 186 3.534 -3.991 -3.815 1.00 73.13 H new ATOM 0 HD1 TRP A 186 3.710 -5.134 -0.435 1.00 14.11 H new ATOM 0 HE1 TRP A 186 1.403 -5.294 0.703 1.00 3.01 H new ATOM 0 HE3 TRP A 186 1.026 -2.301 -3.749 1.00 72.51 H new ATOM 0 HZ2 TRP A 186 -1.202 -4.353 0.216 1.00 74.03 H new ATOM 0 HZ3 TRP A 186 -1.383 -1.985 -3.342 1.00 72.13 H new ATOM 0 HH2 TRP A 186 -2.477 -2.999 -1.389 1.00 73.15 H new ATOM 2749 N LEU A 187 6.739 -4.119 -4.302 1.00 23.43 N ATOM 2750 CA LEU A 187 7.420 -3.700 -5.509 1.00 30.21 C ATOM 2751 C LEU A 187 6.493 -4.002 -6.644 1.00 32.43 C ATOM 2752 O LEU A 187 5.982 -5.117 -6.740 1.00 21.24 O ATOM 2753 CB LEU A 187 8.738 -4.463 -5.730 1.00 21.24 C ATOM 2754 CG LEU A 187 9.869 -4.207 -4.750 1.00 44.55 C ATOM 2755 CD1 LEU A 187 11.045 -5.097 -5.094 1.00 2.41 C ATOM 2756 CD2 LEU A 187 10.292 -2.752 -4.811 1.00 13.34 C ATOM 0 H LEU A 187 6.831 -5.112 -4.088 1.00 23.43 H new ATOM 0 HA LEU A 187 7.670 -2.642 -5.436 1.00 30.21 H new ATOM 0 HB2 LEU A 187 8.515 -5.530 -5.716 1.00 21.24 H new ATOM 0 HB3 LEU A 187 9.100 -4.226 -6.731 1.00 21.24 H new ATOM 0 HG LEU A 187 9.525 -4.432 -3.740 1.00 44.55 H new ATOM 0 HD11 LEU A 187 11.858 -4.914 -4.391 1.00 2.41 H new ATOM 0 HD12 LEU A 187 10.741 -6.142 -5.033 1.00 2.41 H new ATOM 0 HD13 LEU A 187 11.384 -4.877 -6.106 1.00 2.41 H new ATOM 0 HD21 LEU A 187 11.104 -2.579 -4.104 1.00 13.34 H new ATOM 0 HD22 LEU A 187 10.632 -2.514 -5.819 1.00 13.34 H new ATOM 0 HD23 LEU A 187 9.445 -2.116 -4.554 1.00 13.34 H new ATOM 2768 N VAL A 188 6.238 -3.045 -7.469 1.00 61.24 N ATOM 2769 CA VAL A 188 5.331 -3.260 -8.559 1.00 41.14 C ATOM 2770 C VAL A 188 6.068 -3.586 -9.850 1.00 1.52 C ATOM 2771 O VAL A 188 6.990 -2.864 -10.269 1.00 35.55 O ATOM 2772 CB VAL A 188 4.307 -2.093 -8.731 1.00 44.52 C ATOM 2773 CG1 VAL A 188 4.994 -0.756 -8.904 1.00 74.41 C ATOM 2774 CG2 VAL A 188 3.340 -2.363 -9.881 1.00 53.33 C ATOM 0 H VAL A 188 6.639 -2.109 -7.416 1.00 61.24 H new ATOM 0 HA VAL A 188 4.738 -4.138 -8.304 1.00 41.14 H new ATOM 0 HB VAL A 188 3.728 -2.044 -7.809 1.00 44.52 H new ATOM 0 HG11 VAL A 188 4.244 0.026 -9.020 1.00 74.41 H new ATOM 0 HG12 VAL A 188 5.606 -0.545 -8.027 1.00 74.41 H new ATOM 0 HG13 VAL A 188 5.628 -0.785 -9.790 1.00 74.41 H new ATOM 0 HG21 VAL A 188 2.642 -1.531 -9.972 1.00 53.33 H new ATOM 0 HG22 VAL A 188 3.900 -2.470 -10.810 1.00 53.33 H new ATOM 0 HG23 VAL A 188 2.787 -3.281 -9.683 1.00 53.33 H new ATOM 2784 N LYS A 189 5.676 -4.694 -10.438 1.00 2.14 N ATOM 2785 CA LYS A 189 6.224 -5.170 -11.681 1.00 2.42 C ATOM 2786 C LYS A 189 5.943 -4.223 -12.812 1.00 44.31 C ATOM 2787 O LYS A 189 4.794 -3.824 -13.028 1.00 45.21 O ATOM 2788 CB LYS A 189 5.648 -6.550 -12.019 1.00 24.23 C ATOM 2789 CG LYS A 189 5.894 -7.012 -13.456 1.00 41.11 C ATOM 2790 CD LYS A 189 5.235 -8.349 -13.731 1.00 43.41 C ATOM 2791 CE LYS A 189 5.261 -8.695 -15.218 1.00 71.33 C ATOM 2792 NZ LYS A 189 6.629 -8.771 -15.780 1.00 31.14 N ATOM 0 H LYS A 189 4.951 -5.300 -10.054 1.00 2.14 H new ATOM 0 HA LYS A 189 7.304 -5.240 -11.555 1.00 2.42 H new ATOM 0 HB2 LYS A 189 6.077 -7.284 -11.337 1.00 24.23 H new ATOM 0 HB3 LYS A 189 4.574 -6.535 -11.836 1.00 24.23 H new ATOM 0 HG2 LYS A 189 5.508 -6.266 -14.150 1.00 41.11 H new ATOM 0 HG3 LYS A 189 6.966 -7.090 -13.636 1.00 41.11 H new ATOM 0 HD2 LYS A 189 5.745 -9.129 -13.167 1.00 43.41 H new ATOM 0 HD3 LYS A 189 4.203 -8.325 -13.381 1.00 43.41 H new ATOM 0 HE2 LYS A 189 4.760 -9.651 -15.370 1.00 71.33 H new ATOM 0 HE3 LYS A 189 4.691 -7.946 -15.768 1.00 71.33 H new ATOM 0 HZ1 LYS A 189 6.580 -9.075 -16.773 1.00 31.14 H new ATOM 0 HZ2 LYS A 189 7.079 -7.835 -15.726 1.00 31.14 H new ATOM 0 HZ3 LYS A 189 7.190 -9.457 -15.236 1.00 31.14 H new ATOM 2806 N ALA A 190 6.980 -3.853 -13.511 1.00 64.11 N ATOM 2807 CA ALA A 190 6.806 -3.061 -14.703 1.00 21.03 C ATOM 2808 C ALA A 190 6.815 -3.978 -15.903 1.00 45.12 C ATOM 2809 O ALA A 190 7.901 -4.231 -16.458 1.00 37.46 O ATOM 2810 CB ALA A 190 7.880 -2.021 -14.823 1.00 60.31 C ATOM 2811 OXT ALA A 190 5.755 -4.503 -16.262 1.00 37.46 O ATOM 0 H ALA A 190 7.947 -4.083 -13.282 1.00 64.11 H new ATOM 0 HA ALA A 190 5.852 -2.537 -14.649 1.00 21.03 H new ATOM 0 HB1 ALA A 190 7.723 -1.439 -15.731 1.00 60.31 H new ATOM 0 HB2 ALA A 190 7.844 -1.360 -13.957 1.00 60.31 H new ATOM 0 HB3 ALA A 190 8.854 -2.508 -14.868 1.00 60.31 H new