USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1129 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 91 MET CE :methyl -118:sc= -2.93! (180deg=-7.22!) USER MOD Set 1.2: A 95 GLN : amide:sc= -0.0208 K(o=-2.9,f=-5.4) USER MOD Single : A 10 SER OG : rot -15:sc= 0.742 USER MOD Single : A 11 ASN : amide:sc= -0.421 K(o=-0.42,f=-2.7) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.185 X(o=-0.18,f=-0.31) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 155:sc= -0.295 (180deg=-1.55!) USER MOD Single : A 28 MET CE :methyl 169:sc= -1.04 (180deg=-1.14) USER MOD Single : A 29 SER OG : rot 79:sc= 1.27 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.105 X(o=-0.1,f=0) USER MOD Single : A 40 TYR OH : rot 165:sc= -0.0934 USER MOD Single : A 43 MET CE :methyl -134:sc= -0.138 (180deg=-4.02!) USER MOD Single : A 45 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.103) USER MOD Single : A 53 THR OG1 : rot 61:sc= 1.22 USER MOD Single : A 57 THR OG1 : rot -37:sc= -0.463 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -57:sc= 1.05 USER MOD Single : A 70 HIS : no HD1:sc= -3.24! X(o=-3.2!,f=-2.9) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.0221 X(o=-0.022,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.0227 K(o=-0.023,f=-1.2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -175:sc= -1.8 (180deg=-1.87) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.228 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -1.29! C(o=-1.3!,f=-2.6!) USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 106 TYR OH : rot -15:sc= -1.27 USER MOD Single : A 107 LYS NZ :NH3+ 167:sc= -0.192 (180deg=-0.464) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -1.74 X(o=-1.7,f=-1.6) USER MOD Single : A 110 MET CE :methyl -179:sc= -0.152 (180deg=-0.153) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-2.2) USER MOD Single : A 122 LYS NZ :NH3+ 164:sc= -0.204 (180deg=-0.206) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 GLN : amide:sc= -0.155 K(o=-0.16,f=-1.3) USER MOD Single : A 134 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00148) USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 3.564 6.719 -8.666 1.00 21.24 N ATOM 98 CA SER A 10 4.405 7.867 -8.981 1.00 44.24 C ATOM 99 C SER A 10 5.070 7.696 -10.344 1.00 73.51 C ATOM 100 O SER A 10 5.175 8.645 -11.119 1.00 63.02 O ATOM 101 CB SER A 10 5.472 8.057 -7.902 1.00 24.14 C ATOM 102 OG SER A 10 5.692 6.854 -7.185 1.00 13.45 O ATOM 0 HA SER A 10 3.770 8.752 -9.014 1.00 44.24 H new ATOM 0 HB2 SER A 10 6.404 8.386 -8.362 1.00 24.14 H new ATOM 0 HB3 SER A 10 5.162 8.843 -7.213 1.00 24.14 H new ATOM 0 HG SER A 10 4.958 6.229 -7.362 1.00 13.45 H new ATOM 108 N ASN A 11 5.516 6.476 -10.628 1.00 41.34 N ATOM 109 CA ASN A 11 6.171 6.179 -11.897 1.00 60.30 C ATOM 110 C ASN A 11 5.253 6.501 -13.072 1.00 72.30 C ATOM 111 O ASN A 11 5.717 6.781 -14.177 1.00 70.34 O ATOM 112 CB ASN A 11 6.586 4.707 -11.948 1.00 33.22 C ATOM 113 CG ASN A 11 5.413 3.785 -12.221 1.00 60.13 C ATOM 114 OD1 ASN A 11 4.318 3.982 -11.694 1.00 41.03 O ATOM 115 ND2 ASN A 11 5.638 2.771 -13.049 1.00 42.21 N ATOM 0 H ASN A 11 5.436 5.678 -9.997 1.00 41.34 H new ATOM 0 HA ASN A 11 7.061 6.804 -11.973 1.00 60.30 H new ATOM 0 HB2 ASN A 11 7.340 4.571 -12.724 1.00 33.22 H new ATOM 0 HB3 ASN A 11 7.050 4.430 -11.001 1.00 33.22 H new ATOM 0 HD21 ASN A 11 4.887 2.117 -13.271 1.00 42.21 H new ATOM 0 HD22 ASN A 11 6.562 2.646 -13.463 1.00 42.21 H new ATOM 122 N ASP A 12 3.948 6.459 -12.825 1.00 2.43 N ATOM 123 CA ASP A 12 2.964 6.748 -13.861 1.00 50.42 C ATOM 124 C ASP A 12 2.602 8.230 -13.869 1.00 13.34 C ATOM 125 O ASP A 12 2.210 8.780 -14.898 1.00 70.24 O ATOM 126 CB ASP A 12 1.706 5.904 -13.650 1.00 2.23 C ATOM 127 CG ASP A 12 1.721 4.629 -14.469 1.00 75.21 C ATOM 128 OD1 ASP A 12 1.761 4.724 -15.713 1.00 74.14 O ATOM 129 OD2 ASP A 12 1.691 3.535 -13.866 1.00 53.31 O ATOM 0 H ASP A 12 3.547 6.227 -11.916 1.00 2.43 H new ATOM 0 HA ASP A 12 3.404 6.495 -14.826 1.00 50.42 H new ATOM 0 HB2 ASP A 12 1.614 5.653 -12.593 1.00 2.23 H new ATOM 0 HB3 ASP A 12 0.828 6.493 -13.916 1.00 2.23 H new ATOM 134 N LYS A 13 2.734 8.872 -12.713 1.00 0.22 N ATOM 135 CA LYS A 13 2.421 10.291 -12.585 1.00 23.54 C ATOM 136 C LYS A 13 3.281 11.125 -13.529 1.00 73.21 C ATOM 137 O LYS A 13 2.763 11.883 -14.349 1.00 0.31 O ATOM 138 CB LYS A 13 2.635 10.753 -11.141 1.00 71.54 C ATOM 139 CG LYS A 13 1.469 11.546 -10.578 1.00 33.23 C ATOM 140 CD LYS A 13 1.728 11.976 -9.144 1.00 30.34 C ATOM 141 CE LYS A 13 0.429 12.176 -8.378 1.00 51.33 C ATOM 142 NZ LYS A 13 0.666 12.352 -6.919 1.00 4.32 N ATOM 0 H LYS A 13 3.056 8.432 -11.851 1.00 0.22 H new ATOM 0 HA LYS A 13 1.374 10.433 -12.854 1.00 23.54 H new ATOM 0 HB2 LYS A 13 2.808 9.881 -10.511 1.00 71.54 H new ATOM 0 HB3 LYS A 13 3.536 11.364 -11.094 1.00 71.54 H new ATOM 0 HG2 LYS A 13 1.294 12.426 -11.197 1.00 33.23 H new ATOM 0 HG3 LYS A 13 0.563 10.942 -10.620 1.00 33.23 H new ATOM 0 HD2 LYS A 13 2.336 11.223 -8.642 1.00 30.34 H new ATOM 0 HD3 LYS A 13 2.301 12.903 -9.139 1.00 30.34 H new ATOM 0 HE2 LYS A 13 -0.092 13.050 -8.769 1.00 51.33 H new ATOM 0 HE3 LYS A 13 -0.223 11.318 -8.539 1.00 51.33 H new ATOM 0 HZ1 LYS A 13 -0.244 12.485 -6.433 1.00 4.32 H new ATOM 0 HZ2 LYS A 13 1.140 11.508 -6.540 1.00 4.32 H new ATOM 0 HZ3 LYS A 13 1.267 13.186 -6.763 1.00 4.32 H new ATOM 156 N VAL A 14 4.597 10.979 -13.409 1.00 75.54 N ATOM 157 CA VAL A 14 5.528 11.717 -14.254 1.00 73.43 C ATOM 158 C VAL A 14 5.348 11.348 -15.723 1.00 22.13 C ATOM 159 O VAL A 14 5.468 12.197 -16.606 1.00 45.10 O ATOM 160 CB VAL A 14 6.989 11.451 -13.845 1.00 14.23 C ATOM 161 CG1 VAL A 14 7.314 9.969 -13.956 1.00 52.50 C ATOM 162 CG2 VAL A 14 7.939 12.279 -14.696 1.00 1.51 C ATOM 0 H VAL A 14 5.042 10.356 -12.735 1.00 75.54 H new ATOM 0 HA VAL A 14 5.307 12.776 -14.118 1.00 73.43 H new ATOM 0 HB VAL A 14 7.117 11.749 -12.804 1.00 14.23 H new ATOM 0 HG11 VAL A 14 8.350 9.801 -13.663 1.00 52.50 H new ATOM 0 HG12 VAL A 14 6.655 9.402 -13.299 1.00 52.50 H new ATOM 0 HG13 VAL A 14 7.170 9.641 -14.986 1.00 52.50 H new ATOM 0 HG21 VAL A 14 8.967 12.079 -14.394 1.00 1.51 H new ATOM 0 HG22 VAL A 14 7.812 12.015 -15.746 1.00 1.51 H new ATOM 0 HG23 VAL A 14 7.720 13.338 -14.560 1.00 1.51 H new ATOM 172 N TYR A 15 5.059 10.076 -15.976 1.00 42.54 N ATOM 173 CA TYR A 15 4.865 9.594 -17.338 1.00 54.05 C ATOM 174 C TYR A 15 3.527 10.067 -17.898 1.00 53.52 C ATOM 175 O TYR A 15 3.312 10.061 -19.110 1.00 12.22 O ATOM 176 CB TYR A 15 4.934 8.066 -17.376 1.00 13.44 C ATOM 177 CG TYR A 15 4.560 7.476 -18.716 1.00 64.25 C ATOM 178 CD1 TYR A 15 5.135 7.949 -19.890 1.00 54.00 C ATOM 179 CD2 TYR A 15 3.633 6.446 -18.810 1.00 61.52 C ATOM 180 CE1 TYR A 15 4.796 7.413 -21.118 1.00 1.05 C ATOM 181 CE2 TYR A 15 3.290 5.903 -20.033 1.00 73.51 C ATOM 182 CZ TYR A 15 3.874 6.390 -21.184 1.00 33.32 C ATOM 183 OH TYR A 15 3.533 5.852 -22.404 1.00 43.40 O ATOM 0 H TYR A 15 4.954 9.361 -15.256 1.00 42.54 H new ATOM 0 HA TYR A 15 5.663 10.003 -17.958 1.00 54.05 H new ATOM 0 HB2 TYR A 15 5.945 7.750 -17.119 1.00 13.44 H new ATOM 0 HB3 TYR A 15 4.270 7.662 -16.612 1.00 13.44 H new ATOM 0 HD1 TYR A 15 5.859 8.749 -19.842 1.00 54.00 H new ATOM 0 HD2 TYR A 15 3.172 6.063 -17.911 1.00 61.52 H new ATOM 0 HE1 TYR A 15 5.251 7.793 -22.021 1.00 1.05 H new ATOM 0 HE2 TYR A 15 2.568 5.101 -20.088 1.00 73.51 H new ATOM 0 HH TYR A 15 2.872 5.140 -22.274 1.00 43.40 H new ATOM 193 N GLU A 16 2.631 10.478 -17.006 1.00 1.04 N ATOM 194 CA GLU A 16 1.314 10.955 -17.410 1.00 32.11 C ATOM 195 C GLU A 16 1.331 12.462 -17.650 1.00 73.33 C ATOM 196 O GLU A 16 0.931 12.936 -18.713 1.00 21.13 O ATOM 197 CB GLU A 16 0.272 10.609 -16.344 1.00 3.14 C ATOM 198 CG GLU A 16 -0.492 9.328 -16.632 1.00 22.11 C ATOM 199 CD GLU A 16 -1.867 9.588 -17.215 1.00 33.40 C ATOM 200 OE1 GLU A 16 -2.732 10.111 -16.482 1.00 14.20 O ATOM 201 OE2 GLU A 16 -2.079 9.267 -18.403 1.00 41.42 O ATOM 0 H GLU A 16 2.793 10.490 -15.999 1.00 1.04 H new ATOM 0 HA GLU A 16 1.047 10.459 -18.343 1.00 32.11 H new ATOM 0 HB2 GLU A 16 0.769 10.516 -15.379 1.00 3.14 H new ATOM 0 HB3 GLU A 16 -0.436 11.433 -16.259 1.00 3.14 H new ATOM 0 HG2 GLU A 16 0.083 8.715 -17.326 1.00 22.11 H new ATOM 0 HG3 GLU A 16 -0.595 8.755 -15.710 1.00 22.11 H new ATOM 208 N ASN A 17 1.796 13.209 -16.654 1.00 61.42 N ATOM 209 CA ASN A 17 1.864 14.662 -16.756 1.00 65.11 C ATOM 210 C ASN A 17 2.591 15.084 -18.029 1.00 44.41 C ATOM 211 O ASN A 17 2.213 16.059 -18.679 1.00 12.12 O ATOM 212 CB ASN A 17 2.573 15.247 -15.533 1.00 20.13 C ATOM 213 CG ASN A 17 2.171 16.684 -15.264 1.00 44.44 C ATOM 214 OD1 ASN A 17 2.371 17.563 -16.103 1.00 55.14 O ATOM 215 ND2 ASN A 17 1.603 16.930 -14.090 1.00 13.31 N ATOM 0 H ASN A 17 2.131 12.832 -15.767 1.00 61.42 H new ATOM 0 HA ASN A 17 0.845 15.047 -16.796 1.00 65.11 H new ATOM 0 HB2 ASN A 17 2.344 14.639 -14.658 1.00 20.13 H new ATOM 0 HB3 ASN A 17 3.651 15.196 -15.683 1.00 20.13 H new ATOM 0 HD21 ASN A 17 1.313 17.879 -13.853 1.00 13.31 H new ATOM 0 HD22 ASN A 17 1.457 16.170 -13.425 1.00 13.31 H new ATOM 222 N VAL A 18 3.638 14.344 -18.380 1.00 72.42 N ATOM 223 CA VAL A 18 4.417 14.640 -19.576 1.00 63.32 C ATOM 224 C VAL A 18 3.522 14.734 -20.806 1.00 51.14 C ATOM 225 O VAL A 18 3.847 15.422 -21.775 1.00 5.25 O ATOM 226 CB VAL A 18 5.497 13.569 -19.822 1.00 1.03 C ATOM 227 CG1 VAL A 18 4.857 12.243 -20.203 1.00 62.21 C ATOM 228 CG2 VAL A 18 6.469 14.030 -20.897 1.00 42.12 C ATOM 0 H VAL A 18 3.966 13.535 -17.853 1.00 72.42 H new ATOM 0 HA VAL A 18 4.901 15.602 -19.408 1.00 63.32 H new ATOM 0 HB VAL A 18 6.056 13.423 -18.898 1.00 1.03 H new ATOM 0 HG11 VAL A 18 5.635 11.499 -20.373 1.00 62.21 H new ATOM 0 HG12 VAL A 18 4.205 11.909 -19.396 1.00 62.21 H new ATOM 0 HG13 VAL A 18 4.271 12.370 -21.114 1.00 62.21 H new ATOM 0 HG21 VAL A 18 7.225 13.261 -21.058 1.00 42.12 H new ATOM 0 HG22 VAL A 18 5.927 14.206 -21.826 1.00 42.12 H new ATOM 0 HG23 VAL A 18 6.953 14.953 -20.578 1.00 42.12 H new ATOM 238 N THR A 19 2.390 14.038 -20.763 1.00 11.13 N ATOM 239 CA THR A 19 1.447 14.042 -21.874 1.00 14.54 C ATOM 240 C THR A 19 0.411 15.149 -21.711 1.00 34.22 C ATOM 241 O THR A 19 0.163 15.922 -22.635 1.00 63.12 O ATOM 242 CB THR A 19 0.721 12.690 -22.000 1.00 31.44 C ATOM 243 OG1 THR A 19 1.671 11.644 -22.236 1.00 13.32 O ATOM 244 CG2 THR A 19 -0.295 12.724 -23.131 1.00 60.14 C ATOM 0 H THR A 19 2.104 13.464 -19.970 1.00 11.13 H new ATOM 0 HA THR A 19 2.027 14.220 -22.780 1.00 14.54 H new ATOM 0 HB THR A 19 0.194 12.498 -21.066 1.00 31.44 H new ATOM 0 HG1 THR A 19 1.202 10.787 -22.313 1.00 13.32 H new ATOM 0 HG21 THR A 19 -0.795 11.758 -23.200 1.00 60.14 H new ATOM 0 HG22 THR A 19 -1.033 13.501 -22.934 1.00 60.14 H new ATOM 0 HG23 THR A 19 0.214 12.937 -24.071 1.00 60.14 H new ATOM 252 N GLY A 20 -0.193 15.219 -20.528 1.00 42.10 N ATOM 253 CA GLY A 20 -1.195 16.235 -20.266 1.00 12.21 C ATOM 254 C GLY A 20 -0.708 17.631 -20.601 1.00 64.32 C ATOM 255 O GLY A 20 -1.378 18.376 -21.317 1.00 74.42 O ATOM 0 H GLY A 20 -0.006 14.590 -19.747 1.00 42.10 H new ATOM 0 HA2 GLY A 20 -2.090 16.017 -20.848 1.00 12.21 H new ATOM 0 HA3 GLY A 20 -1.481 16.196 -19.215 1.00 12.21 H new ATOM 259 N LEU A 21 0.462 17.988 -20.082 1.00 70.43 N ATOM 260 CA LEU A 21 1.039 19.305 -20.329 1.00 72.43 C ATOM 261 C LEU A 21 1.124 19.590 -21.825 1.00 64.33 C ATOM 262 O LEU A 21 0.938 20.725 -22.263 1.00 75.13 O ATOM 263 CB LEU A 21 2.430 19.400 -19.700 1.00 13.11 C ATOM 264 CG LEU A 21 3.558 18.697 -20.455 1.00 71.22 C ATOM 265 CD1 LEU A 21 4.195 19.641 -21.463 1.00 23.12 C ATOM 266 CD2 LEU A 21 4.602 18.168 -19.483 1.00 20.23 C ATOM 0 H LEU A 21 1.030 17.384 -19.488 1.00 70.43 H new ATOM 0 HA LEU A 21 0.389 20.051 -19.872 1.00 72.43 H new ATOM 0 HB2 LEU A 21 2.690 20.454 -19.598 1.00 13.11 H new ATOM 0 HB3 LEU A 21 2.380 18.985 -18.693 1.00 13.11 H new ATOM 0 HG LEU A 21 3.134 17.852 -20.997 1.00 71.22 H new ATOM 0 HD11 LEU A 21 4.996 19.123 -21.991 1.00 23.12 H new ATOM 0 HD12 LEU A 21 3.442 19.971 -22.179 1.00 23.12 H new ATOM 0 HD13 LEU A 21 4.604 20.507 -20.942 1.00 23.12 H new ATOM 0 HD21 LEU A 21 5.397 17.671 -20.038 1.00 20.23 H new ATOM 0 HD22 LEU A 21 5.021 18.997 -18.913 1.00 20.23 H new ATOM 0 HD23 LEU A 21 4.137 17.457 -18.801 1.00 20.23 H new ATOM 278 N VAL A 22 1.406 18.551 -22.605 1.00 61.13 N ATOM 279 CA VAL A 22 1.513 18.689 -24.053 1.00 21.41 C ATOM 280 C VAL A 22 0.164 19.033 -24.673 1.00 73.23 C ATOM 281 O VAL A 22 0.051 19.973 -25.461 1.00 22.43 O ATOM 282 CB VAL A 22 2.050 17.399 -24.701 1.00 71.33 C ATOM 283 CG1 VAL A 22 2.110 17.546 -26.214 1.00 10.30 C ATOM 284 CG2 VAL A 22 3.418 17.049 -24.137 1.00 24.23 C ATOM 0 H VAL A 22 1.564 17.605 -22.259 1.00 61.13 H new ATOM 0 HA VAL A 22 2.214 19.501 -24.243 1.00 21.41 H new ATOM 0 HB VAL A 22 1.366 16.584 -24.466 1.00 71.33 H new ATOM 0 HG11 VAL A 22 2.492 16.625 -26.654 1.00 10.30 H new ATOM 0 HG12 VAL A 22 1.110 17.746 -26.600 1.00 10.30 H new ATOM 0 HG13 VAL A 22 2.771 18.373 -26.473 1.00 10.30 H new ATOM 0 HG21 VAL A 22 3.782 16.135 -24.606 1.00 24.23 H new ATOM 0 HG22 VAL A 22 4.114 17.863 -24.340 1.00 24.23 H new ATOM 0 HG23 VAL A 22 3.340 16.898 -23.060 1.00 24.23 H new ATOM 294 N LYS A 23 -0.860 18.266 -24.313 1.00 63.32 N ATOM 295 CA LYS A 23 -2.204 18.489 -24.832 1.00 42.13 C ATOM 296 C LYS A 23 -2.633 19.938 -24.626 1.00 43.35 C ATOM 297 O LYS A 23 -3.421 20.478 -25.402 1.00 43.31 O ATOM 298 CB LYS A 23 -3.200 17.549 -24.149 1.00 5.44 C ATOM 299 CG LYS A 23 -2.806 16.085 -24.227 1.00 22.51 C ATOM 300 CD LYS A 23 -2.640 15.628 -25.667 1.00 22.03 C ATOM 301 CE LYS A 23 -1.218 15.164 -25.944 1.00 31.21 C ATOM 302 NZ LYS A 23 -1.189 13.961 -26.822 1.00 45.50 N ATOM 0 H LYS A 23 -0.784 17.484 -23.663 1.00 63.32 H new ATOM 0 HA LYS A 23 -2.192 18.280 -25.902 1.00 42.13 H new ATOM 0 HB2 LYS A 23 -3.297 17.835 -23.102 1.00 5.44 H new ATOM 0 HB3 LYS A 23 -4.181 17.678 -24.607 1.00 5.44 H new ATOM 0 HG2 LYS A 23 -1.873 15.929 -23.685 1.00 22.51 H new ATOM 0 HG3 LYS A 23 -3.565 15.476 -23.736 1.00 22.51 H new ATOM 0 HD2 LYS A 23 -3.336 14.815 -25.874 1.00 22.03 H new ATOM 0 HD3 LYS A 23 -2.895 16.446 -26.341 1.00 22.03 H new ATOM 0 HE2 LYS A 23 -0.658 15.971 -26.415 1.00 31.21 H new ATOM 0 HE3 LYS A 23 -0.719 14.938 -25.001 1.00 31.21 H new ATOM 0 HZ1 LYS A 23 -0.280 13.920 -27.325 1.00 45.50 H new ATOM 0 HZ2 LYS A 23 -1.302 13.105 -26.242 1.00 45.50 H new ATOM 0 HZ3 LYS A 23 -1.965 14.016 -27.512 1.00 45.50 H new ATOM 316 N ALA A 24 -2.108 20.563 -23.577 1.00 64.33 N ATOM 317 CA ALA A 24 -2.434 21.950 -23.272 1.00 43.22 C ATOM 318 C ALA A 24 -1.766 22.901 -24.260 1.00 11.00 C ATOM 319 O ALA A 24 -2.395 23.833 -24.762 1.00 23.12 O ATOM 320 CB ALA A 24 -2.019 22.289 -21.848 1.00 61.01 C ATOM 0 H ALA A 24 -1.455 20.130 -22.924 1.00 64.33 H new ATOM 0 HA ALA A 24 -3.513 22.072 -23.363 1.00 43.22 H new ATOM 0 HB1 ALA A 24 -2.269 23.328 -21.634 1.00 61.01 H new ATOM 0 HB2 ALA A 24 -2.546 21.638 -21.151 1.00 61.01 H new ATOM 0 HB3 ALA A 24 -0.944 22.144 -21.738 1.00 61.01 H new ATOM 326 N VAL A 25 -0.488 22.660 -24.535 1.00 0.03 N ATOM 327 CA VAL A 25 0.265 23.495 -25.463 1.00 61.10 C ATOM 328 C VAL A 25 -0.400 23.530 -26.834 1.00 54.12 C ATOM 329 O VAL A 25 -0.415 24.565 -27.501 1.00 75.15 O ATOM 330 CB VAL A 25 1.713 22.994 -25.620 1.00 42.20 C ATOM 331 CG1 VAL A 25 2.485 23.886 -26.581 1.00 23.42 C ATOM 332 CG2 VAL A 25 2.404 22.931 -24.266 1.00 63.13 C ATOM 0 H VAL A 25 0.047 21.893 -24.128 1.00 0.03 H new ATOM 0 HA VAL A 25 0.280 24.501 -25.044 1.00 61.10 H new ATOM 0 HB VAL A 25 1.688 21.987 -26.037 1.00 42.20 H new ATOM 0 HG11 VAL A 25 3.506 23.517 -26.680 1.00 23.42 H new ATOM 0 HG12 VAL A 25 1.999 23.876 -27.557 1.00 23.42 H new ATOM 0 HG13 VAL A 25 2.503 24.906 -26.196 1.00 23.42 H new ATOM 0 HG21 VAL A 25 3.426 22.575 -24.395 1.00 63.13 H new ATOM 0 HG22 VAL A 25 2.420 23.925 -23.819 1.00 63.13 H new ATOM 0 HG23 VAL A 25 1.862 22.248 -23.612 1.00 63.13 H new ATOM 342 N ILE A 26 -0.950 22.393 -27.248 1.00 41.53 N ATOM 343 CA ILE A 26 -1.619 22.295 -28.540 1.00 24.13 C ATOM 344 C ILE A 26 -3.014 22.908 -28.485 1.00 22.14 C ATOM 345 O