USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1011 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 87 MET CE :methyl 178:sc= -1.56 (180deg=-1.7) USER MOD Set 1.2: A 91 GLN :FLIP amide:sc= -0.0173 F(o=-2.2,f=-1.6) USER MOD Single : A 11 TYR OH : rot 120:sc= 1.35 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 MET CE :methyl 158:sc= -0.344 (180deg=-1.18) USER MOD Single : A 25 LYS NZ :NH3+ 138:sc= -0.248 (180deg=-2.74!) USER MOD Single : A 26 ASN : amide:sc= -0.471 X(o=-0.47,f=0) USER MOD Single : A 29 SER OG : rot -44:sc= 1.13 USER MOD Single : A 30 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.57) USER MOD Single : A 36 TYR OH : rot -1:sc= 0.391 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN :FLIP amide:sc= -1.53! F(o=-2.1,f=-1.5!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.209 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -77:sc= 1.08 USER MOD Single : A 60 SER OG : rot -47:sc= 0.0426 USER MOD Single : A 63 SER OG : rot 180:sc= 0.00323 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -170:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0448 USER MOD Single : A 72 THR OG1 : rot 93:sc= 1.27 USER MOD Single : A 73 GLN : amide:sc= -2.52 K(o=-2.5,f=-9.6!) USER MOD Single : A 74 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0296) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.557 X(o=-0.56,f=-0.21) USER MOD Single : A 86 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00563) USER MOD Single : A 92 GLN : amide:sc=-0.00742 X(o=-0.0074,f=0) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0348 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 146:sc= 0.576 USER MOD Single : A 103 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.734) USER MOD Single : A 105 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.25) USER MOD Single : A 106 MET CE :methyl -155:sc= -1.03 (180deg=-1.74) USER MOD Single : A 108 THR OG1 : rot 67:sc= 0.765 USER MOD Single : A 110 SER OG : rot -60:sc= 0.917 USER MOD Single : A 111 HIS : no HD1:sc= -0.295 K(o=-0.3,f=-1.6) USER MOD Single : A 112 THR OG1 : rot -150:sc= -0.726 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -1.09 X(o=-1.1,f=-1.5) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.627 -8.969 -10.325 1.00 32.22 N ATOM 107 CA ASP A 8 17.545 -10.280 -9.691 1.00 14.13 C ATOM 108 C ASP A 8 16.717 -11.242 -10.537 1.00 13.01 C ATOM 109 O ASP A 8 15.533 -11.456 -10.274 1.00 15.33 O ATOM 110 CB ASP A 8 16.936 -10.157 -8.293 1.00 55.42 C ATOM 111 CG ASP A 8 16.940 -11.473 -7.542 1.00 31.25 C ATOM 112 OD1 ASP A 8 16.020 -12.288 -7.765 1.00 52.34 O ATOM 113 OD2 ASP A 8 17.864 -11.689 -6.730 1.00 72.50 O ATOM 0 HA ASP A 8 18.556 -10.678 -9.605 1.00 14.13 H new ATOM 0 HB2 ASP A 8 17.493 -9.414 -7.722 1.00 55.42 H new ATOM 0 HB3 ASP A 8 15.912 -9.793 -8.377 1.00 55.42 H new ATOM 118 N LEU A 9 17.347 -11.819 -11.554 1.00 74.02 N ATOM 119 CA LEU A 9 16.668 -12.758 -12.441 1.00 22.24 C ATOM 120 C LEU A 9 16.928 -14.198 -12.010 1.00 33.23 C ATOM 121 O LEU A 9 16.856 -15.122 -12.820 1.00 33.42 O ATOM 122 CB LEU A 9 17.132 -12.554 -13.884 1.00 25.12 C ATOM 123 CG LEU A 9 18.574 -12.961 -14.189 1.00 24.40 C ATOM 124 CD1 LEU A 9 18.657 -13.663 -15.536 1.00 3.13 C ATOM 125 CD2 LEU A 9 19.489 -11.746 -14.162 1.00 1.44 C ATOM 0 H LEU A 9 18.327 -11.654 -11.785 1.00 74.02 H new ATOM 0 HA LEU A 9 15.597 -12.567 -12.380 1.00 22.24 H new ATOM 0 HB2 LEU A 9 16.470 -13.118 -14.541 1.00 25.12 H new ATOM 0 HB3 LEU A 9 17.011 -11.501 -14.138 1.00 25.12 H new ATOM 0 HG LEU A 9 18.905 -13.657 -13.418 1.00 24.40 H new ATOM 0 HD11 LEU A 9 19.691 -13.945 -15.736 1.00 3.13 H new ATOM 0 HD12 LEU A 9 18.033 -14.557 -15.519 1.00 3.13 H new ATOM 0 HD13 LEU A 9 18.306 -12.991 -16.319 1.00 3.13 H new ATOM 0 HD21 LEU A 9 20.511 -12.055 -14.381 1.00 1.44 H new ATOM 0 HD22 LEU A 9 19.159 -11.026 -14.911 1.00 1.44 H new ATOM 0 HD23 LEU A 9 19.453 -11.285 -13.175 1.00 1.44 H new ATOM 137 N VAL A 10 17.228 -14.382 -10.728 1.00 1.01 N ATOM 138 CA VAL A 10 17.495 -15.710 -10.188 1.00 11.20 C ATOM 139 C VAL A 10 16.224 -16.344 -9.634 1.00 53.44 C ATOM 140 O VAL A 10 16.144 -17.562 -9.474 1.00 52.24 O ATOM 141 CB VAL A 10 18.557 -15.660 -9.074 1.00 45.50 C ATOM 142 CG1 VAL A 10 18.890 -17.062 -8.590 1.00 22.54 C ATOM 143 CG2 VAL A 10 19.808 -14.945 -9.563 1.00 41.21 C ATOM 0 H VAL A 10 17.292 -13.628 -10.044 1.00 1.01 H new ATOM 0 HA VAL A 10 17.871 -16.316 -11.012 1.00 11.20 H new ATOM 0 HB VAL A 10 18.150 -15.099 -8.233 1.00 45.50 H new ATOM 0 HG11 VAL A 10 19.642 -17.006 -7.803 1.00 22.54 H new ATOM 0 HG12 VAL A 10 17.990 -17.535 -8.198 1.00 22.54 H new ATOM 0 HG13 VAL A 10 19.277 -17.651 -9.421 1.00 22.54 H new ATOM 0 HG21 VAL A 10 20.548 -14.919 -8.763 1.00 41.21 H new ATOM 0 HG22 VAL A 10 20.219 -15.477 -10.421 1.00 41.21 H new ATOM 0 HG23 VAL A 10 19.554 -13.926 -9.856 1.00 41.21 H new ATOM 153 N TYR A 11 15.232 -15.509 -9.344 1.00 75.52 N ATOM 154 CA TYR A 11 13.963 -15.988 -8.806 1.00 45.24 C ATOM 155 C TYR A 11 12.941 -16.190 -9.920 1.00 52.14 C ATOM 156 O TYR A 11 12.107 -17.095 -9.858 1.00 2.43 O ATOM 157 CB TYR A 11 13.419 -15.001 -7.772 1.00 43.22 C ATOM 158 CG TYR A 11 11.954 -14.677 -7.956 1.00 72.45 C ATOM 159 CD1 TYR A 11 11.549 -13.658 -8.810 1.00 4.02 C ATOM 160 CD2 TYR A 11 10.974 -15.390 -7.277 1.00 32.11 C ATOM 161 CE1 TYR A 11 10.212 -13.358 -8.981 1.00 33.22 C ATOM 162 CE2 TYR A 11 9.634 -15.098 -7.443 1.00 31.31 C ATOM 163 CZ TYR A 11 9.258 -14.082 -8.296 1.00 12.53 C ATOM 164 OH TYR A 11 7.924 -13.787 -8.463 1.00 0.13 O ATOM 0 H TYR A 11 15.282 -14.498 -9.472 1.00 75.52 H new ATOM 0 HA TYR A 11 14.141 -16.949 -8.323 1.00 45.24 H new ATOM 0 HB2 TYR A 11 13.569 -15.414 -6.774 1.00 43.22 H new ATOM 0 HB3 TYR A 11 13.996 -14.078 -7.825 1.00 43.22 H new ATOM 0 HD1 TYR A 11 12.293 -13.091 -9.349 1.00 4.02 H new ATOM 0 HD2 TYR A 11 11.265 -16.186 -6.608 1.00 32.11 H new ATOM 0 HE1 TYR A 11 9.915 -12.561 -9.647 1.00 33.22 H new ATOM 0 HE2 TYR A 11 8.885 -15.662 -6.908 1.00 31.31 H new ATOM 0 HH TYR A 11 7.455 -14.576 -8.806 1.00 0.13 H new ATOM 174 N LEU A 12 13.011 -15.341 -10.940 1.00 23.40 N ATOM 175 CA LEU A 12 12.093 -15.425 -12.070 1.00 72.52 C ATOM 176 C LEU A 12 12.089 -16.830 -12.665 1.00 50.25 C ATOM 177 O LEU A 12 11.086 -17.277 -13.219 1.00 74.11 O ATOM 178 CB LEU A 12 12.478 -14.406 -13.143 1.00 44.51 C ATOM 179 CG LEU A 12 11.946 -12.986 -12.942 1.00 74.44 C ATOM 180 CD1 LEU A 12 12.717 -12.000 -13.805 1.00 40.30 C ATOM 181 CD2 LEU A 12 10.458 -12.925 -13.259 1.00 64.30 C ATOM 0 H LEU A 12 13.694 -14.587 -11.007 1.00 23.40 H new ATOM 0 HA LEU A 12 11.090 -15.200 -11.708 1.00 72.52 H new ATOM 0 HB2 LEU A 12 13.566 -14.361 -13.199 1.00 44.51 H new ATOM 0 HB3 LEU A 12 12.124 -14.772 -14.107 1.00 44.51 H new ATOM 0 HG LEU A 12 12.087 -12.710 -11.897 1.00 74.44 H new ATOM 0 HD11 LEU A 12 12.324 -10.995 -13.649 1.00 40.30 H new ATOM 0 HD12 LEU A 12 13.772 -12.024 -13.531 1.00 40.30 H new ATOM 0 HD13 LEU A 12 12.608 -12.273 -14.855 1.00 40.30 H new ATOM 0 HD21 LEU A 12 10.096 -11.908 -13.111 1.00 64.30 H new ATOM 0 HD22 LEU A 12 10.294 -13.221 -14.295 1.00 64.30 H new ATOM 0 HD23 LEU A 12 9.917 -13.603 -12.598 1.00 64.30 H new ATOM 193 N ASN A 13 13.218 -17.521 -12.545 1.00 52.03 N ATOM 194 CA ASN A 13 13.344 -18.876 -13.070 1.00 41.21 C ATOM 195 C ASN A 13 13.098 -19.909 -11.974 1.00 43.35 C ATOM 196 O ASN A 13 12.241 -20.781 -12.110 1.00 34.31 O ATOM 197 CB ASN A 13 14.733 -19.082 -13.679 1.00 14.02 C ATOM 198 CG ASN A 13 15.054 -18.055 -14.748 1.00 35.32 C ATOM 199 OD1 ASN A 13 16.050 -17.338 -14.656 1.00 14.31 O ATOM 200 ND2 ASN A 13 14.208 -17.981 -15.769 1.00 41.02 N ATOM 0 H ASN A 13 14.058 -17.165 -12.089 1.00 52.03 H new ATOM 0 HA ASN A 13 12.591 -19.010 -13.846 1.00 41.21 H new ATOM 0 HB2 ASN A 13 15.484 -19.029 -12.891 1.00 14.02 H new ATOM 0 HB3 ASN A 13 14.793 -20.082 -14.110 1.00 14.02 H new ATOM 0 HD21 ASN A 13 14.371 -17.309 -16.519 1.00 41.02 H new ATOM 0 HD22 ASN A 13 13.395 -18.596 -15.803 1.00 41.02 H new ATOM 207 N VAL A 14 13.857 -19.803 -10.888 1.00 41.01 N ATOM 208 CA VAL A 14 13.721 -20.726 -9.768 1.00 21.22 C ATOM 209 C VAL A 14 12.267 -20.842 -9.324 1.00 40.33 C ATOM 210 O VAL A 14 11.836 -21.889 -8.843 1.00 11.12 O ATOM 211 CB VAL A 14 14.579 -20.283 -8.568 1.00 14.42 C ATOM 212 CG1 VAL A 14 14.137 -21.000 -7.301 1.00 70.24 C ATOM 213 CG2 VAL A 14 16.053 -20.533 -8.846 1.00 22.13 C ATOM 0 H VAL A 14 14.572 -19.087 -10.760 1.00 41.01 H new ATOM 0 HA VAL A 14 14.070 -21.698 -10.116 1.00 21.22 H new ATOM 0 HB VAL A 14 14.438 -19.213 -8.418 1.00 14.42 H new ATOM 0 HG11 VAL A 14 14.755 -20.674 -6.464 1.00 70.24 H new ATOM 0 HG12 VAL A 14 13.093 -20.764 -7.095 1.00 70.24 H new ATOM 0 HG13 VAL A 14 14.246 -22.076 -7.435 1.00 70.24 H new ATOM 0 HG21 VAL A 14 16.644 -20.214 -7.988 1.00 22.13 H new ATOM 0 HG22 VAL A 14 16.215 -21.596 -9.023 1.00 22.13 H new ATOM 0 HG23 VAL A 14 16.358 -19.968 -9.727 1.00 22.13 H new ATOM 223 N MET A 15 11.516 -19.758 -9.491 1.00 35.33 N ATOM 224 CA MET A 15 10.108 -19.739 -9.109 1.00 2.12 C ATOM 225 C MET A 15 9.319 -20.786 -9.888 1.00 21.42 C ATOM 226 O MET A 15 8.806 -21.745 -9.311 1.00 51.51 O ATOM 227 CB MET A 15 9.512 -18.351 -9.349 1.00 54.24 C ATOM 228 CG MET A 15 8.001 -18.303 -9.190 1.00 13.24 C ATOM 229 SD MET A 15 7.322 -16.660 -9.493 1.00 20.13 S ATOM 230 CE MET A 15 7.963 -16.326 -11.131 1.00 43.14 C ATOM 0 H MET A 15 11.858 -18.883 -9.888 1.00 35.33 H new ATOM 0 HA MET A 15 10.042 -19.976 -8.047 1.00 2.12 H new ATOM 0 HB2 MET A 15 9.965 -17.645 -8.653 1.00 54.24 H new ATOM 0 HB3 MET A 15 9.774 -18.021 -10.354 1.00 54.24 H new ATOM 0 HG2 MET A 15 7.544 -19.013 -9.879 1.00 13.24 H new ATOM 0 HG3 MET A 15 7.735 -18.621 -8.182 1.00 13.24 H new ATOM 0 HE1 MET A 15 7.348 -15.567 -11.615 1.00 43.14 H new ATOM 0 HE2 MET A 15 8.989 -15.966 -11.054 1.00 43.14 H new ATOM 0 HE3 MET A 15 7.943 -17.241 -11.723 1.00 43.14 H new ATOM 240 N GLU A 16 9.227 -20.596 -11.200 1.00 74.23 N ATOM 241 CA GLU A 16 8.499 -21.525 -12.057 1.00 35.14 C ATOM 242 C GLU A 16 8.964 -22.959 -11.823 1.00 62.41 C ATOM 243 O GLU A 16 8.189 -23.907 -11.964 1.00 4.40 O ATOM 244 CB GLU A 16 8.685 -21.150 -13.528 1.00 51.13 C ATOM 245 CG GLU A 16 7.721 -20.078 -14.010 1.00 24.30 C ATOM 246 CD GLU A 16 6.370 -20.643 -14.404 1.00 24.01 C ATOM 247 OE1 GLU A 16 5.783 -21.395 -13.598 1.00 41.23 O ATOM 248 OE2 GLU A 16 5.900 -20.332 -15.519 1.00 25.34 O ATOM 0 H GLU A 16 9.647 -19.808 -11.693 1.00 74.23 H new ATOM 0 HA GLU A 16 7.441 -21.459 -11.804 1.00 35.14 H new ATOM 0 HB2 GLU A 16 9.707 -20.802 -13.679 1.00 51.13 H new ATOM 0 HB3 GLU A 16 8.558 -22.043 -14.141 1.00 51.13 H new ATOM 0 HG2 GLU A 16 7.585 -19.336 -13.223 1.00 24.30 H new ATOM 0 HG3 GLU A 16 8.157 -19.560 -14.864 1.00 24.30 H new ATOM 255 N LEU A 17 10.235 -23.112 -11.466 1.00 54.21 N ATOM 256 CA LEU A 17 10.805 -24.430 -11.213 1.00 64.32 C ATOM 257 C LEU A 17 10.194 -25.058 -9.965 1.00 33.11 C ATOM 258 O LEU A 17 9.822 -26.232 -9.966 1.00 55.40 O ATOM 259 CB LEU A 17 12.324 -24.329 -11.055 1.00 55.24 C ATOM 260 CG LEU A 17 13.003 -25.495 -10.337 1.00 0.25 C ATOM 261 CD1 LEU A 17 12.558 -26.821 -10.932 1.00 71.41 C ATOM 262 CD2 LEU A 17 14.517 -25.357 -10.409 1.00 12.20 C ATOM 0 H LEU A 17 10.890 -22.339 -11.345 1.00 54.21 H new ATOM 0 HA LEU A 17 10.576 -25.067 -12.067 1.00 64.32 H new ATOM 0 HB2 LEU A 17 12.767 -24.232 -12.046 1.00 55.24 H new ATOM 0 HB3 LEU A 17 12.553 -23.412 -10.512 1.00 55.24 H new ATOM 0 HG LEU A 17 12.706 -25.473 -9.289 1.00 0.25 H new ATOM 0 HD11 LEU A 17 13.052 -27.639 -10.408 1.00 71.41 H new ATOM 0 HD12 LEU A 17 11.478 -26.923 -10.827 1.00 71.41 H new ATOM 0 HD13 LEU A 17 12.825 -26.854 -11.988 1.00 71.41 H new ATOM 0 HD21 LEU A 17 14.984 -26.196 -9.893 1.00 12.20 H new ATOM 0 HD22 LEU A 17 14.833 -25.352 -11.452 1.00 12.20 H new ATOM 0 HD23 LEU A 17 14.820 -24.424 -9.934 1.00 12.20 H new ATOM 274 N VAL A 18 10.091 -24.268 -8.901 1.00 11.10 N ATOM 275 CA VAL A 18 9.521 -24.745 -7.647 1.00 1.15 C ATOM 276 C VAL A 18 8.046 -25.094 -7.811 1.00 22.14 C ATOM 277 O VAL A 18 7.486 -25.854 -7.020 1.00 62.25 O ATOM 278 CB VAL A 18 9.668 -23.696 -6.529 1.00 13.34 C ATOM 279 CG1 VAL A 18 9.072 -24.214 -5.228 1.00 44.13 C ATOM 280 CG2 VAL A 18 11.129 -23.317 -6.342 1.00 22.31 C ATOM 0 H VAL A 18 10.395 -23.295 -8.883 1.00 11.10 H new ATOM 0 HA VAL A 18 10.074 -25.642 -7.369 1.00 1.15 H new ATOM 0 HB VAL A 18 9.119 -22.801 -6.821 1.00 13.34 H new ATOM 0 HG11 VAL A 18 9.185 -23.459 -4.450 1.00 44.13 H new ATOM 0 HG12 VAL A 18 8.013 -24.430 -5.373 1.00 44.13 H new ATOM 0 HG13 VAL A 18 9.590 -25.125 -4.928 1.00 44.13 H new ATOM 0 HG21 VAL A 18 11.214 -22.575 -5.548 1.00 22.31 H new ATOM 0 HG22 VAL A 18 11.703 -24.203 -6.073 1.00 22.31 H new ATOM 0 HG23 VAL A 18 11.519 -22.901 -7.271 1.00 22.31 H new ATOM 290 N ARG A 19 7.422 -24.534 -8.842 1.00 24.21 N ATOM 291 CA ARG A 19 6.012 -24.786 -9.110 1.00 15.24 C ATOM 292 C ARG A 19 5.838 -26.010 -10.004 1.00 33.13 C ATOM 293 O ARG A 19 5.088 -26.929 -9.676 1.00 32.03 O ATOM 294 CB ARG A 19 5.370 -23.564 -9.770 1.00 11.14 C ATOM 295 CG ARG A 19 4.847 -22.539 -8.776 1.00 61.30 C ATOM 296 CD ARG A 19 5.943 -21.581 -8.335 1.00 72.24 C ATOM 297 NE ARG A 19 5.469 -20.633 -7.331 1.00 22.04 N ATOM 298 CZ ARG A 19 5.248 -20.957 -6.061 1.00 53.45 C ATOM 299 NH1 ARG A 19 5.456 -22.198 -5.644 1.00 43.41 N ATOM 300 NH2 ARG A 19 4.817 -20.038 -5.207 1.00 0.43 N ATOM 0 H ARG A 19 7.871 -23.903 -9.505 1.00 24.21 H new ATOM 0 HA ARG A 19 5.517 -24.979 -8.159 1.00 15.24 H new ATOM 0 HB2 ARG A 19 6.103 -23.086 -10.420 1.00 