ILE A 26 -3.327 23.830 -29.236 1.00 41.24 O ATOM 346 CB ILE A 26 -1.731 20.831 -29.005 1.00 53.11 C ATOM 347 CG1 ILE A 26 -0.343 20.196 -29.104 1.00 3.14 C ATOM 348 CG2 ILE A 26 -2.451 20.755 -30.343 1.00 62.35 C ATOM 349 CD1 ILE A 26 -0.267 18.813 -28.497 1.00 25.34 C ATOM 0 H ILE A 26 -0.946 21.528 -26.708 1.00 41.53 H new ATOM 0 HA ILE A 26 -1.010 22.849 -29.254 1.00 24.13 H new ATOM 0 HB ILE A 26 -2.312 20.275 -28.269 1.00 53.11 H new ATOM 0 HG12 ILE A 26 -0.052 20.140 -30.153 1.00 3.14 H new ATOM 0 HG13 ILE A 26 0.380 20.843 -28.607 1.00 3.14 H new ATOM 0 HG21 ILE A 26 -2.523 19.714 -30.659 1.00 62.35 H new ATOM 0 HG22 ILE A 26 -3.452 21.173 -30.242 1.00 62.35 H new ATOM 0 HG23 ILE A 26 -1.894 21.323 -31.088 1.00 62.35 H new ATOM 0 HD11 ILE A 26 0.746 18.424 -28.603 1.00 25.34 H new ATOM 0 HD12 ILE A 26 -0.527 18.865 -27.440 1.00 25.34 H new ATOM 0 HD13 ILE A 26 -0.965 18.152 -29.010 1.00 25.34 H new ATOM 361 N GLU A 27 -3.847 22.389 -27.588 1.00 11.53 N ATOM 362 CA GLU A 27 -5.209 22.887 -27.434 1.00 50.20 C ATOM 363 C GLU A 27 -5.218 24.403 -27.257 1.00 24.21 C ATOM 364 O GLU A 27 -5.981 25.111 -27.914 1.00 23.44 O ATOM 365 CB GLU A 27 -5.888 22.219 -26.237 1.00 22.14 C ATOM 366 CG GLU A 27 -7.369 22.538 -26.121 1.00 20.53 C ATOM 367 CD GLU A 27 -7.931 22.208 -24.751 1.00 51.24 C ATOM 368 OE1 GLU A 27 -7.815 23.056 -23.842 1.00 60.11 O ATOM 369 OE2 GLU A 27 -8.488 21.102 -24.590 1.00 22.22 O ATOM 0 H GLU A 27 -3.603 21.625 -26.958 1.00 11.53 H new ATOM 0 HA GLU A 27 -5.762 22.641 -28.340 1.00 50.20 H new ATOM 0 HB2 GLU A 27 -5.763 21.139 -26.315 1.00 22.14 H new ATOM 0 HB3 GLU A 27 -5.385 22.533 -25.323 1.00 22.14 H new ATOM 0 HG2 GLU A 27 -7.526 23.596 -26.329 1.00 20.53 H new ATOM 0 HG3 GLU A 27 -7.918 21.979 -26.879 1.00 20.53 H new ATOM 376 N MET A 28 -4.364 24.893 -26.364 1.00 43.23 N ATOM 377 CA MET A 28 -4.272 26.325 -26.101 1.00 33.42 C ATOM 378 C MET A 28 -3.964 27.094 -27.381 1.00 41.41 C ATOM 379 O MET A 28 -4.590 28.114 -27.669 1.00 52.24 O ATOM 380 CB MET A 28 -3.194 26.604 -25.052 1.00 35.13 C ATOM 381 CG MET A 28 -3.204 28.034 -24.536 1.00 72.13 C ATOM 382 SD MET A 28 -1.555 28.759 -24.469 1.00 42.44 S ATOM 383 CE MET A 28 -0.848 27.867 -23.087 1.00 31.42 C ATOM 0 H MET A 28 -3.726 24.320 -25.811 1.00 43.23 H new ATOM 0 HA MET A 28 -5.236 26.662 -25.719 1.00 33.42 H new ATOM 0 HB2 MET A 28 -3.331 25.922 -24.212 1.00 35.13 H new ATOM 0 HB3 MET A 28 -2.216 26.388 -25.482 1.00 35.13 H new ATOM 0 HG2 MET A 28 -3.839 28.644 -25.179 1.00 72.13 H new ATOM 0 HG3 MET A 28 -3.646 28.054 -23.540 1.00 72.13 H new ATOM 0 HE1 MET A 28 0.224 28.058 -23.041 1.00 31.42 H new ATOM 0 HE2 MET A 28 -1.316 28.201 -22.161 1.00 31.42 H new ATOM 0 HE3 MET A 28 -1.021 26.799 -23.217 1.00 31.42 H new ATOM 393 N SER A 29 -2.995 26.600 -28.145 1.00 72.30 N ATOM 394 CA SER A 29 -2.601 27.244 -29.393 1.00 32.15 C ATOM 395 C SER A 29 -3.760 27.260 -30.385 1.00 1.51 C ATOM 396 O SER A 29 -3.760 28.034 -31.343 1.00 34.43 O ATOM 397 CB SER A 29 -1.400 26.523 -30.006 1.00 64.32 C ATOM 398 OG SER A 29 -0.278 26.575 -29.142 1.00 45.33 O ATOM 0 H SER A 29 -2.468 25.756 -27.922 1.00 72.30 H new ATOM 0 HA SER A 29 -2.322 28.274 -29.170 1.00 32.15 H new ATOM 0 HB2 SER A 29 -1.660 25.484 -30.207 1.00 64.32 H new ATOM 0 HB3 SER A 29 -1.147 26.980 -30.963 1.00 64.32 H new ATOM 0 HG SER A 29 -0.378 25.904 -28.435 1.00 45.33 H new ATOM 404 N SER A 30 -4.746 26.401 -30.148 1.00 40.20 N ATOM 405 CA SER A 30 -5.910 26.313 -31.022 1.00 42.23 C ATOM 406 C SER A 30 -6.841 27.503 -30.808 1.00 60.35 C ATOM 407 O SER A 30 -7.173 28.224 -31.750 1.00 33.54 O ATOM 408 CB SER A 30 -6.666 25.007 -30.770 1.00 41.31 C ATOM 409 OG SER A 30 -7.066 24.406 -31.989 1.00 53.34 O ATOM 0 H SER A 30 -4.762 25.756 -29.358 1.00 40.20 H new ATOM 0 HA SER A 30 -5.561 26.328 -32.054 1.00 42.23 H new ATOM 0 HB2 SER A 30 -6.032 24.318 -30.212 1.00 41.31 H new ATOM 0 HB3 SER A 30 -7.543 25.204 -30.153 1.00 41.31 H new ATOM 0 HG SER A 30 -7.546 23.572 -31.801 1.00 53.34 H new ATOM 415 N LYS A 31 -7.259 27.702 -29.563 1.00 52.12 N ATOM 416 CA LYS A 31 -8.151 28.804 -29.222 1.00 72.13 C ATOM 417 C LYS A 31 -7.372 29.967 -28.616 1.00 34.22 C ATOM 418 O LYS A 31 -7.934 30.795 -27.899 1.00 14.40 O ATOM 419 CB LYS A 31 -9.228 28.331 -28.243 1.00 1.41 C ATOM 420 CG LYS A 31 -9.847 26.996 -28.618 1.00 13.14 C ATOM 421 CD LYS A 31 -10.603 27.082 -29.933 1.00 71.41 C ATOM 422 CE LYS A 31 -11.725 26.057 -29.999 1.00 31.21 C ATOM 423 NZ LYS A 31 -11.230 24.718 -30.423 1.00 45.21 N ATOM 0 H LYS A 31 -6.994 27.114 -28.773 1.00 52.12 H new ATOM 0 HA LYS A 31 -8.629 29.149 -30.139 1.00 72.13 H new ATOM 0 HB2 LYS A 31 -8.793 28.253 -27.247 1.00 1.41 H new ATOM 0 HB3 LYS A 31 -10.014 29.084 -28.189 1.00 1.41 H new ATOM 0 HG2 LYS A 31 -9.065 26.240 -28.695 1.00 13.14 H new ATOM 0 HG3 LYS A 31 -10.525 26.673 -27.828 1.00 13.14 H new ATOM 0 HD2 LYS A 31 -11.016 28.084 -30.051 1.00 71.41 H new ATOM 0 HD3 LYS A 31 -9.913 26.922 -30.762 1.00 71.41 H new ATOM 0 HE2 LYS A 31 -12.200 25.975 -29.021 1.00 31.21 H new ATOM 0 HE3 LYS A 31 -12.489 26.399 -30.697 1.00 31.21 H new ATOM 0 HZ1 LYS A 31 -12.025 24.048 -30.455 1.00 45.21 H new ATOM 0 HZ2 LYS A 31 -10.799 24.790 -31.367 1.00 45.21 H new ATOM 0 HZ3 LYS A 31 -10.520 24.379 -29.743 1.00 45.21 H new ATOM 437 N ILE A 32 -6.078 30.023 -28.909 1.00 24.41 N ATOM 438 CA ILE A 32 -5.224 31.086 -28.394 1.00 65.42 C ATOM 439 C ILE A 32 -5.694 32.452 -28.880 1.00 43.41 C ATOM 440 O ILE A 32 -5.683 33.426 -28.128 1.00 5.41 O ATOM 441 CB ILE A 32 -3.756 30.881 -28.814 1.00 3.35 C ATOM 442 CG1 ILE A 32 -2.886 32.021 -28.278 1.00 72.13 C ATOM 443 CG2 ILE A 32 -3.645 30.790 -30.328 1.00 74.01 C ATOM 444 CD1 ILE A 32 -2.940 32.166 -26.774 1.00 3.34 C ATOM 0 H ILE A 32 -5.598 29.345 -29.500 1.00 24.41 H new ATOM 0 HA ILE A 32 -5.291 31.047 -27.307 1.00 65.42 H new ATOM 0 HB ILE A 32 -3.399 29.944 -28.387 1.00 3.35 H new ATOM 0 HG12 ILE A 32 -1.853 31.852 -28.582 1.00 72.13 H new ATOM 0 HG13 ILE A 32 -3.205 32.957 -28.737 1.00 72.13 H new ATOM 0 HG21 ILE A 32 -2.602 30.645 -30.608 1.00 74.01 H new ATOM 0 HG22 ILE A 32 -4.237 29.948 -30.686 1.00 74.01 H new ATOM 0 HG23 ILE A 32 -4.017 31.712 -30.776 1.00 74.01 H new ATOM 0 HD11 ILE A 32 -2.300 32.993 -26.465 1.00 3.34 H new ATOM 0 HD12 ILE A 32 -3.966 32.366 -26.464 1.00 3.34 H new ATOM 0 HD13 ILE A 32 -2.593 31.244 -26.307 1.00 3.34 H new ATOM 456 N GLN A 33 -6.108 32.516 -30.141 1.00 62.35 N ATOM 457 CA GLN A 33 -6.583 33.763 -30.727 1.00 53.42 C ATOM 458 C GLN A 33 -7.841 34.253 -30.018 1.00 14.23 C ATOM 459 O GLN A 33 -7.874 35.339 -29.438 1.00 22.10 O ATOM 460 CB GLN A 33 -6.865 33.576 -32.219 1.00 40.30 C ATOM 461 CG GLN A 33 -5.784 34.153 -33.119 1.00 53.02 C ATOM 462 CD GLN A 33 -6.017 35.614 -33.448 1.00 54.34 C ATOM 463 OE1 GLN A 33 -6.527 35.948 -34.519 1.00 21.13 O ATOM 464 NE2 GLN A 33 -5.645 36.496 -32.528 1.00 20.44 N ATOM 0 H GLN A 33 -6.124 31.718 -30.777 1.00 62.35 H new ATOM 0 HA GLN A 33 -5.802 34.513 -30.603 1.00 53.42 H new ATOM 0 HB2 GLN A 33 -6.972 32.512 -32.430 1.00 40.30 H new ATOM 0 HB3 GLN A 33 -7.818 34.046 -32.462 1.00 40.30 H new ATOM 0 HG2 GLN A 33 -4.815 34.044 -32.632 1.00 53.02 H new ATOM 0 HG3 GLN A 33 -5.742 33.578 -34.044 1.00 53.02 H new ATOM 0 HE21 GLN A 33 -5.226 36.176 -31.655 1.00 20.44 H new ATOM 0 HE22 GLN A 33 -5.778 37.493 -32.695 1.00 20.44 H new ATOM 473 N PRO A 34 -8.904 33.435 -30.063 1.00 45.33 N ATOM 474 CA PRO A 34 -10.184 33.764 -29.430 1.00 2.43 C ATOM 475 C PRO A 34 -10.102 33.733 -27.907 1.00 51.44 C ATOM 476 O PRO A 34 -11.049 34.111 -27.218 1.00 2.21 O ATOM 477 CB PRO A 34 -11.123 32.667 -29.937 1.00 51.53 C ATOM 478 CG PRO A 34 -10.228 31.521 -30.260 1.00 4.33 C ATOM 479 CD PRO A 34 -8.936 32.126 -30.737 1.00 12.14 C ATOM 0 HA PRO A 34 -10.513 34.773 -29.677 1.00 2.43 H new ATOM 0 HB2 PRO A 34 -11.858 32.394 -29.180 1.00 51.53 H new ATOM 0 HB3 PRO A 34 -11.678 32.996 -30.816 1.00 51.53 H new ATOM 0 HG2 PRO A 34 -10.065 30.894 -29.383 1.00 4.33 H new ATOM 0 HG3 PRO A 34 -10.669 30.886 -31.029 1.00 4.33 H new ATOM 0 HD2 PRO A 34 -8.079 31.511 -30.462 1.00 12.14 H new ATOM 0 HD3 PRO A 34 -8.918 32.232 -31.822 1.00 12.14 H new ATOM 487 N ALA A 35 -8.965 33.281 -27.390 1.00 2.25 N ATOM 488 CA ALA A 35 -8.759 33.204 -25.949 1.00 31.44 C ATOM 489 C ALA A 35 -9.190 34.495 -25.262 1.00 40.31 C ATOM 490 O ALA A 35 -8.522 35.526 -25.350 1.00 55.04 O ATOM 491 CB ALA A 35 -7.301 32.900 -25.639 1.00 44.32 C ATOM 0 H ALA A 35 -8.172 32.963 -27.947 1.00 2.25 H new ATOM 0 HA ALA A 35 -9.378 32.394 -25.562 1.00 31.44 H new ATOM 0 HB1 ALA A 35 -7.162 32.846 -24.559 1.00 44.32 H new ATOM 0 HB2 ALA A 35 -7.025 31.946 -26.089 1.00 44.32 H new ATOM 0 HB3 ALA A 35 -6.670 33.690 -26.046 1.00 44.32 H new ATOM 497 N PRO A 36 -10.333 34.441 -24.562 1.00 4.52 N ATOM 498 CA PRO A 36 -10.878 35.599 -23.847 1.00 11.13 C ATOM 499 C PRO A 36 -10.037 35.980 -22.633 1.00 34.52 C ATOM 500 O PRO A 36 -9.146 35.243 -22.209 1.00 53.02 O ATOM 501 CB PRO A 36 -12.266 35.124 -23.409 1.00 24.25 C ATOM 502 CG PRO A 36 -12.153 33.640 -23.337 1.00 4.14 C ATOM 503 CD PRO A 36 -11.180 33.246 -24.413 1.00 42.25 C ATOM 0 HA PRO A 36 -10.895 36.492 -24.471 1.00 11.13 H new ATOM 0 HB2 PRO A 36 -12.543 35.547 -22.443 1.00 24.25 H new ATOM 0 HB3 PRO A 36 -13.032 35.429 -24.122 1.00 24.25 H new ATOM 0 HG2 PRO A 36 -11.799 33.323 -22.356 1.00 4.14 H new ATOM 0 HG3 PRO A 36 -13.122 33.167 -23.495 1.00 4.14 H new ATOM 0 HD2 PRO A 36 -10.595 32.372 -24.125 1.00 42.25 H new ATOM 0 HD3 PRO A 36 -11.690 32.996 -25.344 1.00 42.25 H new ATOM 511 N PRO A 37 -10.325 37.157 -22.058 1.00 34.42 N ATOM 512 CA PRO A 37 -9.607 37.661 -20.883 1.00 74.34 C ATOM 513 C PRO A 37 -9.919 36.858 -19.625 1.00 12.32 C ATOM 514 O PRO A 37 -9.181 36.917 -18.642 1.00 64.34 O ATOM 515 CB PRO A 37 -10.120 39.096 -20.743 1.00 52.13 C ATOM 516 CG PRO A 37 -11.463 39.083 -21.388 1.00 13.23 C ATOM 517 CD PRO A 37 -11.375 38.086 -22.510 1.00 23.24 C ATOM 0 HA PRO A 37 -8.526 37.590 -21.004 1.00 74.34 H new ATOM 0 HB2 PRO A 37 -10.186 39.392 -19.696 1.00 52.13 H new ATOM 0 HB3 PRO A 37 -9.452 39.805 -21.233 1.00 52.13 H new ATOM 0 HG2 PRO A 37 -12.236 38.799 -20.674 1.00 13.23 H new ATOM 0 HG3 PRO A 37 -11.724 40.072 -21.765 1.00 13.23 H new ATOM 0 HD2 PRO A 37 -12.324 37.574 -22.668 1.00 23.24 H new ATOM 0 HD3 PRO A 37 -11.110 38.564 -23.453 1.00 23.24 H new ATOM 525 N GLU A 38 -11.017 36.110 -19.662 1.00 71.24 N ATOM 526 CA GLU A 38 -11.426 35.296 -18.523 1.00 45.14 C ATOM 527 C GLU A 38 -10.731 33.938 -18.548 1.00 71.54 C ATOM 528 O GLU A 38 -10.587 33.284 -17.516 1.00 12.02 O ATOM 529 CB GLU A 38 -12.944 35.105 -18.523 1.00 3.22 C ATOM 530 CG GLU A 38 -13.684 36.120 -17.668 1.00 74.12 C ATOM 531 CD GLU A 38 -14.655 36.962 -18.473 1.00 12.44 C ATOM 532 OE1 GLU A 38 -14.192 37.856 -19.213 1.00 34.43 O ATOM 533 OE2 GLU A 38 -15.877 36.729 -18.362 1.00 41.02 O ATOM 0 H GLU A 38 -11.639 36.051 -20.468 1.00 71.24 H new ATOM 0 HA GLU A 38 -11.133 35.818 -17.612 1.00 45.14 H new ATOM 0 HB2 GLU A 38 -13.310 35.170 -19.548 1.00 3.22 H new ATOM 0 HB3 GLU A 38 -13.176 34.102 -18.164 1.00 3.22 H new ATOM 0 HG2 GLU A 38 -14.227 35.599 -16.880 1.00 74.12 H new ATOM 0 HG3 GLU A 38 -12.962 36.773 -17.179 1.00 74.12 H new ATOM 540 N GLU A 39 -10.304 33.520 -19.736 1.00 25.22 N ATOM 541 CA GLU A 39 -9.626 32.239 -19.895 1.00 63.45 C ATOM 542 C GLU A 39 -8.110 32.417 -19.866 1.00 15.33 C ATOM 543 O GLU A 39 -7.365 31.456 -19.679 1.00 64.55 O ATOM 544 CB GLU A 39 -10.046 31.574 -21.208 1.00 51.11 C ATOM 545 CG GLU A 39 -9.835 30.069 -21.223 1.00 51.44 C ATOM 546 CD GLU A 39 -10.682 29.351 -20.191 1.00 72.01 C ATOM 547 OE1 GLU A 39 -11.862 29.726 -20.028 1.00 74.22 O ATOM 548 OE2 GLU A 39 -10.166 28.415 -19.546 1.00 64.24 O ATOM 0 H GLU A 39 -10.416 34.049 -20.601 1.00 25.22 H new ATOM 0 HA GLU A 39 -9.916 31.599 -19.062 1.00 63.45 H new ATOM 0 HB2 GLU A 39 -11.099 31.787 -21.393 1.00 51.11 H new ATOM 0 HB3 GLU A 39 -9.482 32.020 -22.028 1.00 51.11 H new ATOM 0 HG2 GLU A 39 -10.072 29.683 -22.214 1.00 51.44 H new ATOM 0 HG3 GLU A 39 -8.783 29.852 -21.039 1.00 51.44 H new ATOM 555 N TYR A 40 -7.663 33.654 -20.051 1.00 10.20 N ATOM 556 CA TYR A 40 -6.237 33.960 -20.049 1.00 33.44 C ATOM 557 C TYR A 40 -5.675 33.926 -18.631 1.00 33.14 C ATOM 558 O TYR A 40 -4.528 33.536 -18.414 1.00 2.20 O ATOM 559 CB TYR A 40 -5.987 35.332 -20.676 1.00 13.23 C ATOM 560 CG TYR A 40 -5.136 35.281 -21.925 1.00 15.45 C ATOM 561 CD1 TYR A 40 -5.411 34.374 -22.940 1.00 31.31 C ATOM 562 CD2 TYR A 40 -4.058 36.142 -22.089 1.00 52.24 C ATOM 563 CE1 TYR A 40 -4.636 34.324 -24.082 1.00 62.51 C ATOM 564 CE2 TYR A 40 -3.278 36.100 -23.229 1.00 13.11 C ATOM 565 CZ TYR A 40 -3.571 35.189 -24.222 1.00 62.21 C ATOM 566 OH TYR A 40 -2.797 35.143 -25.359 1.00 61.20 O ATOM 0 H TYR A 40 -8.267 34.461 -20.204 1.00 10.20 H new ATOM 0 HA TYR A 40 -5.727 33.200 -20.641 1.00 33.44 H new ATOM 0 HB2 TYR A 40 -6.945 35.792 -20.918 1.00 13.23 H new ATOM 0 HB3 TYR A 40 -5.502 35.975 -19.942 1.00 13.23 H new ATOM 0 HD1 TYR A 40 -6.245 33.696 -22.835 1.00 31.31 H new ATOM 0 HD2 TYR A 40 -3.826 36.856 -21.313 1.00 52.24 H new ATOM 0 HE1 TYR A 40 -4.863 33.611 -24.861 1.00 62.51 H new ATOM 0 HE2 TYR A 40 -2.444 36.777 -23.342 1.00 13.11 H new ATOM 0 HH TYR A 40 -2.251 35.955 -25.416 1.00 61.20 H new ATOM 576 N VAL A 41 -6.493 34.337 -17.667 1.00 34.11 N ATOM 577 CA VAL A 41 -6.081 34.353 -16.269 1.00 24.23 C ATOM 578 C VAL A 41 -5.726 32.951 -15.785 1.00 4.55 C ATOM 579 O VAL A 41 -4.616 32.691 -15.320 1.00 24.11 O ATOM 580 CB VAL A 41 -7.184 34.932 -15.364 1.00 53.31 C ATOM 581 CG1 VAL A 41 -7.128 34.301 -13.981 1.00 44.42 C ATOM 582 CG2 VAL A 41 -7.059 36.446 -15.274 1.00 71.33 C ATOM 0 H VAL A 41 -7.446 34.664 -17.829 1.00 34.11 H new ATOM 0 HA VAL A 41 -5.199 34.991 -16.207 1.00 24.23 H new ATOM 0 HB VAL A 41 -8.152 34.695 -15.805 1.00 53.31 H new ATOM 0 HG11 VAL A 41 -7.915 34.723 -13.356 1.00 44.42 H new ATOM 0 HG12 VAL A 41 -7.271 33.224 -14.066 1.00 44.42 H new ATOM 0 HG13 VAL A 41 -6.158 34.503 -13.528 1.00 44.42 H new ATOM 0 HG21 VAL A 41 -7.846 36.838 -14.631 1.00 71.33 H new ATOM 0 HG22 VAL A 41 -6.086 36.707 -14.857 1.00 71.33 H new ATOM 0 HG23 VAL A 41 -7.155 36.879 -16.270 1.00 71.33 H new ATOM 592 N PRO A 42 -6.689 32.025 -15.895 1.00 55.42 N ATOM 593 CA PRO A 42 -6.502 30.634 -15.475 1.00 31.41 C ATOM 594 C PRO A 42 -5.537 29.879 -16.383 1.00 21.13 C ATOM 595 O PRO A 42 -4.844 28.962 -15.942 1.00 1.40 O ATOM 596 CB PRO A 42 -7.909 30.039 -15.578 1.00 41.34 C ATOM 597 CG PRO A 42 -8.602 30.881 -16.594 1.00 22.31 C ATOM 598 CD PRO A 42 -8.036 32.266 -16.440 1.00 34.53 C ATOM 0 HA PRO A 42 -6.067 30.565 -14.478 1.00 31.41 H new ATOM 0 HB2 PRO A 42 -7.875 28.994 -15.886 1.00 41.34 H new ATOM 0 HB3 PRO A 42 -8.424 30.072 -14.618 1.00 41.34 H new ATOM 0 HG2 PRO A 42 -8.430 30.499 -17.600 1.00 22.31 H new ATOM 0 HG3 PRO A 42 -9.680 30.880 -16.432 1.00 22.31 H new ATOM 0 HD2 PRO A 42 -7.995 32.792 -17.394 1.00 34.53 H new ATOM 0 HD3 PRO A 42 -8.639 32.874 -15.766 1.00 34.53 H new ATOM 606 N MET A 43 -5.497 30.270 -17.652 1.00 40.51 N ATOM 607 CA MET A 43 -4.615 29.631 -18.621 1.00 43.13 C ATOM 608 C MET A 43 -3.182 29.578 -18.100 1.00 40.33 C ATOM 609 O MET A 43 -2.469 28.598 -18.314 1.00 62.12 O ATOM 610 CB MET A 43 -4.658 30.381 -19.954 1.00 64.53 C ATOM 611 CG MET A 43 -5.495 29.686 -21.015 1.00 75.34 C ATOM 612 SD MET A 43 -5.585 30.622 -22.553 1.00 44.55 S ATOM 613 CE MET A 43 -7.110 29.990 -23.247 1.00 13.51 C ATOM 0 H MET A 43 -6.065 31.026 -18.033 1.00 40.51 H new ATOM 0 HA MET A 43 -4.965 28.610 -18.775 1.00 43.13 H new ATOM 0 HB2 MET A 43 -5.057 31.381 -19.786 1.00 64.53 H new ATOM 0 HB3 MET A 43 -3.641 30.502 -20.327 1.00 64.53 H new ATOM 0 HG2 MET A 43 -5.073 28.702 -21.218 1.00 75.34 H new ATOM 0 HG3 MET A 43 -6.503 29.528 -20.631 1.00 75.34 H new ATOM 0 HE1 MET A 43 -6.960 29.755 -24.301 1.00 13.51 H new ATOM 0 HE2 MET A 43 -7.406 29.087 -22.713 1.00 13.51 H new ATOM 0 HE3 MET A 43 -7.893 30.742 -23.150 1.00 13.51 H new ATOM 623 N VAL A 44 -2.766 30.639 -17.416 1.00 