11.14 H new ATOM 0 HB3 ARG A 19 4.548 -23.894 -10.405 1.00 11.14 H new ATOM 0 HG2 ARG A 19 4.030 -21.976 -9.228 1.00 61.30 H new ATOM 0 HG3 ARG A 19 4.438 -23.051 -7.905 1.00 61.30 H new ATOM 0 HD2 ARG A 19 6.780 -22.150 -7.930 1.00 72.24 H new ATOM 0 HD3 ARG A 19 6.317 -21.035 -9.201 1.00 72.24 H new ATOM 0 HE ARG A 19 5.298 -19.670 -7.620 1.00 22.04 H new ATOM 0 HH11 ARG A 19 5.787 -22.907 -6.298 1.00 43.41 H new ATOM 0 HH12 ARG A 19 5.286 -22.444 -4.669 1.00 43.41 H new ATOM 0 HH21 ARG A 19 4.655 -19.082 -5.525 1.00 0.43 H new ATOM 0 HH22 ARG A 19 4.647 -20.287 -4.232 1.00 0.43 H new ATOM 314 N ALA A 20 6.536 -26.014 -11.135 1.00 33.43 N ATOM 315 CA ALA A 20 6.460 -27.126 -12.075 1.00 13.50 C ATOM 316 C ALA A 20 6.833 -28.441 -11.401 1.00 61.51 C ATOM 317 O ALA A 20 6.326 -29.503 -11.764 1.00 54.45 O ATOM 318 CB ALA A 20 7.364 -26.868 -13.271 1.00 2.50 C ATOM 0 H ALA A 20 7.160 -25.260 -11.422 1.00 33.43 H new ATOM 0 HA ALA A 20 5.430 -27.206 -12.423 1.00 13.50 H new ATOM 0 HB1 ALA A 20 7.298 -27.706 -13.965 1.00 2.50 H new ATOM 0 HB2 ALA A 20 7.049 -25.954 -13.775 1.00 2.50 H new ATOM 0 HB3 ALA A 20 8.394 -26.759 -12.932 1.00 2.50 H new ATOM 324 N VAL A 21 7.724 -28.365 -10.418 1.00 22.54 N ATOM 325 CA VAL A 21 8.165 -29.551 -9.692 1.00 44.14 C ATOM 326 C VAL A 21 7.186 -29.912 -8.582 1.00 35.13 C ATOM 327 O VAL A 21 7.273 -30.987 -7.987 1.00 74.43 O ATOM 328 CB VAL A 21 9.564 -29.347 -9.081 1.00 44.34 C ATOM 329 CG1 VAL A 21 9.514 -28.318 -7.962 1.00 54.24 C ATOM 330 CG2 VAL A 21 10.123 -30.669 -8.576 1.00 51.44 C ATOM 0 H VAL A 21 8.155 -27.495 -10.106 1.00 22.54 H new ATOM 0 HA VAL A 21 8.207 -30.366 -10.414 1.00 44.14 H new ATOM 0 HB VAL A 21 10.229 -28.971 -9.858 1.00 44.34 H new ATOM 0 HG11 VAL A 21 10.512 -28.188 -7.543 1.00 54.24 H new ATOM 0 HG12 VAL A 21 9.160 -27.366 -8.358 1.00 54.24 H new ATOM 0 HG13 VAL A 21 8.835 -28.662 -7.182 1.00 54.24 H new ATOM 0 HG21 VAL A 21 11.112 -30.506 -8.148 1.00 51.44 H new ATOM 0 HG22 VAL A 21 9.460 -31.077 -7.813 1.00 51.44 H new ATOM 0 HG23 VAL A 21 10.198 -31.373 -9.405 1.00 51.44 H new ATOM 340 N LEU A 22 6.253 -29.007 -8.306 1.00 75.54 N ATOM 341 CA LEU A 22 5.254 -29.230 -7.266 1.00 70.44 C ATOM 342 C LEU A 22 4.022 -29.927 -7.835 1.00 53.41 C ATOM 343 O LEU A 22 3.305 -30.624 -7.118 1.00 24.03 O ATOM 344 CB LEU A 22 4.852 -27.901 -6.624 1.00 62.44 C ATOM 345 CG LEU A 22 4.638 -27.925 -5.111 1.00 1.14 C ATOM 346 CD1 LEU A 22 4.195 -26.558 -4.613 1.00 1.21 C ATOM 347 CD2 LEU A 22 3.618 -28.988 -4.733 1.00 35.53 C ATOM 0 H LEU A 22 6.167 -28.112 -8.788 1.00 75.54 H new ATOM 0 HA LEU A 22 5.694 -29.875 -6.506 1.00 70.44 H new ATOM 0 HB2 LEU A 22 5.622 -27.163 -6.850 1.00 62.44 H new ATOM 0 HB3 LEU A 22 3.932 -27.556 -7.096 1.00 62.44 H new ATOM 0 HG LEU A 22 5.586 -28.174 -4.634 1.00 1.14 H new ATOM 0 HD11 LEU A 22 4.047 -26.594 -3.534 1.00 1.21 H new ATOM 0 HD12 LEU A 22 4.960 -25.819 -4.850 1.00 1.21 H new ATOM 0 HD13 LEU A 22 3.259 -26.280 -5.098 1.00 1.21 H new ATOM 0 HD21 LEU A 22 3.479 -28.990 -3.652 1.00 35.53 H new ATOM 0 HD22 LEU A 22 2.668 -28.770 -5.221 1.00 35.53 H new ATOM 0 HD23 LEU A 22 3.976 -29.966 -5.055 1.00 35.53 H new ATOM 359 N GLU A 23 3.783 -29.733 -9.129 1.00 21.55 N ATOM 360 CA GLU A 23 2.638 -30.345 -9.793 1.00 10.40 C ATOM 361 C GLU A 23 2.837 -31.850 -9.946 1.00 42.31 C ATOM 362 O GLU A 23 1.917 -32.636 -9.716 1.00 42.15 O ATOM 363 CB GLU A 23 2.416 -29.706 -11.166 1.00 22.13 C ATOM 364 CG GLU A 23 2.544 -28.192 -11.161 1.00 34.05 C ATOM 365 CD GLU A 23 1.877 -27.555 -9.957 1.00 54.41 C ATOM 366 OE1 GLU A 23 0.801 -28.041 -9.549 1.00 24.24 O ATOM 367 OE2 GLU A 23 2.429 -26.570 -9.424 1.00 41.33 O ATOM 0 H GLU A 23 4.366 -29.158 -9.737 1.00 21.55 H new ATOM 0 HA GLU A 23 1.757 -30.174 -9.174 1.00 10.40 H new ATOM 0 HB2 GLU A 23 3.136 -30.121 -11.871 1.00 22.13 H new ATOM 0 HB3 GLU A 23 1.424 -29.977 -11.527 1.00 22.13 H new ATOM 0 HG2 GLU A 23 3.599 -27.920 -11.173 1.00 34.05 H new ATOM 0 HG3 GLU A 23 2.101 -27.790 -12.072 1.00 34.05 H new ATOM 374 N LEU A 24 4.044 -32.244 -10.336 1.00 44.11 N ATOM 375 CA LEU A 24 4.366 -33.655 -10.521 1.00 51.21 C ATOM 376 C LEU A 24 4.223 -34.422 -9.211 1.00 22.14 C ATOM 377 O LEU A 24 3.887 -35.606 -9.205 1.00 71.52 O ATOM 378 CB LEU A 24 5.789 -33.807 -11.062 1.00 75.22 C ATOM 379 CG LEU A 24 6.907 -33.269 -10.170 1.00 24.45 C ATOM 380 CD1 LEU A 24 7.299 -34.302 -9.124 1.00 20.00 C ATOM 381 CD2 LEU A 24 8.114 -32.872 -11.008 1.00 30.34 C ATOM 0 H LEU A 24 4.816 -31.606 -10.530 1.00 44.11 H new ATOM 0 HA LEU A 24 3.663 -34.071 -11.243 1.00 51.21 H new ATOM 0 HB2 LEU A 24 5.975 -34.865 -11.245 1.00 75.22 H new ATOM 0 HB3 LEU A 24 5.846 -33.302 -12.026 1.00 75.22 H new ATOM 0 HG LEU A 24 6.539 -32.381 -9.655 1.00 24.45 H new ATOM 0 HD11 LEU A 24 8.096 -33.901 -8.498 1.00 20.00 H new ATOM 0 HD12 LEU A 24 6.434 -34.538 -8.504 1.00 20.00 H new ATOM 0 HD13 LEU A 24 7.648 -35.208 -9.620 1.00 20.00 H new ATOM 0 HD21 LEU A 24 8.900 -32.491 -10.356 1.00 30.34 H new ATOM 0 HD22 LEU A 24 8.483 -33.743 -11.551 1.00 30.34 H new ATOM 0 HD23 LEU A 24 7.825 -32.098 -11.718 1.00 30.34 H new ATOM 393 N LYS A 25 4.479 -33.739 -8.100 1.00 50.11 N ATOM 394 CA LYS A 25 4.376 -34.354 -6.782 1.00 50.30 C ATOM 395 C LYS A 25 2.958 -34.854 -6.524 1.00 41.41 C ATOM 396 O LYS A 25 2.737 -35.706 -5.665 1.00 64.22 O ATOM 397 CB LYS A 25 4.781 -33.353 -5.697 1.00 33.41 C ATOM 398 CG LYS A 25 6.271 -33.062 -5.663 1.00 61.33 C ATOM 399 CD LYS A 25 6.608 -31.996 -4.635 1.00 11.31 C ATOM 400 CE LYS A 25 6.343 -32.484 -3.219 1.00 10.52 C ATOM 401 NZ LYS A 25 7.110 -33.721 -2.906 1.00 32.21 N ATOM 0 H LYS A 25 4.760 -32.758 -8.086 1.00 50.11 H new ATOM 0 HA LYS A 25 5.054 -35.207 -6.752 1.00 50.30 H new ATOM 0 HB2 LYS A 25 4.241 -32.420 -5.856 1.00 33.41 H new ATOM 0 HB3 LYS A 25 4.472 -33.739 -4.725 1.00 33.41 H new ATOM 0 HG2 LYS A 25 6.816 -33.977 -5.431 1.00 61.33 H new ATOM 0 HG3 LYS A 25 6.601 -32.735 -6.649 1.00 61.33 H new ATOM 0 HD2 LYS A 25 7.656 -31.713 -4.733 1.00 11.31 H new ATOM 0 HD3 LYS A 25 6.016 -31.101 -4.829 1.00 11.31 H new ATOM 0 HE2 LYS A 25 6.611 -31.701 -2.509 1.00 10.52 H new ATOM 0 HE3 LYS A 25 5.277 -32.676 -3.095 1.00 10.52 H new ATOM 0 HZ1 LYS A 25 7.500 -33.653 -1.944 1.00 32.21 H new ATOM 0 HZ2 LYS A 25 6.479 -34.545 -2.966 1.00 32.21 H new ATOM 0 HZ3 LYS A 25 7.887 -33.830 -3.588 1.00 32.21 H new ATOM 415 N ASN A 26 2.001 -34.318 -7.275 1.00 30.03 N ATOM 416 CA ASN A 26 0.604 -34.711 -7.127 1.00 63.04 C ATOM 417 C ASN A 26 0.196 -35.689 -8.225 1.00 32.45 C ATOM 418 O ASN A 26 -0.824 -36.369 -8.115 1.00 54.51 O ATOM 419 CB ASN A 26 -0.301 -33.478 -7.165 1.00 62.03 C ATOM 420 CG ASN A 26 -0.516 -32.876 -5.790 1.00 45.11 C ATOM 421 OD1 ASN A 26 -1.638 -32.532 -5.419 1.00 42.33 O ATOM 422 ND2 ASN A 26 0.563 -32.746 -5.026 1.00 41.14 N ATOM 0 H ASN A 26 2.167 -33.611 -7.991 1.00 30.03 H new ATOM 0 HA ASN A 26 0.491 -35.206 -6.163 1.00 63.04 H new ATOM 0 HB2 ASN A 26 0.139 -32.728 -7.822 1.00 62.03 H new ATOM 0 HB3 ASN A 26 -1.265 -33.751 -7.594 1.00 62.03 H new ATOM 0 HD21 ASN A 26 0.481 -32.347 -4.091 1.00 41.14 H new ATOM 0 HD22 ASN A 26 1.474 -33.045 -5.375 1.00 41.14 H new ATOM 429 N GLU A 27 1.000 -35.755 -9.281 1.00 24.32 N ATOM 430 CA GLU A 27 0.722 -36.651 -10.398 1.00 11.54 C ATOM 431 C GLU A 27 1.364 -38.017 -10.173 1.00 40.51 C ATOM 432 O GLU A 27 1.403 -38.853 -11.076 1.00 71.04 O ATOM 433 CB GLU A 27 1.232 -36.044 -11.706 1.00 44.31 C ATOM 434 CG GLU A 27 0.505 -34.773 -12.112 1.00 43.21 C ATOM 435 CD GLU A 27 1.187 -34.052 -13.259 1.00 0.54 C ATOM 436 OE1 GLU A 27 2.431 -34.118 -13.347 1.00 32.24 O ATOM 437 OE2 GLU A 27 0.476 -33.420 -14.068 1.00 73.43 O ATOM 0 H GLU A 27 1.849 -35.199 -9.387 1.00 24.32 H new ATOM 0 HA GLU A 27 -0.358 -36.784 -10.464 1.00 11.54 H new ATOM 0 HB2 GLU A 27 2.296 -35.828 -11.606 1.00 44.31 H new ATOM 0 HB3 GLU A 27 1.130 -36.781 -12.503 1.00 44.31 H new ATOM 0 HG2 GLU A 27 -0.517 -35.019 -12.399 1.00 43.21 H new ATOM 0 HG3 GLU A 27 0.442 -34.104 -11.253 1.00 43.21 H new ATOM 444 N LEU A 28 1.867 -38.235 -8.963 1.00 62.33 N ATOM 445 CA LEU A 28 2.509 -39.499 -8.619 1.00 33.44 C ATOM 446 C LEU A 28 1.486 -40.629 -8.554 1.00 60.34 C ATOM 447 O LEU A 28 1.762 -41.754 -8.970 1.00 64.42 O ATOM 448 CB LEU A 28 3.235 -39.376 -7.278 1.00 34.53 C ATOM 449 CG LEU A 28 4.420 -40.320 -7.067 1.00 53.42 C ATOM 450 CD1 LEU A 28 3.957 -41.768 -7.076 1.00 61.35 C ATOM 451 CD2 LEU A 28 5.480 -40.090 -8.134 1.00 3.31 C ATOM 0 H LEU A 28 1.843 -37.554 -8.204 1.00 62.33 H new ATOM 0 HA LEU A 28 3.234 -39.734 -9.398 1.00 33.44 H new ATOM 0 HB2 LEU A 28 3.590 -38.351 -7.172 1.00 34.53 H new ATOM 0 HB3 LEU A 28 2.513 -39.547 -6.480 1.00 34.53 H new ATOM 0 HG LEU A 28 4.861 -40.108 -6.093 1.00 53.42 H new ATOM 0 HD11 LEU A 28 4.814 -42.425 -6.925 1.00 61.35 H new ATOM 0 HD12 LEU A 28 3.234 -41.924 -6.275 1.00 61.35 H new ATOM 0 HD13 LEU A 28 3.491 -41.995 -8.035 1.00 61.35 H new ATOM 0 HD21 LEU A 28 6.316 -40.770 -7.969 1.00 3.31 H new ATOM 0 HD22 LEU A 28 5.051 -40.275 -9.119 1.00 3.31 H new ATOM 0 HD23 LEU A 28 5.834 -39.060 -8.080 1.00 3.31 H new ATOM 463 N SER A 29 0.303 -40.321 -8.033 1.00 1.04 N ATOM 464 CA SER A 29 -0.761 -41.311 -7.913 1.00 1.13 C ATOM 465 C SER A 29 -1.959 -40.927 -8.775 1.00 74.44 C ATOM 466 O SER A 29 -3.097 -41.281 -8.467 1.00 71.12 O ATOM 467 CB SER A 29 -1.194 -41.451 -6.452 1.00 24.20 C ATOM 468 OG SER A 29 -2.204 -42.435 -6.312 1.00 13.53 O ATOM 0 H SER A 29 0.057 -39.394 -7.687 1.00 1.04 H new ATOM 0 HA SER A 29 -0.375 -42.268 -8.263 1.00 1.13 H new ATOM 0 HB2 SER A 29 -0.334 -41.718 -5.838 1.00 24.20 H new ATOM 0 HB3 SER A 29 -1.562 -40.493 -6.085 1.00 24.20 H new ATOM 0 HG SER A 29 -2.872 -42.321 -7.020 1.00 13.53 H new ATOM 474 N GLN A 30 -1.694 -40.202 -9.857 1.00 11.11 N ATOM 475 CA GLN A 30 -2.751 -39.769 -10.764 1.00 65.51 C ATOM 476 C GLN A 30 -2.393 -40.096 -12.211 1.00 12.45 C ATOM 477 O GLN A 30 -3.248 -40.512 -12.993 1.00 60.35 O ATOM 478 CB GLN A 30 -2.998 -38.267 -10.614 1.00 22.54 C ATOM 479 CG GLN A 30 -4.230 -37.934 -9.789 1.00 15.50 C ATOM 480 CD GLN A 30 -3.928 -37.817 -8.308 1.00 41.11 C ATOM 481 OE1 GLN A 30 -3.498 -36.766 -7.831 1.00 54.03 O ATOM 482 NE2 GLN A 30 -4.151 -38.899 -7.571 1.00 41.30 N ATOM 0 H GLN A 30 -0.757 -39.902 -10.127 1.00 11.11 H new ATOM 0 HA GLN A 30 -3.662 -40.307 -10.503 1.00 65.51 H new ATOM 0 HB2 GLN A 30 -2.125 -37.808 -10.150 1.00 22.54 H new ATOM 0 HB3 GLN A 30 -3.103 -37.824 -11.604 1.00 22.54 H new ATOM 0 HG2 GLN A 30 -4.657 -36.996 -10.144 1.00 15.50 H new ATOM 0 HG3 GLN A 30 -4.984 -38.706 -9.942 1.00 15.50 H new ATOM 0 HE21 GLN A 30 -4.508 -39.749 -8.008 1.00 41.30 H new ATOM 0 HE22 GLN A 30 -3.965 -38.880 -6.568 1.00 41.30 H new ATOM 491 N LEU A 31 -1.126 -39.903 -12.559 1.00 60.13 N ATOM 492 CA LEU A 31 -0.655 -40.176 -13.913 1.00 21.53 C ATOM 493 C LEU A 31 0.362 -41.313 -13.916 1.00 72.51 C ATOM 494 O LEU A 31 0.979 -41.630 -12.899 1.00 31.31 O ATOM 495 CB LEU A 31 -0.032 -38.919 -14.521 1.00 54.40 C ATOM 496 CG LEU A 31 -1.009 -37.921 -15.145 1.00 1.33 C ATOM 497 CD1 LEU A 31 -0.282 -36.651 -15.560 1.00 11.13 C ATOM 498 CD2 LEU A 31 -1.720 -38.544 -16.337 1.00 21.41 C ATOM 0 H LEU A 31 -0.406 -39.559 -11.923 1.00 60.13 H new ATOM 0 HA LEU A 31 -1.512 -40.477 -14.515 1.00 21.53 H new ATOM 0 HB2 LEU A 31 0.534 -38.406 -13.744 1.00 54.40 H new ATOM 0 HB3 LEU A 31 0.682 -39.225 -15.286 1.00 54.40 H new ATOM 0 HG LEU A 31 -1.758 -37.659 -14.397 1.00 1.33 H new ATOM 0 HD11 LEU A 31 -0.993 -35.953 -16.002 1.00 11.13 H new ATOM 0 HD12 LEU A 31 0.180 -36.194 -14.685 1.00 11.13 H new ATOM 0 HD13 LEU A 31 0.489 -36.895 -16.291 1.00 11.13 H new ATOM 0 HD21 LEU A 31 -2.411 -37.819 -16.768 1.00 21.41 H new ATOM 0 HD22 LEU A 31 -0.985 -38.835 -17.087 1.00 21.41 H new ATOM 0 HD23 LEU A 31 -2.274 -39.424 -16.011 1.00 21.41 H new ATOM 510 N PRO A 32 0.543 -41.942 -15.087 1.00 44.21 N ATOM 511 CA PRO A 32 1.487 -43.051 -15.252 1.00 71.51 C ATOM 512 C PRO A 32 2.939 -42.596 -15.160 1.00 22.15 C ATOM 513 O PRO A 32 3.244 -41.404 -15.191 1.00 44.23 O ATOM 514 CB PRO A 32 1.179 -43.573 -16.658 1.00 33.12 C ATOM 515 CG PRO A 32 0.595 -42.405 -17.376 1.00 23.43 C ATOM 516 CD PRO A 32 -0.158 -41.617 -16.340 1.00 51.04 C ATOM 0 HA PRO A 32 1.374 -43.801 -14.469 1.00 71.51 H new ATOM 0 HB2 PRO A 32 2.081 -43.932 -17.154 1.00 33.12 H new ATOM 0 HB3 PRO A 32 0.479 -44.408 -16.626 1.00 33.12 H new ATOM 0 HG2 PRO A 32 1.376 -41.799 -17.836 1.00 23.43 H new ATOM 0 HG3 PRO A 32 -0.069 -42.731 -18.177 1.00 23.43 H new ATOM 0 HD2 PRO A 32 -0.130 -40.548 -16.550 1.00 51.04 H new ATOM 0 HD3 PRO A 32 -1.208 -41.907 -16.300 1.00 51.04 H new ATOM 524 N PRO A 33 3.858 -43.566 -15.043 1.00 21.24 N ATOM 525 CA PRO A 33 5.294 -43.289 -14.944 1.00 41.31 C ATOM 526 C PRO A 33 5.874 -42.762 -16.252 1.00 71.35 C ATOM 527 O PRO A 33 6.815 -41.969 -16.250 1.00 34.12 O ATOM 528 CB PRO A 33 5.897 -44.654 -14.603 1.00 53.11 C ATOM 529 CG PRO A 33 4.922 -45.643 -15.141 1.00 73.43 C ATOM 530 CD PRO A 33 3.566 -45.009 -14.998 1.00 50.21 C ATOM 0 HA PRO A 33 5.510 -42.517 -14.206 1.00 41.31 H new ATOM 0 HB2 PRO A 33 6.879 -44.778 -15.059 1.00 53.11 H new ATOM 0 HB3 PRO A 33 6.028 -44.772 -13.527 1.00 53.11 H new ATOM 0 HG2 PRO A 33 5.136 -45.874 -16.184 1.00 73.43 H new ATOM 0 HG3 PRO A 33 4.974 -46.582 -14.589 1.00 73.43 H new ATOM 0 HD2 PRO A 33 2.895 -45.309 -15.803 1.00 50.21 H new ATOM 0 HD3 PRO A 33 3.086 -45.293 -14.061 1.00 50.21 H new ATOM 538 N GLU A 34 5.306 -43.209 -17.368 1.00 52.23 N ATOM 539 CA GLU A 34 5.768 -42.782 -18.684 1.00 10.22 C ATOM 540 C GLU A 34 5.810 -41.259 -18.778 1.00 20.32 C ATOM 541 O GLU A 34 6.879 -40.663 -18.900 1.00 23.33 O ATOM 542 CB GLU A 34 4.858 -43.346 -19.777 1.00 31.34 C ATOM 543 CG GLU A 34 5.475 -43.303 -21.165 1.00 33.44 C ATOM 544 CD GLU A 34 4.763 -44.212 -22.148 1.00 31.43 C ATOM 545 OE1 GLU A 34 5.066 -45.424 -22.161 1.00 13.03 O ATOM 546 OE2 GLU A 34 3.904 -43.713 -22.904 1.00 12.34 O ATOM 0 H GLU A 34 4.526 -43.866 -17.387 1.00 52.23 H new ATOM 0 HA GLU A 34 6.778 -43.166 -18.828 1.00 10.22 H new ATOM 0 HB2 GLU A 34 4.607 -44.378 -19.532 1.00 31.34 H new ATOM 0 HB3 GLU A 34 3.924 -42.784 -19.786 1.00 31.34 H new ATOM 0 HG2 GLU A 34 5.449 -42.279 -21.538 1.00 33.44 H new ATOM 0 HG3 GLU A 34 6.524 -43.593 -21.102 1.00 33.44 H new ATOM 553 N GLY A 35 4.637 -40.636 -18.721 1.00 11.11 N ATOM 554 CA GLY A 35 4.561 -39.189 -18.802 1.00 1.12 C ATOM 555 C GLY A 35 5.519 -38.504 -17.848 1.00 3.12 C ATOM 556 O GLY A 35 6.007 -37.408 -18.127 1.00 32.22 O ATOM 0 H GLY A 35 3.738 -41.107 -18.620 1.00 11.11 H new ATOM 0 HA2 GLY A 35 4.781 -38.873 -19.822 1.00 1.12 H new ATOM 0 HA3 GLY A 35 3.543 -38.869 -18.582 1.00 1.12 H new ATOM 560 N TYR A 36 5.789 -39.149 -16.718 1.00 41.14 N ATOM 561 CA TYR A 36 6.692 -38.593 -15.718 1.00 2.03 C ATOM 562 C TYR A 36 8.050 -38.265 -16.331 1.00 51.14 C ATOM 563 O TYR A 36 8.605 -37.191 -16.101 1.00 43.41 O ATOM 564 CB TYR A 36 6.868 -39.574 -14.558 1.00 21.43 C ATOM 565 CG TYR A 36 6.597 -38.964 -13.201 1.00 51.44 C ATOM 566 CD1 TYR A 36 5.325 -38.523 -12.857 1.00 71.24 C ATOM 567 CD2 TYR A 36 7.613 -38.828 -12.263 1.00 40.13 C ATOM 568 CE1 TYR A 36 5.073 -37.964 -11.620 1.00 1.13 C ATOM 569 CE2 TYR A 36 7.370 -38.271 -11.023 1.00 30.25 C ATOM 570 CZ TYR A 36 6.099 -37.840 -10.706 1.00 34.23 C ATOM 571 OH TYR A 36 5.851 -37.285 -9.471 1.00 44.11 O ATOM 0 H TYR A 36 5.395 -40.057 -16.472 1.00 41.14 H new ATOM 0 HA TYR A 36 6.251 -37.670 -15.342 1.00 2.03 H new ATOM 0 HB2 TYR A 36 6.199 -40.422 -14.706 1.00 21.43 H new ATOM 0 HB3 TYR A 36 7.886 -39.964 -14.575 1.00 21.43 H new ATOM 0 HD1 TYR A 36 4.519 -38.619 -13.570 1.00 71.24 H new ATOM 0 HD2 TYR A 36 8.610 -39.164 -12.508 1.00 40.13 H new ATOM 0 HE1 TYR A 36 4.078 -37.626 -11.369 1.00 1.13 H new ATOM 0 HE2 TYR A 36 8.171 -38.173 -10.305 1.00 30.25 H new ATOM 0 HH TYR A 36 4.909 -37.022 -9.414 1.00 44.11 H new ATOM 581 N VAL A 37 8.579 -39.199 -17.115 1.00 60.21 N ATOM 582 CA VAL A 37 9.871 -39.011 -17.765 1.00 13.45 C ATOM 583 C VAL A 37 9.852 -37.792 -18.681 1.00 24.23 C ATOM 584 O VAL A 37 10.901 -37.260 -19.045 1.00 61.22 O ATOM 585 CB VAL A 37 10.273 -40.250 -18.585 1.00 74.43 C ATOM 586 CG1 VAL A 37 9.535 -40.273 -19.915 1.00 52.33 C ATOM 587 CG2 VAL A 37 11.778 -40.281 -18.801 1.00 21.01 C ATOM 0 H VAL A 37 8.133 -40.094 -17.316 1.00 60.21 H new ATOM 0 HA VAL A 37 10.604 -38.856 -16.973 1.00 13.45 H new ATOM 0 HB VAL A 37 9.991 -41.141 -18.025 1.00 74.43 H new ATOM 0 HG11 VAL A 37 9.832 -41.156 -20.481 1.00 52.33 H new ATOM 0 HG12 VAL A 37 8.460 -40.302 -19.734 1.00 52.33 H new ATOM 0 HG13 VAL A 37 9.783 -39.377 -20.484 1.00 52.33 H new ATOM 0 HG21 VAL A 37 12.044 -41.164 -19.383 1.00 21.01 H new ATOM 0 HG22 VAL A 37 12.087 -39.385 -19.340 1.00 21.01 H new ATOM 0 HG23 VAL A 37 12.283 -40.316 -17.836 1.00 21.01 H new ATOM 597 N VAL A 38 8.653 -37.354 -19.050 1.00 11.13 N ATOM 598 CA VAL A 38 8.497 -36.196 -19.922 1.00 61.55 C ATOM 599 C VAL A 38 8.359 -34.912 -19.113 1.00 22.13 C ATOM 600 O VAL A 38 8.626 -33.819 -19.612 1.00 12.10 O ATOM 601 CB VAL A 38 7.269 -36.346 -20.840 1.00 32.43 C ATOM 602 CG1 VAL A 38 7.183 -35.180 -21.813 1.00 21.35 C ATOM 603 CG2 VAL A 38 7.320 -37.671 -21.586 1.00 21.23 C ATOM 0 H VAL A 38 7.775 -37.784 -18.759 1.00 11.13 H new ATOM 0 HA VAL A 38 9.396 -36.140 -20.536 1.00 61.55 H new ATOM 0 HB VAL A 38 6.372 -36.338 -20.221 1.00 32.43 H new ATOM 0 HG11 VAL A 38 6.309 -35.304 -22.453 1.00 21.35 H new ATOM 0 HG12 VAL A 38 7.096 -34.247 -21.256 1.00 21.35 H new ATOM 0 HG13 VAL A 38 8.082 -35.152 -22.428 1.00 21.35 H new ATOM 0 HG21 VAL A 38 6.445 -37.760 -22.230 1.00 21.23 H new ATOM 0 HG22 VAL A 38 8.224 -37.711 -22.194 1.00 21.23 H new ATOM 0 HG23 VAL A 38 7.328 -38.492 -20.869 1.00 21.23 H new ATOM 613 N VAL A 39 7.941 -35.052 -17.859 1.00 1.34 N ATOM 614 CA VAL A 39 7.769 -33.903 -16.978 1.00 0.33 C ATOM 615 C VAL A 39 9.058 -33.587 -16.228 1.00 45.12 C ATOM 616 O VAL A 39 9.426 -32.423 -16.066 1.00 61.21 O ATOM 617 CB VAL A 39 6.640 -34.142 -15.957 1.00 44.23 C ATOM 618 CG1 VAL A 39 6.422 -32.903 -15.103 1.00 14.33 C ATOM 619 CG2 VAL A 39 5.357 -34.543 -16.668 1.00 35.12 C ATOM 0 H VAL A 39 7.715 -35.950 -17.430 1.00 1.34 H new ATOM 0 HA VAL A 39 7.503 -33.056 -17.611 1.00 0.33 H new ATOM 0 HB VAL A 39 6.934 -34.960 -15.299 1.00 44.23 H new ATOM 0 HG11 VAL A 39 5.621 -33.090 -14.388 1.00 14.33 H new ATOM 0 HG12 VAL A 39 7.340 -32.665 -14.566 1.00 14.33 H new ATOM 0 HG13 VAL A 39 6.148 -32.064 -15.743 1.00 14.33 H new ATOM 0 HG21 VAL A 39 4.570 -34.708 -15.932 1.00 35.12 H new ATOM 0 HG22 VAL A 39 5.055 -33.748 -17.350 1.00 35.12 H new ATOM 0 HG23 VAL A 39 5.525 -35.461 -17.232 1.00 35.12 H new ATOM 629 N VAL A 40 9.743 -34.632 -15.773 1.00 12.43 N ATOM 630 CA VAL A 40 10.993 -34.466 -15.041 1.00 61.42 C ATOM 631 C VAL A 40 12.006 -33.670 -15.856 1.00 55.52 C ATOM 632 O VAL A 40 12.907 -33.039 -15.303 1.00 31.21 O ATOM 633 CB VAL A 40 11.609 -35.828 -14.668 1.00 11.25 C ATOM 634 CG1 VAL A 40 12.807 -35.638 -13.750 1.00 21.31 C ATOM 635 CG2 VAL A 40 10.565 -36.724 -14.017 1.00 44.44 C ATOM 0 H VAL A 40 9.453 -35.602 -15.899 1.00 12.43 H new ATOM 0 HA VAL A 40 10.755 -33.920 -14.128 1.00 61.42 H new ATOM 0 HB VAL A 40 11.954 -36.314 -15.581 1.00 11.25 H new ATOM 0 HG11 VAL A 40 13.229 -36.610 -13.497 1.00 21.31 H new ATOM 0 HG12 VAL A 40 13.561 -35.035 -14.256 1.00 21.31 H new ATOM 0 HG13 VAL A 40 12.490 -35.132 -12.838 1.00 21.31 H new ATOM 0 HG21 VAL A 40 11.017 -37.682 -13.760 1.00 44.44 H new ATOM 0 HG22 VAL A 40 10.188 -36.246 -13.113 1.00 44.44 H new ATOM 0 HG23 VAL A 40 9.741 -36.886 -14.712 1.00 44.44 H new ATOM 645 N LYS A 41 11.851 -33.701 -17.176 1.00 30.35 N ATOM 646 CA LYS A 41 12.750 -32.981 -18.069 1.00 50.22 C ATOM 647 C LYS A 41 12.595 -31.473 -17.897 1.00 24.10 C ATOM 648 O LYS A 41 13.565 -30.768 -17.622 1.00 1.02 O ATOM 649 CB LYS A 41 12.476 -33.369 -19.524 1.00 32.42 C ATOM 650 CG LYS A 41 13.714 -33.828 -20.275 1.00 10.14 C ATOM 651 CD LYS A 41 13.874 -35.338 -20.217 1.00 2.24 C ATOM 652 CE LYS A 41 14.008 -35.829 -18.783 1.00 64.34 C ATOM 653 NZ LYS A 41 14.787 -37.096 -18.702 1.00 44.11 N ATOM 0 H LYS A 41 11.110 -34.218 -17.650 1.00 30.35 H new ATOM 0 HA LYS A 41 13.773 -33.256 -17.812 1.00 50.22 H new ATOM 0 HB2 LYS A 41 11.733 -34.166 -19.545 1.00 32.42 H new ATOM 0 HB3 LYS A 41 12.042 -32.515 -20.043 1.00 32.42 H new ATOM 0 HG2 LYS A 41 13.649 -33.508 -21.315 1.00 10.14 H new ATOM 0 HG3 LYS A 41 14.597 -33.351 -19.849 1.00 10.14 H new ATOM 0 HD2 LYS A 41 13.014 -35.815 -20.687 1.00 2.24 H new ATOM 0 HD3 LYS A 41 14.754 -35.634 -20.788 1.00 2.24 H new ATOM 0 HE2 LYS A 41 14.497 -35.063 -18.181 1.00 64.34 H new ATOM 0 HE3 LYS A 41 13.016 -35.984 -18.358 1.00 64.34 H new ATOM 0 HZ1 LYS A 41 14.856 -37.398 -17.709 1.00 44.11 H new ATOM 0 HZ2 LYS A 41 14.308 -37.834 -19.256 1.00 44.11 H new ATOM 0 HZ3 LYS A 41 15.742 -36.942 -19.084 1.00 44.11 H new ATOM 667 N ASN A 42 11.369 -30.986 -18.060 1.00 24.14 N ATOM 668 CA ASN A 42 11.088 -29.562 -17.921 1.00 43.20 C ATOM 669 C ASN A 42 11.267 -29.110 -16.475 1.00 33.34 C ATOM 670 O ASN A 42 11.472 -27.927 -16.203 1.00 32.21 O ATOM 671 CB ASN A 42 9.665 -29.253 -18.391 1.00 64.54 C ATOM 672 CG ASN A 42 8.628 -29.544 -17.324 1.00 51.21 C ATOM 673 OD1 ASN A 42 7.894 -30.638 -17.494 1.00 62.41 O flip ATOM 674 ND2 ASN A 42 8.488 -28.793 -16.358 1.00 43.42 N flip ATOM 0 H ASN A 42 10.555 -31.556 -18.288 1.00 24.14 H new ATOM 0 HA ASN A 42 11.796 -29.016 -18.544 1.00 43.20 H new ATOM 0 HB2 ASN A 42 9.600 -28.204 -18.680 1.00 64.54 H new ATOM 0 HB3 ASN A 42 9.443 -29.843 -19.280 1.00 64.54 H new ATOM 0 HD21 ASN A 42 9.074 -27.963 -16.268 1.00 43.42 H new ATOM 0 HD22 ASN A 42 7.786 -29.001 -15.648 1.00 43.42 H new ATOM 681 N VAL A 43 11.188 -30.062 -15.549 1.00 53.44 N ATOM 682 CA VAL A 43 11.342 -29.763 -14.131 1.00 1.13 C ATOM 683 C VAL A 43 12.813 -29.626 -13.755 1.00 2.21 C ATOM 684 O VAL A 43 13.159 -28.934 -12.798 1.00 55.33 O ATOM 685 CB VAL A 43 10.699 -30.854 -13.254 1.00 62.12 C ATOM 686 CG1 VAL A 43 10.934 -30.562 -11.780 1.00 64.50 C ATOM 687 CG2 VAL A 43 9.212 -30.969 -13.553 1.00 20.22 C ATOM 0 H VAL A 43 11.018 -31.046 -15.757 1.00 53.44 H new ATOM 0 HA VAL A 43 10.834 -28.816 -13.950 1.00 1.13 H new ATOM 0 HB VAL A 43 11.169 -31.809 -13.489 1.00 62.12 H new ATOM 0 HG11 VAL A 43 10.473 -31.343 -11.176 1.00 64.50 H new ATOM 0 HG12 VAL A 43 12.005 -30.535 -11.581 1.00 64.50 H new ATOM 0 HG13 VAL A 43 10.493 -29.598 -11.525 1.00 64.50 H new ATOM 0 HG21 VAL A 43 8.773 -31.744 -12.925 1.00 20.22 H new ATOM 0 HG22 VAL A 43 8.725 -30.016 -13.347 1.00 20.22 H new ATOM 0 HG23 VAL A 43 9.071 -31.229 -14.602 1.00 20.22 H new ATOM 697 N GLY A 44 13.677 -30.291 -14.516 1.00 4.30 N ATOM 698 CA GLY A 44 15.102 -30.230 -14.247 1.00 43.23 C ATOM 699 C GLY A 44 15.846 -29.374 -15.254 1.00 30.34 C ATOM 700 O GLY A 44 17.029 -29.080 -15.076 1.00 71.41 O ATOM 0 H GLY A 44 13.416 -30.871 -15.314 1.00 4.30 H new ATOM 0 HA2 GLY A 44 15.263 -29.830 -13.246 1.00 43.23 H new ATOM 0 HA3 GLY A 44 15.514 -31.239 -14.257 1.00 43.23 H new ATOM 704 N LEU A 45 15.153 -28.974 -16.314 1.00 62.52 N ATOM 705 CA LEU A 45 15.756 -28.148 -17.355 1.00 31.43 C ATOM 706 C LEU A 45 15.669 -26.669 -16.994 1.00 11.10 C ATOM 707 O LEU A 45 16.262 -25.820 -17.660 1.00 5.21 O ATOM 708 CB LEU A 45 15.065 -28.399 -18.696 1.00 64.34 C ATOM 709 CG LEU A 45 15.709 -29.456 -19.595 1.00 50.44 C ATOM 710 CD1 LEU A 45 14.649 -30.184 -20.406 1.00 73.42 C ATOM 711 CD2 LEU A 45 16.740 -28.817 -20.514 1.00 64.22 C ATOM 0 H LEU A 45 14.173 -29.208 -16.476 1.00 62.52 H new ATOM 0 HA LEU A 45 16.808 -28.421 -17.439 1.00 31.43 H new ATOM 0 HB2 LEU A 45 14.034 -28.696 -18.501 1.00 64.34 H new ATOM 0 HB3 LEU A 45 15.028 -27.458 -19.245 1.00 64.34 H new ATOM 0 HG LEU A 45 16.217 -30.184 -18.962 1.00 50.44 H new ATOM 0 HD11 LEU A 45 15.126 -30.932 -21.040 1.00 73.42 H new ATOM 0 HD12 LEU A 45 13.947 -30.674 -19.731 1.00 73.42 H new ATOM 0 HD13 LEU A 45 14.113 -29.469 -21.030 1.00 73.42 H new ATOM 0 HD21 LEU A 45 17.188 -29.583 -21.146 1.00 64.22 H new ATOM 0 HD22 LEU A 45 16.255 -28.068 -21.140 1.00 64.22 H new ATOM 0 HD23 LEU A 45 17.516 -28.341 -19.915 1.00 64.22 H new ATOM 723 N THR A 46 14.926 -26.366 -15.933 1.00 65.25 N ATOM 724 CA THR A 46 14.763 -24.990 -15.483 1.00 15.10 C ATOM 725 C THR A 46 15.963 -24.534 -14.661 1.00 54.20 C ATOM 726 O THR A 46 16.500 -23.447 -14.878 1.00 41.04 O ATOM 727 CB THR A 46 13.484 -24.823 -14.640 1.00 61.21 C ATOM 728 OG1 THR A 46 12.474 -25.729 -15.098 1.00 12.21 O ATOM 729 CG2 THR A 46 12.966 -23.395 -14.720 1.00 31.15 C ATOM 0 H THR A 46 14.428 -27.056 -15.370 1.00 65.25 H new ATOM 0 HA THR A 46 14.684 -24.372 -16.377 1.00 15.10 H new ATOM 0 HB THR A 46 13.728 -25.046 -13.601 1.00 61.21 H new ATOM 0 HG1 THR A 46 11.665 -25.618 -14.556 1.00 12.21 H new ATOM 0 HG21 THR A 46 12.063 -23.301 -14.117 1.00 31.15 H new ATOM 0 HG22 THR A 46 13.726 -22.711 -14.343 1.00 31.15 H new ATOM 0 HG23 THR A 46 12.737 -23.148 -15.757 1.00 31.15 H new ATOM 737 N LEU A 47 16.379 -25.370 -13.717 1.00 21.12 N ATOM 738 CA LEU A 47 17.518 -25.053 -12.862 1.00 13.13 C ATOM 739 C LEU A 47 18.788 -24.878 -13.688 1.00 73.44 C ATOM 740 O LEU A 47 19.521 -23.904 -13.520 1.00 20.13 O ATOM 741 CB LEU A 47 17.721 -26.154 -11.820 1.00 70.40 C ATOM 742 CG LEU A 47 17.747 -27.587 -12.354 1.00 42.13 C ATOM 743 CD1 LEU A 47 19.180 -28.078 -12.495 1.00 34.01 C ATOM 744 CD2 LEU A 47 16.952 -28.511 -11.443 1.00 53.54 C ATOM 0 H LEU A 47 15.945 -26.273 -13.524 1.00 21.12 H new ATOM 0 HA LEU A 47 17.307 -24.113 -12.352 1.00 13.13 H new ATOM 0 HB2 LEU A 47 18.659 -25.965 -11.299 1.00 70.40 H new ATOM 0 HB3 LEU A 47 16.924 -26.078 -11.080 1.00 70.40 H new ATOM 0 HG LEU A 47 17.283 -27.595 -13.340 1.00 42.13 H new ATOM 0 HD11 LEU A 47 19.179 -29.099 -12.876 1.00 34.01 H new ATOM 0 HD12 LEU A 47 19.719 -27.433 -13.188 1.00 34.01 H new ATOM 0 HD13 LEU A 47 19.670 -28.055 -11.522 1.00 34.01 H new ATOM 0 HD21 LEU A 47 16.982 -29.526 -11.839 1.00 53.54 H new ATOM 0 HD22 LEU A 47 17.386 -28.498 -10.443 1.00 53.54 H new ATOM 0 HD23 LEU A 47 15.918 -28.171 -11.393 1.00 53.54 H new ATOM 756 N ARG A 48 19.040 -25.828 -14.584 1.00 11.24 N ATOM 757 CA ARG A 48 20.221 -25.779 -15.437 1.00 55.55 C ATOM 758 C ARG A 48 20.129 -24.620 -16.426 1.00 14.42 C ATOM 759 O ARG A 48 21.112 -24.265 -17.077 1.00 14.11 O ATOM 760 CB ARG A 48 20.383 -27.097 -16.195 1.00 64.44 C ATOM 761 CG ARG A 48 19.181 -27.461 -17.050 1.00 55.05 C ATOM 762 CD ARG A 48 19.508 -28.581 -18.026 1.00 4.32 C ATOM 763 NE ARG A 48 18.852 -29.834 -17.661 1.00 44.54 N ATOM 764 CZ ARG A 48 19.338 -30.683 -16.763 1.00 61.34 C ATOM 765 NH1 ARG A 48 20.478 -30.416 -16.141 1.00 51.22 N ATOM 766 NH2 ARG A 48 18.683 -31.803 -16.486 1.00 31.33 N ATOM 0 H ARG A 48 18.442 -26.640 -14.737 1.00 11.24 H new ATOM 0 HA ARG A 48 21.092 -25.624 -14.801 1.00 55.55 H new ATOM 0 HB2 ARG A 48 21.265 -27.034 -16.832 1.00 64.44 H new ATOM 0 HB3 ARG A 48 20.564 -27.898 -15.479 1.00 64.44 H new ATOM 0 HG2 ARG A 48 18.356 -27.767 -16.407 1.00 55.05 H new ATOM 0 HG3 ARG A 48 18.847 -26.583 -17.602 1.00 55.05 H new ATOM 0 HD2 ARG A 48 19.199 -28.289 -19.030 1.00 4.32 H new ATOM 0 HD3 ARG A 48 20.587 -28.732 -18.056 1.00 4.32 H new ATOM 0 HE ARG A 48 17.973 -30.070 -18.121 1.00 44.54 H new ATOM 0 HH11 ARG A 48 20.985 -29.556 -16.352 1.00 51.22 H new ATOM 0 HH12 ARG A 48 20.848 -31.070 -15.452 1.00 51.22 H new ATOM 0 HH21 ARG A 48 17.806 -32.012 -16.963 1.00 31.33 H new ATOM 0 HH22 ARG A 48 19.057 -32.455 -15.796 1.00 31.33 H new ATOM 780 N LYS A 49 18.941 -24.033 -16.533 1.00 62.11 N ATOM 781 CA LYS A 49 18.719 -22.914 -17.441 1.00 4.32 C ATOM 782 C LYS A 49 18.885 -21.583 -16.714 1.00 42.11 C ATOM 783 O LYS A 49 19.228 -20.569 -17.324 1.00 60.22 O ATOM 784 CB LYS A 49 17.321 -23.000 -18.057 1.00 44.42 C ATOM 785 CG LYS A 49 17.302 -23.643 -19.433 1.00 52.42 C ATOM 786 CD LYS A 49 16.007 -23.344 -20.170 1.00 34.44 C ATOM 787 CE LYS A 49 14.820 -24.031 -19.511 1.00 11.34 C ATOM 788 NZ LYS A 49 13.532 -23.656 -20.158 1.00 45.42 N ATOM 0 H LYS A 49 18.117 -24.314 -16.002 1.00 62.11 H new ATOM 0 HA LYS A 49 19.463 -22.970 -18.235 1.00 4.32 H new ATOM 0 HB2 LYS A 49 16.673 -23.569 -17.390 1.00 44.42 H new ATOM 0 HB3 LYS A 49 16.902 -21.996 -18.128 1.00 44.42 H new ATOM 0 HG2 LYS A 49 18.147 -23.279 -20.018 1.00 52.42 H new ATOM 0 HG3 LYS A 49 17.424 -24.722 -19.333 1.00 52.42 H new ATOM 0 HD2 LYS A 49 15.840 -22.267 -20.192 1.00 34.44 H new ATOM 0 HD3 LYS A 49 16.091 -23.674 -21.205 1.00 34.44 H new ATOM 0 HE2 LYS A 49 14.951 -25.112 -19.563 1.00 11.34 H new ATOM 0 HE3 LYS A 49 14.787 -23.764 -18.455 1.00 11.34 H new ATOM 0 HZ1 LYS A 49 12.748 -24.145 -19.680 1.00 45.42 H new ATOM 0 HZ2 LYS A 49 13.394 -22.628 -20.086 1.00 45.42 H new ATOM 0 HZ3 LYS A 49 13.553 -23.933 -21.160 1.00 45.42 H new ATOM 802 N LEU A 50 18.641 -21.593 -15.408 1.00 45.23 N ATOM 803 CA LEU A 50 18.765 -20.386 -14.598 1.00 24.34 C ATOM 804 C LEU A 50 20.136 -20.316 -13.932 1.00 32.25 C ATOM 805 O LEU A 50 20.611 -19.236 -13.578 1.00 75.34 O ATOM 806 CB LEU A 50 17.666 -20.347 -13.534 1.00 64.44 C ATOM 807 CG LEU A 50 17.900 -21.213 -12.296 1.00 34.40 C ATOM 808 CD1 LEU A 50 18.665 -20.435 -11.237 1.00 30.31 C ATOM 809 CD2 LEU A 50 16.575 -21.715 -11.739 1.00 3.01 C ATOM 0 H LEU A 50 18.356 -22.423 -14.888 1.00 45.23 H new ATOM 0 HA LEU A 50 18.656 -19.524 -15.256 1.00 24.34 H new ATOM 0 HB2 LEU A 50 17.537 -19.314 -13.211 1.00 64.44 H new ATOM 0 HB3 LEU A 50 16.729 -20.656 -13.997 1.00 64.44 H new ATOM 0 HG LEU A 50 18.500 -22.075 -12.587 1.00 34.40 H new ATOM 0 HD11 LEU A 50 18.822 -21.068 -10.363 1.00 30.31 H new ATOM 0 HD12 LEU A 50 19.630 -20.125 -11.639 1.00 30.31 H new ATOM 0 HD13 LEU A 50 18.092 -19.554 -10.948 1.00 30.31 H new ATOM 0 HD21 LEU A 50 16.760 -22.330 -10.858 1.00 3.01 H new ATOM 0 HD22 LEU A 50 15.951 -20.865 -11.464 1.00 3.01 H new ATOM 0 HD23 LEU A 50 16.064 -22.310 -12.496 1.00 3.01 H new ATOM 821 N ILE A 51 20.767 -21.474 -13.765 1.00 51.42 N ATOM 822 CA ILE A 51 22.084 -21.543 -13.145 1.00 1.42 C ATOM 823 C ILE A 51 23.072 -20.618 -13.848 1.00 61.01 C ATOM 824 O ILE A 51 23.984 -20.076 -13.224 1.00 74.42 O ATOM 825 CB ILE A 51 22.640 -22.979 -13.163 1.00 3.33 C ATOM 826 CG1 ILE A 51 22.008 -23.808 -12.043 1.00 3.44 C ATOM 827 CG2 ILE A 51 24.155 -22.962 -13.026 1.00 44.42 C ATOM 828 CD1 ILE A 51 21.897 -25.280 -12.370 1.00 75.20 C ATOM 0 H ILE A 51 20.387 -22.377 -14.050 1.00 51.42 H new ATOM 0 HA ILE A 51 21.963 -21.222 -12.110 1.00 1.42 H new ATOM 0 HB ILE A 51 22.386 -23.439 -14.118 1.00 3.33 H new ATOM 0 HG12 ILE A 51 22.600 -23.689 -11.136 1.00 3.44 H new ATOM 0 HG13 ILE A 51 21.014 -23.416 -11.828 1.00 3.44 H new ATOM 0 HG21 ILE A 51 24.533 -23.984 -13.040 1.00 44.42 H new ATOM 0 HG22 ILE A 51 24.589 -22.403 -13.855 1.00 44.42 H new ATOM 0 HG23 ILE A 51 24.430 -22.487 -12.084 1.00 44.42 H new ATOM 0 HD11 ILE A 51 21.440 -25.806 -11.531 1.00 75.20 H new ATOM 0 HD12 ILE A 51 21.280 -25.410 -13.259 1.00 75.20 H new ATOM 0 HD13 ILE A 51 22.891 -25.687 -12.556 1.00 75.20 H new ATOM 840 N GLY A 52 22.883 -20.441 -15.152 1.00 41.33 N ATOM 841 CA GLY A 52 23.764 -19.579 -15.919 1.00 62.51 C ATOM 842 C GLY A 52 23.646 -18.123 -15.516 1.00 25.01 C ATOM 843 O GLY A 52 24.550 -17.327 -15.769 1.00 42.35 O ATOM 0 H GLY A 52 22.136 -20.879 -15.691 1.00 41.33 H new ATOM 0 HA2 GLY A 52 24.795 -19.907 -15.786 1.00 62.51 H new ATOM 0 HA3 GLY A 52 23.532 -19.679 -16.979 1.00 62.51 H new ATOM 847 N SER A 53 22.529 -17.773 -14.888 1.00 33.05 N ATOM 848 CA SER A 53 22.293 -16.401 -14.453 1.00 44.04 C ATOM 849 C SER A 53 23.155 -16.059 -13.241 1.00 72.43 C ATOM 850 O SER A 53 23.777 -14.998 -13.186 1.00 74.42 O ATOM 851 CB SER A 53 20.815 -16.197 -14.117 1.00 1.44 C ATOM 852 OG SER A 53 20.503 -16.734 -12.843 1.00 3.42 O ATOM 0 H SER A 53 21.772 -18.421 -14.669 1.00 33.05 H new ATOM 0 HA SER A 53 22.567 -15.735 -15.271 1.00 44.04 H new ATOM 0 HB2 SER A 53 20.578 -15.133 -14.135 1.00 1.44 H new ATOM 0 HB3 SER A 53 20.197 -16.674 -14.878 1.00 1.44 H new ATOM 0 HG SER A 53 20.426 -17.709 -12.909 1.00 3.42 H new ATOM 858 N VAL A 54 23.186 -16.967 -12.271 1.00 30.23 N ATOM 859 CA VAL A 54 23.971 -16.764 -11.059 1.00 62.21 C ATOM 860 C VAL A 54 25.432 -17.137 -11.282 1.00 45.03 C ATOM 861 O VAL A 54 26.306 -16.763 -10.499 1.00 72.22 O ATOM 862 CB VAL A 54 23.415 -17.592 -9.885 1.00 3.52 C ATOM 863 CG1 VAL A 54 23.924 -17.047 -8.559 1.00 45.52 C ATOM 864 CG2 VAL A 54 21.894 -17.605 -9.916 1.00 65.42 C ATOM 0 H VAL A 54 22.677 -17.850 -12.301 1.00 30.23 H new ATOM 0 HA VAL A 54 23.903 -15.705 -10.811 1.00 62.21 H new ATOM 0 HB VAL A 54 23.767 -18.618 -9.988 1.00 3.52 H new ATOM 0 HG11 VAL A 54 23.521 -17.644 -7.741 1.00 45.52 H new ATOM 0 HG12 VAL A 54 25.013 -17.094 -8.540 1.00 45.52 H new ATOM 0 HG13 VAL A 54 23.604 -16.012 -8.444 1.00 45.52 H new ATOM 0 HG21 VAL A 54 21.518 -18.194 -9.080 1.00 65.42 H new ATOM 0 HG22 VAL A 54 21.520 -16.584 -9.838 1.00 65.42 H new ATOM 0 HG23 VAL A 54 21.553 -18.046 -10.853 1.00 65.42 H new ATOM 874 N ASP A 55 25.691 -17.875 -12.356 1.00 24.42 N ATOM 875 CA ASP A 55 27.048 -18.298 -12.684 1.00 30.21 C ATOM 876 C ASP A 55 27.786 -17.207 -13.453 1.00 2.10 C ATOM 877 O ASP A 55 29.014 -17.131 -13.418 1.00 25.34 O ATOM 878 CB ASP A 55 27.018 -19.588 -13.506 1.00 4.31 C ATOM 879 CG ASP A 55 28.406 -20.138 -13.770 1.00 2.02 C ATOM 880 OD1 ASP A 55 29.173 -19.485 -14.508 1.00 14.42 O ATOM 881 OD2 ASP A 55 28.726 -21.223 -13.239 1.00 14.50 O ATOM 0 H ASP A 55 24.979 -18.193 -13.014 1.00 24.42 H new ATOM 0 HA ASP A 55 27.580 -18.483 -11.751 1.00 30.21 H new ATOM 0 HB2 ASP A 55 26.427 -20.338 -12.979 1.00 4.31 H new ATOM 0 HB3 ASP A 55 26.518 -19.399 -14.456 1.00 4.31 H new ATOM 886 N ASP A 56 27.029 -16.365 -14.148 1.00 3.22 N ATOM 887 CA ASP A 56 27.611 -15.277 -14.926 1.00 24.42 C ATOM 888 C ASP A 56 28.451 -14.363 -14.039 1.00 32.32 C ATOM 889 O ASP A 56 29.414 -13.748 -14.498 1.00 60.11 O ATOM 890 CB ASP A 56 26.511 -14.469 -15.616 1.00 21.54 C ATOM 891 CG ASP A 56 27.068 -13.406 -16.541 1.00 53.51 C ATOM 892 OD1 ASP A 56 27.619 -13.770 -17.601 1.00 2.11 O ATOM 893 OD2 ASP A 56 26.951 -12.208 -16.206 1.00 61.40 O ATOM 0 H ASP A 56 26.011 -16.415 -14.189 1.00 3.22 H new ATOM 0 HA ASP A 56 28.260 -15.713 -15.685 1.00 24.42 H new ATOM 0 HB2 ASP A 56 25.872 -15.143 -16.186 1.00 21.54 H new ATOM 0 HB3 ASP A 56 25.883 -13.997 -14.861 1.00 21.54 H new ATOM 898 N LEU A 57 28.079 -14.278 -12.766 1.00 52.24 N ATOM 899 CA LEU A 57 28.797 -13.438 -11.814 1.00 53.41 C ATOM 900 C LEU A 57 29.303 -14.262 -10.635 1.00 12.45 C ATOM 901 O LEU A 57 29.621 -13.719 -9.575 1.00 61.14 O ATOM 902 CB LEU A 57 27.891 -12.312 -11.313 1.00 15.30 C ATOM 903 CG LEU A 57 27.204 -11.472 -12.391 1.00 65.12 C ATOM 904 CD1 LEU A 57 25.708 -11.390 -12.132 1.00 61.23 C ATOM 905 CD2 LEU A 57 27.814 -10.079 -12.451 1.00 23.22 C ATOM 0 H LEU A 57 27.285 -14.780 -12.370 1.00 52.24 H new ATOM 0 HA LEU A 57 29.656 -13.004 -12.325 1.00 53.41 H new ATOM 0 HB2 LEU A 57 27.122 -12.748 -10.676 1.00 15.30 H new ATOM 0 HB3 LEU A 57 28.485 -11.647 -10.686 1.00 15.30 H new ATOM 0 HG LEU A 57 27.359 -11.957 -13.355 1.00 65.12 H new ATOM 0 HD11 LEU A 57 25.237 -10.788 -12.909 1.00 61.23 H new ATOM 0 HD12 LEU A 57 25.282 -12.393 -12.141 1.00 61.23 H new ATOM 0 HD13 LEU A 57 25.532 -10.930 -11.160 1.00 61.23 H new ATOM 0 HD21 LEU A 57 27.313 -9.495 -13.223 1.00 23.22 H new ATOM 0 HD22 LEU A 57 27.691 -9.586 -11.487 1.00 23.22 H new ATOM 0 HD23 LEU A 57 28.876 -10.156 -12.686 1.00 23.22 H new ATOM 917 N LEU A 58 29.377 -15.574 -10.825 1.00 31.20 N ATOM 918 CA LEU A 58 29.847 -16.474 -9.777 1.00 61.04 C ATOM 919 C LEU A 58 31.172 -15.990 -9.198 1.00 3.20 C ATOM 920 O LEU A 58 31.298 -15.736 -8.000 1.00 3.31 O ATOM 921 CB LEU A 58 30.006 -17.892 -10.329 1.00 43.22 C ATOM 922 CG LEU A 58 29.202 -18.982 -9.621 1.00 32.15 C ATOM 923 CD1 LEU A 58 29.599 -20.357 -10.134 1.00 31.41 C ATOM 924 CD2 LEU A 58 29.398 -18.896 -8.114 1.00 43.10 C ATOM 0 H LEU A 58 29.118 -16.039 -11.695 1.00 31.20 H new ATOM 0 HA LEU A 58 29.104 -16.482 -8.979 1.00 61.04 H new ATOM 0 HB2 LEU A 58 29.722 -17.885 -11.381 1.00 43.22 H new ATOM 0 HB3 LEU A 58 31.061 -18.161 -10.286 1.00 43.22 H new ATOM 0 HG LEU A 58 28.145 -18.827 -9.839 1.00 32.15 H new ATOM 0 HD11 LEU A 58 29.016 -21.120 -9.618 1.00 31.41 H new ATOM 0 HD12 LEU A 58 29.406 -20.415 -11.205 1.00 31.41 H new ATOM 0 HD13 LEU A 58 30.660 -20.523 -9.947 1.00 31.41 H new ATOM 0 HD21 LEU A 58 28.818 -19.680 -7.626 1.00 43.10 H new ATOM 0 HD22 LEU A 58 30.454 -19.025 -7.876 1.00 43.10 H new ATOM 0 HD23 LEU A 58 29.062 -17.922 -7.758 1.00 43.10 H new ATOM 936 N PRO A 59 32.185 -15.856 -10.067 1.00 60.23 N ATOM 937 CA PRO A 59 33.518 -15.399 -9.665 1.00 44.32 C ATOM 938 C PRO A 59 33.532 -13.925 -9.273 1.00 33.22 C ATOM 939 O PRO A 59 34.541 -13.410 -8.793 1.00 45.01 O ATOM 940 CB PRO A 59 34.365 -15.625 -10.920 1.00 73.54 C ATOM 941 CG PRO A 59 33.392 -15.576 -12.047 1.00 53.34 C ATOM 942 CD PRO A 59 32.106 -16.141 -11.510 1.00 22.21 C ATOM 0 HA PRO A 59 33.882 -15.931 -8.786 1.00 44.32 H new ATOM 0 HB2 PRO A 59 35.131 -14.857 -11.024 1.00 73.54 H new ATOM 0 HB3 PRO A 59 34.880 -16.585 -10.883 1.00 73.54 H new ATOM 0 HG2 PRO A 59 33.252 -14.553 -12.398 1.00 53.34 H new ATOM 0 HG3 PRO A 59 33.749 -16.158 -12.896 1.00 53.34 H new ATOM 0 HD2 PRO A 59 31.237 -15.667 -11.966 1.00 22.21 H new ATOM 0 HD3 PRO A 59 32.025 -17.210 -11.705 1.00 22.21 H new ATOM 950 N SER A 60 32.404 -13.252 -9.479 1.00 62.33 N ATOM 951 CA SER A 60 32.288 -11.837 -9.150 1.00 13.41 C ATOM 952 C SER A 60 31.754 -11.651 -7.733 1.00 10.32 C ATOM 953 O SER A 60 31.343 -10.554 -7.350 1.00 63.22 O ATOM 954 CB SER A 60 31.368 -11.133 -10.150 1.00 3.42 C ATOM 955 OG SER A 60 31.636 -9.742 -10.197 1.00 12.21 O ATOM 0 H SER A 60 31.558 -13.664 -9.872 1.00 62.33 H new ATOM 0 HA SER A 60 33.282 -11.393 -9.207 1.00 13.41 H new ATOM 0 HB2 SER A 60 31.503 -11.566 -11.141 1.00 3.42 H new ATOM 0 HB3 SER A 60 30.328 -11.297 -9.870 1.00 3.42 H new ATOM 0 HG SER A 60 31.691 -9.388 -9.285 1.00 12.21 H new ATOM 961 N LEU A 61 31.763 -12.730 -6.958 1.00 52.30 N ATOM 962 CA LEU A 61 31.280 -12.688 -5.582 1.00 52.51 C ATOM 963 C LEU A 61 32.444 -12.678 -4.596 1.00 51.25 C ATOM 964 O LEU A 61 33.542 -13.151 -4.890 1.00 50.21 O ATOM 965 CB LEU A 61 30.370 -13.885 -5.303 1.00 64.51 C ATOM 966 CG LEU A 61 29.324 -14.197 -6.373 1.00 71.33 C ATOM 967 CD1 LEU A 61 28.786 -15.609 -6.199 1.00 30.14 C ATOM 968 CD2 LEU A 61 28.191 -13.183 -6.323 1.00 13.21 C ATOM 0 H LEU A 61 32.099 -13.645 -7.259 1.00 52.30 H new ATOM 0 HA LEU A 61 30.710 -11.768 -5.451 1.00 52.51 H new ATOM 0 HB2 LEU A 61 30.995 -14.767 -5.167 1.00 64.51 H new ATOM 0 HB3 LEU A 61 29.854 -13.711 -4.359 1.00 64.51 H new ATOM 0 HG LEU A 61 29.802 -14.130 -7.350 1.00 71.33 H new ATOM 0 HD11 LEU A 61 28.043 -15.813 -6.970 1.00 30.14 H new ATOM 0 HD12 LEU A 61 29.604 -16.324 -6.286 1.00 30.14 H new ATOM 0 HD13 LEU A 61 28.325 -15.704 -5.216 1.00 30.14 H new ATOM 0 HD21 LEU A 61 27.456 -13.421 -7.092 1.00 13.21 H new ATOM 0 HD22 LEU A 61 27.715 -13.217 -5.343 1.00 13.21 H new ATOM 0 HD23 LEU A 61 28.589 -12.184 -6.499 1.00 13.21 H new ATOM 980 N PRO A 62 32.200 -12.128 -3.398 1.00 31.15 N ATOM 981 CA PRO A 62 33.215 -12.046 -2.343 1.00 32.10 C ATOM 982 C PRO A 62 33.553 -13.412 -1.757 1.00 24.52 C ATOM 983 O PRO A 62 32.988 -14.429 -2.160 1.00 14.24 O ATOM 984 CB PRO A 62 32.555 -11.159 -1.284 1.00 44.33 C ATOM 985 CG PRO A 62 31.092 -11.335 -1.501 1.00 11.44 C ATOM 986 CD PRO A 62 30.914 -11.545 -2.979 1.00 2.11 C ATOM 0 HA PRO A 62 34.161 -11.655 -2.717 1.00 32.10 H new ATOM 0 HB2 PRO A 62 32.845 -11.461 -0.278 1.00 44.33 H new ATOM 0 HB3 PRO A 62 32.850 -10.116 -1.401 1.00 44.33 H new ATOM 0 HG2 PRO A 62 30.714 -12.188 -0.938 1.00 11.44 H new ATOM 0 HG3 PRO A 62 30.539 -10.459 -1.162 1.00 11.44 H new ATOM 0 HD2 PRO A 62 30.081 -12.215 -3.192 1.00 2.11 H new ATOM 0 HD3 PRO A 62 30.710 -10.608 -3.496 1.00 2.11 H new ATOM 994 N SER A 63 34.479 -13.429 -0.803 1.00 65.45 N ATOM 995 CA SER A 63 34.896 -14.672 -0.164 1.00 72.01 C ATOM 996 C SER A 63 33.930 -15.059 0.952 1.00 2.31 C ATOM 997 O SER A 63 34.303 -15.098 2.125 1.00 50.44 O ATOM 998 CB SER A 63 36.312 -14.532 0.397 1.00 1.01 C ATOM 999 OG SER A 63 37.074 -13.611 -0.364 1.00 54.13 O ATOM 0 H SER A 63 34.955 -12.596 -0.456 1.00 65.45 H new ATOM 0 HA SER A 63 34.888 -15.460 -0.917 1.00 72.01 H new ATOM 0 HB2 SER A 63 36.264 -14.200 1.434 1.00 1.01 H new ATOM 0 HB3 SER A 63 36.805 -15.504 0.396 1.00 1.01 H new ATOM 0 HG SER A 63 37.974 -13.538 0.016 1.00 54.13 H new ATOM 1005 N SER A 64 32.687 -15.344 0.578 1.00 10.21 N ATOM 1006 CA SER A 64 31.665 -15.724 1.547 