14.24 N ATOM 624 CA VAL A 44 -1.419 30.713 -16.863 1.00 50.15 C ATOM 625 C VAL A 44 -1.195 29.631 -15.814 1.00 33.54 C ATOM 626 O VAL A 44 -0.196 28.913 -15.849 1.00 22.51 O ATOM 627 CB VAL A 44 -1.146 32.091 -16.231 1.00 35.43 C ATOM 628 CG1 VAL A 44 0.280 32.166 -15.708 1.00 62.35 C ATOM 629 CG2 VAL A 44 -1.414 33.201 -17.236 1.00 70.50 C ATOM 0 H VAL A 44 -3.343 31.460 -17.231 1.00 14.24 H new ATOM 0 HA VAL A 44 -0.728 30.559 -17.692 1.00 50.15 H new ATOM 0 HB VAL A 44 -1.824 32.225 -15.388 1.00 35.43 H new ATOM 0 HG11 VAL A 44 0.454 33.147 -15.265 1.00 62.35 H new ATOM 0 HG12 VAL A 44 0.432 31.395 -14.953 1.00 62.35 H new ATOM 0 HG13 VAL A 44 0.978 32.010 -16.531 1.00 62.35 H new ATOM 0 HG21 VAL A 44 -1.216 34.167 -16.772 1.00 70.50 H new ATOM 0 HG22 VAL A 44 -0.763 33.073 -18.101 1.00 70.50 H new ATOM 0 HG23 VAL A 44 -2.455 33.159 -17.556 1.00 70.50 H new ATOM 639 N LYS A 45 -2.133 29.518 -14.879 1.00 30.20 N ATOM 640 CA LYS A 45 -2.041 28.522 -13.818 1.00 61.53 C ATOM 641 C LYS A 45 -1.894 27.119 -14.400 1.00 43.33 C ATOM 642 O LYS A 45 -1.208 26.271 -13.831 1.00 64.14 O ATOM 643 CB LYS A 45 -3.279 28.586 -12.921 1.00 72.54 C ATOM 644 CG LYS A 45 -3.338 29.831 -12.054 1.00 31.12 C ATOM 645 CD LYS A 45 -2.667 29.606 -10.709 1.00 42.14 C ATOM 646 CE LYS A 45 -1.553 30.613 -10.467 1.00 42.14 C ATOM 647 NZ LYS A 45 -0.209 30.025 -10.723 1.00 43.40 N ATOM 0 H LYS A 45 -2.966 30.105 -14.835 1.00 30.20 H new ATOM 0 HA LYS A 45 -1.156 28.744 -13.222 1.00 61.53 H new ATOM 0 HB2 LYS A 45 -4.172 28.545 -13.545 1.00 72.54 H new ATOM 0 HB3 LYS A 45 -3.298 27.705 -12.279 1.00 72.54 H new ATOM 0 HG2 LYS A 45 -2.852 30.659 -12.570 1.00 31.12 H new ATOM 0 HG3 LYS A 45 -4.378 30.119 -11.899 1.00 31.12 H new ATOM 0 HD2 LYS A 45 -3.408 29.684 -9.914 1.00 42.14 H new ATOM 0 HD3 LYS A 45 -2.261 28.595 -10.668 1.00 42.14 H new ATOM 0 HE2 LYS A 45 -1.700 31.479 -11.113 1.00 42.14 H new ATOM 0 HE3 LYS A 45 -1.603 30.970 -9.438 1.00 42.14 H new ATOM 0 HZ1 LYS A 45 0.524 30.656 -10.342 1.00 43.40 H new ATOM 0 HZ2 LYS A 45 -0.142 29.097 -10.259 1.00 43.40 H new ATOM 0 HZ3 LYS A 45 -0.070 29.910 -11.747 1.00 43.40 H new ATOM 661 N GLU A 46 -2.541 26.884 -15.537 1.00 50.24 N ATOM 662 CA GLU A 46 -2.480 25.584 -16.195 1.00 54.45 C ATOM 663 C GLU A 46 -1.046 25.236 -16.581 1.00 43.45 C ATOM 664 O GLU A 46 -0.456 24.299 -16.044 1.00 32.12 O ATOM 665 CB GLU A 46 -3.371 25.576 -17.439 1.00 73.25 C ATOM 666 CG GLU A 46 -4.752 24.991 -17.195 1.00 53.21 C ATOM 667 CD GLU A 46 -4.704 23.532 -16.786 1.00 71.34 C ATOM 668 OE1 GLU A 46 -4.738 22.664 -17.684 1.00 23.33 O ATOM 669 OE2 GLU A 46 -4.633 23.258 -15.570 1.00 70.43 O ATOM 0 H GLU A 46 -3.113 27.576 -16.021 1.00 50.24 H new ATOM 0 HA GLU A 46 -2.841 24.832 -15.493 1.00 54.45 H new ATOM 0 HB2 GLU A 46 -3.478 26.597 -17.806 1.00 73.25 H new ATOM 0 HB3 GLU A 46 -2.877 25.005 -18.225 1.00 73.25 H new ATOM 0 HG2 GLU A 46 -5.254 25.566 -16.417 1.00 53.21 H new ATOM 0 HG3 GLU A 46 -5.350 25.091 -18.101 1.00 53.21 H new ATOM 676 N VAL A 47 -0.490 25.998 -17.518 1.00 44.41 N ATOM 677 CA VAL A 47 0.876 25.772 -17.977 1.00 12.13 C ATOM 678 C VAL A 47 1.869 25.890 -16.826 1.00 13.11 C ATOM 679 O VAL A 47 2.761 25.057 -16.674 1.00 42.12 O ATOM 680 CB VAL A 47 1.269 26.769 -19.083 1.00 74.44 C ATOM 681 CG1 VAL A 47 2.616 26.397 -19.683 1.00 2.10 C ATOM 682 CG2 VAL A 47 0.194 26.821 -20.159 1.00 13.04 C ATOM 0 H VAL A 47 -0.964 26.777 -17.974 1.00 44.41 H new ATOM 0 HA VAL A 47 0.911 24.760 -18.381 1.00 12.13 H new ATOM 0 HB VAL A 47 1.357 27.761 -18.640 1.00 74.44 H new ATOM 0 HG11 VAL A 47 2.877 27.113 -20.463 1.00 2.10 H new ATOM 0 HG12 VAL A 47 3.378 26.414 -18.904 1.00 2.10 H new ATOM 0 HG13 VAL A 47 2.559 25.397 -20.113 1.00 2.10 H new ATOM 0 HG21 VAL A 47 0.488 27.530 -20.933 1.00 13.04 H new ATOM 0 HG22 VAL A 47 0.073 25.832 -20.601 1.00 13.04 H new ATOM 0 HG23 VAL A 47 -0.750 27.138 -19.715 1.00 13.04 H new ATOM 692 N GLY A 48 1.706 26.932 -16.016 1.00 24.03 N ATOM 693 CA GLY A 48 2.596 27.140 -14.888 1.00 13.21 C ATOM 694 C GLY A 48 2.615 25.959 -13.939 1.00 34.34 C ATOM 695 O GLY A 48 3.635 25.674 -13.310 1.00 60.44 O ATOM 0 H GLY A 48 0.974 27.635 -16.121 1.00 24.03 H new ATOM 0 HA2 GLY A 48 3.606 27.323 -15.255 1.00 13.21 H new ATOM 0 HA3 GLY A 48 2.287 28.033 -14.345 1.00 13.21 H new ATOM 699 N LEU A 49 1.484 25.270 -13.831 1.00 72.15 N ATOM 700 CA LEU A 49 1.373 24.113 -12.950 1.00 24.30 C ATOM 701 C LEU A 49 2.183 22.938 -13.489 1.00 44.12 C ATOM 702 O LEU A 49 2.799 22.194 -12.727 1.00 5.23 O ATOM 703 CB LEU A 49 -0.093 23.706 -12.791 1.00 63.23 C ATOM 704 CG LEU A 49 -0.354 22.447 -11.963 1.00 50.15 C ATOM 705 CD1 LEU A 49 -1.434 22.706 -10.925 1.00 0.14 C ATOM 706 CD2 LEU A 49 -0.747 21.287 -12.866 1.00 53.05 C ATOM 0 H LEU A 49 0.630 25.493 -14.343 1.00 72.15 H new ATOM 0 HA LEU A 49 1.774 24.391 -11.975 1.00 24.30 H new ATOM 0 HB2 LEU A 49 -0.632 24.536 -12.334 1.00 63.23 H new ATOM 0 HB3 LEU A 49 -0.518 23.558 -13.784 1.00 63.23 H new ATOM 0 HG LEU A 49 0.566 22.180 -11.442 1.00 50.15 H new ATOM 0 HD11 LEU A 49 -1.606 21.799 -10.345 1.00 0.14 H new ATOM 0 HD12 LEU A 49 -1.114 23.507 -10.259 1.00 0.14 H new ATOM 0 HD13 LEU A 49 -2.357 22.998 -11.426 1.00 0.14 H new ATOM 0 HD21 LEU A 49 -0.929 20.400 -12.260 1.00 53.05 H new ATOM 0 HD22 LEU A 49 -1.653 21.544 -13.415 1.00 53.05 H new ATOM 0 HD23 LEU A 49 0.059 21.086 -13.571 1.00 53.05 H new ATOM 718 N ALA A 50 2.179 22.779 -14.809 1.00 3.34 N ATOM 719 CA ALA A 50 2.917 21.698 -15.450 1.00 41.22 C ATOM 720 C ALA A 50 4.405 21.782 -15.127 1.00 20.40 C ATOM 721 O ALA A 50 5.033 20.780 -14.781 1.00 71.24 O ATOM 722 CB ALA A 50 2.699 21.731 -16.956 1.00 4.43 C ATOM 0 H ALA A 50 1.673 23.385 -15.455 1.00 3.34 H new ATOM 0 HA ALA A 50 2.540 20.753 -15.060 1.00 41.22 H new ATOM 0 HB1 ALA A 50 3.256 20.918 -17.422 1.00 4.43 H new ATOM 0 HB2 ALA A 50 1.637 21.614 -17.173 1.00 4.43 H new ATOM 0 HB3 ALA A 50 3.048 22.684 -17.353 1.00 4.43 H new ATOM 728 N LEU A 51 4.964 22.981 -15.242 1.00 2.10 N ATOM 729 CA LEU A 51 6.380 23.195 -14.962 1.00 51.34 C ATOM 730 C LEU A 51 6.691 22.930 -13.493 1.00 20.40 C ATOM 731 O LEU A 51 7.575 22.136 -13.169 1.00 52.11 O ATOM 732 CB LEU A 51 6.782 24.625 -15.330 1.00 60.43 C ATOM 733 CG LEU A 51 6.789 24.957 -16.823 1.00 35.12 C ATOM 734 CD1 LEU A 51 5.940 26.188 -17.099 1.00 52.22 C ATOM 735 CD2 LEU A 51 8.213 25.167 -17.316 1.00 73.12 C ATOM 0 H LEU A 51 4.459 23.820 -15.527 1.00 2.10 H new ATOM 0 HA LEU A 51 6.955 22.495 -15.568 1.00 51.34 H new ATOM 0 HB2 LEU A 51 6.101 25.313 -14.828 1.00 60.43 H new ATOM 0 HB3 LEU A 51 7.778 24.815 -14.931 1.00 60.43 H new ATOM 0 HG LEU A 51 6.359 24.115 -17.365 1.00 35.12 H new ATOM 0 HD11 LEU A 51 5.956 26.410 -18.166 1.00 52.22 H new ATOM 0 HD12 LEU A 51 4.914 26.000 -16.783 1.00 52.22 H new ATOM 0 HD13 LEU A 51 6.340 27.038 -16.546 1.00 52.22 H new ATOM 0 HD21 LEU A 51 8.199 25.402 -18.380 1.00 73.12 H new ATOM 0 HD22 LEU A 51 8.670 25.991 -16.768 1.00 73.12 H new ATOM 0 HD23 LEU A 51 8.792 24.258 -17.153 1.00 73.12 H new ATOM 747 N ARG A 52 5.958 23.597 -12.608 1.00 74.21 N ATOM 748 CA ARG A 52 6.155 23.432 -11.173 1.00 34.10 C ATOM 749 C ARG A 52 5.996 21.970 -10.767 1.00 21.41 C ATOM 750 O ARG A 52 6.752 21.457 -9.941 1.00 44.20 O ATOM 751 CB ARG A 52 5.161 24.298 -10.397 1.00 54.33 C ATOM 752 CG ARG A 52 5.790 25.064 -9.245 1.00 50.32 C ATOM 753 CD ARG A 52 4.870 26.164 -8.738 1.00 74.35 C ATOM 754 NE ARG A 52 3.596 25.634 -8.260 1.00 75.33 N ATOM 755 CZ ARG A 52 2.576 26.398 -7.885 1.00 51.24 C ATOM 756 NH1 ARG A 52 2.680 27.719 -7.934 1.00 5.04 N ATOM 757 NH2 ARG A 52 1.448 25.841 -7.462 1.00 4.53 N ATOM 0 H ARG A 52 5.222 24.257 -12.859 1.00 74.21 H new ATOM 0 HA ARG A 52 7.169 23.750 -10.932 1.00 34.10 H new ATOM 0 HB2 ARG A 52 4.697 25.007 -11.083 1.00 54.33 H new ATOM 0 HB3 ARG A 52 4.365 23.663 -10.008 1.00 54.33 H new ATOM 0 HG2 ARG A 52 6.019 24.376 -8.431 1.00 50.32 H new ATOM 0 HG3 ARG A 52 6.735 25.500 -9.569 1.00 50.32 H new ATOM 0 HD2 ARG A 52 5.363 26.706 -7.931 1.00 74.35 H new ATOM 0 HD3 ARG A 52 4.687 26.881 -9.538 1.00 74.35 H new ATOM 0 HE ARG A 52 3.483 24.621 -8.211 1.00 75.33 H new ATOM 0 HH11 ARG A 52 3.545 28.151 -8.260 1.00 5.04 H new ATOM 0 HH12 ARG A 52 1.895 28.303 -7.646 1.00 5.04 H new ATOM 0 HH21 ARG A 52 1.364 24.825 -7.425 1.00 4.53 H new ATOM 0 HH22 ARG A 52 0.666 26.429 -7.174 1.00 4.53 H new ATOM 771 N THR A 53 5.007 21.302 -11.353 1.00 31.13 N ATOM 772 CA THR A 53 4.748 19.900 -11.051 1.00 74.23 C ATOM 773 C THR A 53 5.839 19.003 -11.624 1.00 42.24 C ATOM 774 O THR A 53 6.247 18.025 -10.996 1.00 51.13 O ATOM 775 CB THR A 53 3.384 19.448 -11.607 1.00 51.44 C ATOM 776 OG1 THR A 53 2.338 20.257 -11.056 1.00 22.40 O ATOM 777 CG2 THR A 53 3.125 17.985 -11.283 1.00 71.24 C ATOM 0 H THR A 53 4.372 21.710 -12.040 1.00 31.13 H new ATOM 0 HA THR A 53 4.739 19.808 -9.965 1.00 74.23 H new ATOM 0 HB THR A 53 3.401 19.566 -12.691 1.00 51.44 H new ATOM 0 HG1 THR A 53 2.479 21.193 -11.312 1.00 22.40 H new ATOM 0 HG21 THR A 53 2.156 17.689 -11.686 1.00 71.24 H new ATOM 0 HG22 THR A 53 3.907 17.370 -11.729 1.00 71.24 H new ATOM 0 HG23 THR A 53 3.126 17.846 -10.202 1.00 71.24 H new ATOM 785 N LEU A 54 6.310 19.342 -12.819 1.00 53.25 N ATOM 786 CA LEU A 54 7.356 18.568 -13.478 1.00 21.53 C ATOM 787 C LEU A 54 8.550 18.367 -12.550 1.00 62.01 C ATOM 788 O LEU A 54 9.125 17.280 -12.487 1.00 64.51 O ATOM 789 CB LEU A 54 7.805 19.267 -14.762 1.00 10.54 C ATOM 790 CG LEU A 54 6.960 18.993 -16.006 1.00 63.13 C ATOM 791 CD1 LEU A 54 6.969 20.198 -16.934 1.00 2.01 C ATOM 792 CD2 LEU A 54 7.467 17.755 -16.732 1.00 52.12 C ATOM 0 H LEU A 54 5.984 20.148 -13.352 1.00 53.25 H new ATOM 0 HA LEU A 54 6.946 17.590 -13.730 1.00 21.53 H new ATOM 0 HB2 LEU A 54 7.814 20.342 -14.583 1.00 10.54 H new ATOM 0 HB3 LEU A 54 8.833 18.971 -14.973 1.00 10.54 H new ATOM 0 HG LEU A 54 5.933 18.811 -15.691 1.00 63.13 H new ATOM 0 HD11 LEU A 54 6.362 19.984 -17.814 1.00 2.01 H new ATOM 0 HD12 LEU A 54 6.559 21.062 -16.412 1.00 2.01 H new ATOM 0 HD13 LEU A 54 7.992 20.412 -17.242 1.00 2.01 H new ATOM 0 HD21 LEU A 54 6.854 17.575 -17.615 1.00 52.12 H new ATOM 0 HD22 LEU A 54 8.503 17.909 -17.034 1.00 52.12 H new ATOM 0 HD23 LEU A 54 7.408 16.893 -16.067 1.00 52.12 H new ATOM 804 N LEU A 55 8.917 19.421 -11.830 1.00 51.41 N ATOM 805 CA LEU A 55 10.042 19.361 -10.903 1.00 53.00 C ATOM 806 C LEU A 55 9.863 18.222 -9.904 1.00 44.20 C ATOM 807 O LEU A 55 10.796 17.464 -9.639 1.00 0.42 O ATOM 808 CB LEU A 55 10.186 20.690 -10.159 1.00 24.42 C ATOM 809 CG LEU A 55 10.226 21.946 -11.030 1.00 23.14 C ATOM 810 CD1 LEU A 55 9.598 23.122 -10.299 1.00 1.25 C ATOM 811 CD2 LEU A 55 11.657 22.269 -11.434 1.00 2.42 C ATOM 0 H LEU A 55 8.452 20.328 -11.870 1.00 51.41 H new ATOM 0 HA LEU A 55 10.948 19.175 -11.480 1.00 53.00 H new ATOM 0 HB2 LEU A 55 9.355 20.784 -9.459 1.00 24.42 H new ATOM 0 HB3 LEU A 55 11.100 20.654 -9.566 1.00 24.42 H new ATOM 0 HG LEU A 55 9.648 21.757 -11.935 1.00 23.14 H new ATOM 0 HD11 LEU A 55 9.635 24.007 -10.934 1.00 1.25 H new ATOM 0 HD12 LEU A 55 8.560 22.890 -10.061 1.00 1.25 H new ATOM 0 HD13 LEU A 55 10.148 23.313 -9.377 1.00 1.25 H new ATOM 0 HD21 LEU A 55 11.667 23.166 -12.054 1.00 2.42 H new ATOM 0 HD22 LEU A 55 12.258 22.439 -10.541 1.00 2.42 H new ATOM 0 HD23 LEU A 55 12.073 21.434 -11.998 1.00 2.42 H new ATOM 823 N ALA A 56 8.659 18.107 -9.355 1.00 12.03 N ATOM 824 CA ALA A 56 8.357 17.058 -8.388 1.00 50.25 C ATOM 825 C ALA A 56 8.260 15.697 -9.068 1.00 72.25 C ATOM 826 O ALA A 56 8.840 14.715 -8.603 1.00 13.22 O ATOM 827 CB ALA A 56 7.064 17.376 -7.652 1.00 22.35 C ATOM 0 H ALA A 56 7.876 18.727 -9.563 1.00 12.03 H new ATOM 0 HA ALA A 56 9.173 17.017 -7.666 1.00 50.25 H new ATOM 0 HB1 ALA A 56 6.850 16.585 -6.933 1.00 22.35 H new ATOM 0 HB2 ALA A 56 7.168 18.325 -7.126 1.00 22.35 H new ATOM 0 HB3 ALA A 56 6.245 17.446 -8.368 1.00 22.35 H new ATOM 833 N THR A 57 7.522 15.643 -10.173 1.00 41.32 N ATOM 834 CA THR A 57 7.347 14.402 -10.916 1.00 63.13 C ATOM 835 C THR A 57 8.693 13.772 -11.259 1.00 34.04 C ATOM 836 O THR A 57 8.915 12.587 -11.011 1.00 64.34 O ATOM 837 CB THR A 57 6.555 14.632 -12.217 1.00 44.52 C ATOM 838 OG1 THR A 57 7.330 15.419 -13.129 1.00 51.03 O ATOM 839 CG2 THR A 57 5.236 15.332 -11.930 1.00 55.34 C ATOM 0 H THR A 57 7.036 16.446 -10.573 1.00 41.32 H new ATOM 0 HA THR A 57 6.785 13.725 -10.272 1.00 63.13 H new ATOM 0 HB THR A 57 6.343 13.661 -12.665 1.00 44.52 H new ATOM 0 HG1 THR A 57 7.839 16.092 -12.630 1.00 51.03 H new ATOM 0 HG21 THR A 57 4.694 15.484 -12.863 1.00 55.34 H new ATOM 0 HG22 THR A 57 4.637 14.718 -11.258 1.00 55.34 H new ATOM 0 HG23 THR A 57 5.431 16.297 -11.462 1.00 55.34 H new ATOM 847 N VAL A 58 9.588 14.572 -11.829 1.00 12.44 N ATOM 848 CA VAL A 58 10.913 14.093 -12.203 1.00 51.33 C ATOM 849 C VAL A 58 11.725 13.704 -10.973 1.00 74.20 C ATOM 850 O VAL A 58 12.497 12.745 -11.004 1.00 15.21 O ATOM 851 CB VAL A 58 11.689 15.157 -13.001 1.00 45.45 C ATOM 852 CG1 VAL A 58 13.071 14.642 -13.375 1.00 1.24 C ATOM 853 CG2 VAL A 58 10.910 15.565 -14.243 1.00 4.53 C ATOM 0 H VAL A 58 9.419 15.555 -12.042 1.00 12.44 H new ATOM 0 HA VAL A 58 10.766 13.214 -12.830 1.00 51.33 H new ATOM 0 HB VAL A 58 11.813 16.038 -12.372 1.00 45.45 H new ATOM 0 HG11 VAL A 58 13.604 15.408 -13.938 1.00 1.24 H new ATOM 0 HG12 VAL A 58 13.628 14.404 -12.469 1.00 1.24 H new ATOM 0 HG13 VAL A 58 12.972 13.745 -13.986 1.00 1.24 H new ATOM 0 HG21 VAL A 58 11.473 16.318 -14.795 1.00 4.53 H new ATOM 0 HG22 VAL A 58 10.753 14.692 -14.877 1.00 4.53 H new ATOM 0 HG23 VAL A 58 9.945 15.978 -13.948 1.00 4.53 H new ATOM 863 N ASP A 59 11.545 14.453 -9.891 1.00 13.10 N ATOM 864 CA ASP A 59 12.259 14.186 -8.648 1.00 63.42 C ATOM 865 C ASP A 59 12.116 12.722 -8.243 1.00 34.00 C ATOM 866 O ASP A 59 13.096 12.068 -7.889 1.00 73.51 O ATOM 867 CB ASP A 59 11.739 15.091 -7.531 1.00 34.44 C ATOM 868 CG ASP A 59 12.649 15.096 -6.318 1.00 70.33 C ATOM 869 OD1 ASP A 59 13.584 14.269 -6.276 1.00 0.44 O ATOM 870 OD2 ASP A 59 12.426 15.925 -5.412 1.00 12.52 O ATOM 0 H ASP A 59 10.910 15.250 -9.849 1.00 13.10 H new ATOM 0 HA ASP A 59 13.316 14.397 -8.812 1.00 63.42 H new ATOM 0 HB2 ASP A 59 11.637 16.108 -7.909 1.00 34.44 H new ATOM 0 HB3 ASP A 59 10.744 14.761 -7.233 1.00 34.44 H new ATOM 875 N GLU A 60 10.887 12.216 -8.297 1.00 4.14 N ATOM 876 CA GLU A 60 10.616 10.830 -7.933 1.00 43.20 C ATOM 877 C GLU A 60 10.972 9.887 -9.079 1.00 4.41 C ATOM 878 O GLU A 60 11.065 8.674 -8.893 1.00 4.24 O ATOM 879 CB GLU A 60 9.144 10.658 -7.555 1.00 33.40 C ATOM 880 CG GLU A 60 8.180 11.094 -8.646 1.00 1.34 C ATOM 881 CD GLU A 60 6.729 10.864 -8.269 1.00 4.12 C ATOM 882 OE1 GLU A 60 6.444 10.740 -7.059 1.00 52.13 O ATOM 883 OE2 GLU A 60 5.880 10.808 -9.183 1.00 23.35 O ATOM 0 H GLU A 60 10.065 12.744 -8.589 1.00 4.14 H new ATOM 0 HA GLU A 60 11.236 10.579 -7.073 1.00 43.20 H new ATOM 0 HB2 GLU A 60 8.959 9.611 -7.316 1.00 33.40 H new ATOM 0 HB3 GLU A 60 8.940 11.232 -6.651 1.00 33.40 H new ATOM 0 HG2 GLU A 60 8.333 12.152 -8.859 1.00 1.34 H new ATOM 0 HG3 GLU A 60 8.404 10.549 -9.563 1.00 1.34 H new ATOM 890 N SER A 61 11.170 10.455 -10.265 1.00 30.24 N ATOM 891 CA SER A 61 11.511 9.666 -11.442 1.00 65.42 C ATOM 892 C SER A 61 12.957 9.183 -11.372 1.00 42.34 C ATOM 893 O SER A 61 13.323 8.188 -11.999 1.00 61.01 O ATOM 894 CB SER A 61 11.297 10.489 -12.714 1.00 4.03 C ATOM 895 OG SER A 61 11.026 9.651 -13.824 1.00 45.42 O ATOM 0 H SER A 61 11.100 11.458 -10.435 1.00 30.24 H new ATOM 0 HA SER A 61 10.856 8.795 -11.467 1.00 65.42 H new ATOM 0 HB2 SER A 61 10.469 11.182 -12.567 1.00 4.03 H new ATOM 0 HB3 SER A 61 12.184 11.090 -12.916 1.00 4.03 H new ATOM 0 HG SER A 61 10.892 10.201 -14.624 1.00 45.42 H new ATOM 901 N LEU A 62 13.775 9.896 -10.606 1.00 24.10 N ATOM 902 CA LEU A 62 15.182 9.542 -10.453 1.00 4.02 C ATOM 903 C LEU A 62 15.337 8.067 -10.098 1.00 23.32 C ATOM 904 O LEU A 62 15.962 7.291 -10.822 1.00 31.04 O ATOM 905 CB LEU A 62 15.832 10.409 -9.373 1.00 41.10 C ATOM 906 CG LEU A 62 16.750 11.526 -9.871 1.00 53.23 C ATOM 907 CD1 LEU A 62 17.088 12.484 -8.739 