1.00 44.22 C ATOM 1007 C SER A 64 30.425 -16.266 0.844 1.00 72.14 C ATOM 1008 O SER A 64 29.916 -17.331 1.192 1.00 61.50 O ATOM 1009 CB SER A 64 31.288 -14.525 2.419 1.00 42.32 C ATOM 1010 OG SER A 64 30.794 -14.946 3.678 1.00 12.44 O ATOM 0 H SER A 64 32.363 -15.319 -0.389 1.00 10.21 H new ATOM 0 HA SER A 64 32.075 -16.510 2.181 1.00 44.22 H new ATOM 0 HB2 SER A 64 32.160 -13.887 2.562 1.00 42.32 H new ATOM 0 HB3 SER A 64 30.533 -13.925 1.911 1.00 42.32 H new ATOM 0 HG SER A 64 30.562 -14.161 4.217 1.00 12.44 H new ATOM 1016 N SER A 65 29.943 -15.524 -0.149 1.00 20.34 N ATOM 1017 CA SER A 65 28.760 -15.927 -0.899 1.00 73.44 C ATOM 1018 C SER A 65 29.142 -16.814 -2.081 1.00 11.40 C ATOM 1019 O SER A 65 28.347 -17.635 -2.538 1.00 13.03 O ATOM 1020 CB SER A 65 28.001 -14.695 -1.396 1.00 34.42 C ATOM 1021 OG SER A 65 28.269 -13.568 -0.580 1.00 72.11 O ATOM 0 H SER A 65 30.354 -14.641 -0.452 1.00 20.34 H new ATOM 0 HA SER A 65 28.114 -16.498 -0.232 1.00 73.44 H new ATOM 0 HB2 SER A 65 28.287 -14.479 -2.425 1.00 34.42 H new ATOM 0 HB3 SER A 65 26.930 -14.900 -1.398 1.00 34.42 H new ATOM 0 HG SER A 65 27.658 -12.840 -0.817 1.00 72.11 H new ATOM 1027 N ARG A 66 30.365 -16.641 -2.571 1.00 41.50 N ATOM 1028 CA ARG A 66 30.854 -17.423 -3.700 1.00 55.11 C ATOM 1029 C ARG A 66 30.774 -18.917 -3.401 1.00 71.12 C ATOM 1030 O ARG A 66 30.331 -19.706 -4.236 1.00 75.23 O ATOM 1031 CB ARG A 66 32.296 -17.034 -4.031 1.00 74.34 C ATOM 1032 CG ARG A 66 32.859 -17.759 -5.243 1.00 54.01 C ATOM 1033 CD ARG A 66 34.378 -17.697 -5.273 1.00 33.31 C ATOM 1034 NE ARG A 66 34.984 -18.740 -4.450 1.00 61.41 N ATOM 1035 CZ ARG A 66 36.296 -18.923 -4.344 1.00 74.31 C ATOM 1036 NH1 ARG A 66 37.134 -18.137 -5.005 1.00 15.51 N ATOM 1037 NH2 ARG A 66 36.771 -19.894 -3.575 1.00 62.41 N ATOM 0 H ARG A 66 31.036 -15.966 -2.204 1.00 41.50 H new ATOM 0 HA ARG A 66 30.221 -17.208 -4.561 1.00 55.11 H new ATOM 0 HB2 ARG A 66 32.342 -15.959 -4.207 1.00 74.34 H new ATOM 0 HB3 ARG A 66 32.927 -17.243 -3.167 1.00 74.34 H new ATOM 0 HG2 ARG A 66 32.536 -18.800 -5.228 1.00 54.01 H new ATOM 0 HG3 ARG A 66 32.458 -17.314 -6.153 1.00 54.01 H new ATOM 0 HD2 ARG A 66 34.725 -17.799 -6.301 1.00 33.31 H new ATOM 0 HD3 ARG A 66 34.708 -16.720 -4.921 1.00 33.31 H new ATOM 0 HE ARG A 66 34.367 -19.362 -3.928 1.00 61.41 H new ATOM 0 HH11 ARG A 66 36.772 -17.389 -5.597 1.00 15.51 H new ATOM 0 HH12 ARG A 66 38.140 -18.280 -4.922 1.00 15.51 H new ATOM 0 HH21 ARG A 66 36.129 -20.501 -3.065 1.00 62.41 H new ATOM 0 HH22 ARG A 66 37.778 -20.034 -3.494 1.00 62.41 H new ATOM 1051 N THR A 67 31.207 -19.300 -2.204 1.00 1.10 N ATOM 1052 CA THR A 67 31.187 -20.699 -1.795 1.00 52.41 C ATOM 1053 C THR A 67 29.760 -21.229 -1.719 1.00 55.43 C ATOM 1054 O THR A 67 29.535 -22.438 -1.743 1.00 25.22 O ATOM 1055 CB THR A 67 31.868 -20.894 -0.428 1.00 22.15 C ATOM 1056 OG1 THR A 67 32.869 -19.889 -0.231 1.00 11.04 O ATOM 1057 CG2 THR A 67 32.502 -22.274 -0.331 1.00 11.40 C ATOM 0 H THR A 67 31.576 -18.660 -1.500 1.00 1.10 H new ATOM 0 HA THR A 67 31.739 -21.257 -2.551 1.00 52.41 H new ATOM 0 HB THR A 67 31.107 -20.805 0.348 1.00 22.15 H new ATOM 0 HG1 THR A 67 33.296 -20.019 0.641 1.00 11.04 H new ATOM 0 HG21 THR A 67 32.977 -22.389 0.643 1.00 11.40 H new ATOM 0 HG22 THR A 67 31.733 -23.037 -0.452 1.00 11.40 H new ATOM 0 HG23 THR A 67 33.251 -22.386 -1.115 1.00 11.40 H new ATOM 1065 N GLU A 68 28.798 -20.315 -1.629 1.00 71.11 N ATOM 1066 CA GLU A 68 27.392 -20.693 -1.550 1.00 14.41 C ATOM 1067 C GLU A 68 26.852 -21.073 -2.926 1.00 1.12 C ATOM 1068 O GLU A 68 26.401 -22.199 -3.138 1.00 11.15 O ATOM 1069 CB GLU A 68 26.565 -19.546 -0.965 1.00 11.31 C ATOM 1070 CG GLU A 68 27.134 -18.982 0.326 1.00 1.02 C ATOM 1071 CD GLU A 68 27.311 -20.041 1.397 1.00 14.12 C ATOM 1072 OE1 GLU A 68 26.349 -20.796 1.650 1.00 71.00 O ATOM 1073 OE2 GLU A 68 28.412 -20.114 1.982 1.00 34.04 O ATOM 0 H GLU A 68 28.967 -19.309 -1.609 1.00 71.11 H new ATOM 0 HA GLU A 68 27.312 -21.561 -0.895 1.00 14.41 H new ATOM 0 HB2 GLU A 68 26.497 -18.746 -1.702 1.00 11.31 H new ATOM 0 HB3 GLU A 68 25.550 -19.898 -0.782 1.00 11.31 H new ATOM 0 HG2 GLU A 68 28.097 -18.514 0.120 1.00 1.02 H new ATOM 0 HG3 GLU A 68 26.473 -18.200 0.699 1.00 1.02 H new ATOM 1080 N ILE A 69 26.902 -20.126 -3.857 1.00 13.15 N ATOM 1081 CA ILE A 69 26.419 -20.361 -5.212 1.00 32.35 C ATOM 1082 C ILE A 69 27.241 -21.440 -5.908 1.00 74.43 C ATOM 1083 O ILE A 69 26.691 -22.399 -6.450 1.00 24.34 O ATOM 1084 CB ILE A 69 26.461 -19.074 -6.056 1.00 3.01 C ATOM 1085 CG1 ILE A 69 25.504 -18.029 -5.480 1.00 55.34 C ATOM 1086 CG2 ILE A 69 26.112 -19.379 -7.505 1.00 24.31 C ATOM 1087 CD1 ILE A 69 25.763 -16.627 -5.987 1.00 61.32 C ATOM 0 H ILE A 69 27.272 -19.189 -3.698 1.00 13.15 H new ATOM 0 HA ILE A 69 25.385 -20.694 -5.126 1.00 32.35 H new ATOM 0 HB ILE A 69 27.473 -18.669 -6.024 1.00 3.01 H new ATOM 0 HG12 ILE A 69 24.480 -18.312 -5.725 1.00 55.34 H new ATOM 0 HG13 ILE A 69 25.585 -18.034 -4.393 1.00 55.34 H new ATOM 0 HG21 ILE A 69 26.146 -18.459 -8.089 1.00 24.31 H new ATOM 0 HG22 ILE A 69 26.830 -20.092 -7.910 1.00 24.31 H new ATOM 0 HG23 ILE A 69 25.110 -19.804 -7.556 1.00 24.31 H new ATOM 0 HD11 ILE A 69 25.047 -15.939 -5.537 1.00 61.32 H new ATOM 0 HD12 ILE A 69 26.775 -16.324 -5.719 1.00 61.32 H new ATOM 0 HD13 ILE A 69 25.653 -16.606 -7.071 1.00 61.32 H new ATOM 1099 N GLU A 70 28.560 -21.277 -5.889 1.00 13.01 N ATOM 1100 CA GLU A 70 29.457 -22.238 -6.518 1.00 62.54 C ATOM 1101 C GLU A 70 29.209 -23.646 -5.983 1.00 51.23 C ATOM 1102 O GLU A 70 29.511 -24.636 -6.647 1.00 24.50 O ATOM 1103 CB GLU A 70 30.915 -21.840 -6.280 1.00 63.42 C ATOM 1104 CG GLU A 70 31.847 -22.236 -7.413 1.00 62.03 C ATOM 1105 CD GLU A 70 33.256 -22.531 -6.935 1.00 15.55 C ATOM 1106 OE1 GLU A 70 33.501 -22.430 -5.714 1.00 62.34 O ATOM 1107 OE2 GLU A 70 34.112 -22.862 -7.781 1.00 41.40 O ATOM 0 H GLU A 70 29.031 -20.489 -5.445 1.00 13.01 H new ATOM 0 HA GLU A 70 29.257 -22.235 -7.589 1.00 62.54 H new ATOM 0 HB2 GLU A 70 30.969 -20.761 -6.136 1.00 63.42 H new ATOM 0 HB3 GLU A 70 31.263 -22.302 -5.356 1.00 63.42 H new ATOM 0 HG2 GLU A 70 31.447 -23.116 -7.917 1.00 62.03 H new ATOM 0 HG3 GLU A 70 31.878 -21.433 -8.150 1.00 62.03 H new ATOM 1114 N GLY A 71 28.656 -23.725 -4.777 1.00 13.13 N ATOM 1115 CA GLY A 71 28.376 -25.014 -4.172 1.00 25.23 C ATOM 1116 C GLY A 71 26.923 -25.420 -4.316 1.00 0.41 C ATOM 1117 O GLY A 71 26.556 -26.558 -4.024 1.00 72.45 O ATOM 0 H GLY A 71 28.397 -22.919 -4.208 1.00 13.13 H new ATOM 0 HA2 GLY A 71 29.009 -25.773 -4.632 1.00 25.23 H new ATOM 0 HA3 GLY A 71 28.637 -24.980 -3.114 1.00 25.23 H new ATOM 1121 N THR A 72 26.091 -24.485 -4.766 1.00 22.04 N ATOM 1122 CA THR A 72 24.669 -24.750 -4.945 1.00 43.30 C ATOM 1123 C THR A 72 24.359 -25.132 -6.388 1.00 11.33 C ATOM 1124 O THR A 72 23.750 -26.169 -6.647 1.00 34.04 O ATOM 1125 CB THR A 72 23.817 -23.528 -4.555 1.00 12.53 C ATOM 1126 OG1 THR A 72 24.016 -23.212 -3.172 1.00 62.52 O ATOM 1127 CG2 THR A 72 22.341 -23.793 -4.812 1.00 1.21 C ATOM 0 H THR A 72 26.378 -23.538 -5.013 1.00 22.04 H new ATOM 0 HA THR A 72 24.417 -25.583 -4.289 1.00 43.30 H new ATOM 0 HB THR A 72 24.131 -22.684 -5.169 1.00 12.53 H new ATOM 0 HG1 THR A 72 24.733 -22.550 -3.088 1.00 62.52 H new ATOM 0 HG21 THR A 72 21.759 -22.916 -4.529 1.00 1.21 H new ATOM 0 HG22 THR A 72 22.188 -24.004 -5.870 1.00 1.21 H new ATOM 0 HG23 THR A 72 22.017 -24.650 -4.221 1.00 1.21 H new ATOM 1135 N GLN A 73 24.782 -24.287 -7.323 1.00 25.42 N ATOM 1136 CA GLN A 73 24.549 -24.538 -8.740 1.00 71.11 C ATOM 1137 C GLN A 73 25.091 -25.904 -9.148 1.00 30.01 C ATOM 1138 O GLN A 73 24.600 -26.522 -10.093 1.00 45.32 O ATOM 1139 CB GLN A 73 25.201 -23.444 -9.587 1.00 55.23 C ATOM 1140 CG GLN A 73 24.879 -22.035 -9.114 1.00 74.44 C ATOM 1141 CD GLN A 73 23.466 -21.908 -8.580 1.00 13.11 C ATOM 1142 OE1 GLN A 73 23.246 -21.901 -7.368 1.00 43.13 O ATOM 1143 NE2 GLN A 73 22.498 -21.806 -9.483 1.00 52.03 N ATOM 0 H GLN A 73 25.287 -23.423 -7.125 1.00 25.42 H new ATOM 0 HA GLN A 73 23.473 -24.529 -8.912 1.00 71.11 H new ATOM 0 HB2 GLN A 73 26.282 -23.584 -9.576 1.00 55.23 H new ATOM 0 HB3 GLN A 73 24.875 -23.554 -10.621 1.00 55.23 H new ATOM 0 HG2 GLN A 73 25.585 -21.747 -8.335 1.00 74.44 H new ATOM 0 HG3 GLN A 73 25.015 -21.338 -9.941 1.00 74.44 H new ATOM 0 HE21 GLN A 73 22.725 -21.816 -10.477 1.00 52.03 H new ATOM 0 HE22 GLN A 73 21.527 -21.717 -9.182 1.00 52.03 H new ATOM 1152 N LYS A 74 26.106 -26.371 -8.429 1.00 44.41 N ATOM 1153 CA LYS A 74 26.716 -27.664 -8.715 1.00 32.15 C ATOM 1154 C LYS A 74 25.834 -28.803 -8.214 1.00 75.55 C ATOM 1155 O LYS A 74 25.657 -29.812 -8.899 1.00 63.21 O ATOM 1156 CB LYS A 74 28.099 -27.754 -8.066 1.00 0.42 C ATOM 1157 CG LYS A 74 28.082 -27.532 -6.563 1.00 75.52 C ATOM 1158 CD LYS A 74 28.070 -28.850 -5.806 1.00 5.32 C ATOM 1159 CE LYS A 74 29.481 -29.328 -5.498 1.00 43.25 C ATOM 1160 NZ LYS A 74 30.082 -28.586 -4.355 1.00 54.13 N ATOM 0 H LYS A 74 26.524 -25.873 -7.643 1.00 44.41 H new ATOM 0 HA LYS A 74 26.822 -27.757 -9.796 1.00 32.15 H new ATOM 0 HB2 LYS A 74 28.526 -28.735 -8.275 1.00 0.42 H new ATOM 0 HB3 LYS A 74 28.756 -27.016 -8.526 1.00 0.42 H new ATOM 0 HG2 LYS A 74 28.956 -26.951 -6.270 1.00 75.52 H new ATOM 0 HG3 LYS A 74 27.204 -26.946 -6.290 1.00 75.52 H new ATOM 0 HD2 LYS A 74 27.514 -28.732 -4.876 1.00 5.32 H new ATOM 0 HD3 LYS A 74 27.549 -29.605 -6.395 1.00 5.32 H new ATOM 0 HE2 LYS A 74 29.461 -30.393 -5.269 1.00 43.25 H new ATOM 0 HE3 LYS A 74 30.107 -29.203 -6.381 1.00 43.25 H new ATOM 0 HZ1 LYS A 74 31.016 -28.987 -4.134 1.00 54.13 H new ATOM 0 HZ2 LYS A 74 30.187 -27.583 -4.609 1.00 54.13 H new ATOM 0 HZ3 LYS A 74 29.463 -28.670 -3.523 1.00 54.13 H new ATOM 1174 N LEU A 75 25.280 -28.636 -7.018 1.00 43.15 N ATOM 1175 CA LEU A 75 24.414 -29.650 -6.427 1.00 62.12 C ATOM 1176 C LEU A 75 23.025 -29.615 -7.057 1.00 45.40 C ATOM 1177 O LEU A 75 22.252 -30.566 -6.936 1.00 5.02 O ATOM 1178 CB LEU A 75 24.307 -29.439 -4.916 1.00 31.20 C ATOM 1179 CG LEU A 75 23.177 -28.523 -4.445 1.00 3.33 C ATOM 1180 CD1 LEU A 75 21.908 -29.323 -4.199 1.00 31.14 C ATOM 1181 CD2 LEU A 75 23.589 -27.772 -3.187 1.00 22.24 C ATOM 0 H LEU A 75 25.415 -27.808 -6.438 1.00 43.15 H new ATOM 0 HA LEU A 75 24.856 -30.628 -6.621 1.00 62.12 H new ATOM 0 HB2 LEU A 75 24.181 -30.412 -4.441 1.00 31.20 H new ATOM 0 HB3 LEU A 75 25.252 -29.030 -4.558 1.00 31.20 H new ATOM 0 HG LEU A 75 22.975 -27.794 -5.230 1.00 3.33 H new ATOM 0 HD11 LEU A 75 21.115 -28.654 -3.864 1.00 31.14 H new ATOM 0 HD12 LEU A 75 21.603 -29.814 -5.123 1.00 31.14 H new ATOM 0 HD13 LEU A 75 22.095 -30.075 -3.433 1.00 31.14 H new ATOM 0 HD21 LEU A 75 22.773 -27.125 -2.866 1.00 22.24 H new ATOM 0 HD22 LEU A 75 23.819 -28.486 -2.396 1.00 22.24 H new ATOM 0 HD23 LEU A 75 24.471 -27.167 -3.397 1.00 22.24 H new ATOM 1193 N LEU A 76 22.716 -28.513 -7.731 1.00 55.14 N ATOM 1194 CA LEU A 76 21.420 -28.354 -8.383 1.00 41.22 C ATOM 1195 C LEU A 76 21.194 -29.449 -9.421 1.00 23.15 C ATOM 1196 O LEU A 76 20.056 -29.794 -9.735 1.00 63.14 O ATOM 1197 CB LEU A 76 21.327 -26.979 -9.048 1.00 31.12 C ATOM 1198 CG LEU A 76 20.109 -26.134 -8.674 1.00 12.04 C ATOM 1199 CD1 LEU A 76 20.047 -25.924 -7.169 1.00 11.43 C ATOM 1200 CD2 LEU A 76 20.144 -24.797 -9.400 1.00 33.22 C ATOM 0 H LEU A 76 23.344 -27.717 -7.841 1.00 55.14 H new ATOM 0 HA LEU A 76 20.645 -28.436 -7.621 1.00 41.22 H new ATOM 0 HB2 LEU A 76 22.226 -26.415 -8.798 1.00 31.12 H new ATOM 0 HB3 LEU A 76 21.329 -27.119 -10.129 1.00 31.12 H new ATOM 0 HG LEU A 76 19.211 -26.669 -8.983 1.00 12.04 H new ATOM 0 HD11 LEU A 76 19.174 -25.320 -6.922 1.00 11.43 H new ATOM 0 HD12 LEU A 76 19.974 -26.890 -6.670 1.00 11.43 H new ATOM 0 HD13 LEU A 76 20.949 -25.411 -6.836 1.00 11.43 H new ATOM 0 HD21 LEU A 76 19.269 -24.209 -9.122 1.00 33.22 H new ATOM 0 HD22 LEU A 76 21.049 -24.256 -9.122 1.00 33.22 H new ATOM 0 HD23 LEU A 76 20.139 -24.967 -10.477 1.00 33.22 H new ATOM 1212 N ASN A 77 22.287 -29.993 -9.946 1.00 70.24 N ATOM 1213 CA ASN A 77 22.208 -31.051 -10.947 1.00 61.12 C ATOM 1214 C ASN A 77 22.194 -32.426 -10.286 1.00 10.23 C ATOM 1215 O ASN A 77 22.218 -33.454 -10.963 1.00 44.31 O ATOM 1216 CB ASN A 77 23.386 -30.952 -11.918 1.00 64.12 C ATOM 1217 CG ASN A 77 23.164 -29.905 -12.992 1.00 41.13 C ATOM 1218 OD1 ASN A 77 22.586 -30.189 -14.041 1.00 54.33 O ATOM 1219 ND2 ASN A 77 23.624 -28.686 -12.734 1.00 63.24 N ATOM 0 H ASN A 77 23.237 -29.719 -9.695 1.00 70.24 H new ATOM 0 HA ASN A 77 21.278 -30.924 -11.500 1.00 61.12 H new ATOM 0 HB2 ASN A 77 24.292 -30.712 -11.362 1.00 64.12 H new ATOM 0 HB3 ASN A 77 23.548 -31.922 -12.388 1.00 64.12 H new ATOM 0 HD21 ASN A 77 23.504 -27.940 -13.419 1.00 63.24 H new ATOM 0 HD22 ASN A 77 24.097 -28.496 -11.851 1.00 63.24 H new ATOM 1226 N LYS A 78 22.154 -32.437 -8.958 1.00 12.24 N ATOM 1227 CA LYS A 78 22.134 -33.684 -8.203 1.00 3.04 C ATOM 1228 C LYS A 78 20.758 -33.929 -7.593 1.00 31.34 C ATOM 1229 O LYS A 78 20.397 -35.066 -7.288 1.00 24.34 O ATOM 1230 CB LYS A 78 23.195 -33.653 -7.099 1.00 55.14 C ATOM 1231 CG LYS A 78 24.606 -33.439 -7.618 1.00 60.52 C ATOM 1232 CD LYS A 78 25.645 -33.947 -6.632 1.00 41.43 C ATOM 1233 CE LYS A 78 25.714 -35.466 -6.627 1.00 60.04 C ATOM 1234 NZ LYS A 78 26.716 -35.979 -7.602 1.00 51.14 N ATOM 0 H LYS A 78 22.135 -31.595 -8.382 1.00 12.24 H new ATOM 0 HA LYS A 78 22.357 -34.500 -8.891 1.00 3.04 H new ATOM 0 HB2 LYS A 78 22.951 -32.858 -6.395 1.00 55.14 H new ATOM 0 HB3 LYS A 78 23.159 -34.591 -6.545 1.00 55.14 H new ATOM 0 HG2 LYS A 78 24.726 -33.953 -8.572 1.00 60.52 H new ATOM 0 HG3 LYS A 78 24.769 -32.378 -7.805 1.00 60.52 H new ATOM 0 HD2 LYS A 78 26.622 -33.538 -6.889 1.00 41.43 H new ATOM 0 HD3 LYS A 78 25.403 -33.590 -5.631 1.00 41.43 H new ATOM 0 HE2 LYS A 78 25.969 -35.815 -5.626 1.00 60.04 H new ATOM 0 HE3 LYS A 78 24.732 -35.875 -6.866 1.00 60.04 H new ATOM 0 HZ1 LYS A 78 26.733 -37.018 -7.568 1.00 51.14 H new ATOM 0 HZ2 LYS A 78 26.459 -35.668 -8.560 1.00 51.14 H new ATOM 0 HZ3 LYS A 78 27.657 -35.610 -7.359 1.00 51.14 H new ATOM 1248 N ASP A 79 19.993 -32.857 -7.419 1.00 63.00 N ATOM 1249 CA ASP A 79 18.655 -32.956 -6.848 1.00 21.51 C ATOM 1250 C ASP A 79 17.714 -33.697 -7.794 1.00 4.34 C ATOM 1251 O ASP A 79 16.657 -34.178 -7.384 1.00 11.41 O ATOM 1252 CB ASP A 79 18.102 -31.563 -6.545 1.00 73.14 C ATOM 1253 CG ASP A 79 19.068 -30.719 -5.738 1.00 30.24 C ATOM 1254 OD1 ASP A 79 19.853 -31.298 -4.957 1.00 35.20 O ATOM 1255 OD2 ASP A 79 19.040 -29.480 -5.887 1.00 3.13 O ATOM 0 H ASP A 79 20.277 -31.909 -7.665 1.00 63.00 H new ATOM 0 HA ASP A 79 18.724 -33.520 -5.918 1.00 21.51 H new ATOM 0 HB2 ASP A 79 17.875 -31.054 -7.482 1.00 73.14 H new ATOM 0 HB3 ASP A 79 17.164 -31.659 -5.998 1.00 73.14 H new ATOM 1260 N LEU A 80 18.105 -33.784 -9.060 1.00 42.32 N ATOM 1261 CA LEU A 80 17.296 -34.465 -10.065 1.00 44.44 C ATOM 1262 C LEU A 80 17.960 -35.764 -10.509 1.00 71.40 C ATOM 1263 O LEU A 80 17.314 -36.636 -11.090 1.00 34.04 O ATOM 1264 CB LEU A 80 17.076 -33.553 -11.274 1.00 34.12 C ATOM 1265 CG LEU A 80 18.203 -32.569 -11.587 1.00 11.52 C ATOM 1266 CD1 LEU A 80 19.489 -33.314 -11.909 1.00 75.13 C ATOM 1267 CD2 LEU A 80 17.810 -31.656 -12.740 1.00 34.43 C ATOM 0 H LEU A 80 18.977 -33.392 -9.415 1.00 42.32 H new ATOM 0 HA LEU A 80 16.331 -34.705 -9.618 1.00 44.44 H new ATOM 0 HB2 LEU A 80 16.914 -34.179 -12.151 1.00 34.12 H new ATOM 0 HB3 LEU A 80 16.159 -32.985 -11.113 1.00 34.12 H new ATOM 0 HG LEU A 80 18.376 -31.953 -10.705 1.00 11.52 H new ATOM 0 HD11 LEU A 80 20.280 -32.597 -12.129 1.00 75.13 H new ATOM 0 HD12 LEU A 80 19.780 -33.924 -11.054 1.00 75.13 H new ATOM 0 HD13 LEU A 80 19.330 -33.956 -12.775 1.00 75.13 H new ATOM 0 HD21 LEU A 80 18.624 -30.962 -12.949 1.00 34.43 H new ATOM 0 HD22 LEU A 80 17.608 -32.256 -13.627 1.00 34.43 H new ATOM 0 HD23 LEU A 80 16.915 -31.095 -12.471 1.00 34.43 H new ATOM 1279 N ALA A 81 19.253 -35.888 -10.230 1.00 3.14 N ATOM 1280 CA ALA A 81 20.003 -37.083 -10.596 1.00 2.11 C ATOM 1281 C ALA A 81 19.401 -38.327 -9.952 1.00 65.53 C ATOM 1282 O ALA A 81 19.521 -39.431 -10.483 1.00 44.03 O ATOM 1283 CB ALA A 81 21.463 -36.933 -10.196 1.00 5.14 C ATOM 0 H ALA A 81 19.803 -35.175 -9.751 1.00 3.14 H new ATOM 0 HA ALA A 81 19.945 -37.202 -11.678 1.00 2.11 H new ATOM 0 HB1 ALA A 81 22.011 -37.833 -10.475 1.00 5.14 H new ATOM 0 HB2 ALA A 81 21.894 -36.072 -10.707 1.00 5.14 H new ATOM 0 HB3 ALA A 81 21.532 -36.786 -9.118 1.00 5.14 H new ATOM 1289 N GLU A 82 18.755 -38.142 -8.806 1.00 0.54 N ATOM 1290 CA GLU A 82 18.136 -39.251 -8.090 1.00 3.13 C ATOM 1291 C GLU A 82 16.671 -39.405 -8.487 1.00 61.43 C ATOM 1292 O GLU A 82 16.130 -40.512 -8.491 1.00 22.10 O ATOM 1293 CB GLU A 82 18.246 -39.037 -6.579 1.00 2.43 C ATOM 1294 CG GLU A 82 19.655 -38.714 -6.111 1.00 3.23 C ATOM 1295 CD GLU A 82 19.718 -38.383 -4.632 1.00 74.41 C ATOM 1296 OE1 GLU A 82 19.216 -37.307 -4.244 1.00 21.54 O ATOM 1297 OE2 GLU A 82 20.268 -39.200 -3.864 1.00 15.32 O ATOM 0 H GLU A 82 18.646 -37.235 -8.353 1.00 0.54 H new ATOM 0 HA GLU A 82 18.666 -40.164 -8.360 1.00 3.13 H new ATOM 0 HB2 GLU A 82 17.580 -38.225 -6.286 1.00 2.43 H new ATOM 0 HB3 GLU A 82 17.899 -39.935 -6.067 1.00 2.43 H new ATOM 0 HG2 GLU A 82 20.306 -39.564 -6.317 1.00 3.23 H new ATOM 0 HG3 GLU A 82 20.040 -37.871 -6.685 1.00 3.23 H new ATOM 1304 N LEU A 83 16.034 -38.288 -8.821 1.00 30.52 N ATOM 1305 CA LEU A 83 14.631 -38.298 -9.220 1.00 32.02 C ATOM 1306 C LEU A 83 14.448 -39.022 -10.550 1.00 12.21 C ATOM 1307 O LEU A 83 13.604 -39.910 -10.673 1.00 55.34 O ATOM 1308 CB LEU A 83 14.101 -36.867 -9.328 1.00 22.02 C ATOM 1309 CG LEU A 83 12.847 -36.678 -10.181 1.00 75.32 C ATOM 1310 CD1 LEU A 83 11.753 -37.640 -9.743 1.00 10.14 C ATOM 1311 CD2 LEU A 83 12.358 -35.239 -10.100 1.00 70.44 C ATOM 0 H LEU A 83 16.467 -37.364 -8.823 1.00 30.52 H new ATOM 0 HA LEU A 83 14.065 -38.832 -8.456 1.00 32.02 H new ATOM 0 HB2 LEU A 83 13.890 -36.502 -8.323 1.00 22.02 H new ATOM 0 HB3 LEU A 83 14.892 -36.238 -9.736 1.00 22.02 H new ATOM 0 HG LEU A 83 13.101 -36.897 -11.218 1.00 75.32 H new ATOM 0 HD11 LEU A 83 10.868 -37.491 -10.362 1.00 10.14 H new ATOM 0 HD12 LEU A 83 12.105 -38.666 -9.854 1.00 10.14 H new ATOM 0 HD13 LEU A 83 11.501 -37.454 -8.699 1.00 10.14 H new ATOM 0 HD21 LEU A 83 11.465 -35.123 -10.714 1.00 70.44 H new ATOM 0 HD22 LEU A 83 12.122 -34.993 -9.065 1.00 70.44 H new ATOM 0 HD23 LEU A 83 13.137 -34.569 -10.464 1.00 70.44 H new ATOM 1323 N ILE A 84 15.245 -38.638 -11.541 1.00 62.00 N ATOM 1324 CA ILE A 84 15.173 -39.253 -12.861 1.00 1.14 C ATOM 1325 C ILE A 84 15.554 -40.728 -12.801 1.00 74.41 C ATOM 1326 O ILE A 84 14.787 -41.595 -13.219 1.00 13.20 O ATOM 1327 CB ILE A 84 16.094 -38.537 -13.866 1.00 71.03 C ATOM 1328 CG1 ILE A 84 15.704 -37.063 -13.988 1.00 54.45 C ATOM 1329 CG2 ILE A 84 16.030 -39.222 -15.223 1.00 52.34 C ATOM 1330 CD1 ILE A 84 16.824 -36.181 -14.495 1.00 75.13 C ATOM 0 H ILE A 84 15.948 -37.904 -11.455 1.00 62.00 H new ATOM 0 HA ILE A 84 14.140 -39.160 -13.197 1.00 1.14 H new ATOM 0 HB ILE A 84 17.119 -38.592 -13.501 1.00 71.03 H new ATOM 0 HG12 ILE A 84 14.851 -36.976 -14.661 1.00 54.45 H new ATOM 0 HG13 ILE A 84 15.379 -36.700 -13.013 1.00 54.45 H new ATOM 0 HG21 ILE A 84 16.686 -38.705 -15.923 1.00 52.34 H new ATOM 0 HG22 ILE A 84 16.351 -40.259 -15.123 1.00 52.34 H new ATOM 0 HG23 ILE A 84 15.006 -39.194 -15.597 1.00 52.34 H new ATOM 0 HD11 ILE A 84 16.476 -35.150 -14.556 1.00 75.13 H new ATOM 0 HD12 ILE A 84 17.670 -36.238 -13.811 1.00 75.13 H new ATOM 0 HD13 ILE A 84 17.134 -36.519 -15.484 1.00 75.13 H new ATOM 1342 N ASN A 85 16.743 -41.006 -12.277 1.00 31.51 N ATOM 1343 CA ASN A 85 17.225 -42.378 -12.161 1.00 42.10 C ATOM 1344 C ASN A 85 16.195 -43.260 -11.462 1.00 52.23 C ATOM 1345 O ASN A 85 15.884 -44.358 -11.925 1.00 44.43 O ATOM 1346 CB ASN A 85 18.548 -42.412 -11.392 1.00 74.22 C ATOM 1347 CG ASN A 85 19.742 -42.127 -12.283 1.00 34.05 C ATOM 1348 OD1 ASN A 85 20.582 -42.997 -12.510 1.00 23.10 O ATOM 1349 ND2 ASN A 85 19.821 -40.903 -12.791 1.00 3.10 N ATOM 0 H ASN A 85 17.390 -40.300 -11.926 1.00 31.51 H new ATOM 0 HA ASN A 85 17.386 -42.766 -13.167 1.00 42.10 H new ATOM 0 HB2 ASN A 85 18.516 -41.678 -10.586 1.00 74.22 H new ATOM 0 HB3 ASN A 85 18.670 -43.390 -10.927 1.00 74.22 H new ATOM 0 HD21 ASN A 85 20.602 -40.652 -13.397 1.00 3.10 H new ATOM 0 HD22 ASN A 85 19.101 -40.214 -12.575 1.00 3.10 H new ATOM 1356 N LYS A 86 15.667 -42.772 -10.345 1.00 10.31 N ATOM 1357 CA LYS A 86 14.670 -43.513 -9.582 1.00 12.12 C ATOM 1358 C LYS A 86 13.376 -43.661 -10.376 1.00 63.04 C ATOM 1359 O LYS A 86 12.596 -44.583 -10.143 1.00 32.41 O ATOM 1360 CB LYS A 86 14.387 -42.808 -8.253 1.00 71.12 C ATOM 1361 CG LYS A 86 13.585 -43.650 -7.277 1.00 32.55 C ATOM 1362 CD LYS A 86 14.482 -44.574 -6.470 1.00 34.34 C ATOM 1363 CE LYS A 86 13.774 -45.876 -6.124 1.00 3.32 C ATOM 1364 NZ LYS A 86 14.251 -46.440 -4.831 1.00 3.42 N ATOM 0 H LYS A 86 15.913 -41.865 -9.948 1.00 10.31 H new ATOM 0 HA LYS A 86 15.068 -44.508 -9.382 1.00 12.12 H new ATOM 0 HB2 LYS A 86 15.334 -42.532 -7.789 1.00 71.12 H new ATOM 0 HB3 LYS A 86 13.847 -41.882 -8.450 1.00 71.12 H new ATOM 0 HG2 LYS A 86 13.031 -42.998 -6.602 1.00 32.55 H new ATOM 0 HG3 LYS A 86 12.850 -44.241 -7.823 1.00 32.55 H new ATOM 0 HD2 LYS A 86 15.387 -44.790 -7.037 1.00 34.34 H new ATOM 0 HD3 LYS A 86 14.792 -44.072 -5.553 1.00 34.34 H new ATOM 0 HE2 LYS A 86 12.699 -45.702 -6.070 1.00 3.32 H new ATOM 0 HE3 LYS A 86 13.939 -46.602 -6.920 1.00 3.32 H new ATOM 0 HZ1 LYS A 86 13.709 -47.299 -4.606 1.00 3.42 H new ATOM 0 HZ2 LYS A 86 15.261 -46.678 -4.907 1.00 3.42 H new ATOM 0 HZ3 LYS A 86 14.117 -45.738 -4.075 1.00 3.42 H new ATOM 1378 N MET A 87 13.157 -42.748 -11.317 1.00 13.35 N ATOM 1379 CA MET A 87 11.959 -42.779 -12.147 1.00 74.32 C ATOM 1380 C MET A 87 11.986 -43.973 -13.096 1.00 22.51 C ATOM 1381 O MET A 87 11.168 -44.887 -12.983 1.00 5.22 O ATOM 1382 CB MET A 87 11.832 -41.481 -12.947 1.00 12.05 C ATOM 1383 CG MET A 87 10.405 -40.965 -13.045 1.00 44.11 C ATOM 1384 SD MET A 87 9.259 -42.207 -13.673 1.00 21.34 S ATOM 1385 CE MET A 87 9.587 -42.113 -15.431 1.00 31.11 C ATOM 0 H MET A 87 13.793 -41.978 -11.523 1.00 13.35 H new ATOM 0 HA MET A 87 11.095 -42.878 -11.490 1.00 74.32 H new ATOM 0 HB2 MET A 87 12.455 -40.716 -12.484 1.00 12.05 H new ATOM 0 HB3 MET A 87 12.221 -41.644 -13.952 1.00 12.05 H new ATOM 0 HG2 MET A 87 10.074 -40.635 -12.060 1.00 44.11 H new ATOM 0 HG3 MET A 87 10.382 -40.092 -13.698 1.00 44.11 H new ATOM 0 HE1 MET A 87 8.978 -42.850 -15.955 1.00 31.11 H new ATOM 0 HE2 MET A 87 9.341 -41.115 -15.794 1.00 31.11 H new ATOM 0 HE3 MET A 87 10.642 -42.317 -15.616 1.00 31.11 H new ATOM 1395 N ARG A 88 12.931 -43.959 -14.030 1.00 60.54 N ATOM 1396 CA ARG A 88 13.063 -45.041 -14.999 1.00 44.34 C ATOM 1397 C ARG A 88 13.186 -46.389 -14.296 1.00 21.21 C ATOM 1398 O ARG A 88 12.820 -47.426 -14.850 1.00 63.54 O ATOM 1399 CB ARG A 88 14.283 -44.807 -15.893 1.00 53.11 C ATOM 1400 CG ARG A 88 15.594 -44.735 -15.128 1.00 11.42 C ATOM 1401 CD ARG A 88 16.778 -44.565 -16.066 1.00 42.44 C ATOM 1402 NE ARG A 88 18.051 -44.589 -15.351 1.00 63.34 N ATOM 1403 CZ ARG A 88 18.640 -45.706 -14.937 1.00 13.34 C ATOM 1404 NH1 ARG A 88 18.073 -46.882 -15.165 1.00 74.20 N ATOM 1405 NH2 ARG A 88 19.798 -45.647 -14.292 1.00 42.42 N ATOM 0 H ARG A 88 13.616 -43.211 -14.137 1.00 60.54 H new ATOM 0 HA ARG A 88 12.165 -45.054 -15.616 1.00 44.34 H new ATOM 0 HB2 ARG A 88 14.344 -45.610 -16.627 1.00 53.11 H new ATOM 0 HB3 ARG A 88 14.144 -43.879 -16.447 1.00 53.11 H new ATOM 0 HG2 ARG A 88 15.562 -43.901 -14.426 1.00 11.42 H new ATOM 0 HG3 ARG A 88 15.723 -45.643 -14.539 1.00 11.42 H new ATOM 0 HD2 ARG A 88 16.766 -45.360 -16.812 1.00 42.44 H new ATOM 0 HD3 ARG A 88 16.682 -43.622 -16.604 1.00 42.44 H new ATOM 0 HE ARG A 88 18.513 -43.700 -15.159 1.00 63.34 H new ATOM 0 HH11 ARG A 88 17.182 -46.931 -15.659 1.00 74.20 H new ATOM 0 HH12 ARG A 88 18.527 -47.738 -14.846 1.00 74.20 H new ATOM 0 HH21 ARG A 88 20.237 -44.744 -14.114 1.00 42.42 H new ATOM 0 HH22 ARG A 88 20.249 -46.505 -13.975 1.00 42.42 H new ATOM 1419 N LEU A 89 13.703 -46.367 -13.073 1.00 24.35 N ATOM 1420 CA LEU A 89 13.875 -47.588 -12.293 1.00 22.15 C ATOM 1421 C LEU A 89 12.551 -48.034 -11.681 1.00 21.23 C ATOM 1422 O LEU A 89 12.320 -49.226 -11.478 1.00 51.20 O ATOM 1423 CB LEU A 89 14.912 -47.370 -11.189 1.00 61.12 C ATOM 1424 CG LEU A 89 14.931 -48.412 -10.070 1.00 73.13 C ATOM 1425 CD1 LEU A 89 15.348 -49.770 -10.613 1.00 33.34 C ATOM 1426 CD2 LEU A 89 15.862 -47.974 -8.949 1.00 63.44 C ATOM 0 H LEU A 89 14.011 -45.517 -12.600 1.00 24.35 H new ATOM 0 HA LEU A 89 14.227 -48.372 -12.964 1.00 22.15 H new ATOM 0 HB2 LEU A 89 15.900 -47.341 -11.647 1.00 61.12 H new ATOM 0 HB3 LEU A 89 14.738 -46.391 -10.743 1.00 61.12 H new ATOM 0 HG LEU A 89 13.923 -48.500 -9.664 1.00 73.13 H new ATOM 0 HD11 LEU A 89 15.356 -50.499 -9.803 1.00 33.34 H new ATOM 0 HD12 LEU A 89 14.642 -50.088 -11.380 1.00 33.34 H new ATOM 0 HD13 LEU A 89 16.346 -49.698 -11.046 1.00 33.34 H new ATOM 0 HD21 LEU A 89 15.863 -48.728 -8.161 1.00 63.44 H new ATOM 0 HD22 LEU A 89 16.873 -47.857 -9.340 1.00 63.44 H new ATOM 0 HD23 LEU A 89 15.518 -47.023 -8.541 1.00 63.44 H new ATOM 1438 N ALA A 90 11.684 -47.069 -11.391 1.00 23.53 N ATOM 1439 CA ALA A 90 10.382 -47.363 -10.806 1.00 73.23 C ATOM 1440 C ALA A 90 9.507 -48.145 -11.780 1.00 72.13 C ATOM 1441 O ALA A 90 9.017 -49.227 -11.457 1.00 11.31 O ATOM 1442 CB ALA A 90 9.688 -46.075 -10.388 1.00 62.02 C ATOM 0 H ALA A 90 11.860 -46.077 -11.552 1.00 23.53 H new ATOM 0 HA ALA A 90 10.540 -47.981 -9.922 1.00 73.23 H new ATOM 0 HB1 ALA A 90 8.717 -46.310 -9.953 1.00 62.02 H new ATOM 0 HB2 ALA A 90 10.300 -45.555 -9.651 1.00 62.02 H new ATOM 0 HB3 ALA A 90 9.550 -45.436 -11.261 1.00 62.02 H new ATOM 1448 N GLN A 91 9.315 -47.590 -12.973 1.00 34.04 N ATOM 1449 CA GLN A 91 8.497 -48.236 -13.993 1.00 20.05 C ATOM 1450 C GLN A 91 9.028 -49.629 -14.314 1.00 31.20 C ATOM 1451 O GLN A 91 8.288 -50.491 -14.787 1.00 33.13 O ATOM 1452 CB GLN A 91 8.462 -47.385 -15.263 1.00 44.20 C ATOM 1453 CG GLN A 91 9.762 -47.415 -16.051 1.00 71.02 C ATOM 1454 CD GLN A 91 9.786 -46.399 -17.176 1.00 70.11 C ATOM 1455 OE1 GLN A 91 9.651 -45.125 -16.827 1.00 32.12 O flip ATOM 1456 NE2 GLN A 91 9.924 -46.755 -18.347 1.00 24.15 N flip ATOM 0 H GLN A 91 9.714 -46.695 -13.257 1.00 34.04 H new ATOM 0 HA GLN A 91 7.484 -48.334 -13.603 1.00 20.05 H new ATOM 0 HB2 GLN A 91 7.651 -47.734 -15.902 1.00 44.20 H new ATOM 0 HB3 GLN A 91 8.234 -46.354 -14.993 1.00 44.20 H new ATOM 0 HG2 GLN A 91 10.596 -47.224 -15.376 1.00 71.02 H new ATOM 0 HG3 GLN A 91 9.909 -48.413 -16.464 1.00 71.02 H new ATOM 0 HE21 GLN A 91 10.024 -47.745 -18.571 1.00 24.15 H new ATOM 0 HE22 GLN A 91 9.938 -46.060 -19.093 1.00 24.15 H new ATOM 1465 N GLN A 92 10.314 -49.841 -14.054 1.00 61.45 N ATOM 1466 CA GLN A 92 10.943 -51.130 -14.318 1.00 24.03 C ATOM 1467 C GLN A 92 10.147 -52.265 -13.681 1.00 45.32 C ATOM 1468 O GLN A 92 9.631 -52.128 -12.573 1.00 25.11 O ATOM 1469 CB GLN A 92 12.378 -51.138 -13.788 1.00 64.20 C ATOM 1470 CG GLN A 92 13.305 -52.067 -14.555 1.00 71.54 C ATOM 1471 CD GLN A 92 14.752 -51.938 -14.122 1.00 12.31 C ATOM 