1.00 65.53 C ATOM 908 CD2 LEU A 62 18.018 10.944 -10.477 1.00 62.24 C ATOM 0 H LEU A 62 13.489 10.722 -10.081 1.00 24.10 H new ATOM 0 HA LEU A 62 15.682 9.722 -11.405 1.00 4.02 H new ATOM 0 HB2 LEU A 62 15.042 10.857 -8.771 1.00 41.10 H new ATOM 0 HB3 LEU A 62 16.407 9.761 -8.712 1.00 41.10 H new ATOM 0 HG LEU A 62 16.224 12.084 -10.646 1.00 53.23 H new ATOM 0 HD11 LEU A 62 17.742 13.272 -9.112 1.00 65.53 H new ATOM 0 HD12 LEU A 62 16.171 12.927 -8.351 1.00 65.53 H new ATOM 0 HD13 LEU A 62 17.594 11.940 -7.941 1.00 65.53 H new ATOM 0 HD21 LEU A 62 18.659 11.753 -10.826 1.00 62.24 H new ATOM 0 HD22 LEU A 62 18.547 10.361 -9.723 1.00 62.24 H new ATOM 0 HD23 LEU A 62 17.757 10.300 -11.317 1.00 62.24 H new ATOM 920 N PRO A 63 14.754 7.668 -8.958 1.00 32.31 N ATOM 921 CA PRO A 63 14.811 6.282 -8.482 1.00 53.23 C ATOM 922 C PRO A 63 13.986 5.337 -9.350 1.00 5.22 C ATOM 923 O PRO A 63 14.417 4.225 -9.656 1.00 13.11 O ATOM 924 CB PRO A 63 14.220 6.367 -7.073 1.00 33.52 C ATOM 925 CG PRO A 63 13.338 7.567 -7.103 1.00 2.12 C ATOM 926 CD PRO A 63 13.993 8.538 -8.046 1.00 0.22 C ATOM 0 HA PRO A 63 15.825 5.882 -8.511 1.00 53.23 H new ATOM 0 HB2 PRO A 63 13.656 5.468 -6.825 1.00 33.52 H new ATOM 0 HB3 PRO A 63 15.003 6.470 -6.321 1.00 33.52 H new ATOM 0 HG2 PRO A 63 12.336 7.307 -7.445 1.00 2.12 H new ATOM 0 HG3 PRO A 63 13.233 7.999 -6.108 1.00 2.12 H new ATOM 0 HD2 PRO A 63 13.256 9.136 -8.583 1.00 0.22 H new ATOM 0 HD3 PRO A 63 14.645 9.234 -7.518 1.00 0.22 H new ATOM 934 N VAL A 64 12.799 5.787 -9.744 1.00 22.11 N ATOM 935 CA VAL A 64 11.915 4.982 -10.578 1.00 61.40 C ATOM 936 C VAL A 64 12.649 4.451 -11.804 1.00 62.13 C ATOM 937 O VAL A 64 12.322 3.383 -12.324 1.00 31.04 O ATOM 938 CB VAL A 64 10.687 5.790 -11.038 1.00 64.11 C ATOM 939 CG1 VAL A 64 9.810 4.953 -11.956 1.00 60.51 C ATOM 940 CG2 VAL A 64 9.896 6.286 -9.837 1.00 61.13 C ATOM 0 H VAL A 64 12.428 6.705 -9.499 1.00 22.11 H new ATOM 0 HA VAL A 64 11.580 4.144 -9.967 1.00 61.40 H new ATOM 0 HB VAL A 64 11.034 6.658 -11.599 1.00 64.11 H new ATOM 0 HG11 VAL A 64 8.948 5.541 -12.271 1.00 60.51 H new ATOM 0 HG12 VAL A 64 10.384 4.652 -12.833 1.00 60.51 H new ATOM 0 HG13 VAL A 64 9.469 4.065 -11.424 1.00 60.51 H new ATOM 0 HG21 VAL A 64 9.032 6.855 -10.180 1.00 61.13 H new ATOM 0 HG22 VAL A 64 9.558 5.434 -9.247 1.00 61.13 H new ATOM 0 HG23 VAL A 64 10.530 6.925 -9.222 1.00 61.13 H new ATOM 950 N LEU A 65 13.644 5.203 -12.263 1.00 34.21 N ATOM 951 CA LEU A 65 14.426 4.808 -13.429 1.00 42.21 C ATOM 952 C LEU A 65 15.874 4.523 -13.042 1.00 72.24 C ATOM 953 O LEU A 65 16.365 4.970 -12.006 1.00 32.24 O ATOM 954 CB LEU A 65 14.378 5.904 -14.495 1.00 53.31 C ATOM 955 CG LEU A 65 13.162 5.885 -15.423 1.00 25.20 C ATOM 956 CD1 LEU A 65 13.436 5.018 -16.642 1.00 73.22 C ATOM 957 CD2 LEU A 65 11.931 5.389 -14.679 1.00 1.01 C ATOM 0 H LEU A 65 13.928 6.089 -11.845 1.00 34.21 H new ATOM 0 HA LEU A 65 13.991 3.895 -13.835 1.00 42.21 H new ATOM 0 HB2 LEU A 65 14.413 6.872 -13.994 1.00 53.31 H new ATOM 0 HB3 LEU A 65 15.278 5.828 -15.106 1.00 53.31 H new ATOM 0 HG LEU A 65 12.971 6.903 -15.762 1.00 25.20 H new ATOM 0 HD11 LEU A 65 12.560 5.016 -17.291 1.00 73.22 H new ATOM 0 HD12 LEU A 65 14.291 5.417 -17.187 1.00 73.22 H new ATOM 0 HD13 LEU A 65 13.653 3.999 -16.322 1.00 73.22 H new ATOM 0 HD21 LEU A 65 11.076 5.382 -15.355 1.00 1.01 H new ATOM 0 HD22 LEU A 65 12.111 4.379 -14.311 1.00 1.01 H new ATOM 0 HD23 LEU A 65 11.723 6.050 -13.838 1.00 1.01 H new ATOM 969 N PRO A 66 16.576 3.762 -13.896 1.00 14.24 N ATOM 970 CA PRO A 66 17.978 3.403 -13.666 1.00 20.51 C ATOM 971 C PRO A 66 18.914 4.598 -13.808 1.00 71.03 C ATOM 972 O PRO A 66 18.810 5.369 -14.762 1.00 1.34 O ATOM 973 CB PRO A 66 18.262 2.368 -14.758 1.00 23.14 C ATOM 974 CG PRO A 66 17.288 2.682 -15.840 1.00 61.01 C ATOM 975 CD PRO A 66 16.054 3.195 -15.151 1.00 3.23 C ATOM 0 HA PRO A 66 18.143 3.032 -12.654 1.00 20.51 H new ATOM 0 HB2 PRO A 66 19.289 2.442 -15.116 1.00 23.14 H new ATOM 0 HB3 PRO A 66 18.127 1.353 -14.386 1.00 23.14 H new ATOM 0 HG2 PRO A 66 17.692 3.429 -16.524 1.00 61.01 H new ATOM 0 HG3 PRO A 66 17.064 1.795 -16.433 1.00 61.01 H new ATOM 0 HD2 PRO A 66 15.543 3.948 -15.750 1.00 3.23 H new ATOM 0 HD3 PRO A 66 15.337 2.396 -14.963 1.00 3.23 H new ATOM 983 N ALA A 67 19.828 4.745 -12.855 1.00 13.13 N ATOM 984 CA ALA A 67 20.784 5.845 -12.876 1.00 14.42 C ATOM 985 C ALA A 67 21.513 5.913 -14.213 1.00 42.12 C ATOM 986 O ALA A 67 22.143 4.944 -14.637 1.00 42.31 O ATOM 987 CB ALA A 67 21.780 5.701 -11.735 1.00 63.44 C ATOM 0 H ALA A 67 19.927 4.116 -12.058 1.00 13.13 H new ATOM 0 HA ALA A 67 20.232 6.776 -12.746 1.00 14.42 H new ATOM 0 HB1 ALA A 67 22.488 6.529 -11.763 1.00 63.44 H new ATOM 0 HB2 ALA A 67 21.248 5.711 -10.784 1.00 63.44 H new ATOM 0 HB3 ALA A 67 22.319 4.759 -11.839 1.00 63.44 H new ATOM 993 N SER A 68 21.423 7.063 -14.874 1.00 1.14 N ATOM 994 CA SER A 68 22.071 7.255 -16.166 1.00 2.43 C ATOM 995 C SER A 68 21.774 8.645 -16.721 1.00 4.12 C ATOM 996 O SER A 68 22.608 9.248 -17.398 1.00 71.21 O ATOM 997 CB SER A 68 21.606 6.187 -17.157 1.00 53.54 C ATOM 998 OG SER A 68 21.485 6.723 -18.464 1.00 32.11 O ATOM 0 H SER A 68 20.908 7.876 -14.536 1.00 1.14 H new ATOM 0 HA SER A 68 23.148 7.163 -16.023 1.00 2.43 H new ATOM 0 HB2 SER A 68 22.315 5.359 -17.164 1.00 53.54 H new ATOM 0 HB3 SER A 68 20.646 5.782 -16.836 1.00 53.54 H new ATOM 0 HG SER A 68 21.188 6.021 -19.079 1.00 32.11 H new ATOM 1004 N THR A 69 20.579 9.149 -16.429 1.00 43.31 N ATOM 1005 CA THR A 69 20.170 10.467 -16.899 1.00 62.20 C ATOM 1006 C THR A 69 20.042 11.449 -15.740 1.00 64.31 C ATOM 1007 O THR A 69 19.278 12.412 -15.810 1.00 60.33 O ATOM 1008 CB THR A 69 18.828 10.403 -17.653 1.00 24.31 C ATOM 1009 OG1 THR A 69 18.481 11.701 -18.146 1.00 10.41 O ATOM 1010 CG2 THR A 69 17.722 9.886 -16.746 1.00 0.45 C ATOM 0 H THR A 69 19.877 8.664 -15.869 1.00 43.31 H new ATOM 0 HA THR A 69 20.946 10.814 -17.581 1.00 62.20 H new ATOM 0 HB THR A 69 18.939 9.715 -18.491 1.00 24.31 H new ATOM 0 HG1 THR A 69 18.444 12.335 -17.400 1.00 10.41 H new ATOM 0 HG21 THR A 69 16.784 9.850 -17.300 1.00 0.45 H new ATOM 0 HG22 THR A 69 17.976 8.885 -16.397 1.00 0.45 H new ATOM 0 HG23 THR A 69 17.612 10.552 -15.890 1.00 0.45 H new ATOM 1018 N HIS A 70 20.796 11.200 -14.674 1.00 21.33 N ATOM 1019 CA HIS A 70 20.768 12.064 -13.499 1.00 33.21 C ATOM 1020 C HIS A 70 21.171 13.489 -13.863 1.00 44.31 C ATOM 1021 O HIS A 70 20.509 14.451 -13.473 1.00 42.10 O ATOM 1022 CB HIS A 70 21.699 11.518 -12.416 1.00 1.40 C ATOM 1023 CG HIS A 70 21.104 10.395 -11.624 1.00 51.11 C ATOM 1024 ND1 HIS A 70 21.251 10.276 -10.258 1.00 45.23 N ATOM 1025 CD2 HIS A 70 20.355 9.337 -12.014 1.00 13.14 C ATOM 1026 CE1 HIS A 70 20.620 9.193 -9.842 1.00 64.21 C ATOM 1027 NE2 HIS A 70 20.067 8.605 -10.888 1.00 4.22 N ATOM 0 H HIS A 70 21.434 10.407 -14.600 1.00 21.33 H new ATOM 0 HA HIS A 70 19.748 12.081 -13.115 1.00 33.21 H new ATOM 0 HB2 HIS A 70 22.622 11.173 -12.882 1.00 1.40 H new ATOM 0 HB3 HIS A 70 21.967 12.328 -11.737 1.00 1.40 H new ATOM 0 HD2 HIS A 70 20.042 9.111 -13.023 1.00 13.14 H new ATOM 0 HE1 HIS A 70 20.565 8.847 -8.820 1.00 64.21 H new ATOM 0 HE2 HIS A 70 19.516 7.747 -10.863 1.00 4.22 H new ATOM 1035 N ARG A 71 22.262 13.617 -14.612 1.00 11.30 N ATOM 1036 CA ARG A 71 22.755 14.925 -15.027 1.00 14.33 C ATOM 1037 C ARG A 71 21.642 15.746 -15.671 1.00 55.31 C ATOM 1038 O ARG A 71 21.333 16.850 -15.223 1.00 31.21 O ATOM 1039 CB ARG A 71 23.919 14.768 -16.006 1.00 4.00 C ATOM 1040 CG ARG A 71 24.560 16.087 -16.407 1.00 25.34 C ATOM 1041 CD ARG A 71 25.439 15.928 -17.638 1.00 20.44 C ATOM 1042 NE ARG A 71 26.736 15.342 -17.312 1.00 65.40 N ATOM 1043 CZ ARG A 71 27.804 15.437 -18.097 1.00 73.22 C ATOM 1044 NH1 ARG A 71 27.728 16.092 -19.248 1.00 22.35 N ATOM 1045 NH2 ARG A 71 28.950 14.877 -17.732 1.00 32.41 N ATOM 0 H ARG A 71 22.821 12.831 -14.944 1.00 11.30 H new ATOM 0 HA ARG A 71 23.105 15.452 -14.139 1.00 14.33 H new ATOM 0 HB2 ARG A 71 24.677 14.127 -15.556 1.00 4.00 H new ATOM 0 HB3 ARG A 71 23.563 14.260 -16.902 1.00 4.00 H new ATOM 0 HG2 ARG A 71 23.783 16.825 -16.606 1.00 25.34 H new ATOM 0 HG3 ARG A 71 25.157 16.469 -15.579 1.00 25.34 H new ATOM 0 HD2 ARG A 71 24.930 15.299 -18.368 1.00 20.44 H new ATOM 0 HD3 ARG A 71 25.588 16.901 -18.105 1.00 20.44 H new ATOM 0 HE ARG A 71 26.827 14.832 -16.434 1.00 65.40 H new ATOM 0 HH11 ARG A 71 26.849 16.524 -19.532 1.00 22.35 H new ATOM 0 HH12 ARG A 71 28.549 16.164 -19.849 1.00 22.35 H new ATOM 0 HH21 ARG A 71 29.012 14.373 -16.848 1.00 32.41 H new ATOM 0 HH22 ARG A 71 29.769 14.951 -18.336 1.00 32.41 H new ATOM 1059 N GLU A 72 21.044 15.199 -16.725 1.00 51.32 N ATOM 1060 CA GLU A 72 19.966 15.882 -17.431 1.00 45.44 C ATOM 1061 C GLU A 72 18.792 16.158 -16.497 1.00 22.14 C ATOM 1062 O GLU A 72 18.161 17.213 -16.570 1.00 62.22 O ATOM 1063 CB GLU A 72 19.498 15.046 -18.624 1.00 12.10 C ATOM 1064 CG GLU A 72 20.625 14.619 -19.549 1.00 4.43 C ATOM 1065 CD GLU A 72 20.124 13.905 -20.789 1.00 41.40 C ATOM 1066 OE1 GLU A 72 19.084 14.326 -21.337 1.00 32.12 O ATOM 1067 OE2 GLU A 72 20.773 12.926 -21.212 1.00 21.42 O ATOM 0 H GLU A 72 21.288 14.286 -17.108 1.00 51.32 H new ATOM 0 HA GLU A 72 20.351 16.835 -17.793 1.00 45.44 H new ATOM 0 HB2 GLU A 72 18.986 14.157 -18.255 1.00 12.10 H new ATOM 0 HB3 GLU A 72 18.769 15.620 -19.195 1.00 12.10 H new ATOM 0 HG2 GLU A 72 21.198 15.497 -19.847 1.00 4.43 H new ATOM 0 HG3 GLU A 72 21.306 13.963 -19.007 1.00 4.43 H new ATOM 1074 N ILE A 73 18.505 15.202 -15.619 1.00 42.23 N ATOM 1075 CA ILE A 73 17.408 15.342 -14.670 1.00 72.21 C ATOM 1076 C ILE A 73 17.632 16.530 -13.741 1.00 24.10 C ATOM 1077 O ILE A 73 16.743 17.359 -13.552 1.00 70.03 O ATOM 1078 CB ILE A 73 17.231 14.068 -13.823 1.00 21.03 C ATOM 1079 CG1 ILE A 73 16.646 12.939 -14.675 1.00 4.54 C ATOM 1080 CG2 ILE A 73 16.339 14.350 -12.623 1.00 23.33 C ATOM 1081 CD1 ILE A 73 16.921 11.559 -14.120 1.00 44.21 C ATOM 0 H ILE A 73 19.017 14.323 -15.546 1.00 42.23 H new ATOM 0 HA ILE A 73 16.504 15.508 -15.255 1.00 72.21 H new ATOM 0 HB ILE A 73 18.209 13.753 -13.459 1.00 21.03 H new ATOM 0 HG12 ILE A 73 15.568 13.080 -14.760 1.00 4.54 H new ATOM 0 HG13 ILE A 73 17.056 13.005 -15.683 1.00 4.54 H new ATOM 0 HG21 ILE A 73 16.223 13.440 -12.034 1.00 23.33 H new ATOM 0 HG22 ILE A 73 16.793 15.126 -12.007 1.00 23.33 H new ATOM 0 HG23 ILE A 73 15.361 14.686 -12.968 1.00 23.33 H new ATOM 0 HD11 ILE A 73 16.477 10.809 -14.774 1.00 44.21 H new ATOM 0 HD12 ILE A 73 17.997 11.398 -14.061 1.00 44.21 H new ATOM 0 HD13 ILE A 73 16.486 11.474 -13.124 1.00 44.21 H new ATOM 1093 N GLU A 74 18.828 16.606 -13.165 1.00 31.13 N ATOM 1094 CA GLU A 74 19.169 17.694 -12.256 1.00 23.12 C ATOM 1095 C GLU A 74 19.071 19.043 -12.961 1.00 51.44 C ATOM 1096 O GLU A 74 18.381 19.950 -12.496 1.00 73.22 O ATOM 1097 CB GLU A 74 20.581 17.499 -11.699 1.00 21.01 C ATOM 1098 CG GLU A 74 20.622 17.330 -10.189 1.00 41.34 C ATOM 1099 CD GLU A 74 20.008 16.022 -9.732 1.00 32.42 C ATOM 1100 OE1 GLU A 74 20.708 14.988 -9.783 1.00 53.51 O ATOM 1101 OE2 GLU A 74 18.828 16.030 -9.323 1.00 1.22 O ATOM 0 H GLU A 74 19.576 15.928 -13.312 1.00 31.13 H new ATOM 0 HA GLU A 74 18.456 17.682 -11.432 1.00 23.12 H new ATOM 0 HB2 GLU A 74 21.029 16.622 -12.167 1.00 21.01 H new ATOM 0 HB3 GLU A 74 21.194 18.357 -11.977 1.00 21.01 H new ATOM 0 HG2 GLU A 74 21.657 17.380 -9.850 1.00 41.34 H new ATOM 0 HG3 GLU A 74 20.092 18.159 -9.720 1.00 41.34 H new ATOM 1108 N MET A 75 19.767 19.168 -14.087 1.00 11.23 N ATOM 1109 CA MET A 75 19.758 20.406 -14.857 1.00 53.41 C ATOM 1110 C MET A 75 18.353 20.722 -15.362 1.00 2.45 C ATOM 1111 O MET A 75 18.009 21.883 -15.581 1.00 42.32 O ATOM 1112 CB MET A 75 20.725 20.305 -16.038 1.00 24.23 C ATOM 1113 CG MET A 75 22.092 19.758 -15.658 1.00 1.51 C ATOM 1114 SD MET A 75 23.439 20.849 -16.156 1.00 71.11 S ATOM 1115 CE MET A 75 24.810 20.125 -15.259 1.00 12.54 C ATOM 0 H MET A 75 20.344 18.427 -14.486 1.00 11.23 H new ATOM 0 HA MET A 75 20.080 21.214 -14.201 1.00 53.41 H new ATOM 0 HB2 MET A 75 20.286 19.664 -16.803 1.00 24.23 H new ATOM 0 HB3 MET A 75 20.848 21.293 -16.482 1.00 24.23 H new ATOM 0 HG2 MET A 75 22.132 19.607 -14.579 1.00 1.51 H new ATOM 0 HG3 MET A 75 22.230 18.781 -16.122 1.00 1.51 H new ATOM 0 HE1 MET A 75 25.719 20.691 -15.465 1.00 12.54 H new ATOM 0 HE2 MET A 75 24.600 20.152 -14.190 1.00 12.54 H new ATOM 0 HE3 MET A 75 24.947 19.091 -15.576 1.00 12.54 H new ATOM 1125 N ALA A 76 17.546 19.682 -15.543 1.00 65.12 N ATOM 1126 CA ALA A 76 16.179 19.849 -16.020 1.00 3.50 C ATOM 1127 C ALA A 76 15.321 20.570 -14.985 1.00 65.13 C ATOM 1128 O ALA A 76 14.409 21.318 -15.335 1.00 62.15 O ATOM 1129 CB ALA A 76 15.571 18.498 -16.364 1.00 30.00 C ATOM 0 H ALA A 76 17.816 18.714 -15.366 1.00 65.12 H new ATOM 0 HA ALA A 76 16.207 20.462 -16.921 1.00 3.50 H new ATOM 0 HB1 ALA A 76 14.550 18.638 -16.719 1.00 30.00 H new ATOM 0 HB2 ALA A 76 16.164 18.020 -17.144 1.00 30.00 H new ATOM 0 HB3 ALA A 76 15.563 17.866 -15.476 1.00 30.00 H new ATOM 1135 N GLN A 77 15.620 20.339 -13.711 1.00 63.51 N ATOM 1136 CA GLN A 77 14.874 20.965 -12.626 1.00 44.21 C ATOM 1137 C GLN A 77 14.895 22.484 -12.758 1.00 52.41 C ATOM 1138 O GLN A 77 13.884 23.103 -13.092 1.00 40.11 O ATOM 1139 CB GLN A 77 15.456 20.551 -11.273 1.00 42.14 C ATOM 1140 CG GLN A 77 15.108 19.127 -10.872 1.00 30.13 C ATOM 1141 CD GLN A 77 15.329 18.867 -9.395 1.00 31.44 C ATOM 1142 OE1 GLN A 77 16.101 17.985 -9.017 1.00 34.35 O ATOM 1143 NE2 GLN A 77 14.651 19.635 -8.550 1.00 30.21 N ATOM 0 H GLN A 77 16.373 19.723 -13.405 1.00 63.51 H new ATOM 0 HA GLN A 77 13.840 20.627 -12.687 1.00 44.21 H new ATOM 0 HB2 GLN A 77 16.540 20.656 -11.306 1.00 42.14 H new ATOM 0 HB3 GLN A 77 15.093 21.235 -10.506 1.00 42.14 H new ATOM 0 HG2 GLN A 77 14.065 18.928 -11.120 1.00 30.13 H new ATOM 0 HG3 GLN A 77 15.713 18.431 -11.454 1.00 30.13 H new ATOM 0 HE21 GLN A 77 14.022 20.354 -8.907 1.00 30.21 H new ATOM 0 HE22 GLN A 77 14.759 19.506 -7.544 1.00 30.21 H new ATOM 1152 N LYS A 78 16.052 23.081 -12.493 1.00 62.13 N ATOM 1153 CA LYS A 78 16.206 24.528 -12.583 1.00 12.10 C ATOM 1154 C LYS A 78 15.848 25.028 -13.979 1.00 61.31 C ATOM 1155 O LYS A 78 15.274 26.106 -14.135 1.00 41.34 O ATOM 1156 CB LYS A 78 17.641 24.932 -12.238 1.00 20.45 C ATOM 1157 CG LYS A 78 17.797 26.408 -11.917 1.00 22.15 C ATOM 1158 CD LYS A 78 19.178 26.918 -12.294 1.00 60.40 C ATOM 1159 CE LYS A 78 19.725 27.875 -11.246 1.00 75.10 C ATOM 1160 NZ LYS A 78 19.551 29.298 -11.650 1.00 65.44 N ATOM 0 H LYS A 78 16.898 22.584 -12.214 1.00 62.13 H new ATOM 0 HA LYS A 78 15.524 24.985 -11.866 1.00 12.10 H new ATOM 0 HB2 LYS A 78 17.979 24.345 -11.384 1.00 20.45 H new ATOM 0 HB3 LYS A 78 18.292 24.680 -13.075 1.00 20.45 H new ATOM 0 HG2 LYS A 78 17.039 26.980 -12.452 1.00 22.15 H new ATOM 0 HG3 LYS A 78 17.626 26.570 -10.853 1.00 22.15 H new ATOM 0 HD2 LYS A 78 19.859 26.075 -12.409 1.00 60.40 H new ATOM 0 HD3 LYS A 78 19.130 27.423 -13.259 1.00 60.40 H new ATOM 0 HE2 LYS A 78 19.218 27.702 -10.297 1.00 75.10 H new ATOM 0 HE3 LYS A 78 20.783 27.670 -11.084 1.00 75.10 H new ATOM 0 HZ1 LYS A 78 19.936 29.919 -10.910 1.00 65.44 H new ATOM 0 HZ2 LYS A 78 20.056 29.470 -12.543 1.00 65.44 H new ATOM 0 HZ3 LYS A 78 18.539 29.501 -11.780 1.00 65.44 H new ATOM 1174 N LEU A 79 16.189 24.237 -14.991 1.00 2.23 N ATOM 1175 CA LEU A 79 15.902 24.599 -16.375 1.00 24.34 C ATOM 1176 C LEU A 79 14.424 24.929 -16.556 1.00 43.10 C ATOM 1177 O LEU A 79 14.070 26.037 -16.960 1.00 11.51 O ATOM 1178 CB LEU A 79 16.301 23.459 -17.313 1.00 72.53 C ATOM 1179 CG LEU A 79 15.905 23.628 -18.781 1.00 24.03 C ATOM 1180 CD1 LEU A 79 17.123 23.489 -19.681 1.00 42.50 C ATOM 1181 CD2 LEU A 79 14.837 22.615 -19.166 1.00 22.24 C ATOM 0 H LEU A 79 16.664 23.341 -14.879 1.00 2.23 H new ATOM 0 HA LEU A 79 16.486 25.486 -16.622 1.00 24.34 H new ATOM 0 HB2 LEU A 79 17.383 23.334 -17.261 1.00 72.53 H new ATOM 0 HB3 LEU A 79 15.856 22.536 -16.941 1.00 72.53 H new ATOM 0 HG LEU A 79 15.493 24.628 -18.913 1.00 24.03 H new ATOM 0 HD11 LEU A 79 16.822 23.612 -20.722 1.00 42.50 H new ATOM 0 