1472 OE1 GLN A 92 15.348 -52.889 -13.615 1.00 53.40 O ATOM 1473 NE2 GLN A 92 15.326 -50.757 -14.319 1.00 54.44 N ATOM 0 H GLN A 92 10.940 -49.138 -13.661 1.00 61.45 H new ATOM 0 HA GLN A 92 10.960 -51.284 -15.397 1.00 24.03 H new ATOM 0 HB2 GLN A 92 12.777 -50.125 -13.829 1.00 64.20 H new ATOM 0 HB3 GLN A 92 12.367 -51.434 -12.739 1.00 64.20 H new ATOM 0 HG2 GLN A 92 12.978 -53.097 -14.414 1.00 71.54 H new ATOM 0 HG3 GLN A 92 13.228 -51.851 -15.621 1.00 71.54 H new ATOM 0 HE21 GLN A 92 14.795 -49.996 -14.743 1.00 54.44 H new ATOM 0 HE22 GLN A 92 16.298 -50.611 -14.047 1.00 54.44 H new ATOM 1482 N ASN A 93 10.052 -53.385 -14.391 1.00 1.53 N ATOM 1483 CA ASN A 93 9.318 -54.543 -13.895 1.00 72.12 C ATOM 1484 C ASN A 93 10.050 -55.191 -12.724 1.00 14.55 C ATOM 1485 O ASN A 93 10.808 -56.143 -12.902 1.00 42.12 O ATOM 1486 CB ASN A 93 9.121 -55.566 -15.016 1.00 11.20 C ATOM 1487 CG ASN A 93 7.986 -55.190 -15.949 1.00 34.14 C ATOM 1488 OD1 ASN A 93 6.923 -55.812 -15.933 1.00 42.11 O ATOM 1489 ND2 ASN A 93 8.206 -54.168 -16.767 1.00 62.02 N ATOM 0 H ASN A 93 10.474 -53.515 -15.311 1.00 1.53 H new ATOM 0 HA ASN A 93 8.343 -54.202 -13.547 1.00 72.12 H new ATOM 0 HB2 ASN A 93 10.044 -55.656 -15.589 1.00 11.20 H new ATOM 0 HB3 ASN A 93 8.920 -56.545 -14.580 1.00 11.20 H new ATOM 0 HD21 ASN A 93 7.479 -53.869 -17.417 1.00 62.02 H new ATOM 0 HD22 ASN A 93 9.102 -53.682 -16.746 1.00 62.02 H new ATOM 1496 N ALA A 94 9.816 -54.667 -11.525 1.00 13.24 N ATOM 1497 CA ALA A 94 10.450 -55.195 -10.323 1.00 41.03 C ATOM 1498 C ALA A 94 9.415 -55.780 -9.368 1.00 4.42 C ATOM 1499 O ALA A 94 8.812 -55.059 -8.573 1.00 42.50 O ATOM 1500 CB ALA A 94 11.256 -54.107 -9.630 1.00 1.50 C ATOM 0 H ALA A 94 9.192 -53.877 -11.360 1.00 13.24 H new ATOM 0 HA ALA A 94 11.125 -55.997 -10.621 1.00 41.03 H new ATOM 0 HB1 ALA A 94 11.724 -54.515 -8.734 1.00 1.50 H new ATOM 0 HB2 ALA A 94 12.027 -53.739 -10.306 1.00 1.50 H new ATOM 0 HB3 ALA A 94 10.595 -53.286 -9.352 1.00 1.50 H new ATOM 1506 N VAL A 95 9.214 -57.091 -9.451 1.00 40.11 N ATOM 1507 CA VAL A 95 8.252 -57.773 -8.593 1.00 41.43 C ATOM 1508 C VAL A 95 8.585 -57.565 -7.120 1.00 45.13 C ATOM 1509 O VAL A 95 7.711 -57.643 -6.257 1.00 20.34 O ATOM 1510 CB VAL A 95 8.207 -59.283 -8.890 1.00 62.32 C ATOM 1511 CG1 VAL A 95 7.124 -59.958 -8.063 1.00 30.33 C ATOM 1512 CG2 VAL A 95 7.985 -59.528 -10.375 1.00 43.32 C ATOM 0 H VAL A 95 9.704 -57.702 -10.104 1.00 40.11 H new ATOM 0 HA VAL A 95 7.275 -57.339 -8.806 1.00 41.43 H new ATOM 0 HB VAL A 95 9.167 -59.718 -8.613 1.00 62.32 H new ATOM 0 HG11 VAL A 95 7.107 -61.025 -8.286 1.00 30.33 H new ATOM 0 HG12 VAL A 95 7.332 -59.813 -7.003 1.00 30.33 H new ATOM 0 HG13 VAL A 95 6.155 -59.521 -8.306 1.00 30.33 H new ATOM 0 HG21 VAL A 95 7.956 -60.601 -10.566 1.00 43.32 H new ATOM 0 HG22 VAL A 95 7.040 -59.079 -10.681 1.00 43.32 H new ATOM 0 HG23 VAL A 95 8.800 -59.080 -10.944 1.00 43.32 H new ATOM 1522 N THR A 96 9.857 -57.299 -6.839 1.00 3.23 N ATOM 1523 CA THR A 96 10.307 -57.080 -5.470 1.00 25.10 C ATOM 1524 C THR A 96 9.464 -56.016 -4.777 1.00 43.12 C ATOM 1525 O THR A 96 9.031 -55.049 -5.403 1.00 42.34 O ATOM 1526 CB THR A 96 11.787 -56.655 -5.426 1.00 64.05 C ATOM 1527 OG1 THR A 96 12.526 -57.349 -6.438 1.00 4.12 O ATOM 1528 CG2 THR A 96 12.393 -56.943 -4.061 1.00 42.11 C ATOM 0 H THR A 96 10.593 -57.230 -7.541 1.00 3.23 H new ATOM 0 HA THR A 96 10.193 -58.028 -4.945 1.00 25.10 H new ATOM 0 HB THR A 96 11.839 -55.582 -5.610 1.00 64.05 H new ATOM 0 HG1 THR A 96 13.466 -57.072 -6.405 1.00 4.12 H new ATOM 0 HG21 THR A 96 13.438 -56.634 -4.055 1.00 42.11 H new ATOM 0 HG22 THR A 96 11.847 -56.390 -3.297 1.00 42.11 H new ATOM 0 HG23 THR A 96 12.329 -58.011 -3.852 1.00 42.11 H new ATOM 1536 N SER A 97 9.235 -56.200 -3.481 1.00 23.11 N ATOM 1537 CA SER A 97 8.441 -55.256 -2.703 1.00 74.53 C ATOM 1538 C SER A 97 9.041 -53.855 -2.771 1.00 72.55 C ATOM 1539 O SER A 97 8.345 -52.859 -2.573 1.00 53.31 O ATOM 1540 CB SER A 97 8.349 -55.714 -1.246 1.00 54.13 C ATOM 1541 OG SER A 97 9.634 -55.801 -0.657 1.00 3.31 O ATOM 0 H SER A 97 9.588 -56.994 -2.947 1.00 23.11 H new ATOM 0 HA SER A 97 7.439 -55.224 -3.130 1.00 74.53 H new ATOM 0 HB2 SER A 97 7.733 -55.015 -0.680 1.00 54.13 H new ATOM 0 HB3 SER A 97 7.857 -56.685 -1.197 1.00 54.13 H new ATOM 0 HG SER A 97 9.548 -56.094 0.274 1.00 3.31 H new ATOM 1547 N LEU A 98 10.337 -53.787 -3.053 1.00 62.32 N ATOM 1548 CA LEU A 98 11.033 -52.509 -3.148 1.00 44.20 C ATOM 1549 C LEU A 98 10.322 -51.572 -4.120 1.00 25.51 C ATOM 1550 O LEU A 98 10.391 -50.351 -3.983 1.00 71.10 O ATOM 1551 CB LEU A 98 12.480 -52.725 -3.596 1.00 73.33 C ATOM 1552 CG LEU A 98 13.508 -51.736 -3.046 1.00 61.52 C ATOM 1553 CD1 LEU A 98 14.921 -52.238 -3.302 1.00 31.35 C ATOM 1554 CD2 LEU A 98 13.309 -50.361 -3.665 1.00 10.52 C ATOM 0 H LEU A 98 10.927 -54.602 -3.220 1.00 62.32 H new ATOM 0 HA LEU A 98 11.030 -52.048 -2.160 1.00 44.20 H new ATOM 0 HB2 LEU A 98 12.783 -53.731 -3.306 1.00 73.33 H new ATOM 0 HB3 LEU A 98 12.512 -52.684 -4.685 1.00 73.33 H new ATOM 0 HG LEU A 98 13.363 -51.652 -1.969 1.00 61.52 H new ATOM 0 HD11 LEU A 98 15.639 -51.521 -2.904 1.00 31.35 H new ATOM 0 HD12 LEU A 98 15.059 -53.201 -2.811 1.00 31.35 H new ATOM 0 HD13 LEU A 98 15.078 -52.351 -4.375 1.00 31.35 H new ATOM 0 HD21 LEU A 98 14.049 -49.670 -3.262 1.00 10.52 H new ATOM 0 HD22 LEU A 98 13.426 -50.428 -4.747 1.00 10.52 H new ATOM 0 HD23 LEU A 98 12.308 -49.998 -3.431 1.00 10.52 H new ATOM 1566 N SER A 99 9.639 -52.154 -5.100 1.00 55.33 N ATOM 1567 CA SER A 99 8.916 -51.371 -6.096 1.00 72.33 C ATOM 1568 C SER A 99 7.997 -50.354 -5.426 1.00 71.40 C ATOM 1569 O SER A 99 8.019 -49.170 -5.757 1.00 44.51 O ATOM 1570 CB SER A 99 8.099 -52.292 -7.005 1.00 23.31 C ATOM 1571 OG SER A 99 8.744 -52.480 -8.253 1.00 0.12 O ATOM 0 H SER A 99 9.571 -53.164 -5.226 1.00 55.33 H new ATOM 0 HA SER A 99 9.647 -50.832 -6.699 1.00 72.33 H new ATOM 0 HB2 SER A 99 7.956 -53.256 -6.517 1.00 23.31 H new ATOM 0 HB3 SER A 99 7.109 -51.866 -7.165 1.00 23.31 H new ATOM 0 HG SER A 99 8.574 -53.390 -8.575 1.00 0.12 H new ATOM 1577 N GLU A 100 7.190 -50.828 -4.482 1.00 14.32 N ATOM 1578 CA GLU A 100 6.262 -49.960 -3.765 1.00 61.14 C ATOM 1579 C GLU A 100 6.999 -48.789 -3.122 1.00 22.11 C ATOM 1580 O GLU A 100 6.526 -47.653 -3.152 1.00 23.50 O ATOM 1581 CB GLU A 100 5.510 -50.754 -2.695 1.00 10.31 C ATOM 1582 CG GLU A 100 4.525 -51.761 -3.264 1.00 23.41 C ATOM 1583 CD GLU A 100 3.147 -51.169 -3.487 1.00 4.24 C ATOM 1584 OE1 GLU A 100 2.691 -50.389 -2.624 1.00 30.41 O ATOM 1585 OE2 GLU A 100 2.526 -51.484 -4.522 1.00 74.24 O ATOM 0 H GLU A 100 7.160 -51.807 -4.196 1.00 14.32 H new ATOM 0 HA GLU A 100 5.545 -49.564 -4.484 1.00 61.14 H new ATOM 0 HB2 GLU A 100 6.232 -51.279 -2.069 1.00 10.31 H new ATOM 0 HB3 GLU A 100 4.974 -50.059 -2.049 1.00 10.31 H new ATOM 0 HG2 GLU A 100 4.909 -52.144 -4.209 1.00 23.41 H new ATOM 0 HG3 GLU A 100 4.446 -52.610 -2.585 1.00 23.41 H new ATOM 1592 N GLU A 101 8.160 -49.076 -2.540 1.00 53.42 N ATOM 1593 CA GLU A 101 8.961 -48.047 -1.888 1.00 42.43 C ATOM 1594 C GLU A 101 9.551 -47.085 -2.915 1.00 43.54 C ATOM 1595 O GLU A 101 9.645 -45.882 -2.673 1.00 1.33 O ATOM 1596 CB GLU A 101 10.084 -48.686 -1.069 1.00 32.25 C ATOM 1597 CG GLU A 101 11.096 -47.685 -0.538 1.00 21.25 C ATOM 1598 CD GLU A 101 12.114 -48.321 0.390 1.00 15.40 C ATOM 1599 OE1 GLU A 101 12.541 -49.460 0.109 1.00 31.23 O ATOM 1600 OE2 GLU A 101 12.482 -47.679 1.396 1.00 61.30 O ATOM 0 H GLU A 101 8.566 -50.011 -2.507 1.00 53.42 H new ATOM 0 HA GLU A 101 8.309 -47.484 -1.220 1.00 42.43 H new ATOM 0 HB2 GLU A 101 9.647 -49.228 -0.230 1.00 32.25 H new ATOM 0 HB3 GLU A 101 10.601 -49.419 -1.688 1.00 32.25 H new ATOM 0 HG2 GLU A 101 11.615 -47.219 -1.376 1.00 21.25 H new ATOM 0 HG3 GLU A 101 10.572 -46.891 -0.007 1.00 21.25 H new ATOM 1607 N ALA A 102 9.948 -47.624 -4.063 1.00 62.22 N ATOM 1608 CA ALA A 102 10.528 -46.815 -5.128 1.00 12.31 C ATOM 1609 C ALA A 102 9.499 -45.849 -5.705 1.00 53.32 C ATOM 1610 O ALA A 102 9.852 -44.819 -6.281 1.00 22.50 O ATOM 1611 CB ALA A 102 11.089 -47.708 -6.224 1.00 62.11 C ATOM 0 H ALA A 102 9.878 -48.618 -4.279 1.00 62.22 H new ATOM 0 HA ALA A 102 11.341 -46.227 -4.702 1.00 12.31 H new ATOM 0 HB1 ALA A 102 11.519 -47.090 -7.012 1.00 62.11 H new ATOM 0 HB2 ALA A 102 11.862 -48.354 -5.807 1.00 62.11 H new ATOM 0 HB3 ALA A 102 10.289 -48.321 -6.639 1.00 62.11 H new ATOM 1617 N LYS A 103 8.223 -46.187 -5.548 1.00 44.04 N ATOM 1618 CA LYS A 103 7.142 -45.350 -6.053 1.00 54.13 C ATOM 1619 C LYS A 103 7.065 -44.036 -5.282 1.00 33.31 C ATOM 1620 O LYS A 103 6.659 -43.009 -5.826 1.00 3.01 O ATOM 1621 CB LYS A 103 5.806 -46.091 -5.954 1.00 25.14 C ATOM 1622 CG LYS A 103 4.602 -45.218 -6.258 1.00 53.25 C ATOM 1623 CD LYS A 103 3.518 -45.996 -6.986 1.00 22.45 C ATOM 1624 CE LYS A 103 3.564 -45.747 -8.485 1.00 61.53 C ATOM 1625 NZ LYS A 103 2.675 -44.623 -8.888 1.00 43.43 N ATOM 0 H LYS A 103 7.913 -47.036 -5.075 1.00 44.04 H new ATOM 0 HA LYS A 103 7.349 -45.125 -7.099 1.00 54.13 H new ATOM 0 HB2 LYS A 103 5.816 -46.934 -6.644 1.00 25.14 H new ATOM 0 HB3 LYS A 103 5.702 -46.502 -4.950 1.00 25.14 H new ATOM 0 HG2 LYS A 103 4.200 -44.815 -5.329 1.00 53.25 H new ATOM 0 HG3 LYS A 103 4.912 -44.368 -6.866 1.00 53.25 H new ATOM 0 HD2 LYS A 103 3.639 -47.061 -6.789 1.00 22.45 H new ATOM 0 HD3 LYS A 103 2.540 -45.709 -6.598 1.00 22.45 H new ATOM 0 HE2 LYS A 103 4.588 -45.525 -8.785 1.00 61.53 H new ATOM 0 HE3 LYS A 103 3.266 -46.653 -9.013 1.00 61.53 H new ATOM 0 HZ1 LYS A 103 1.940 -44.976 -9.533 1.00 43.43 H new ATOM 0 HZ2 LYS A 103 2.227 -44.215 -8.043 1.00 43.43 H new ATOM 0 HZ3 LYS A 103 3.236 -43.892 -9.370 1.00 43.43 H new ATOM 1639 N ARG A 104 7.458 -44.077 -4.013 1.00 15.41 N ATOM 1640 CA ARG A 104 7.433 -42.889 -3.167 1.00 60.24 C ATOM 1641 C ARG A 104 8.803 -42.219 -3.132 1.00 4.14 C ATOM 1642 O ARG A 104 8.910 -41.016 -2.895 1.00 53.14 O ATOM 1643 CB ARG A 104 6.996 -43.257 -1.748 1.00 51.51 C ATOM 1644 CG ARG A 104 7.969 -44.177 -1.030 1.00 62.12 C ATOM 1645 CD ARG A 104 7.726 -44.183 0.471 1.00 44.10 C ATOM 1646 NE ARG A 104 8.602 -45.124 1.163 1.00 21.45 N ATOM 1647 CZ ARG A 104 8.353 -45.604 2.377 1.00 11.51 C ATOM 1648 NH1 ARG A 104 7.260 -45.232 3.029 1.00 54.34 N ATOM 1649 NH2 ARG A 104 9.198 -46.457 2.941 1.00 11.12 N ATOM 0 H ARG A 104 7.797 -44.919 -3.548 1.00 15.41 H new ATOM 0 HA ARG A 104 6.715 -42.186 -3.590 1.00 60.24 H new ATOM 0 HB2 ARG A 104 6.876 -42.343 -1.166 1.00 51.51 H new ATOM 0 HB3 ARG A 104 6.019 -43.738 -1.791 1.00 51.51 H new ATOM 0 HG2 ARG A 104 7.869 -45.190 -1.420 1.00 62.12 H new ATOM 0 HG3 ARG A 104 8.991 -43.857 -1.233 1.00 62.12 H new ATOM 0 HD2 ARG A 104 7.885 -43.180 0.868 1.00 44.10 H new ATOM 0 HD3 ARG A 104 6.686 -44.443 0.669 1.00 44.10 H new ATOM 0 HE ARG A 104 9.452 -45.430 0.689 1.00 21.45 H new ATOM 0 HH11 ARG A 104 6.608 -44.576 2.599 1.00 54.34 H new ATOM 0 HH12 ARG A 104 7.071 -45.602 3.961 1.00 54.34 H new ATOM 0 HH21 ARG A 104 10.040 -46.745 2.443 1.00 11.12 H new ATOM 0 HH22 ARG A 104 9.006 -46.825 3.873 1.00 11.12 H new ATOM 1663 N GLN A 105 9.848 -43.006 -3.367 1.00 71.31 N ATOM 1664 CA GLN A 105 11.211 -42.489 -3.360 1.00 40.34 C ATOM 1665 C GLN A 105 11.435 -41.530 -4.525 1.00 61.34 C ATOM 1666 O GLN A 105 12.287 -40.645 -4.458 1.00 11.31 O ATOM 1667 CB GLN A 105 12.216 -43.639 -3.431 1.00 23.54 C ATOM 1668 CG GLN A 105 12.488 -44.293 -2.085 1.00 42.31 C ATOM 1669 CD GLN A 105 13.104 -43.334 -1.085 1.00 22.51 C ATOM 1670 OE1 GLN A 105 14.247 -42.903 -1.243 1.00 73.42 O ATOM 1671 NE2 GLN A 105 12.349 -42.995 -0.047 1.00 33.31 N ATOM 0 H GLN A 105 9.777 -44.004 -3.565 1.00 71.31 H new ATOM 0 HA GLN A 105 11.360 -41.943 -2.429 1.00 40.34 H new ATOM 0 HB2 GLN A 105 11.844 -44.394 -4.124 1.00 23.54 H new ATOM 0 HB3 GLN A 105 13.155 -43.266 -3.841 1.00 23.54 H new ATOM 0 HG2 GLN A 105 11.555 -44.684 -1.680 1.00 42.31 H new ATOM 0 HG3 GLN A 105 13.155 -45.143 -2.226 1.00 42.31 H new ATOM 0 HE21 GLN A 105 11.407 -43.376 0.045 1.00 33.31 H new ATOM 0 HE22 GLN A 105 12.711 -42.354 0.659 1.00 33.31 H new ATOM 1680 N MET A 106 10.665 -41.714 -5.593 1.00 22.11 N ATOM 1681 CA MET A 106 10.780 -40.865 -6.773 1.00 13.43 C ATOM 1682 C MET A 106 10.213 -39.475 -6.499 1.00 61.01 C ATOM 1683 O MET A 106 10.724 -38.475 -7.004 1.00 43.42 O ATOM 1684 CB MET A 106 10.051 -41.501 -7.958 1.00 45.22 C ATOM 1685 CG MET A 106 8.541 -41.548 -7.790 1.00 5.24 C ATOM 1686 SD MET A 106 7.781 -42.895 -8.715 1.00 71.42 S ATOM 1687 CE MET A 106 8.625 -42.745 -10.288 1.00 4.04 C ATOM 0 H MET A 106 9.955 -42.443 -5.665 1.00 22.11 H new ATOM 0 HA MET A 106 11.838 -40.766 -7.017 1.00 13.43 H new ATOM 0 HB2 MET A 106 10.290 -40.943 -8.863 1.00 45.22 H new ATOM 0 HB3 MET A 106 10.424 -42.515 -8.101 1.00 45.22 H new ATOM 0 HG2 MET A 106 8.300 -41.657 -6.733 1.00 5.24 H new ATOM 0 HG3 MET A 106 8.113 -40.601 -8.118 1.00 5.24 H new ATOM 0 HE1 MET A 106 8.003 -43.168 -11.077 1.00 4.04 H new ATOM 0 HE2 MET A 106 8.815 -41.693 -10.500 1.00 4.04 H new ATOM 0 HE3 MET A 106 9.572 -43.283 -10.246 1.00 4.04 H new ATOM 1697 N LEU A 107 9.155 -39.420 -5.698 1.00 1.23 N ATOM 1698 CA LEU A 107 8.519 -38.152 -5.357 1.00 74.11 C ATOM 1699 C LEU A 107 9.325 -37.404 -4.300 1.00 63.43 C ATOM 1700 O LEU A 107 9.201 -36.188 -4.153 1.00 74.01 O ATOM 1701 CB LEU A 107 7.095 -38.393 -4.852 1.00 72.04 C ATOM 1702 CG LEU A 107 6.422 -37.212 -4.152 1.00 50.24 C ATOM 1703 CD1 LEU A 107 4.940 -37.165 -4.490 1.00 50.33 C ATOM 1704 CD2 LEU A 107 6.625 -37.298 -2.647 1.00 20.13 C ATOM 0 H LEU A 107 8.719 -40.238 -5.272 1.00 1.23 H new ATOM 0 HA LEU