HD12 LEU A 79 17.856 24.253 -19.422 1.00 42.50 H new ATOM 0 HD13 LEU A 79 17.565 22.502 -19.545 1.00 42.50 H new ATOM 0 HD21 LEU A 79 14.568 22.750 -20.214 1.00 22.24 H new ATOM 0 HD22 LEU A 79 15.222 21.606 -19.018 1.00 22.24 H new ATOM 0 HD23 LEU A 79 13.955 22.762 -18.543 1.00 22.24 H new ATOM 1193 N LEU A 80 13.566 23.962 -16.253 1.00 72.32 N ATOM 1194 CA LEU A 80 12.125 24.150 -16.380 1.00 52.04 C ATOM 1195 C LEU A 80 11.673 25.408 -15.645 1.00 61.13 C ATOM 1196 O LEU A 80 10.848 26.169 -16.148 1.00 12.44 O ATOM 1197 CB LEU A 80 11.381 22.931 -15.833 1.00 31.31 C ATOM 1198 CG LEU A 80 10.984 21.870 -16.860 1.00 23.51 C ATOM 1199 CD1 LEU A 80 12.189 21.452 -17.689 1.00 21.15 C ATOM 1200 CD2 LEU A 80 10.366 20.663 -16.169 1.00 1.05 C ATOM 0 H LEU A 80 13.843 23.039 -15.918 1.00 72.32 H new ATOM 0 HA LEU A 80 11.891 24.266 -17.438 1.00 52.04 H new ATOM 0 HB2 LEU A 80 12.006 22.459 -15.076 1.00 31.31 H new ATOM 0 HB3 LEU A 80 10.478 23.277 -15.330 1.00 31.31 H new ATOM 0 HG LEU A 80 10.240 22.301 -17.529 1.00 23.51 H new ATOM 0 HD11 LEU A 80 11.887 20.696 -18.414 1.00 21.15 H new ATOM 0 HD12 LEU A 80 12.588 22.320 -18.214 1.00 21.15 H new ATOM 0 HD13 LEU A 80 12.956 21.040 -17.034 1.00 21.15 H new ATOM 0 HD21 LEU A 80 10.090 19.918 -16.915 1.00 1.05 H new ATOM 0 HD22 LEU A 80 11.088 20.231 -15.476 1.00 1.05 H new ATOM 0 HD23 LEU A 80 9.477 20.974 -15.620 1.00 1.05 H new ATOM 1212 N ASN A 81 12.222 25.620 -14.454 1.00 32.25 N ATOM 1213 CA ASN A 81 11.876 26.787 -13.650 1.00 24.33 C ATOM 1214 C ASN A 81 12.021 28.070 -14.463 1.00 24.54 C ATOM 1215 O ASN A 81 11.107 28.892 -14.513 1.00 34.44 O ATOM 1216 CB ASN A 81 12.764 26.855 -12.405 1.00 52.31 C ATOM 1217 CG ASN A 81 12.058 27.499 -11.227 1.00 23.52 C ATOM 1218 OD1 ASN A 81 12.405 28.604 -10.809 1.00 71.34 O ATOM 1219 ND2 ASN A 81 11.063 26.807 -10.684 1.00 54.34 N ATOM 0 H ASN A 81 12.908 25.000 -14.024 1.00 32.25 H new ATOM 0 HA ASN A 81 10.835 26.690 -13.341 1.00 24.33 H new ATOM 0 HB2 ASN A 81 13.078 25.848 -12.131 1.00 52.31 H new ATOM 0 HB3 ASN A 81 13.667 27.419 -12.637 1.00 52.31 H new ATOM 0 HD21 ASN A 81 10.552 27.188 -9.888 1.00 54.34 H new ATOM 0 HD22 ASN A 81 10.810 25.895 -11.063 1.00 54.34 H new ATOM 1226 N SER A 82 13.177 28.233 -15.099 1.00 0.34 N ATOM 1227 CA SER A 82 13.444 29.417 -15.907 1.00 14.20 C ATOM 1228 C SER A 82 12.332 29.639 -16.928 1.00 43.05 C ATOM 1229 O SER A 82 11.777 30.733 -17.030 1.00 51.02 O ATOM 1230 CB SER A 82 14.789 29.280 -16.622 1.00 42.10 C ATOM 1231 OG SER A 82 15.362 30.551 -16.878 1.00 62.54 O ATOM 0 H SER A 82 13.943 27.560 -15.070 1.00 0.34 H new ATOM 0 HA SER A 82 13.481 30.280 -15.242 1.00 14.20 H new ATOM 0 HB2 SER A 82 15.470 28.687 -16.012 1.00 42.10 H new ATOM 0 HB3 SER A 82 14.652 28.743 -17.561 1.00 42.10 H new ATOM 0 HG SER A 82 16.222 30.436 -17.334 1.00 62.54 H new ATOM 1237 N ASP A 83 12.014 28.593 -17.683 1.00 13.11 N ATOM 1238 CA ASP A 83 10.968 28.672 -18.697 1.00 22.45 C ATOM 1239 C ASP A 83 9.647 29.121 -18.081 1.00 31.14 C ATOM 1240 O ASP A 83 8.969 30.002 -18.612 1.00 64.43 O ATOM 1241 CB ASP A 83 10.791 27.316 -19.383 1.00 14.24 C ATOM 1242 CG ASP A 83 11.948 26.976 -20.301 1.00 52.21 C ATOM 1243 OD1 ASP A 83 12.697 27.901 -20.679 1.00 41.14 O ATOM 1244 OD2 ASP A 83 12.105 25.785 -20.641 1.00 13.00 O ATOM 0 H ASP A 83 12.465 27.681 -17.612 1.00 13.11 H new ATOM 0 HA ASP A 83 11.271 29.410 -19.440 1.00 22.45 H new ATOM 0 HB2 ASP A 83 10.692 26.539 -18.625 1.00 14.24 H new ATOM 0 HB3 ASP A 83 9.865 27.321 -19.957 1.00 14.24 H new ATOM 1249 N LEU A 84 9.285 28.510 -16.958 1.00 24.12 N ATOM 1250 CA LEU A 84 8.044 28.846 -16.269 1.00 40.13 C ATOM 1251 C LEU A 84 7.944 30.349 -16.030 1.00 53.24 C ATOM 1252 O LEU A 84 6.996 30.996 -16.474 1.00 54.30 O ATOM 1253 CB LEU A 84 7.958 28.100 -14.937 1.00 25.51 C ATOM 1254 CG LEU A 84 6.917 28.616 -13.944 1.00 3.45 C ATOM 1255 CD1 LEU A 84 6.070 27.470 -13.413 1.00 42.12 C ATOM 1256 CD2 LEU A 84 7.594 29.356 -12.799 1.00 14.34 C ATOM 0 H LEU A 84 9.834 27.779 -16.505 1.00 24.12 H new ATOM 0 HA LEU A 84 7.212 28.541 -16.903 1.00 40.13 H new ATOM 0 HB2 LEU A 84 7.745 27.051 -15.144 1.00 25.51 H new ATOM 0 HB3 LEU A 84 8.937 28.138 -14.459 1.00 25.51 H new ATOM 0 HG LEU A 84 6.261 29.314 -14.465 1.00 3.45 H new ATOM 0 HD11 LEU A 84 5.335 27.857 -12.708 1.00 42.12 H new ATOM 0 HD12 LEU A 84 5.556 26.983 -14.242 1.00 42.12 H new ATOM 0 HD13 LEU A 84 6.711 26.747 -12.908 1.00 42.12 H new ATOM 0 HD21 LEU A 84 6.838 29.717 -12.101 1.00 14.34 H new ATOM 0 HD22 LEU A 84 8.274 28.680 -12.280 1.00 14.34 H new ATOM 0 HD23 LEU A 84 8.156 30.202 -13.194 1.00 14.34 H new ATOM 1268 N ALA A 85 8.929 30.899 -15.328 1.00 62.41 N ATOM 1269 CA ALA A 85 8.954 32.326 -15.034 1.00 41.01 C ATOM 1270 C ALA A 85 8.845 33.152 -16.312 1.00 21.44 C ATOM 1271 O ALA A 85 8.218 34.210 -16.325 1.00 11.20 O ATOM 1272 CB ALA A 85 10.224 32.687 -14.277 1.00 35.11 C ATOM 0 H ALA A 85 9.721 30.377 -14.952 1.00 62.41 H new ATOM 0 HA ALA A 85 8.092 32.558 -14.408 1.00 41.01 H new ATOM 0 HB1 ALA A 85 10.229 33.756 -14.064 1.00 35.11 H new ATOM 0 HB2 ALA A 85 10.260 32.130 -13.341 1.00 35.11 H new ATOM 0 HB3 ALA A 85 11.094 32.434 -14.883 1.00 35.11 H new ATOM 1278 N GLU A 86 9.460 32.660 -17.383 1.00 4.33 N ATOM 1279 CA GLU A 86 9.433 33.355 -18.664 1.00 52.04 C ATOM 1280 C GLU A 86 8.010 33.431 -19.211 1.00 43.34 C ATOM 1281 O GLU A 86 7.569 34.481 -19.682 1.00 22.13 O ATOM 1282 CB GLU A 86 10.341 32.648 -19.672 1.00 43.15 C ATOM 1283 CG GLU A 86 11.054 33.598 -20.620 1.00 41.12 C ATOM 1284 CD GLU A 86 12.272 32.970 -21.269 1.00 71.24 C ATOM 1285 OE1 GLU A 86 12.417 31.732 -21.188 1.00 14.34 O ATOM 1286 OE2 GLU A 86 13.080 33.717 -21.860 1.00 23.41 O ATOM 0 H GLU A 86 9.982 31.784 -17.389 1.00 4.33 H new ATOM 0 HA GLU A 86 9.798 34.370 -18.506 1.00 52.04 H new ATOM 0 HB2 GLU A 86 11.084 32.063 -19.131 1.00 43.15 H new ATOM 0 HB3 GLU A 86 9.745 31.946 -20.255 1.00 43.15 H new ATOM 0 HG2 GLU A 86 10.359 33.920 -21.396 1.00 41.12 H new ATOM 0 HG3 GLU A 86 11.358 34.491 -20.073 1.00 41.12 H new ATOM 1293 N LEU A 87 7.297 32.312 -19.147 1.00 44.30 N ATOM 1294 CA LEU A 87 5.924 32.251 -19.636 1.00 23.40 C ATOM 1295 C LEU A 87 5.010 33.144 -18.804 1.00 54.24 C ATOM 1296 O LEU A 87 4.335 34.026 -19.337 1.00 61.25 O ATOM 1297 CB LEU A 87 5.415 30.809 -19.603 1.00 72.34 C ATOM 1298 CG LEU A 87 4.814 30.280 -20.906 1.00 60.42 C ATOM 1299 CD1 LEU A 87 4.409 28.822 -20.754 1.00 33.23 C ATOM 1300 CD2 LEU A 87 3.621 31.126 -21.326 1.00 31.23 C ATOM 0 H LEU A 87 7.647 31.435 -18.761 1.00 44.30 H new ATOM 0 HA LEU A 87 5.914 32.611 -20.665 1.00 23.40 H new ATOM 0 HB2 LEU A 87 6.242 30.159 -19.318 1.00 72.34 H new ATOM 0 HB3 LEU A 87 4.661 30.729 -18.820 1.00 72.34 H new ATOM 0 HG LEU A 87 5.573 30.346 -21.686 1.00 60.42 H new ATOM 0 HD11 LEU A 87 3.983 28.463 -21.691 1.00 33.23 H new ATOM 0 HD12 LEU A 87 5.286 28.225 -20.501 1.00 33.23 H new ATOM 0 HD13 LEU A 87 3.667 28.731 -19.960 1.00 33.23 H new ATOM 0 HD21 LEU A 87 3.206 30.735 -22.255 1.00 31.23 H new ATOM 0 HD22 LEU A 87 2.860 31.093 -20.547 1.00 31.23 H new ATOM 0 HD23 LEU A 87 3.941 32.157 -21.477 1.00 31.23 H new ATOM 1312 N ILE A 88 4.994 32.912 -17.496 1.00 75.53 N ATOM 1313 CA ILE A 88 4.164 33.698 -16.591 1.00 64.43 C ATOM 1314 C ILE A 88 4.406 35.191 -16.782 1.00 54.21 C ATOM 1315 O ILE A 88 3.463 35.977 -16.862 1.00 53.14 O ATOM 1316 CB ILE A 88 4.432 33.330 -15.120 1.00 21.21 C ATOM 1317 CG1 ILE A 88 4.223 31.830 -14.900 1.00 41.03 C ATOM 1318 CG2 ILE A 88 3.528 34.136 -14.199 1.00 43.44 C ATOM 1319 CD1 ILE A 88 4.475 31.387 -13.476 1.00 62.01 C ATOM 0 H ILE A 88 5.546 32.186 -17.039 1.00 75.53 H new ATOM 0 HA ILE A 88 3.126 33.467 -16.832 1.00 64.43 H new ATOM 0 HB ILE A 88 5.468 33.572 -14.884 1.00 21.21 H new ATOM 0 HG12 ILE A 88 3.202 31.569 -15.178 1.00 41.03 H new ATOM 0 HG13 ILE A 88 4.885 31.278 -15.566 1.00 41.03 H new ATOM 0 HG21 ILE A 88 3.729 33.865 -13.163 1.00 43.44 H new ATOM 0 HG22 ILE A 88 3.721 35.200 -14.340 1.00 43.44 H new ATOM 0 HG23 ILE A 88 2.485 33.922 -14.434 1.00 43.44 H new ATOM 0 HD11 ILE A 88 4.308 30.313 -13.394 1.00 62.01 H new ATOM 0 HD12 ILE A 88 5.504 31.616 -13.200 1.00 62.01 H new ATOM 0 HD13 ILE A 88 3.795 31.912 -12.806 1.00 62.01 H new ATOM 1331 N ASN A 89 5.676 35.575 -16.856 1.00 11.22 N ATOM 1332 CA ASN A 89 6.042 36.975 -17.039 1.00 12.01 C ATOM 1333 C ASN A 89 5.525 37.502 -18.374 1.00 13.42 C ATOM 1334 O ASN A 89 4.765 38.470 -18.420 1.00 34.13 O ATOM 1335 CB ASN A 89 7.561 37.140 -16.967 1.00 2.34 C ATOM 1336 CG ASN A 89 7.976 38.581 -16.741 1.00 11.41 C ATOM 1337 OD1 ASN A 89 7.265 39.349 -16.092 1.00 3.12 O ATOM 1338 ND2 ASN A 89 9.132 38.955 -17.278 1.00 14.33 N ATOM 0 H ASN A 89 6.469 34.937 -16.792 1.00 11.22 H new ATOM 0 HA ASN A 89 5.582 37.553 -16.237 1.00 12.01 H new ATOM 0 HB2 ASN A 89 7.953 36.521 -16.160 1.00 2.34 H new ATOM 0 HB3 ASN A 89 8.007 36.777 -17.893 1.00 2.34 H new ATOM 0 HD21 ASN A 89 9.463 39.913 -17.160 1.00 14.33 H new ATOM 0 HD22 ASN A 89 9.689 38.285 -17.808 1.00 14.33 H new ATOM 1345 N LYS A 90 5.941 36.859 -19.459 1.00 44.12 N ATOM 1346 CA LYS A 90 5.520 37.260 -20.796 1.00 40.51 C ATOM 1347 C LYS A 90 4.001 37.373 -20.877 1.00 30.30 C ATOM 1348 O LYS A 90 3.470 38.265 -21.537 1.00 74.35 O ATOM 1349 CB LYS A 90 6.024 36.256 -21.835 1.00 51.10 C ATOM 1350 CG LYS A 90 6.034 36.801 -23.253 1.00 4.13 C ATOM 1351 CD LYS A 90 7.450 36.930 -23.790 1.00 52.11 C ATOM 1352 CE LYS A 90 7.922 35.635 -24.432 1.00 63.14 C ATOM 1353 NZ LYS A 90 8.967 35.877 -25.466 1.00 12.11 N ATOM 0 H LYS A 90 6.570 36.057 -19.439 1.00 44.12 H new ATOM 0 HA LYS A 90 5.951 38.239 -21.007 1.00 40.51 H new ATOM 0 HB2 LYS A 90 7.034 35.945 -21.567 1.00 51.10 H new ATOM 0 HB3 LYS A 90 5.397 35.365 -21.801 1.00 51.10 H new ATOM 0 HG2 LYS A 90 5.457 36.142 -23.901 1.00 4.13 H new ATOM 0 HG3 LYS A 90 5.546 37.775 -23.273 1.00 4.13 H new ATOM 0 HD2 LYS A 90 7.491 37.736 -24.522 1.00 52.11 H new ATOM 0 HD3 LYS A 90 8.125 37.202 -22.978 1.00 52.11 H new ATOM 0 HE2 LYS A 90 8.319 34.972 -23.663 1.00 63.14 H new ATOM 0 HE3 LYS A 90 7.073 35.124 -24.886 1.00 63.14 H new ATOM 0 HZ1 LYS A 90 9.262 34.970 -25.880 1.00 12.11 H new ATOM 0 HZ2 LYS A 90 8.581 36.489 -26.213 1.00 12.11 H new ATOM 0 HZ3 LYS A 90 9.788 36.341 -25.028 1.00 12.11 H new ATOM 1367 N MET A 91 3.308 36.463 -20.200 1.00 21.02 N ATOM 1368 CA MET A 91 1.850 36.462 -20.194 1.00 12.55 C ATOM 1369 C MET A 91 1.308 37.737 -19.553 1.00 64.14 C ATOM 1370 O MET A 91 0.418 38.388 -20.099 1.00 52.45 O ATOM 1371 CB MET A 91 1.322 35.238 -19.444 1.00 61.51 C ATOM 1372 CG MET A 91 0.070 34.639 -20.064 1.00 33.02 C ATOM 1373 SD MET A 91 -1.300 35.810 -20.130 1.00 32.43 S ATOM 1374 CE MET A 91 -1.373 36.342 -18.421 1.00 73.21 C ATOM 0 H MET A 91 3.733 35.717 -19.649 1.00 21.02 H new ATOM 0 HA MET A 91 1.508 36.421 -21.228 1.00 12.55 H new ATOM 0 HB2 MET A 91 2.102 34.477 -19.413 1.00 61.51 H new ATOM 0 HB3 MET A 91 1.108 35.518 -18.413 1.00 61.51 H new ATOM 0 HG2 MET A 91 0.298 34.295 -21.073 1.00 33.02 H new ATOM 0 HG3 MET A 91 -0.232 33.764 -19.489 1.00 33.02 H new ATOM 0 HE1 MET A 91 -2.339 36.070 -17.996 1.00 73.21 H new ATOM 0 HE2 MET A 91 -0.578 35.856 -17.855 1.00 73.21 H new ATOM 0 HE3 MET A 91 -1.246 37.423 -18.371 1.00 73.21 H new ATOM 1384 N LYS A 92 1.851 38.087 -18.392 1.00 45.25 N ATOM 1385 CA LYS A 92 1.424 39.284 -17.678 1.00 3.13 C ATOM 1386 C LYS A 92 1.459 40.505 -18.591 1.00 42.03 C ATOM 1387 O LYS A 92 0.615 41.396 -18.486 1.00 43.22 O ATOM 1388 CB LYS A 92 2.318 39.521 -16.458 1.00 72.10 C ATOM 1389 CG LYS A 92 1.546 39.863 -15.196 1.00 13.14 C ATOM 1390 CD LYS A 92 2.475 40.297 -14.074 1.00 53.53 C ATOM 1391 CE LYS A 92 2.401 41.798 -13.840 1.00 4.52 C ATOM 1392 NZ LYS A 92 3.620 42.313 -13.155 1.00 35.00 N ATOM 0 H LYS A 92 2.588 37.558 -17.925 1.00 45.25 H new ATOM 0 HA LYS A 92 0.397 39.131 -17.345 1.00 3.13 H new ATOM 0 HB2 LYS A 92 2.916 38.628 -16.277 1.00 72.10 H new ATOM 0 HB3 LYS A 92 3.013 40.331 -16.679 1.00 72.10 H new ATOM 0 HG2 LYS A 92 0.834 40.660 -15.409 1.00 13.14 H new ATOM 0 HG3 LYS A 92 0.968 38.996 -14.876 1.00 13.14 H new ATOM 0 HD2 LYS A 92 2.210 39.771 -13.157 1.00 53.53 H new ATOM 0 HD3 LYS A 92 3.499 40.016 -14.319 1.00 53.53 H new ATOM 0 HE2 LYS A 92 2.278 42.309 -14.795 1.00 4.52 H new ATOM 0 HE3 LYS A 92 1.522 42.029 -13.239 1.00 4.52 H new ATOM 0 HZ1 LYS A 92 3.531 43.339 -13.014 1.00 35.00 H new ATOM 0 HZ2 LYS A 92 3.724 41.844 -12.233 1.00 35.00 H new ATOM 0 HZ3 LYS A 92 4.457 42.115 -13.740 1.00 35.00 H new ATOM 1406 N LEU A 93 2.439 40.539 -19.488 1.00 54.31 N ATOM 1407 CA LEU A 93 2.582 41.651 -20.422 1.00 24.20 C ATOM 1408 C LEU A 93 1.419 41.688 -21.407 1.00 73.14 C ATOM 1409 O LEU A 93 0.740 42.705 -21.543 1.00 53.21 O ATOM 1410 CB LEU A 93 3.905 41.537 -21.181 1.00 63.45 C ATOM 1411 CG LEU A 93 4.249 42.702 -22.109 1.00 42.33 C ATOM 1412 CD1 LEU A 93 5.123 43.718 -21.389 1.00 74.02 C ATOM 1413 CD2 LEU A 93 4.942 42.197 -23.367 1.00 32.15 C ATOM 0 H LEU A 93 3.146 39.810 -19.588 1.00 54.31 H new ATOM 0 HA LEU A 93 2.577 42.578 -19.849 1.00 24.20 H new ATOM 0 HB2 LEU A 93 4.710 41.428 -20.454 1.00 63.45 H new ATOM 0 HB3 LEU A 93 3.884 40.622 -21.772 1.00 63.45 H new ATOM 0 HG LEU A 93 3.321 43.193 -22.402 1.00 42.33 H new ATOM 0 HD11 LEU A 93 5.358 44.540 -22.065 1.00 74.02 H new ATOM 0 HD12 LEU A 93 4.591 44.104 -20.519 1.00 74.02 H new ATOM 0 HD13 LEU A 93 6.047 43.239 -21.066 1.00 74.02 H new ATOM 0 HD21 LEU A 93 5.179 43.041 -24.015 1.00 32.15 H new ATOM 0 HD22 LEU A 93 5.862 41.680 -23.093 1.00 32.15 H new ATOM 0 HD23 LEU A 93 4.282 41.508 -23.894 1.00 32.15 H new ATOM 1425 N ALA A 94 1.193 40.571 -22.091 1.00 63.14 N ATOM 1426 CA ALA A 94 0.109 40.474 -23.061 1.00 2.41 C ATOM 1427 C ALA A 94 -1.215 40.919 -22.450 1.00 12.24 C ATOM 1428 O ALA A 94 -2.064 41.489 -23.134 1.00 50.43 O ATOM 1429 CB ALA A 94 -0.002 39.052 -23.588 1.00 71.42 C ATOM 0 H ALA A 94 1.747 39.720 -21.991 1.00 63.14 H new ATOM 0 HA ALA A 94 0.338 41.141 -23.893 1.00 2.41 H new ATOM 0 HB1 ALA A 94 -0.815 38.994 -24.311 1.00 71.42 H new ATOM 0 HB2 ALA A 94 0.933 38.769 -24.071 1.00 71.42 H new ATOM 0 HB3 ALA A 94 -0.204 38.372 -22.760 1.00 71.42 H new ATOM 1435 N GLN A 95 -1.384 40.654 -21.158 1.00 73.13 N ATOM 1436 CA GLN A 95 -2.607 41.026 -20.456 1.00 42.22 C ATOM 1437 C GLN A 95 -2.869 42.524 -20.576 1.00 22.10 C ATOM 1438 O GLN A 95 -4.019 42.962 -20.592 1.00 5.43 O ATOM 1439 CB GLN A 95 -2.515 40.629 -18.982 1.00 25.20 C ATOM 1440 CG GLN A 95 -3.868 40.451 -18.314 1.00 14.11 C ATOM 1441 CD GLN A 95 -4.547 39.154 -18.707 1.00 55.11 C ATOM 1442 OE1 GLN A 95 -3.972 38.329 -19.417 1.00 24.45 O ATOM 1443 NE2 GLN A 95 -5.779 38.967 -18.247 1.00 50.10 N ATOM 0 H GLN A 95 -0.690 40.184 -20.577 1.00 73.13 H new ATOM 0 HA GLN A 95 -3.438 40.492 -20.917 1.00 42.22 H new ATOM 0 HB2 GLN A 95 -1.953 39.699 -18.899 1.00 25.20 H new ATOM 0 HB3 GLN A 95 -1.951 41.391 -18.444 1.00 25.20 H new ATOM 0 HG2 GLN A 95 -3.741 40.477 -17.232 1.00 14.11 H new ATOM 0 HG3 GLN A 95 -4.513 41.289 -18.579 1.00 14.11 H new ATOM 0 HE21 GLN A 95 -6.218 39.677 -17.661 1.00 50.10 H new ATOM 0 HE22 GLN A 95 -6.286 38.113 -18.480 1.00 50.10 H new ATOM 1452 N GLN A 96 -1.795 43.303 -20.660 1.00 20.43 N ATOM 1453 CA GLN A 96 -1.910 44.751 -20.777 1.00 1.41 C ATOM 1454 C GLN A 96 -1.647 45.204 -22.209 1.00 52.34 C ATOM 1455 O GLN A 96 -2.096 46.273 -22.625 1.00 70.44 O ATOM 1456 CB GLN A 96 -0.932 45.441 -19.824 1.00 64.51 C ATOM 1457 CG GLN A 96 -1.539 45.786 -18.474 1.00 24.11 C ATOM 1458 CD GLN A 96 -0.566 46.512 -17.565 1.00 52.14 C ATOM 1459 OE1 GLN A 96 -0.206 46.014 -16.498 1.00 43.44 O ATOM 1460 NE2 GLN A 96 -0.136 47.696 -17.985 1.00 4.25 N ATOM 0 H GLN A 96 -0.836 42.955 -20.649 1.00 20.43 H new ATOM 0 HA GLN A 96 -2.928 45.032 -20.507 1.00 1.41 H new ATOM 0 HB2 GLN A 96 -0.069 44.793 -19.670 1.00 64.51 H new ATOM 0 HB3 GLN A 96 -0.565 46.354 -20.292 1.00 64.51 H new ATOM 0 HG2 GLN A 96 -2.422 46.407 -18.625 1.00 24.11 H new ATOM 0 HG3 GLN A 96 -1.873 44.871 -17.985 1.00 24.11 H new ATOM 0 HE21 GLN A 96 -0.461 48.070 -18.877 1.00 4.25 H new ATOM 0 HE22 GLN A 96 0.520 48.232 -17.416 1.00 4.25 H new ATOM 1469 N TYR A 97 -0.918 44.386 -22.959 1.00 25.52 N ATOM 1470 CA TYR A 97 -0.593 44.703 -24.344 1.00 44.32 C ATOM 1471 C TYR A 97 -1.577 44.039 -25.301 1.00 75.51 C ATOM 1472 O TYR A 97 -1.253 43.773 -26.459 1.00 35.23 O ATOM 1473 CB TYR A 97 0.833 44.257 -24.671 1.00 25.31 C ATOM 1474 CG TYR A 97 1.895 45.223 -24.196 1.00 14.34 C ATOM 1475 CD1 TYR A 97 2.018 45.544 -22.849 1.00 71.34 C ATOM 1476 CD2 TYR A 97 2.775 45.815 -25.093 1.00 53.42 C ATOM 1477 CE1 TYR A 97 2.985 46.427 -22.411 1.00 64.10 C ATOM 1478 CE2 TYR A 97 3.746 46.699 -24.664 1.00 23.44 C ATOM 1479 CZ TYR A 97 3.847 47.001 -23.322 1.00 3.52 C ATOM 1480 OH TYR A 97 4.813 47.881 -22.889 1.00 24.41 O ATOM 0 H TYR A 97 -0.540 43.497 -22.631 1.00 25.52 H new ATOM 0 HA TYR A 97 -0.666 45.783 -24.468 1.00 44.32 H new ATOM 0 HB2 TYR A 97 1.012 43.282 -24.218 1.00 25.31 H new ATOM 0 HB3 TYR A 97 0.926 44.130 -25.749 1.00 25.31 H new ATOM 0 HD1 TYR A 97 1.346 45.095 -22.133 1.00 71.34 H new ATOM 0 HD2 TYR A 97 2.699 45.580 -26.144 1.00 53.42 H new ATOM 0 HE1 TYR A 97 3.066 46.667 -21.361 1.00 64.10 H new ATOM 0 HE2 TYR A 97 4.422 47.151 -25.375 1.00 23.44 H new ATOM 0 HH TYR A 97 5.337 48.194 -23.655 1.00 24.41 H new ATOM 1490 N VAL A 98 -2.783 43.773 -24.809 1.00 32.15 N ATOM 1491 CA VAL A 98 -3.818 43.141 -25.619 1.00 23.14 C ATOM 1492 C VAL A 98 -4.958 44.111 -25.908 1.00 31.51 C ATOM 1493 O VAL A 98 -5.522 44.112 -27.001 1.00 54.15 O ATOM 1494 CB VAL A 98 -4.387 41.889 -24.925 1.00 64.33 C ATOM 1495 CG1 VAL A 98 -4.901 42.234 -23.536 1.00 51.43 C ATOM 1496 CG2 VAL A 98 -5.487 41.266 -25.771 1.00 33.22 C ATOM 0 H VAL A 98 -3.067 43.986 -23.853 1.00 32.15 H new ATOM 0 HA VAL A 98 -3.349 42.846 -26.558 1.00 23.14 H new ATOM 0 HB VAL A 98 -3.585 41.159 -24.817 1.00 64.33 H new ATOM 0 HG11 VAL A 98 -5.299 41.337 -23.062 1.00 51.43 H new ATOM 0 HG12 VAL A 98 -4.084 42.631 -22.934 1.00 51.43 H new ATOM 0 HG13 VAL A 98 -5.689 42.982 -23.615 1.00 51.43 H new ATOM 0 HG21 VAL A 98 -5.878 40.383 -25.266 1.00 33.22 H new ATOM 0 HG22 VAL A 98 -6.291 41.989 -25.912 1.00 33.22 H new ATOM 0 HG23 VAL A 98 -5.082 40.980 -26.741 1.00 33.22 H new ATOM 1506 N MET A 99 -5.292 44.935 -24.920 1.00 63.40 N ATOM 1507 CA MET A 99 -6.364 45.911 -25.069 1.00 54.14 C ATOM 1508 C MET A 99 -5.917 47.081 -25.940 1.00 72.14 C ATOM 1509 O MET A 99 -6.742 47.842 -26.447 1.00 41.23 O ATOM 1510 CB MET A 99 -6.812 46.423 -23.699 1.00 20.43 C ATOM 1511 CG MET A 99 -8.056 47.295 -23.752 1.00 63.11 C ATOM 1512 SD MET A 99 -7.809 48.905 -22.979 1.00 24.23 S ATOM 1513 CE MET A 99 -6.482 49.564 -23.985 1.00 63.23 C ATOM 0 H MET A 99 -4.835 44.946 -24.008 1.00 63.40 H new ATOM 0 HA MET A 99 -7.205 45.417 -25.557 1.00 54.14 H new ATOM 0 HB2 MET A 99 -7.003 45.571 -23.047 1.00 20.43 H new ATOM 0 HB3 MET A 99 -5.998 46.992 -23.249 1.00 20.43 H new ATOM 0 HG2 MET A 99 -8.351 47.437 -24.792 1.00 63.11 H new ATOM 0 HG3 MET A 99 -8.878 46.780 -23.255 1.00 63.11 H new ATOM 0 HE1 MET A 99 -6.156 50.520 -23.576 1.00 63.23 H new ATOM 0 HE2 MET A 99 -5.645 48.865 -23.987 1.00 63.23 H new ATOM 0 HE3 MET A 99 -6.836 49.708 -25.006 1.00 63.23 H new ATOM 1523 N THR A 100 -4.606 47.219 -26.110 1.00 41.14 N ATOM 1524 CA THR A 100 -4.049 48.297 -26.919 1.00 35.34 C ATOM 1525 C THR A 100 -4.179 47.991 -28.406 1.00 40.45 C ATOM 1526 O THR A 100 -5.011 48.576 -29.100 1.00 1.52 O ATOM 1527 CB THR A 100 -2.566 48.542 -26.584 1.00 31.33 C ATOM 1528 OG1 THR A 100 -1.874 47.292 -26.484 1.00 4.34 O ATOM 1529 CG2 THR A 100 -2.426 49.311 -25.279 1.00 22.12 C ATOM 0 H THR A 100 -3.910 46.598 -25.698 1.00 41.14 H new ATOM 0 HA THR A 100 -4.620 49.196 -26.685 1.00 35.34 H new ATOM 0 HB THR A 100 -2.128 49.136 -27.386 1.00 31.33 H new ATOM 0 HG1 THR A 100 -0.931 47.456 -26.272 1.00 4.34 H new ATOM 0 HG21 THR A 100 -1.370 49.472 -25.063 1.00 22.12 H new ATOM 0 HG22 THR A 100 -2.929 50.274 -25.368 1.00 22.12 H new ATOM 0 HG23 THR A 100 -2.879 48.739 -24.469 1.00 22.12 H new ATOM 1537 N SER A 101 -3.351 47.071 -28.891 1.00 55.02 N ATOM 1538 CA SER A 101 -3.372 46.690 -30.299 1.00 2.14 C ATOM 1539 C SER A 101 -2.330 45.613 -30.585 1.00 32.41 C ATOM 1540 O SER A 101 -2.544 44.731 -31.418 1.00 52.34 O ATOM 1541 CB SER A 101 -3.115 47.912 -31.183 1.00 61.42 C ATOM 1542 OG SER A 101 -2.052 48.697 -30.672 1.00 10.00 O ATOM 0 H SER A 101 -2.658 46.576 -28.330 1.00 55.02 H new ATOM 0 HA SER A 101 -4.359 46.286 -30.527 1.00 2.14 H new ATOM 0 HB2 SER A 101 -2.877 47.588 -32.196 1.00 61.42 H new ATOM 0 HB3 SER A 101 -4.020 48.516 -31.245 1.00 61.42 H new ATOM 0 HG SER A 101 -1.907 49.471 -31.256 1.00 10.00 H new ATOM 1548 N LEU A 102 -1.202 45.690 -29.888 1.00 62.21 N ATOM 1549 CA LEU A 102 -0.125 44.722 -30.066 1.00 70.20 C ATOM 1550 C LEU A 102 -0.454 43.407 -29.367 1.00 20.23 C ATOM 1551 O LEU A 102 0.241 42.997 -28.437 1.00 70.04 O ATOM 1552 CB LEU A 102 1.189 45.286 -29.524 1.00 3.11 C ATOM 1553 CG LEU A 102 1.476 46.752 -29.851 1.00 11.13 C ATOM 1554 CD1 LEU A 102 2.756 47.210 -29.170 1.00 2.42 C ATOM 1555 CD2 LEU A 102 1.568 46.955 -31.356 1.00 63.31 C ATOM 0 H LEU A 102 -1.009 46.413 -29.194 1.00 62.21 H new ATOM 0 HA LEU A 102 -0.017 44.528 -31.133 1.00 70.20 H new ATOM 0 HB2 LEU A 102 1.192 45.169 -28.440 1.00 3.11 H new ATOM 0 HB3 LEU A 102 2.008 44.681 -29.912 1.00 3.11 H new ATOM 0 HG LEU A 102 0.652 47.357 -29.473 1.00 11.13 H new ATOM 0 HD11 LEU A 102 2.944 48.256 -29.414 1.00 2.42 H new ATOM 0 HD12 LEU A 102 2.652 47.103 -28.090 1.00 2.42 H new ATOM 0 HD13 LEU A 102 3.591 46.601 -29.517 1.00 2.42 H new ATOM 0 HD21 LEU A 102 1.773 48.004 -31.570 1.00 63.31 H new ATOM 0 HD22 LEU A 102 2.373 46.339 -31.758 1.00 63.31 H new ATOM 0 HD23 LEU A 102 0.625 46.667 -31.820 1.00 63.31 H new ATOM 1567 N GLN A 103 -1.516 42.750 -29.822 1.00 12.14 N ATOM 1568 CA GLN A 103 -1.936 41.480 -29.240 1.00 44.50 C ATOM 1569 C GLN A 103 -1.383 40.306 -30.040 1.00 65.14 C ATOM 1570 O GLN A 103 -0.730 39.420 -29.489 1.00 45.50 O ATOM 1571 CB GLN A 103 -3.462 41.401 -29.184 1.00 31.25 C ATOM 1572 CG GLN A 103 -3.982 40.098 -28.597 1.00 50.22 C ATOM 1573 CD GLN A 103 -5.461 39.891 -28.856 1.00 14.22 C ATOM 1574 OE1 GLN A 103 -6.108 40.706 -29.514 1.00 53.31 O ATOM 1575 NE2 GLN A 103 -6.006 38.796 -28.338 1.00 4.21 N ATOM 0 H GLN A 103 -2.101 43.076 -30.591 1.00 12.14 H new ATOM 0 HA GLN A 103 -1.539 41.424 -28.226 1.00 44.50 H new ATOM 0 HB2 GLN A 103 -3.839 42.234 -28.590 1.00 31.25 H new ATOM 0 HB3 GLN A 103 -3.861 41.521 -30.191 1.00 31.25 H new ATOM 0 HG2 GLN A 103 -3.423 39.264 -29.021 1.00 50.22 H new ATOM 0 HG3 GLN A 103 -3.801 40.090 -27.522 1.00 50.22 H new ATOM 0 HE21 GLN A 103 -5.433 38.147 -27.799 1.00 4.21 H new ATOM 0 HE22 GLN A 103 -6.998 38.604 -28.479 1.00 4.21 H new ATOM 1584 N GLN A 104 -1.649 40.306 -31.342 1.00 71.35 N ATOM 1585 CA GLN A 104 -1.178 39.239 -32.218 1.00 35.21 C ATOM 1586 C GLN A 104 0.320 39.013 -32.043 1.00 73.45 C ATOM 1587 O GLN A 104 0.794 37.878 -32.085 1.00 31.14 O ATOM 1588 CB GLN A 104 -1.489 39.574 -33.678 1.00 32.23 C ATOM 1589 CG GLN A 104 -2.972 39.532 -34.009 1.00 52.11 C ATOM 1590 CD GLN A 104 -3.238 39.564 -35.501 1.00 42.43 C ATOM 1591 OE1 GLN A 104 -2.371 39.943 -36.290 1.00 30.42 O ATOM 1592 NE2 GLN A 104 -4.441 39.167 -35.897 1.00 72.44 N ATOM 0 H GLN A 104 -2.188 41.032 -31.814 1.00 71.35 H new ATOM 0 HA GLN A 104 -1.699 38.322 -31.945 1.00 35.21 H new ATOM 0 HB2 GLN A 104 -1.103 40.568 -33.904 1.00 32.23 H new ATOM 0 HB3 GLN A 104 -0.961 38.872 -34.324 1.00 32.23 H new ATOM 0 HG2 GLN A 104 -3.410 38.628 -33.585 1.00 52.11 H new ATOM 0 HG3 GLN A 104 -3.470 40.379 -33.537 1.00 52.11 H new ATOM 0 HE21 GLN A 104 -5.129 38.861 -35.209 1.00 72.44 H new ATOM 0 HE22 GLN A 104 -4.677 39.168 -36.889 1.00 72.44 H new ATOM 1601 N GLU A 105 1.059 40.100 -31.849 1.00 52.32 N ATOM 1602 CA GLU A 105 2.504 40.019 -31.670 1.00 13.20 C ATOM 1603 C GLU A 105 2.861 39.007 -30.586 1.00 24.05 C ATOM 1604 O GLU A 105 3.554 38.022 -30.844 1.00 41.52 O ATOM 1605 CB GLU A 105 3.073 41.393 -31.309 1.00 20.23 C ATOM 1606 CG GLU A 105 4.580 41.396 -31.116 1.00 62.55 C ATOM 1607 CD GLU A 105 5.222 42.697 -31.556 1.00 0.20 C ATOM 1608 OE1 GLU A 105 4.986 43.117 -32.708 1.00 73.51 O ATOM 1609 OE2 GLU A 105 5.961 43.296 -30.747 1.00 12.53 O ATOM 0 H GLU A 105 0.682 41.047 -31.812 1.00 52.32 H new ATOM 0 HA GLU A 105 2.944 39.688 -32.611 1.00 13.20 H new ATOM 0 HB2 GLU A 105 2.814 42.102 -32.095 1.00 20.23 H new ATOM 0 HB3 GLU A 105 2.597 41.745 -30.394 1.00 20.23 H new ATOM 0 HG2 GLU A 105 4.808 41.220 -30.065 1.00 62.55 H new ATOM 0 HG3 GLU A 105 5.016 40.571 -31.679 1.00 62.55 H new ATOM 1616 N TYR A 106 2.385 39.257 -29.371 1.00 73.12 N ATOM 1617 CA TYR A 106 2.656 38.370 -28.246 1.00 61.11 C ATOM 1618 C TYR A 106 2.248 36.936 -28.572 1.00 5.31 C ATOM 1619 O TYR A 106 2.834 35.980 -28.063 1.00 43.33 O ATOM 1620 CB TYR A 106 1.914 38.852 -26.999 1.00 14.12 C ATOM 1621 CG TYR A 106 1.799 37.801 -25.918 1.00 73.22 C ATOM 1622 CD1 TYR A 106 2.776 37.674 -24.938 1.00 51.15 C ATOM 1623 CD2 TYR A 106 0.714 36.934 -25.877 1.00 70.33 C ATOM 1624 CE1 TYR A 106 2.676 36.715 -23.950 1.00 33.45 C ATOM 1625 CE2 TYR A 106 0.605 35.972 -24.891 1.00 52.43 C ATOM 1626 CZ TYR A 106 1.588 35.867 -23.930 1.00 21.40 C ATOM 1627 OH TYR A 106 1.484 34.909 -22.947 1.00 13.30 O ATOM 0 H TYR A 106 1.809 40.067 -29.140 1.00 73.12 H new ATOM 0 HA TYR A 106 3.728 38.388 -28.052 1.00 61.11 H new ATOM 0 HB2 TYR A 106 2.429 39.723 -26.594 1.00 14.12 H new ATOM 0 HB3 TYR A 106 0.914 39.178 -27.285 1.00 14.12 H new ATOM 0 HD1 TYR A 106 3.628 38.337 -24.949 1.00 51.15 H new ATOM 0 HD2 TYR A 106 -0.057 37.013 -26.629 1.00 70.33 H new ATOM 0 HE1 TYR A 106 3.445 36.629 -23.197 1.00 33.45 H new ATOM 0 HE2 TYR A 106 -0.245 35.306 -24.873 1.00 52.43 H new ATOM 0 HH TYR A 106 2.350 34.802 -22.502 1.00 13.30 H new ATOM 1637 N LYS A 107 1.240 36.794 -29.425 1.00 15.52 N ATOM 1638 CA LYS A 107 0.752 35.479 -29.822 1.00 43.03 C ATOM 1639 C LYS A 107 1.840 34.692 -30.547 1.00 54.22 C ATOM 1640 O LYS A 107 2.078 33.522 -30.248 1.00 74.23 O ATOM 1641 CB LYS A 107 -0.477 35.619 -30.723 1.00 33.43 C ATOM 1642 CG LYS A 107 -1.426 34.435 -30.645 1.00 22.22 C ATOM 1643 CD LYS A 107 -1.643 33.804 -32.010 1.00 34.32 C ATOM 1644 CE LYS A 107 -2.296 34.779 -32.977 1.00 53.21 C ATOM 1645 NZ LYS A 107 -2.779 34.098 -34.210 1.00 55.00 N ATOM 0 H LYS A 107 0.744 37.575 -29.855 1.00 15.52 H new ATOM 0 HA LYS A 107 0.473 34.934 -28.920 1.00 43.03 H new ATOM 0 HB2 LYS A 107 -1.017 36.525 -30.449 1.00 33.43 H new ATOM 0 HB3 LYS A 107 -0.149 35.743 -31.755 1.00 33.43 H new ATOM 0 HG2 LYS A 107 -1.024 33.690 -29.958 1.00 22.22 H new ATOM 0 HG3 LYS A 107 -2.383 34.761 -30.237 1.00 22.22 H new ATOM 0 HD2 LYS A 107 -0.687 33.473 -32.415 1.00 34.32 H new ATOM 0 HD3 LYS A 107 -2.269 32.918 -31.907 1.00 34.32 H new ATOM 0 HE2 LYS A 107 -3.133 35.274 -32.484 1.00 53.21 H new ATOM 0 HE3 LYS A 107 -1.581 35.556 -33.248 1.00 53.21 H new ATOM 0 HZ1 LYS A 107 -3.405 34.739 -34.738 1.00 55.00 H new ATOM 0 HZ2 LYS A 107 -1.966 33.839 -34.805 1.00 55.00 H new ATOM 0 HZ3 LYS A 107 -3.304 33.239 -33.949 1.00 55.00 H new ATOM 1659 N LYS A 108 2.498 35.342 -31.501 1.00 0.54 N ATOM 1660 CA LYS A 108 3.563 34.705 -32.267 1.00 15.42 C ATOM 1661 C LYS A 108 4.686 34.233 -31.349 1.00 52.42 C ATOM 1662 O LYS A 108 5.029 33.052 -31.332 1.00 65.23 O ATOM 1663 CB LYS A 108 4.117 35.676 -33.312 1.00 64.32 C ATOM 1664 CG LYS A 108 3.866 35.236 -34.744 1.00 53.12 C ATOM 1665 CD LYS A 108 3.216 36.341 -35.561 1.00 21.24 C ATOM 1666 CE LYS A 108 2.627 35.804 -36.856 1.00 30.21 C ATOM 1667 NZ LYS A 108 1.547 36.685 -37.381 1.00 64.35 N ATOM 0 H LYS A 108 2.312 36.310 -31.762 1.00 0.54 H new ATOM 0 HA LYS A 108 3.143 33.836 -32.774 1.00 15.42 H new ATOM 0 HB2 LYS A 108 3.668 36.657 -33.158 1.00 64.32 H new ATOM 0 HB3 LYS A 108 5.190 35.789 -33.158 1.00 64.32 H new ATOM 0 HG2 LYS A 108 4.809 34.946 -35.207 1.00 53.12 H new ATOM 0 HG3 LYS A 108 3.225 34.354 -34.748 1.00 53.12 H new ATOM 0 HD2 LYS A 108 2.431 36.816 -34.973 1.00 21.24 H new ATOM 0 HD3 LYS A 108 3.955 37.110 -35.787 1.00 21.24 H new ATOM 0 HE2 LYS A 108 3.416 35.712 -37.603 1.00 30.21 H new ATOM 0 HE3 LYS A 108 2.229 34.803 -36.687 1.00 30.21 H new ATOM 0 HZ1 LYS A 108 1.171 36.285 -38.264 1.00 64.35 H new ATOM 0 HZ2 LYS A 108 0.783 36.753 -36.679 1.00 64.35 H new ATOM 0 HZ3 LYS A 108 1.932 37.633 -37.567 1.00 64.35 H new ATOM 1681 N GLN A 109 5.252 35.164 -30.587 1.00 70.25 N ATOM 1682 CA GLN A 109 6.336 34.841 -29.667 1.00 12.11 C ATOM 1683 C GLN A 109 5.890 33.801 -28.644 1.00 50.23 C ATOM 1684 O GLN A 109 6.651 32.903 -28.286 1.00 61.12 O ATOM 1685 CB GLN A 109 6.818 36.104 -28.951 1.00 31.12 C ATOM 1686 CG GLN A 109 5.745 36.771 -28.106 1.00 11.32 C ATOM 1687 CD GLN A 109 6.164 38.139 -27.604 1.00 50.22 C ATOM 1688 OE1 GLN A 109 6.704 38.950 -28.357 1.00 5.33 O ATOM 1689 NE2 GLN A 109 5.916 38.403 -26.327 1.00 2.04 N ATOM 0 H GLN A 109 4.978 36.147 -30.589 1.00 70.25 H new ATOM 0 HA GLN A 109 7.159 34.424 -30.247 1.00 12.11 H new ATOM 0 HB2 GLN A 109 7.665 35.850 -28.314 1.00 31.12 H new ATOM 0 HB3 GLN A 109 7.180 36.816 -29.692 1.00 31.12 H new ATOM 0 HG2 GLN A 109 4.833 36.868 -28.694 1.00 11.32 H new ATOM 0 HG3 GLN A 109 5.509 36.132 -27.255 1.00 11.32 H new ATOM 0 HE21 GLN A 109 5.466 37.701 -25.739 1.00 2.04 H new ATOM 0 HE22 GLN A 109 6.175 39.308 -25.934 1.00 2.04 H new ATOM 1698 N MET A 110 4.652 33.930 -28.178 1.00 22.11 N ATOM 1699 CA MET A 110 4.105 33.000 -27.197 1.00 2.14 C ATOM 1700 C MET A 110 4.227 31.560 -27.685 1.00 53.23 C ATOM 1701 O MET A 110 4.734 30.693 -26.973 1.00 32.32 O ATOM 1702 CB MET A 110 2.640 33.332 -26.910 1.00 35.32 C ATOM 1703 CG MET A 110 1.979 32.372 -25.933 1.00 3.41 C ATOM 1704 SD MET A 110 0.424 31.707 -26.557 1.00 11.03 S ATOM 1705 CE MET A 110 0.804 29.958 -26.617 1.00 31.32 C ATOM 0 H MET A 110 4.009 34.669 -28.464 1.00 22.11 H new ATOM 0 HA MET A 110 4.680 33.102 -26.277 1.00 2.14 H new ATOM 0 HB2 MET A 110 2.577 34.344 -26.511 1.00 35.32 H new ATOM 0 HB3 MET A 110 2.084 33.324 -27.847 1.00 35.32 H new ATOM 0 HG2 MET A 110 2.662 31.550 -25.720 1.00 3.41 H new ATOM 0 HG3 MET A 110 1.797 32.888 -24.990 1.00 3.41 H new ATOM 0 HE1 MET A 110 -0.057 29.412 -27.002 1.00 31.32 H new ATOM 0 HE2 MET A 110 1.660 29.794 -27.272 1.00 31.32 H new ATOM 0 HE3 MET A 110 1.041 29.603 -25.614 1.00 31.32 H new ATOM 1715 N LEU A 111 3.758 31.312 -28.904 1.00 5.35 N ATOM 1716 CA LEU A 111 3.815 29.977 -29.488 1.00 35.45 C ATOM 1717 C LEU A 111 5.242 29.440 -29.484 1.00 4.21 C ATOM 1718 O LEU A 111 5.478 28.272 -29.174 1.00 60.22 O ATOM 1719 CB LEU A 111 3.270 30.000 -30.917 1.00 2.41 C ATOM 1720 CG LEU A 111 2.570 28.726 -31.390 1.00 34.05 C ATOM 1721 CD1 LEU A 111 2.301 28.788 -32.885 1.00 71.11 C ATOM 1722 CD2 LEU A 111 3.403 27.500 -31.046 1.00 5.30 C ATOM 0 H LEU A 111 3.334 32.018 -29.506 1.00 5.35 H new ATOM 0 HA LEU A 111 3.197 29.316 -28.881 1.00 35.45 H new ATOM 0 HB2 LEU A 111 2.568 30.829 -31.003 1.00 2.41 H new ATOM 0 HB3 LEU A 111 4.096 30.210 -31.596 1.00 2.41 H new ATOM 0 HG LEU A 111 1.614 28.647 -30.873 1.00 34.05 H new ATOM 0 HD11 LEU A 111 1.802 27.872 -33.203 1.00 71.11 H new ATOM 0 HD12 LEU A 111 1.663 29.644 -33.105 1.00 71.11 H new ATOM 0 HD13 LEU A 111 3.245 28.892 -33.420 1.00 71.11 H new ATOM 0 HD21 LEU A 111 2.889 26.603 -31.390 1.00 5.30 H new ATOM 0 HD22 LEU A 111 4.375 27.572 -31.535 1.00 5.30 H new ATOM 0 HD23 LEU A 111 3.543 27.446 -29.966 1.00 5.30 H new ATOM 1734 N THR A 112 6.194 30.302 -29.828 1.00 40.43 N ATOM 1735 CA THR A 112 7.599 29.916 -29.864 1.00 11.12 C ATOM 1736 C THR A 112 8.020 29.252 -28.558 1.00 74.40 C ATOM 1737 O THR A 112 8.572 28.152 -28.560 1.00 73.11 O ATOM 1738 CB THR A 112 8.509 31.131 -30.125 1.00 1.11 C ATOM 1739 OG1 THR A 112 8.118 31.784 -31.338 1.00 2.43 O ATOM 1740 CG2 THR A 112 9.966 30.705 -30.219 1.00 44.04 C ATOM 0 H THR A 112 6.017 31.273 -30.086 1.00 40.43 H new ATOM 0 HA THR A 112 7.711 29.205 -30.683 1.00 11.12 H new ATOM 0 HB THR A 112 8.403 31.823 -29.290 1.00 1.11 H new ATOM 0 HG1 THR A 112 8.700 32.556 -31.496 1.00 2.43 H new ATOM 0 HG21 THR A 112 10.590 31.580 -30.404 1.00 44.04 H new ATOM 0 HG22 THR A 112 10.269 30.235 -29.283 1.00 44.04 H new ATOM 0 HG23 THR A 112 10.085 29.995 -31.037 1.00 44.04 H new ATOM 1748 N ALA A 113 7.754 29.926 -27.444 1.00 3.00 N ATOM 1749 CA ALA A 113 8.103 29.399 -26.131 1.00 23.04 C ATOM 1750 C ALA A 113 7.393 28.076 -25.863 1.00 51.43 C ATOM 1751 O ALA A 113 8.030 27.070 -25.554 1.00 43.14 O ATOM 1752 CB ALA A 113 7.762 30.412 -25.048 1.00 32.13 C ATOM 0 H ALA A 113 7.298 30.838 -27.425 1.00 3.00 H new ATOM 0 HA ALA A 113 9.177 29.214 -26.115 1.00 23.04 H new ATOM 0 HB1 ALA A 113 8.028 30.005 -24.072 1.00 32.13 H new ATOM 0 HB2 ALA A 113 8.320 31.332 -25.222 1.00 32.13 H new ATOM 0 HB3 ALA A 113 6.693 30.626 -25.073 1.00 32.13 H new ATOM 1758 N ALA A 114 6.069 28.086 -25.984 1.00 24.03 N ATOM 1759 CA ALA A 114 5.273 26.887 -25.756 1.00 71.43 C ATOM 1760 C ALA A 114 5.742 25.739 -26.644 1.00 45.33 C ATOM 1761 O ALA A 114 5.587 24.568 -26.297 1.00 15.10 O ATOM 1762 CB ALA A 114 3.800 27.177 -26.001 1.00 54.11 C ATOM 0 H ALA A 114 5.526 28.911 -26.239 1.00 24.03 H new ATOM 0 HA ALA A 114 5.405 26.586 -24.717 1.00 71.43 H new ATOM 0 HB1 ALA A 114 3.217 26.272 -25.827 1.00 54.11 H new ATOM 0 HB2 ALA A 114 3.465 27.961 -25.321 1.00 54.11 H new ATOM 0 HB3 ALA A 114 3.660 27.506 -27.031 1.00 54.11 H new ATOM 1768 N HIS A 115 6.318 26.083 -27.792 1.00 74.25 N ATOM 1769 CA HIS A 115 6.810 25.081 -28.731 1.00 30.52 C ATOM 1770 C HIS A 115 7.939 24.264 -28.110 1.00 64.23 C ATOM 1771 O HIS A 115 7.873 23.036 -28.055 1.00 52.23 O ATOM 1772 CB HIS A 115 7.296 25.750 -30.017 1.00 10.25 C ATOM 1773 CG HIS A 115 7.444 24.802 -31.167 1.00 12.33 C ATOM 1774 ND1 HIS A 115 8.647 24.230 -31.521 1.00 5.24 N ATOM 1775 CD2 HIS A 115 6.530 24.325 -32.044 1.00 11.50 C ATOM 1776 CE1 HIS A 115 8.468 23.444 -32.567 1.00 30.11 C ATOM 1777 NE2 HIS A 115 7.191 23.484 -32.904 1.00 25.31 N ATOM 0 H HIS A 115 6.455 27.048 -28.094 1.00 74.25 H new ATOM 0 HA HIS A 115 5.987 24.408 -28.971 1.00 30.52 H new ATOM 0 HB2 HIS A 115 6.595 26.538 -30.294 1.00 10.25 H new ATOM 0 HB3 HIS A 115 8.256 26.230 -29.827 1.00 10.25 H new ATOM 0 HD2 HIS A 115 5.477 24.562 -32.063 1.00 11.50 H new ATOM 0 HE1 HIS A 115 9.235 22.867 -33.063 1.00 30.11 H new ATOM 0 HE2 HIS A 115 6.766 22.973 -33.677 1.00 25.31 H new ATOM 1785 N ALA A 116 8.976 24.954 -27.645 1.00 73.22 N ATOM 1786 CA ALA A 116 10.119 24.293 -27.028 1.00 34.51 C ATOM 1787 C ALA A 116 9.722 23.618 -25.719 1.00 13.41 C ATOM 1788 O ALA A 116 10.304 22.606 -25.329 1.00 23.35 O ATOM 1789 CB ALA A 116 11.241 25.292 -26.790 1.00 62.40 C ATOM 0 H ALA A 116 9.047 25.971 -27.684 1.00 73.22 H new ATOM 0 HA ALA A 116 10.474 23.521 -27.711 1.00 34.51 H new ATOM 0 HB1 ALA A 116 12.088 24.785 -26.329 1.00 62.40 H new ATOM 0 HB2 ALA A 116 11.551 25.724 -27.741 1.00 62.40 H new ATOM 0 HB3 ALA A 116 10.889 26.084 -26.129 1.00 62.40 H new ATOM 1795 N LEU A 117 8.728 24.186 -25.044 1.00 70.13 N ATOM 1796 CA LEU A 117 8.253 23.640 -23.778 1.00 22.24 C ATOM 1797 C LEU A 117 7.705 22.228 -23.964 1.00 44.53 C ATOM 1798 O LEU A 117 8.178 21.281 -23.337 1.00 72.23 O ATOM 1799 CB LEU A 117 7.172 24.544 -23.183 1.00 2.11 C ATOM 1800 CG LEU A 117 7.669 25.783 -22.437 1.00 22.10 C ATOM 1801 CD1 LEU A 117 6.496 26.612 -21.939 1.00 0.35 C ATOM 1802 CD2 LEU A 117 8.571 25.382 -21.279 1.00 65.00 C ATOM 0 H LEU A 117 8.236 25.024 -25.353 1.00 70.13 H new ATOM 0 HA LEU A 117 9.098 23.594 -23.091 1.00 22.24 H new ATOM 0 HB2 LEU A 117 6.514 24.869 -23.989 1.00 2.11 H new ATOM 0 HB3 LEU A 117 6.567 23.950 -22.498 1.00 2.11 H new ATOM 0 HG LEU A 117 8.250 26.392 -23.130 1.00 22.10 H new ATOM 0 HD11 LEU A 117 6.869 27.489 -21.411 1.00 0.35 H new ATOM 0 HD12 LEU A 117 5.889 26.930 -22.787 1.00 0.35 H new ATOM 0 HD13 LEU A 117 5.888 26.012 -21.262 1.00 0.35 H new ATOM 0 HD21 LEU A 117 8.915 26.276 -20.759 1.00 65.00 H new ATOM 0 HD22 LEU A 117 8.014 24.751 -20.586 1.00 65.00 H new ATOM 0 HD23 LEU A 117 9.430 24.831 -21.661 1.00 65.00 H new ATOM 1814 N ALA A 118 6.708 22.097 -24.832 1.00 73.53 N ATOM 1815 CA ALA A 118 6.099 20.801 -25.105 1.00 33.41 C ATOM 1816 C ALA A 118 7.157 19.759 -25.452 1.00 31.21 C ATOM 1817 O ALA A 118 7.181 18.669 -24.879 1.00 41.24 O ATOM 1818 CB ALA A 118 5.084 20.921 -26.232 1.00 61.13 C ATOM 0 H ALA A 118 6.305 22.872 -25.358 1.00 73.53 H new ATOM 0 HA ALA A 118 5.585 20.472 -24.202 1.00 33.41 H new ATOM 0 HB1 ALA A 118 4.637 19.946 -26.425 1.00 61.13 H new ATOM 0 HB2 ALA A 118 4.304 21.627 -25.946 1.00 61.13 H new ATOM 0 HB3 ALA A 118 5.582 21.277 -27.134 1.00 61.13 H new ATOM 1824 N VAL A 119 8.031 20.100 -26.394 1.00 15.43 N ATOM 1825 CA VAL A 119 9.092 19.195 -26.817 1.00 33.51 C ATOM 1826 C VAL A 119 10.052 18.900 -25.670 1.00 62.43 C ATOM 1827 O VAL A 119 10.566 17.788 -25.548 1.00 30.53 O ATOM 1828 CB VAL A 119 9.887 19.776 -28.001 1.00 74.43 C ATOM 1829 CG1 VAL A 119 11.001 18.826 -28.414 1.00 51.00 C ATOM 1830 CG2 VAL A 119 8.961 20.065 -29.173 1.00 14.21 C ATOM 0 H VAL A 119 8.025 20.997 -26.879 1.00 15.43 H new ATOM 0 HA VAL A 119 8.611 18.269 -27.132 1.00 33.51 H new ATOM 0 HB VAL A 119 10.341 20.715 -27.685 1.00 74.43 H new ATOM 0 HG11 VAL A 119 11.552 19.253 -29.252 1.00 51.00 H new ATOM 0 HG12 VAL A 119 11.679 18.673 -27.574 1.00 51.00 H new ATOM 0 HG13 VAL A 119 10.572 17.870 -28.712 1.00 51.00 H new ATOM 0 HG21 VAL A 119 9.539 20.475 -30.001 1.00 14.21 H new ATOM 0 HG22 VAL A 119 8.477 19.141 -29.491 1.00 14.21 H new ATOM 0 HG23 VAL A 119 8.202 20.786 -28.868 1.00 14.21 H new ATOM 1840 N ASP A 120 10.290 19.903 -24.832 1.00 60.44 N ATOM 1841 CA ASP A 120 11.188 19.751 -23.694 1.00 21.15 C ATOM 1842 C ASP A 120 10.661 18.700 -22.722 1.00 31.31 C ATOM 1843 O ASP A 120 11.304 17.676 -22.491 1.00 13.12 O ATOM 1844 CB ASP A 120 11.362 21.088 -22.972 1.00 51.42 C ATOM 1845 CG ASP A 120 12.441 21.948 -23.599 1.00 44.44 C ATOM 1846 OD1 ASP A 120 13.341 21.385 -24.256 1.00 64.13 O ATOM 1847 OD2 ASP A 120 12.387 23.185 -23.433 1.00 12.13 O ATOM 0 H ASP A 120 9.873 20.830 -24.920 1.00 60.44 H new ATOM 0 HA ASP A 120 12.156 19.420 -24.069 1.00 21.15 H new ATOM 0 HB2 ASP A 120 10.416 21.630 -22.984 1.00 51.42 H new ATOM 0 HB3 ASP A 120 11.610 20.904 -21.927 1.00 51.42 H new ATOM 1852 N ALA A 121 9.487 18.961 -22.155 1.00 64.43 N ATOM 1853 CA ALA A 121 8.873 18.037 -21.210 1.00 25.24 C ATOM 1854 C ALA A 121 8.807 16.626 -21.785 1.00 2.04 C ATOM 1855 O ALA A 121 8.870 15.641 -21.049 1.00 22.21 O ATOM 1856 CB ALA A 121 7.482 18.519 -20.828 1.00 52.42 C ATOM 0 H ALA A 121 8.943 19.805 -22.334 1.00 64.43 H new ATOM 0 HA ALA A 121 9.494 18.007 -20.314 1.00 25.24 H new ATOM 0 HB1 ALA A 121 7.036 17.819 -20.122 1.00 52.42 H new ATOM 0 HB2 ALA A 121 7.552 19.504 -20.367 1.00 52.42 H new ATOM 0 HB3 ALA A 121 6.860 18.580 -21.721 1.00 52.42 H new ATOM 1862 N LYS A 122 8.679 16.535 -23.104 1.00 11.31 N ATOM 1863 CA LYS A 122 8.604 15.245 -23.779 1.00 44.10 C ATOM 1864 C LYS A 122 9.977 14.583 -23.840 1.00 21.34 C ATOM 1865 O LYS A 122 10.159 13.466 -23.357 1.00 63.10 O ATOM 1866 CB LYS A 122 8.047 15.418 -25.194 1.00 31.03 C ATOM 1867 CG LYS A 122 7.885 14.110 -25.948 1.00 24.51 C ATOM 1868 CD LYS A 122 9.151 13.743 -26.705 1.00 74.34 C ATOM 1869 CE LYS A 122 8.876 12.700 -27.778 1.00 34.22 C ATOM 1870 NZ LYS A 122 9.087 13.244 -29.148 1.00 32.02 N ATOM 0 H LYS A 122 8.625 17.340 -23.728 1.00 11.31 H new ATOM 0 HA LYS A 122 7.934 14.602 -23.207 1.00 44.10 H new ATOM 0 HB2 LYS A 122 7.079 15.916 -25.136 1.00 31.03 H new ATOM 0 HB3 LYS A 122 8.710 16.073 -25.759 1.00 31.03 H new ATOM 0 HG2 LYS A 122 7.635 13.313 -25.247 1.00 24.51 H new ATOM 0 HG3 LYS A 122 7.053 14.192 -26.647 1.00 24.51 H new ATOM 0 HD2 LYS A 122 9.574 14.637 -27.164 1.00 74.34 H new ATOM 0 HD3 LYS A 122 9.896 13.361 -26.007 1.00 74.34 H new ATOM 0 HE2 LYS A 122 9.528 11.840 -27.624 1.00 34.22 H new ATOM 0 HE3 LYS A 122 7.850 12.343 -27.683 1.00 34.22 H new ATOM 0 HZ1 LYS A 122 9.158 12.459 -29.826 1.00 32.02 H new ATOM 0 HZ2 LYS A 122 8.285 13.854 -29.407 1.00 32.02 H new ATOM 0 HZ3 LYS A 122 9.966 13.800 -29.169 1.00 32.02 H new ATOM 1884 N ASN A 123 10.940 15.280 -24.435 1.00 33.35 N ATOM 1885 CA ASN A 123 12.296 14.759 -24.557 1.00 24.20 C ATOM 1886 C ASN A 123 12.830 14.308 -23.201 1.00 24.41 C ATOM 1887 O ASN A 123 13.657 13.399 -23.118 1.00 64.41 O ATOM 1888 CB ASN A 123 13.221 15.822 -25.154 1.00 22.32 C ATOM 1889 CG ASN A 123 14.630 15.305 -25.372 1.00 42.32 C ATOM 1890 OD1 ASN A 123 14.848 14.368 -26.141 1.00 12.53 O ATOM 1891 ND2 ASN A 123 15.596 15.916 -24.695 1.00 35.12 N ATOM 0 H ASN A 123 10.806 16.207 -24.840 1.00 33.35 H new ATOM 0 HA ASN A 123 12.268 13.896 -25.222 1.00 24.20 H new ATOM 0 HB2 ASN A 123 12.811 16.164 -26.104 1.00 22.32 H new ATOM 0 HB3 ASN A 123 13.253 16.686 -24.491 1.00 22.32 H new ATOM 0 HD21 ASN A 123 16.564 15.613 -24.802 1.00 35.12 H new ATOM 0 HD22 ASN A 123 15.370 16.688 -24.068 1.00 35.12 H new ATOM 1898 N LEU A 124 12.352 14.948 -22.140 1.00 52.21 N ATOM 1899 CA LEU A 124 12.780 14.613 -20.786 1.00 71.04 C ATOM 1900 C LEU A 124 12.611 13.121 -20.516 1.00 0.45 C ATOM 1901 O LEU A 124 13.571 12.429 -20.175 1.00 31.31 O ATOM 1902 CB LEU A 124 11.982 15.422 -19.763 1.00 12.42 C ATOM 1903 CG LEU A 124 11.887 14.823 -18.359 1.00 72.55 C ATOM 1904 CD1 LEU A 124 13.272 14.501 -17.822 1.00 24.53 C ATOM 1905 CD2 LEU A 124 11.156 15.773 -17.422 1.00 23.43 C ATOM 0 H LEU A 124 11.667 15.702 -22.191 1.00 52.21 H new ATOM 0 HA LEU A 124 13.837 14.863 -20.692 1.00 71.04 H new ATOM 0 HB2 LEU A 124 12.430 16.413 -19.684 1.00 12.42 H new ATOM 0 HB3 LEU A 124 10.971 15.559 -20.147 1.00 12.42 H new ATOM 0 HG LEU A 124 11.318 13.895 -18.418 1.00 72.55 H new ATOM 0 HD11 LEU A 124 13.185 14.076 -16.822 1.00 24.53 H new ATOM 0 HD12 LEU A 124 13.760 13.782 -18.481 1.00 24.53 H new ATOM 0 HD13 LEU A 124 13.866 15.414 -17.777 1.00 24.53 H new ATOM 0 HD21 LEU A 124 11.098 15.330 -16.428 1.00 23.43 H new ATOM 0 HD22 LEU A 124 11.697 16.718 -17.367 1.00 23.43 H new ATOM 0 HD23 LEU A 124 10.149 15.952 -17.799 1.00 23.43 H new ATOM 1917 N LEU A 125 11.386 12.632 -20.671 1.00 53.41 N ATOM 1918 CA LEU A 125 11.091 11.222 -20.446 1.00 33.44 C ATOM 1919 C LEU A 125 11.682 10.358 -21.555 1.00 75.42 C ATOM 1920 O LEU A 125 12.129 9.237 -21.311 1.00 43.13 O ATOM 1921 CB LEU A 125 9.579 11.003 -20.364 1.00 11.12 C ATOM 1922 CG LEU A 125 9.101 10.005 -19.308 1.00 42.15 C ATOM 1923 CD1 LEU A 125 8.135 10.672 -18.342 1.00 30.02 C ATOM 1924 CD2 LEU A 125 8.449 8.800 -19.971 1.00 22.04 C ATOM 0 H LEU A 125 10.581 13.192 -20.952 1.00 53.41 H new ATOM 0 HA LEU A 125 11.546 10.928 -19.500 1.00 33.44 H new ATOM 0 HB2 LEU A 125 9.103 11.964 -20.169 1.00 11.12 H new ATOM 0 HB3 LEU A 125 9.228 10.666 -21.339 1.00 11.12 H new ATOM 0 HG LEU A 125 9.967 9.660 -18.743 1.00 42.15 H new ATOM 0 HD11 LEU A 125 7.806 9.947 -17.598 1.00 30.02 H new ATOM 0 HD12 LEU A 125 8.635 11.502 -17.843 1.00 30.02 H new ATOM 0 HD13 LEU A 125 7.271 11.046 -18.891 1.00 30.02 H new ATOM 0 HD21 LEU A 125 8.115 8.100 -19.205 1.00 22.04 H new ATOM 0 HD22 LEU A 125 7.593 9.128 -20.561 1.00 22.04 H new ATOM 0 HD23 LEU A 125 9.171 8.308 -20.622 1.00 22.04 H new ATOM 1936 N ASP A 126 11.681 10.887 -22.774 1.00 1.04 N ATOM 1937 CA ASP A 126 12.220 10.166 -23.921 1.00 21.22 C ATOM 1938 C ASP A 126 13.680 9.788 -23.688 1.00 74.31 C ATOM 1939 O ASP A 126 14.097 8.669 -23.987 1.00 63.03 O ATOM 1940 CB ASP A 126 12.096 11.014 -25.188 1.00 33.34 C ATOM 1941 CG ASP A 126 11.123 10.421 -26.188 1.00 14.13 C ATOM 1942 OD1 ASP A 126 10.066 9.912 -25.758 1.00 10.10 O ATOM 1943 OD2 ASP A 126 11.417 10.467 -27.400 1.00 62.12 O ATOM 0 H ASP A 126 11.313 11.813 -22.993 1.00 1.04 H new ATOM 0 HA ASP A 126 11.642 9.251 -24.048 1.00 21.22 H new ATOM 0 HB2 ASP A 126 11.769 12.018 -24.919 1.00 33.34 H new ATOM 0 HB3 ASP A 126 13.077 11.112 -25.654 1.00 33.34 H new ATOM 1948 N VAL A 127 14.451 10.729 -23.153 1.00 64.43 N ATOM 1949 CA VAL A 127 15.864 10.495 -22.880 1.00 64.54 C ATOM 1950 C VAL A 127 16.048 9.408 -21.827 1.00 30.02 C ATOM 1951 O VAL A 127 16.669 8.377 -22.086 1.00 73.41 O ATOM 1952 CB VAL A 127 16.564 11.781 -22.403 1.00 24.31 C ATOM 1953 CG1 VAL A 127 18.014 11.497 -22.040 1.00 31.42 C ATOM 1954 CG2 VAL A 127 16.475 12.862 -23.469 1.00 3.42 C ATOM 0 H VAL A 127 14.121 11.660 -22.900 1.00 64.43 H new ATOM 0 HA VAL A 127 16.317 10.170 -23.816 1.00 64.54 H new ATOM 0 HB VAL A 127 16.055 12.141 -21.509 1.00 24.31 H new ATOM 0 HG11 VAL A 127 18.492 12.417 -21.705 1.00 31.42 H new ATOM 0 HG12 VAL A 127 18.051 10.757 -21.240 1.00 31.42 H new ATOM 0 HG13 VAL A 127 18.539 11.112 -22.914 1.00 31.42 H new ATOM 0 HG21 VAL A 127 16.975 13.764 -23.115 1.00 3.42 H new ATOM 0 HG22 VAL A 127 16.958 12.514 -24.382 1.00 3.42 H new ATOM 0 HG23 VAL A 127 15.428 13.084 -23.675 1.00 3.42 H new ATOM 1964 N ILE A 128 15.504 9.646 -20.638 1.00 52.13 N ATOM 1965 CA ILE A 128 15.606 8.687 -19.546 1.00 23.33 C ATOM 1966 C ILE A 128 15.068 7.322 -19.961 1.00 23.44 C ATOM 1967 O ILE A 128 15.447 6.296 -19.395 1.00 33.31 O ATOM 1968 CB ILE A 128 14.842 9.170 -18.299 1.00 22.22 C ATOM 1969 CG1 ILE A 128 14.971 8.148 -17.167 1.00 75.35 C ATOM 1970 CG2 ILE A 128 13.379 9.414 -18.636 1.00 11.01 C ATOM 1971 CD1 ILE A 128 14.897 8.762 -15.787 1.00 62.11 C ATOM 0 H ILE A 128 14.988 10.495 -20.407 1.00 52.13 H new ATOM 0 HA ILE A 128 16.665 8.599 -19.302 1.00 23.33 H new ATOM 0 HB ILE A 128 15.279 10.111 -17.965 1.00 22.22 H new ATOM 0 HG12 ILE A 128 14.180 7.405 -17.268 1.00 75.35 H new ATOM 0 HG13 ILE A 128 15.919 7.621 -17.271 1.00 75.35 H new ATOM 0 HG21 ILE A 128 12.852 9.755 -17.745 1.00 11.01 H new ATOM 0 HG22 ILE A 128 13.307 10.175 -19.413 1.00 11.01 H new ATOM 0 HG23 ILE A 128 12.928 8.488 -18.992 1.00 11.01 H new ATOM 0 HD11 ILE A 128 14.996 7.979 -15.035 1.00 62.11 H new ATOM 0 HD12 ILE A 128 15.704 9.485 -15.667 1.00 62.11 H new ATOM 0 HD13 ILE A 128 13.938 9.265 -15.664 1.00 62.11 H new ATOM 1983 N ASP A 129 14.185 7.317 -20.953 1.00 20.32 N ATOM 1984 CA ASP A 129 13.597 6.077 -21.447 1.00 15.15 C ATOM 1985 C ASP A 129 14.681 5.087 -21.859 1.00 43.11 C ATOM 1986 O ASP A 129 14.611 3.903 -21.530 1.00 41.24 O ATOM 1987 CB ASP A 129 12.672 6.363 -22.631 1.00 61.31 C ATOM 1988 CG ASP A 129 11.301 5.738 -22.460 1.00 4.14 C ATOM 1989 OD1 ASP A 129 11.222 4.626 -21.896 1.00 70.05 O ATOM 1990 OD2 ASP A 129 10.308 6.362 -22.888 1.00 30.34 O ATOM 0 H ASP A 129 13.860 8.157 -21.431 1.00 20.32 H new ATOM 0 HA ASP A 129 13.014 5.633 -20.640 1.00 15.15 H new ATOM 0 HB2 ASP A 129 12.564 7.441 -22.752 1.00 61.31 H new ATOM 0 HB3 ASP A 129 13.129 5.984 -23.545 1.00 61.31 H new ATOM 1995 N GLN A 130 15.682 5.581 -22.581 1.00 60.53 N ATOM 1996 CA GLN A 130 16.780 4.738 -23.040 1.00 42.20 C ATOM 1997 C GLN A 130 17.485 4.074 -21.862 1.00 65.12 C ATOM 1998 O GLN A 130 18.083 3.008 -22.005 1.00 61.31 O ATOM 1999 CB GLN A 130 17.781 5.565 -23.849 1.00 24.30 C ATOM 2000 CG GLN A 130 17.368 5.774 -25.297 1.00 24.30 C ATOM 2001 CD GLN A 130 17.498 7.218 -25.738 1.00 41.31 C ATOM 2002 OE1 GLN A 130 18.272 7.987 -25.167 1.00 65.31 O ATOM 2003 NE2 GLN A 130 16.739 7.596 -26.760 1.00 34.01 N ATOM 0 H GLN A 130 15.755 6.559 -22.860 1.00 60.53 H new ATOM 0 HA GLN A 130 16.365 3.958 -23.678 1.00 42.20 H new ATOM 0 HB2 GLN A 130 17.906 6.537 -23.372 1.00 24.30 H new ATOM 0 HB3 GLN A 130 18.752 5.070 -23.825 1.00 24.30 H new ATOM 0 HG2 GLN A 130 17.983 5.145 -25.941 1.00 24.30 H new ATOM 0 HG3 GLN A 130 16.335 5.450 -25.427 1.00 24.30 H new ATOM 0 HE21 GLN A 130 16.111 6.926 -27.204 1.00 34.01 H new ATOM 0 HE22 GLN A 130 16.784 8.556 -27.101 1.00 34.01 H new ATOM 2012 N ALA A 131 17.412 4.712 -20.699 1.00 32.24 N ATOM 2013 CA ALA A 131 18.042 4.182 -19.496 1.00 32.23 C ATOM 2014 C ALA A 131 17.285 2.967 -18.969 1.00 61.15 C ATOM 2015 O ALA A 131 17.890 1.967 -18.583 1.00 31.14 O ATOM 2016 CB ALA A 131 18.124 5.259 -18.425 1.00 2.34 C ATOM 0 H ALA A 131 16.923 5.597 -20.564 1.00 32.24 H new ATOM 0 HA ALA A 131 19.052 3.864 -19.755 1.00 32.23 H new ATOM 0 HB1 ALA A 131 18.597 4.849 -17.532 1.00 2.34 H new ATOM 0 HB2 ALA A 131 18.714 6.097 -18.796 1.00 2.34 H new ATOM 0 HB3 ALA A 131 17.120 5.604 -18.178 1.00 2.34 H new ATOM 2022 N ARG A 132 15.959 3.061 -18.957 1.00 45.02 N ATOM 2023 CA ARG A 132 15.121 1.970 -18.476 1.00 75.13 C ATOM 2024 C ARG A 132 15.414 0.682 -19.240 1.00 33.44 C ATOM 2025 O ARG A 132 15.651 -0.368 -18.640 1.00 3.21 O ATOM 2026 CB ARG A 132 13.642 2.334 -18.619 1.00 14.43 C ATOM 2027 CG ARG A 132 12.780 1.848 -17.465 1.00 25.52 C ATOM 2028 CD ARG A 132 11.702 0.887 -17.941 1.00 64.30 C ATOM 2029 NE ARG A 132 11.245 0.004 -16.871 1.00 72.35 N ATOM 2030 CZ ARG A 132 10.189 -0.795 -16.979 1.00 13.31 C ATOM 2031 NH1 ARG A 132 9.485 -0.821 -18.102 1.00 61.24 N ATOM 2032 NH2 ARG A 132 9.835 -1.569 -15.961 1.00 72.34 N ATOM 0 H ARG A 132 15.443 3.881 -19.275 1.00 45.02 H new ATOM 0 HA ARG A 132 15.349 1.808 -17.422 1.00 75.13 H new ATOM 0 HB2 ARG A 132 13.549 3.417 -18.699 1.00 14.43 H new ATOM 0 HB3 ARG A 132 13.261 1.912 -19.549 1.00 14.43 H new ATOM 0 HG2 ARG A 132 13.408 1.354 -16.723 1.00 25.52 H new ATOM 0 HG3 ARG A 132 12.316 2.702 -16.972 1.00 25.52 H new ATOM 0 HD2 ARG A 132 10.856 1.454 -18.329 1.00 64.30 H new ATOM 0 HD3 ARG A 132 12.089 0.288 -18.765 1.00 64.30 H new ATOM 0 HE ARG A 132 11.765 0.001 -15.993 1.00 72.35 H new ATOM 0 HH11 ARG A 132 9.754 -0.227 -18.886 1.00 61.24 H new ATOM 0 HH12 ARG A 132 8.675 -1.435 -18.182 1.00 61.24 H new ATOM 0 HH21 ARG A 132 10.374 -1.551 -15.095 1.00 72.34 H new ATOM 0 HH22 ARG A 132 9.024 -2.182 -16.044 1.00 72.34 H new ATOM 2046 N LEU A 133 15.395 0.768 -20.565 1.00 52.21 N ATOM 2047 CA LEU A 133 15.658 -0.390 -21.411 1.00 62.54 C ATOM 2048 C LEU A 133 17.120 -0.815 -21.313 1.00 72.45 C ATOM 2049 O LEU A 133 17.441 -2.001 -21.403 1.00 13.32 O ATOM 2050 CB LEU A 133 15.303 -0.076 -22.866 1.00 11.14 C ATOM 2051 CG LEU A 133 15.796 -1.079 -23.909 1.00 74.20 C ATOM 2052 CD1 LEU A 133 14.771 -1.240 -25.021 1.00 53.40 C ATOM 2053 CD2 LEU A 133 17.138 -0.642 -24.477 1.00 52.13 C ATOM 0 H LEU A 133 15.200 1.628 -21.077 1.00 52.21 H new ATOM 0 HA LEU A 133 15.035 -1.213 -21.061 1.00 62.54 H new ATOM 0 HB2 LEU A 133 14.218 -0.002 -22.946 1.00 11.14 H new ATOM 0 HB3 LEU A 133 15.709 0.905 -23.114 1.00 11.14 H new ATOM 0 HG LEU A 133 15.928 -2.045 -23.422 1.00 74.20 H new ATOM 0 HD11 LEU A 133 15.139 -1.958 -25.754 1.00 53.40 H new ATOM 0 HD12 LEU A 133 13.832 -1.600 -24.601 1.00 53.40 H new ATOM 0 HD13 LEU A 133 14.606 -0.278 -25.506 1.00 53.40 H new ATOM 0 HD21 LEU A 133 17.473 -1.368 -25.218 1.00 52.13 H new ATOM 0 HD22 LEU A 133 17.033 0.335 -24.948 1.00 52.13 H new ATOM 0 HD23 LEU A 133 17.871 -0.580 -23.672 1.00 52.13 H new ATOM 2065 N LYS A 134 18.003 0.160 -21.127 1.00 72.13 N ATOM 2066 CA LYS A 134 19.431 -0.112 -21.013 1.00 52.32 C ATOM 2067 C LYS A 134 19.707 -1.107 -19.891 1.00 5.44 C ATOM 2068 O LYS A 134 20.626 -1.920 -19.983 1.00 30.55 O ATOM 2069 CB LYS A 134 20.199 1.187 -20.759 1.00 2.12 C ATOM 2070 CG LYS A 134 21.665 0.971 -20.424 1.00 50.13 C ATOM 2071 CD LYS A 134 21.954 1.274 -18.964 1.00 2.03 C ATOM 2072 CE LYS A 134 23.363 0.852 -18.575 1.00 72.22 C ATOM 2073 NZ LYS A 134 24.398 1.670 -19.266 1.00 15.32 N ATOM 0 H LYS A 134 17.755 1.146 -21.052 1.00 72.13 H new ATOM 0 HA LYS A 134 19.769 -0.549 -21.953 1.00 52.32 H new ATOM 0 HB2 LYS A 134 20.126 1.821 -21.643 1.00 2.12 H new ATOM 0 HB3 LYS A 134 19.723 1.726 -19.940 1.00 2.12 H new ATOM 0 HG2 LYS A 134 21.941 -0.060 -20.644 1.00 50.13 H new ATOM 0 HG3 LYS A 134 22.282 1.608 -21.058 1.00 50.13 H new ATOM 0 HD2 LYS A 134 21.829 2.341 -18.781 1.00 2.03 H new ATOM 0 HD3 LYS A 134 21.231 0.756 -18.334 1.00 2.03 H new ATOM 0 HE2 LYS A 134 23.486 0.947 -17.496 1.00 72.22 H new ATOM 0 HE3 LYS A 134 23.508 -0.200 -18.821 1.00 72.22 H new ATOM 0 HZ1 LYS A 134 25.344 1.363 -18.961 1.00 15.32 H new ATOM 0 HZ2 LYS A 134 24.308 1.546 -20.295 1.00 15.32 H new ATOM 0 HZ3 LYS A 134 24.266 2.673 -19.025 1.00 15.32 H new ATOM 2087 N MET A 135 18.906 -1.036 -18.833 1.00 22.13 N ATOM 2088 CA MET A 135 19.064 -1.933 -17.694 1.00 30.12 C ATOM 2089 C MET A 135 18.380 -3.271 -17.956 1.00 53.15 C ATOM 2090 O MET A 135 18.965 -4.332 -17.736 1.00 10.52 O ATOM 2091 CB MET A 135 18.489 -1.292 -16.429 1.00 72.42 C ATOM 2092 CG MET A 135 18.828 -2.050 -15.156 1.00 34.41 C ATOM 2093 SD MET A 135 19.803 -1.067 -14.001 1.00 33.30 S ATOM 2094 CE MET A 135 18.704 -1.017 -12.588 1.00 14.44 C ATOM 0 H MET A 135 18.141 -0.367 -18.741 1.00 22.13 H new ATOM 0 HA MET A 135 20.129 -2.112 -17.550 1.00 30.12 H new ATOM 0 HB2 MET A 135 18.864 -0.272 -16.346 1.00 72.42 H new ATOM 0 HB3 MET A 135 17.405 -1.226 -16.525 1.00 72.42 H new ATOM 0 HG2 MET A 135 17.905 -2.366 -14.669 1.00 34.41 H new ATOM 0 HG3 MET A 135 19.379 -2.955 -15.412 1.00 34.41 H new ATOM 0 HE1 MET A 135 19.168 -0.442 -11.787 1.00 14.44 H new ATOM 0 HE2 MET A 135 17.764 -0.547 -12.875 1.00 14.44 H new ATOM 0 HE3 MET A 135 18.511 -2.032 -12.241 1.00 14.44 H new ATOM 2104 N ILE A 136 17.139 -3.213 -18.428 1.00 71.10 N ATOM 2105 CA ILE A 136 16.377 -4.420 -18.721 1.00 34.50 C ATOM 2106 C ILE A 136 17.148 -5.343 -19.658 1.00 74.55 C ATOM 2107 O ILE A 136 17.410 -6.500 -19.330 1.00 25.23 O ATOM 2108 CB ILE A 136 15.013 -4.086 -19.355 1.00 5.31 C ATOM 2109 CG1 ILE A 136 14.200 -3.185 -18.423 1.00 22.44 C ATOM 2110 CG2 ILE A 136 14.247 -5.362 -19.669 1.00 25.13 C ATOM 2111 CD1 ILE A 136 13.062 -2.470 -19.115 1.00 54.11 C ATOM 0 H ILE A 136 16.640 -2.343 -18.615 1.00 71.10 H new ATOM 0 HA ILE A 136 16.212 -4.927 -17.770 1.00 34.50 H new ATOM 0 HB ILE A 136 15.185 -3.551 -20.289 1.00 5.31 H new ATOM 0 HG12 ILE A 136 13.798 -3.787 -17.608 1.00 22.44 H new ATOM 0 HG13 ILE A 136 14.864 -2.446 -17.975 1.00 22.44 H new ATOM 0 HG21 ILE A 136 13.286 -5.109 -20.116 1.00 25.13 H new ATOM 0 HG22 ILE A 136 14.823 -5.970 -20.367 1.00 25.13 H new ATOM 0 HG23 ILE A 136 14.082 -5.923 -18.749 1.00 25.13 H new ATOM 0 HD11 ILE A 136 12.530 -1.850 -18.394 1.00 54.11 H new ATOM 0 HD12 ILE A 136 13.459 -1.841 -19.912 1.00 54.11 H new ATOM 0 HD13 ILE A 136 12.376 -3.203 -19.539 1.00 54.11 H new ATOM 2123 N SER A 137 17.509 -4.823 -20.827 1.00 60.31 N ATOM 2124 CA SER A 137 18.249 -5.601 -21.814 1.00 31.21 C ATOM 2125 C SER A 137 19.741 -5.604 -21.496 1.00 30.13 C ATOM 2126 O SER A 137 20.556 -5.131 -22.288 1.00 15.04 O ATOM 2127 CB SER A 137 18.016 -5.038 -23.217 1.00 42.22 C ATOM 2128 OG SER A 137 16.658 -5.170 -23.601 1.00 4.51 O ATOM 0 H SER A 137 17.301 -3.866 -21.114 1.00 60.31 H new ATOM 0 HA SER A 137 17.886 -6.628 -21.777 1.00 31.21 H new ATOM 0 HB2 SER A 137 18.304 -3.987 -23.243 1.00 42.22 H new ATOM 0 HB3 SER A 137 18.652 -5.560 -23.932 1.00 42.22 H new ATOM 0 HG SER A 137 16.535 -4.801 -24.501 1.00 4.51 H new ATOM 2272 N GLU A 162 4.189 10.151 -31.517 1.00 42.11 N ATOM 2273 CA GLU A 162 2.888 10.716 -31.180 1.00 11.13 C ATOM 2274 C GLU A 162 3.007 12.203 -30.859 1.00 2.23 C ATOM 2275 O GLU A 162 2.359 13.040 -31.489 1.00 30.12 O ATOM 2276 CB GLU A 162 2.278 9.973 -29.989 1.00 51.50 C ATOM 2277 CG GLU A 162 0.886 10.457 -29.619 1.00 32.24 C ATOM 2278 CD GLU A 162 0.877 11.298 -28.357 1.00 51.31 C ATOM 2279 OE1 GLU A 162 1.940 11.851 -28.004 1.00 55.04 O ATOM 2280 OE2 GLU A 162 -0.194 11.404 -27.723 1.00 22.12 O ATOM 0 HA GLU A 162 2.235 10.600 -32.045 1.00 11.13 H new ATOM 0 HB2 GLU A 162 2.234 8.908 -30.219 1.00 51.50 H new ATOM 0 HB3 GLU A 162 2.934 10.086 -29.126 1.00 51.50 H new ATOM 0 HG2 GLU A 162 0.478 11.041 -30.443 1.00 32.24 H new ATOM 0 HG3 GLU A 162 0.231 9.597 -29.483 1.00 32.24 H new ATOM 2287 N LEU A 163 3.839 12.525 -29.875 1.00 23.15 N ATOM 2288 CA LEU A 163 4.044 13.911 -29.468 1.00 62.12 C ATOM 2289 C LEU A 163 4.712 14.712 -30.582 1.00 32.24 C ATOM 2290 O LEU A 163 4.504 15.919 -30.701 1.00 42.35 O ATOM 2291 CB LEU A 163 4.897 13.970 -28.200 1.00 2.42 C ATOM 2292 CG LEU A 163 4.509 15.041 -27.179 1.00 51.05 C ATOM 2293 CD1 LEU A 163 4.646 14.504 -25.763 1.00 71.44 C ATOM 2294 CD2 LEU A 163 5.362 16.288 -27.364 1.00 20.44 C ATOM 0 H LEU A 163 4.383 11.845 -29.344 1.00 23.15 H new ATOM 0 HA LEU A 163 3.069 14.352 -29.263 1.00 62.12 H new ATOM 0 HB2 LEU A 163 4.853 12.997 -27.711 1.00 2.42 H new ATOM 0 HB3 LEU A 163 5.935 14.133 -28.491 1.00 2.42 H new ATOM 0 HG LEU A 163 3.466 15.311 -27.343 1.00 51.05 H new ATOM 0 HD11 LEU A 163 4.366 15.280 -25.051 1.00 71.44 H new ATOM 0 HD12 LEU A 163 3.992 13.642 -25.636 1.00 71.44 H new ATOM 0 HD13 LEU A 163 5.679 14.205 -25.586 1.00 71.44 H new ATOM 0 HD21 LEU A 163 5.072 17.039 -26.629 1.00 20.44 H new ATOM 0 HD22 LEU A 163 6.413 16.033 -27.228 1.00 20.44 H new ATOM 0 HD23 LEU A 163 5.212 16.686 -28.368 1.00 20.44 H new ATOM 2306 N ASP A 164 5.512 14.031 -31.395 1.00 12.13 N ATOM 2307 CA ASP A 164 6.207 14.678 -32.501 1.00 45.21 C ATOM 2308 C ASP A 164 5.215 15.211 -33.530 1.00 30.12 C ATOM 2309 O ASP A 164 5.337 16.344 -33.996 1.00 61.20 O ATOM 2310 CB ASP A 164 7.174 13.698 -33.167 1.00 23.21 C ATOM 2311 CG ASP A 164 8.495 13.596 -32.429 1.00 40.24 C ATOM 2312 OD1 ASP A 164 8.804 14.511 -31.637 1.00 23.31 O ATOM 2313 OD2 ASP A 164 9.219 12.602 -32.644 1.00 71.21 O ATOM 0 H ASP A 164 5.695 13.031 -31.309 1.00 12.13 H new ATOM 0 HA ASP A 164 6.773 15.519 -32.099 1.00 45.21 H new ATOM 0 HB2 ASP A 164 6.711 12.712 -33.216 1.00 23.21 H new ATOM 0 HB3 ASP A 164 7.358 14.015 -34.194 1.00 23.21 H new ATOM 2318 N ARG A 165 4.234 14.386 -33.880 1.00 54.01 N ATOM 2319 CA ARG A 165 3.222 14.773 -34.855 1.00 55.34 C ATOM 2320 C ARG A 165 2.458 16.008 -34.385 1.00 72.13 C ATOM 2321 O ARG A 165 2.311 16.980 -35.127 1.00 40.23 O ATOM 2322 CB ARG A 165 2.247 13.619 -35.097 1.00 21.13 C ATOM 2323 CG ARG A 165 1.108 13.970 -36.040 1.00 2.41 C ATOM 2324 CD ARG A 165 0.534 12.730 -36.706 1.00 72.01 C ATOM 2325 NE ARG A 165 -0.926 12.761 -36.755 1.00 25.35 N ATOM 2326 CZ ARG A 165 -1.617 13.478 -37.634 1.00 22.25 C ATOM 2327 NH1 ARG A 165 -0.985 14.219 -38.533 1.00 5.12 N ATOM 2328 NH2 ARG A 165 -2.943 13.454 -37.614 1.00 73.14 N ATOM 0 H ARG A 165 4.119 13.445 -33.503 1.00 54.01 H new ATOM 0 HA ARG A 165 3.728 15.014 -35.790 1.00 55.34 H new ATOM 0 HB2 ARG A 165 2.796 12.770 -35.505 1.00 21.13 H new ATOM 0 HB3 ARG A 165 1.831 13.300 -34.141 1.00 21.13 H new ATOM 0 HG2 ARG A 165 0.322 14.484 -35.487 1.00 2.41 H new ATOM 0 HG3 ARG A 165 1.466 14.661 -36.803 1.00 2.41 H new ATOM 0 HD2 ARG A 165 0.929 12.647 -37.718 1.00 72.01 H new ATOM 0 HD3 ARG A 165 0.860 11.843 -36.163 1.00 72.01 H new ATOM 0 HE ARG A 165 -1.443 12.201 -36.077 1.00 25.35 H new ATOM 0 HH11 ARG A 165 0.035 14.240 -38.551 1.00 5.12 H new ATOM 0 HH12 ARG A 165 -1.518 14.769 -39.207 1.00 5.12 H new ATOM 0 HH21 ARG A 165 -3.432 12.885 -36.923 1.00 73.14 H new ATOM 0 HH22 ARG A 165 -3.473 14.005 -38.289 1.00 73.14 H new ATOM 2342 N LEU A 166 1.973 15.962 -33.149 1.00 41.14 N ATOM 2343 CA LEU A 166 1.224 17.077 -32.580 1.00 34.43 C ATOM 2344 C LEU A 166 1.996 18.384 -32.726 1.00 24.43 C ATOM 2345 O LEU A 166 1.448 19.396 -33.164 1.00 62.21 O ATOM 2346 CB LEU A 166 0.921 16.812 -31.104 1.00 31.11 C ATOM 2347 CG LEU A 166 -0.393 16.088 -30.808 1.00 12.45 C ATOM 2348 CD1 LEU A 166 -0.459 15.679 -29.344 1.00 63.44 C ATOM 2349 CD2 LEU A 166 -1.580 16.969 -31.170 1.00 73.44 C ATOM 0 H LEU A 166 2.085 15.165 -32.522 1.00 41.14 H new ATOM 0 HA LEU A 166 0.286 17.169 -33.127 1.00 34.43 H new ATOM 0 HB2 LEU A 166 1.738 16.225 -30.686 1.00 31.11 H new ATOM 0 HB3 LEU A 166 0.913 17.767 -30.578 1.00 31.11 H new ATOM 0 HG LEU A 166 -0.434 15.186 -31.419 1.00 12.45 H new ATOM 0 HD11 LEU A 166 -1.401 15.165 -29.152 1.00 63.44 H new ATOM 0 HD12 LEU A 166 0.372 15.012 -29.115 1.00 63.44 H new ATOM 0 HD13 LEU A 166 -0.395 16.567 -28.715 1.00 63.44 H new ATOM 0 HD21 LEU A 166 -2.507 16.438 -30.953 1.00 73.44 H new ATOM 0 HD22 LEU A 166 -1.543 17.888 -30.585 1.00 73.44 H new ATOM 0 HD23 LEU A 166 -1.542 17.213 -32.232 1.00 73.44 H new ATOM 2361 N LEU A 167 3.272 18.354 -32.358 1.00 4.54 N ATOM 2362 CA LEU A 167 4.122 19.537 -32.450 1.00 24.44 C ATOM 2363 C LEU A 167 4.154 20.075 -33.876 1.00 52.14 C ATOM 2364 O LEU A 167 4.097 21.286 -34.096 1.00 22.21 O ATOM 2365 CB LEU A 167 5.542 19.206 -31.986 1.00 30.51 C ATOM 2366 CG LEU A 167 6.550 20.354 -32.037 1.00 51.32 C ATOM 2367 CD1 LEU A 167 6.446 21.212 -30.785 1.00 63.53 C ATOM 2368 CD2 LEU A 167 7.964 19.816 -32.202 1.00 12.31 C ATOM 0 H LEU A 167 3.741 17.525 -31.993 1.00 4.54 H new ATOM 0 HA LEU A 167 3.704 20.306 -31.801 1.00 24.44 H new ATOM 0 HB2 LEU A 167 5.491 18.839 -30.961 1.00 30.51 H new ATOM 0 HB3 LEU A 167 5.922 18.388 -32.599 1.00 30.51 H new ATOM 0 HG LEU A 167 6.318 20.978 -32.900 1.00 51.32 H new ATOM 0 HD11 LEU A 167 7.171 22.024 -30.839 1.00 63.53 H new ATOM 0 HD12 LEU A 167 5.441 21.627 -30.711 1.00 63.53 H new ATOM 0 HD13 LEU A 167 6.651 20.600 -29.907 1.00 63.53 H new ATOM 0 HD21 LEU A 167 8.668 20.647 -32.236 1.00 12.31 H new ATOM 0 HD22 LEU A 167 8.208 19.169 -31.359 1.00 12.31 H new ATOM 0 HD23 LEU A 167 8.031 19.246 -33.129 1.00 12.31 H new ATOM 2380 N LEU A 168 4.242 19.169 -34.843 1.00 61.53 N ATOM 2381 CA LEU A 168 4.279 19.552 -36.250 1.00 75.14 C ATOM 2382 C LEU A 168 3.119 20.482 -36.592 1.00 35.33 C ATOM 2383 O LEU A 168 3.306 21.511 -37.240 1.00 30.41 O ATOM 2384 CB LEU A 168 4.229 18.308 -37.140 1.00 13.24 C ATOM 2385 CG LEU A 168 4.614 18.515 -38.605 1.00 24.32 C ATOM 2386 CD1 LEU A 168 5.141 17.221 -39.206 1.00 23.24 C ATOM 2387 CD2 LEU A 168 3.425 19.030 -39.402 1.00 32.50 C ATOM 0 H LEU A 168 4.289 18.163 -34.679 1.00 61.53 H new ATOM 0 HA LEU A 168 5.213 20.084 -36.431 1.00 75.14 H new ATOM 0 HB2 LEU A 168 4.891 17.554 -36.714 1.00 13.24 H new ATOM 0 HB3 LEU A 168 3.218 17.901 -37.105 1.00 13.24 H new ATOM 0 HG LEU A 168 5.406 19.262 -38.650 1.00 24.32 H new ATOM 0 HD11 LEU A 168 5.410 17.387 -40.249 1.00 23.24 H new ATOM 0 HD12 LEU A 168 6.021 16.894 -38.652 1.00 23.24 H new ATOM 0 HD13 LEU A 168 4.370 16.453 -39.148 1.00 23.24 H new ATOM 0 HD21 LEU A 168 3.718 19.171 -40.442 1.00 32.50 H new ATOM 0 HD22 LEU A 168 2.611 18.307 -39.349 1.00 32.50 H new ATOM 0 HD23 LEU A 168 3.093 19.981 -38.986 1.00 32.50 H new ATOM 2399 N GLU A 169 1.921 20.113 -36.149 1.00 33.54 N ATOM 2400 CA GLU A 169 0.731 20.915 -36.406 1.00 51.15 C ATOM 2401 C GLU A 169 0.879 22.314 -35.814 1.00 63.25 C ATOM 2402 O GLU A 169 0.488 23.306 -36.431 1.00 23.01 O ATOM 2403 CB GLU A 169 -0.508 20.232 -35.824 1.00 73.14 C ATOM 2404 CG GLU A 169 -1.783 21.043 -35.986 1.00 60.12 C ATOM 2405 CD GLU A 169 -3.031 20.183 -35.937 1.00 53.55 C ATOM 2406 OE1 GLU A 169 -3.056 19.133 -36.612 1.00 51.34 O ATOM 2407 OE2 GLU A 169 -3.984 20.562 -35.223 1.00 63.25 O ATOM 0 H GLU A 169 1.749 19.264 -35.611 1.00 33.54 H new ATOM 0 HA GLU A 169 0.613 21.006 -37.486 1.00 51.15 H new ATOM 0 HB2 GLU A 169 -0.639 19.264 -36.307 1.00 73.14 H new ATOM 0 HB3 GLU A 169 -0.342 20.039 -34.764 1.00 73.14 H new ATOM 0 HG2 GLU A 169 -1.833 21.795 -35.199 1.00 60.12 H new ATOM 0 HG3 GLU A 169 -1.751 21.577 -36.936 1.00 60.12 H new ATOM 2414 N LEU A 170 1.446 22.385 -34.615 1.00 71.11 N ATOM 2415 CA LEU A 170 1.646 23.661 -33.938 1.00 2.40 C ATOM 2416 C LEU A 170 2.363 24.654 -34.848 1.00 13.00 C ATOM 2417 O LEU A 170 1.978 25.819 -34.937 1.00 74.11 O ATOM 2418 CB LEU A 170 2.450 23.459 -32.652 1.00 70.34 C ATOM 2419 CG LEU A 170 1.720 23.779 -31.347 1.00 65.32 C ATOM 2420 CD1 LEU A 170 1.056 22.531 -30.787 1.00 72.23 C ATOM 2421 CD2 LEU A 170 2.683 24.374 -30.330 1.00 43.33 C ATOM 0 H LEU A 170 1.775 21.574 -34.092 1.00 71.11 H new ATOM 0 HA LEU A 170 0.666 24.068 -33.687 1.00 2.40 H new ATOM 0 HB2 LEU A 170 2.782 22.422 -32.614 1.00 70.34 H new ATOM 0 HB3 LEU A 170 3.345 24.079 -32.706 1.00 70.34 H new ATOM 0 HG LEU A 170 0.944 24.515 -31.558 1.00 65.32 H new ATOM 0 HD11 LEU A 170 0.541 22.778 -29.858 1.00 72.23 H new ATOM 0 HD12 LEU A 170 0.336 22.147 -31.510 1.00 72.23 H new ATOM 0 HD13 LEU A 170 1.814 21.772 -30.591 1.00 72.23 H new ATOM 0 HD21 LEU A 170 2.147 24.596 -29.407 1.00 43.33 H new ATOM 0 HD22 LEU A 170 3.481 23.660 -30.123 1.00 43.33 H new ATOM 0 HD23 LEU A 170 3.112 25.293 -30.730 1.00 43.33 H new