A 107 8.481 -37.540 -6.258 1.00 74.11 H new ATOM 0 HB2 LEU A 107 6.476 -38.688 -5.699 1.00 72.04 H new ATOM 0 HB3 LEU A 107 7.114 -39.236 -4.161 1.00 72.04 H new ATOM 0 HG LEU A 107 6.884 -36.292 -4.509 1.00 50.24 H new ATOM 0 HD11 LEU A 107 4.478 -36.318 -3.983 1.00 50.33 H new ATOM 0 HD12 LEU A 107 4.816 -37.055 -5.567 1.00 50.33 H new ATOM 0 HD13 LEU A 107 4.463 -38.089 -4.162 1.00 50.33 H new ATOM 0 HD21 LEU A 107 6.139 -36.449 -2.165 1.00 20.13 H new ATOM 0 HD22 LEU A 107 6.190 -38.225 -2.274 1.00 20.13 H new ATOM 0 HD23 LEU A 107 7.691 -37.281 -2.422 1.00 20.13 H new ATOM 1716 N THR A 108 10.155 -38.140 -3.567 1.00 3.43 N ATOM 1717 CA THR A 108 10.983 -37.547 -2.524 1.00 45.34 C ATOM 1718 C THR A 108 12.183 -36.820 -3.122 1.00 12.10 C ATOM 1719 O THR A 108 12.782 -35.959 -2.479 1.00 25.13 O ATOM 1720 CB THR A 108 11.486 -38.612 -1.532 1.00 33.32 C ATOM 1721 OG1 THR A 108 10.383 -39.385 -1.043 1.00 45.04 O ATOM 1722 CG2 THR A 108 12.214 -37.964 -0.364 1.00 52.32 C ATOM 0 H THR A 108 10.272 -39.147 -3.676 1.00 3.43 H new ATOM 0 HA THR A 108 10.356 -36.832 -1.991 1.00 45.34 H new ATOM 0 HB THR A 108 12.184 -39.265 -2.057 1.00 33.32 H new ATOM 0 HG1 THR A 108 10.000 -39.909 -1.777 1.00 45.04 H new ATOM 0 HG21 THR A 108 12.560 -38.736 0.323 1.00 52.32 H new ATOM 0 HG22 THR A 108 13.069 -37.400 -0.736 1.00 52.32 H new ATOM 0 HG23 THR A 108 11.535 -37.291 0.159 1.00 52.32 H new ATOM 1730 N ALA A 109 12.527 -37.171 -4.357 1.00 30.55 N ATOM 1731 CA ALA A 109 13.653 -36.550 -5.042 1.00 24.12 C ATOM 1732 C ALA A 109 13.213 -35.306 -5.805 1.00 51.32 C ATOM 1733 O ALA A 109 14.008 -34.396 -6.040 1.00 2.12 O ATOM 1734 CB ALA A 109 14.311 -37.546 -5.986 1.00 1.41 C ATOM 0 H ALA A 109 12.041 -37.882 -4.903 1.00 30.55 H new ATOM 0 HA ALA A 109 14.380 -36.244 -4.290 1.00 24.12 H new ATOM 0 HB1 ALA A 109 15.151 -37.069 -6.491 1.00 1.41 H new ATOM 0 HB2 ALA A 109 14.670 -38.404 -5.417 1.00 1.41 H new ATOM 0 HB3 ALA A 109 13.584 -37.880 -6.727 1.00 1.41 H new ATOM 1740 N SER A 110 11.941 -35.273 -6.191 1.00 4.10 N ATOM 1741 CA SER A 110 11.396 -34.142 -6.932 1.00 44.42 C ATOM 1742 C SER A 110 11.498 -32.857 -6.115 1.00 65.05 C ATOM 1743 O SER A 110 12.060 -31.861 -6.571 1.00 44.45 O ATOM 1744 CB SER A 110 9.937 -34.406 -7.308 1.00 21.13 C ATOM 1745 OG SER A 110 9.127 -34.525 -6.151 1.00 75.24 O ATOM 0 H SER A 110 11.269 -36.017 -6.003 1.00 4.10 H new ATOM 0 HA SER A 110 11.982 -34.020 -7.843 1.00 44.42 H new ATOM 0 HB2 SER A 110 9.566 -33.594 -7.934 1.00 21.13 H new ATOM 0 HB3 SER A 110 9.870 -35.320 -7.899 1.00 21.13 H new ATOM 0 HG SER A 110 9.444 -35.275 -5.605 1.00 75.24 H new ATOM 1751 N HIS A 111 10.951 -32.888 -4.905 1.00 13.13 N ATOM 1752 CA HIS A 111 10.980 -31.727 -4.022 1.00 51.35 C ATOM 1753 C HIS A 111 12.411 -31.244 -3.807 1.00 21.35 C ATOM 1754 O HIS A 111 12.646 -30.069 -3.522 1.00 72.32 O ATOM 1755 CB HIS A 111 10.335 -32.065 -2.678 1.00 51.11 C ATOM 1756 CG HIS A 111 9.691 -30.889 -2.010 1.00 74.23 C ATOM 1757 ND1 HIS A 111 10.016 -29.583 -2.309 1.00 13.23 N ATOM 1758 CD2 HIS A 111 8.734 -30.828 -1.055 1.00 74.50 C ATOM 1759 CE1 HIS A 111 9.288 -28.769 -1.565 1.00 32.44 C ATOM 1760 NE2 HIS A 111 8.501 -29.500 -0.795 1.00 62.24 N ATOM 0 H HIS A 111 10.482 -33.704 -4.513 1.00 13.13 H new ATOM 0 HA HIS A 111 10.413 -30.926 -4.496 1.00 51.35 H new ATOM 0 HB2 HIS A 111 9.586 -32.842 -2.829 1.00 51.11 H new ATOM 0 HB3 HIS A 111 11.094 -32.479 -2.014 1.00 51.11 H new ATOM 0 HD2 HIS A 111 8.244 -31.668 -0.585 1.00 74.50 H new ATOM 0 HE1 HIS A 111 9.329 -27.690 -1.583 1.00 32.44 H new ATOM 0 HE2 HIS A 111 7.830 -29.137 -0.118 1.00 62.24 H new ATOM 1768 N THR A 112 13.366 -32.159 -3.943 1.00 31.44 N ATOM 1769 CA THR A 112 14.773 -31.828 -3.761 1.00 25.25 C ATOM 1770 C THR A 112 15.217 -30.753 -4.746 1.00 63.20 C ATOM 1771 O THR A 112 16.218 -30.069 -4.526 1.00 31.52 O ATOM 1772 CB THR A 112 15.670 -33.069 -3.934 1.00 34.00 C ATOM 1773 OG1 THR A 112 15.005 -34.229 -3.421 1.00 53.02 O ATOM 1774 CG2 THR A 112 16.998 -32.881 -3.217 1.00 62.43 C ATOM 0 H THR A 112 13.190 -33.136 -4.179 1.00 31.44 H new ATOM 0 HA THR A 112 14.879 -31.451 -2.744 1.00 25.25 H new ATOM 0 HB THR A 112 15.866 -33.203 -4.998 1.00 34.00 H new ATOM 0 HG1 THR A 112 15.670 -34.868 -3.090 1.00 53.02 H new ATOM 0 HG21 THR A 112 17.614 -33.770 -3.353 1.00 62.43 H new ATOM 0 HG22 THR A 112 17.515 -32.014 -3.630 1.00 62.43 H new ATOM 0 HG23 THR A 112 16.818 -32.724 -2.153 1.00 62.43 H new ATOM 1782 N LEU A 113 14.467 -30.608 -5.833 1.00 4.32 N ATOM 1783 CA LEU A 113 14.783 -29.614 -6.853 1.00 43.00 C ATOM 1784 C LEU A 113 14.284 -28.233 -6.441 1.00 5.33 C ATOM 1785 O LEU A 113 14.801 -27.214 -6.897 1.00 41.54 O ATOM 1786 CB LEU A 113 14.162 -30.014 -8.192 1.00 63.15 C ATOM 1787 CG LEU A 113 14.875 -31.131 -8.956 1.00 44.40 C ATOM 1788 CD1 LEU A 113 14.362 -32.492 -8.513 1.00 63.14 C ATOM 1789 CD2 LEU A 113 14.693 -30.952 -10.456 1.00 51.32 C ATOM 0 H LEU A 113 13.636 -31.166 -6.031 1.00 4.32 H new ATOM 0 HA LEU A 113 15.867 -29.571 -6.960 1.00 43.00 H new ATOM 0 HB2 LEU A 113 13.132 -30.323 -8.014 1.00 63.15 H new ATOM 0 HB3 LEU A 113 14.124 -29.131 -8.830 1.00 63.15 H new ATOM 0 HG LEU A 113 15.940 -31.076 -8.731 1.00 44.40 H new ATOM 0 HD11 LEU A 113 14.881 -33.274 -9.067 1.00 63.14 H new ATOM 0 HD12 LEU A 113 14.546 -32.620 -7.446 1.00 63.14 H new ATOM 0 HD13 LEU A 113 13.292 -32.558 -8.708 1.00 63.14 H new ATOM 0 HD21 LEU A 113 15.207 -31.756 -10.983 1.00 51.32 H new ATOM 0 HD22 LEU A 113 13.631 -30.979 -10.699 1.00 51.32 H new ATOM 0 HD23 LEU A 113 15.111 -29.993 -10.761 1.00 51.32 H new ATOM 1801 N ALA A 114 13.278 -28.207 -5.573 1.00 23.42 N ATOM 1802 CA ALA A 114 12.713 -26.952 -5.095 1.00 53.34 C ATOM 1803 C ALA A 114 13.323 -26.548 -3.757 1.00 71.25 C ATOM 1804 O ALA A 114 13.744 -25.406 -3.575 1.00 64.01 O ATOM 1805 CB ALA A 114 11.200 -27.066 -4.975 1.00 23.21 C ATOM 0 H ALA A 114 12.838 -29.042 -5.186 1.00 23.42 H new ATOM 0 HA ALA A 114 12.952 -26.175 -5.822 1.00 53.34 H new ATOM 0 HB1 ALA A 114 10.791 -26.121 -4.617 1.00 23.21 H new ATOM 0 HB2 ALA A 114 10.774 -27.299 -5.951 1.00 23.21 H new ATOM 0 HB3 ALA A 114 10.950 -27.860 -4.271 1.00 23.21 H new ATOM 1811 N VAL A 115 13.367 -27.493 -2.823 1.00 54.12 N ATOM 1812 CA VAL A 115 13.926 -27.236 -1.501 1.00 53.35 C ATOM 1813 C VAL A 115 15.314 -26.614 -1.604 1.00 10.14 C ATOM 1814 O VAL A 115 15.731 -25.854 -0.729 1.00 61.40 O ATOM 1815 CB VAL A 115 14.014 -28.528 -0.668 1.00 61.02 C ATOM 1816 CG1 VAL A 115 15.138 -29.417 -1.179 1.00 32.02 C ATOM 1817 CG2 VAL A 115 14.210 -28.200 0.804 1.00 11.22 C ATOM 0 H VAL A 115 13.022 -28.443 -2.958 1.00 54.12 H new ATOM 0 HA VAL A 115 13.254 -26.537 -1.003 1.00 53.35 H new ATOM 0 HB VAL A 115 13.076 -29.073 -0.773 1.00 61.02 H new ATOM 0 HG11 VAL A 115 15.185 -30.325 -0.578 1.00 32.02 H new ATOM 0 HG12 VAL A 115 14.949 -29.680 -2.220 1.00 32.02 H new ATOM 0 HG13 VAL A 115 16.086 -28.884 -1.105 1.00 32.02 H new ATOM 0 HG21 VAL A 115 14.270 -29.125 1.378 1.00 11.22 H new ATOM 0 HG22 VAL A 115 15.133 -27.634 0.931 1.00 11.22 H new ATOM 0 HG23 VAL A 115 13.368 -27.606 1.160 1.00 11.22 H new ATOM 1827 N ASP A 116 16.025 -26.941 -2.677 1.00 0.00 N ATOM 1828 CA ASP A 116 17.367 -26.413 -2.895 1.00 71.41 C ATOM 1829 C ASP A 116 17.311 -25.050 -3.576 1.00 55.35 C ATOM 1830 O ASP A 116 18.021 -24.122 -3.190 1.00 71.02 O ATOM 1831 CB ASP A 116 18.189 -27.387 -3.741 1.00 44.51 C ATOM 1832 CG ASP A 116 19.457 -27.835 -3.040 1.00 54.11 C ATOM 1833 OD1 ASP A 116 20.425 -27.048 -3.006 1.00 44.01 O ATOM 1834 OD2 ASP A 116 19.480 -28.973 -2.526 1.00 71.23 O ATOM 0 H ASP A 116 15.695 -27.569 -3.410 1.00 0.00 H new ATOM 0 HA ASP A 116 17.846 -26.293 -1.923 1.00 71.41 H new ATOM 0 HB2 ASP A 116 17.581 -28.260 -3.979 1.00 44.51 H new ATOM 0 HB3 ASP A 116 18.449 -26.912 -4.687 1.00 44.51 H new ATOM 1839 N ALA A 117 16.462 -24.936 -4.593 1.00 32.41 N ATOM 1840 CA ALA A 117 16.312 -23.686 -5.327 1.00 61.34 C ATOM 1841 C ALA A 117 15.893 -22.551 -4.399 1.00 65.04 C ATOM 1842 O ALA A 117 16.169 -21.382 -4.668 1.00 50.53 O ATOM 1843 CB ALA A 117 15.300 -23.852 -6.451 1.00 71.52 C ATOM 0 H ALA A 117 15.868 -25.695 -4.927 1.00 32.41 H new ATOM 0 HA ALA A 117 17.279 -23.429 -5.759 1.00 61.34 H new ATOM 0 HB1 ALA A 117 15.198 -22.911 -6.991 1.00 71.52 H new ATOM 0 HB2 ALA A 117 15.641 -24.628 -7.136 1.00 71.52 H new ATOM 0 HB3 ALA A 117 14.335 -24.137 -6.032 1.00 71.52 H new ATOM 1849 N LYS A 118 15.226 -22.903 -3.306 1.00 14.31 N ATOM 1850 CA LYS A 118 14.769 -21.914 -2.337 1.00 13.23 C ATOM 1851 C LYS A 118 15.938 -21.367 -1.524 1.00 63.34 C ATOM 1852 O LYS A 118 16.029 -20.165 -1.282 1.00 3.31 O ATOM 1853 CB LYS A 118 13.728 -22.531 -1.400 1.00 15.20 C ATOM 1854 CG LYS A 118 12.485 -23.030 -2.116 1.00 54.24 C ATOM 1855 CD LYS A 118 11.446 -21.930 -2.263 1.00 64.04 C ATOM 1856 CE LYS A 118 10.103 -22.351 -1.687 1.00 61.04 C ATOM 1857 NZ LYS A 118 8.986 -21.527 -2.226 1.00 11.44 N ATOM 0 H LYS A 118 14.990 -23.866 -3.069 1.00 14.31 H new ATOM 0 HA LYS A 118 14.313 -21.090 -2.885 1.00 13.23 H new ATOM 0 HB2 LYS A 118 14.184 -23.361 -0.860 1.00 15.20 H new ATOM 0 HB3 LYS A 118 13.436 -21.789 -0.657 1.00 15.20 H new ATOM 0 HG2 LYS A 118 12.758 -23.407 -3.101 1.00 54.24 H new ATOM 0 HG3 LYS A 118 12.056 -23.865 -1.563 1.00 54.24 H new ATOM 0 HD2 LYS A 118 11.794 -21.030 -1.757 1.00 64.04 H new ATOM 0 HD3 LYS A 118 11.328 -21.678 -3.317 1.00 64.04 H new ATOM 0 HE2 LYS A 118 9.923 -23.401 -1.916 1.00 61.04 H new ATOM 0 HE3 LYS A 118 10.129 -22.261 -0.601 1.00 61.04 H new ATOM 0 HZ1 LYS A 118 8.088 -21.845 -1.809 1.00 11.44 H new ATOM 0 HZ2 LYS A 118 9.145 -20.528 -1.986 1.00 11.44 H new ATOM 0 HZ3 LYS A 118 8.944 -21.632 -3.260 1.00 11.44 H new ATOM 1871 N ASN A 119 16.832 -22.259 -1.108 1.00 53.01 N ATOM 1872 CA ASN A 119 17.996 -21.865 -0.324 1.00 25.12 C ATOM 1873 C ASN A 119 18.969 -21.046 -1.167 1.00 73.14 C ATOM 1874 O ASN A 119 19.713 -20.215 -0.645 1.00 40.05 O ATOM 1875 CB ASN A 119 18.704 -23.102 0.233 1.00 0.15 C ATOM 1876 CG ASN A 119 17.729 -24.184 0.656 1.00 65.44 C ATOM 1877 OD1 ASN A 119 16.619 -23.896 1.101 1.00 12.24 O ATOM 1878 ND2 ASN A 119 18.142 -25.439 0.517 1.00 44.13 N ATOM 0 H ASN A 119 16.772 -23.259 -1.301 1.00 53.01 H new ATOM 0 HA ASN A 119 17.652 -21.247 0.505 1.00 25.12 H new ATOM 0 HB2 ASN A 119 19.380 -23.501 -0.523 1.00 0.15 H new ATOM 0 HB3 ASN A 119 19.316 -22.813 1.088 1.00 0.15 H new ATOM 0 HD21 ASN A 119 17.530 -26.210 0.784 1.00 44.13 H new ATOM 0 HD22 ASN A 119 19.071 -25.632 0.143 1.00 44.13 H new ATOM 1885 N LEU A 120 18.956 -21.286 -2.474 1.00 5.20 N ATOM 1886 CA LEU A 120 19.836 -20.570 -3.391 1.00 65.34 C ATOM 1887 C LEU A 120 19.334 -19.150 -3.632 1.00 30.33 C ATOM 1888 O LEU A 120 20.120 -18.236 -3.884 1.00 23.23 O ATOM 1889 CB LEU A 120 19.937 -21.320 -4.721 1.00 44.42 C ATOM 1890 CG LEU A 120 20.959 -20.777 -5.721 1.00 71.24 C ATOM 1891 CD1 LEU A 120 20.403 -19.561 -6.446 1.00 31.12 C ATOM 1892 CD2 LEU A 120 22.263 -20.431 -5.017 1.00 52.23 C ATOM 0 H LEU A 120 18.346 -21.970 -2.922 1.00 5.20 H new ATOM 0 HA LEU A 120 20.825 -20.513 -2.936 1.00 65.34 H new ATOM 0 HB2 LEU A 120 20.182 -22.361 -4.511 1.00 44.42 H new ATOM 0 HB3 LEU A 120 18.955 -21.313 -5.195 1.00 44.42 H new ATOM 0 HG LEU A 120 21.163 -21.552 -6.459 1.00 71.24 H new ATOM 0 HD11 LEU A 120 21.144 -19.189 -7.153 1.00 31.12 H new ATOM 0 HD12 LEU A 120 19.497 -19.841 -6.984 1.00 31.12 H new ATOM 0 HD13 LEU A 120 20.169 -18.781 -5.722 1.00 31.12 H new ATOM 0 HD21 LEU A 120 22.978 -20.046 -5.744 1.00 52.23 H new ATOM 0 HD22 LEU A 120 22.076 -19.673 -4.256 1.00 52.23 H new ATOM 0 HD23 LEU A 120 22.670 -21.325 -4.546 1.00 52.23 H new ATOM 1904 N LEU A 121 18.020 -18.972 -3.550 1.00 42.42 N ATOM 1905 CA LEU A 121 17.412 -17.662 -3.756 1.00 51.34 C ATOM 1906 C LEU A 121 17.875 -16.672 -2.692 1.00 22.52 C ATOM 1907 O LEU A 121 17.869 -15.461 -2.911 1.00 74.00 O ATOM 1908 CB LEU A 121 15.887 -17.776 -3.733 1.00 73.51 C ATOM 1909 CG LEU A 121 15.112 -16.478 -3.962 1.00 64.15 C ATOM 1910 CD1 LEU A 121 15.600 -15.782 -5.224 1.00 14.44 C ATOM 1911 CD2 LEU A 121 13.619 -16.756 -4.048 1.00 14.14 C ATOM 0 H LEU A 121 17.356 -19.718 -3.342 1.00 42.42 H new ATOM 0 HA LEU A 121 17.728 -17.292 -4.731 1.00 51.34 H new ATOM 0 HB2 LEU A 121 15.585 -18.495 -4.495 1.00 73.51 H new ATOM 0 HB3 LEU A 121 15.588 -18.189 -2.769 1.00 73.51 H new ATOM 0 HG LEU A 121 15.289 -15.817 -3.114 1.00 64.15 H new ATOM 0 HD11 LEU A 121 15.038 -14.860 -5.372 1.00 14.44 H new ATOM 0 HD12 LEU A 121 16.660 -15.548 -5.124 1.00 14.44 H new ATOM 0 HD13 LEU A 121 15.452 -16.438 -6.082 1.00 14.44 H new ATOM 0 HD21 LEU A 121 13.084 -15.821 -4.211 1.00 14.14 H new ATOM 0 HD22 LEU A 121 13.423 -17.436 -4.877 1.00 14.14 H new ATOM 0 HD23 LEU A 121 13.279 -17.211 -3.118 1.00 14.14 H new ATOM 1923 N ASP A 122 18.279 -17.197 -1.540 1.00 14.00 N ATOM 1924 CA ASP A 122 18.749 -16.360 -0.442 1.00 32.41 C ATOM 1925 C ASP A 122 20.260 -16.168 -0.514 1.00 44.11 C ATOM 1926 O ASP A 122 20.766 -15.066 -0.304 1.00 43.04 O ATOM 1927 CB ASP A 122 18.365 -16.982 0.902 1.00 71.13 C ATOM 1928 CG ASP A 122 18.809 -16.136 2.079 1.00 71.30 C ATOM 1929 OD1 ASP A 122 19.984 -16.256 2.486 1.00 13.41 O ATOM 1930 OD2 ASP A 122 17.982 -15.355 2.593 1.00 51.54 O ATOM 0 H ASP A 122 18.290 -18.198 -1.343 1.00 14.00 H new ATOM 0 HA ASP A 122 18.272 -15.384 -0.532 1.00 32.41 H new ATOM 0 HB2 ASP A 122 17.284 -17.116 0.942 1.00 71.13 H new ATOM 0 HB3 ASP A 122 18.812 -17.973 0.981 1.00 71.13 H new ATOM 1935 N ALA A 123 20.976 -17.248 -0.811 1.00 53.10 N ATOM 1936 CA ALA A 123 22.429 -17.198 -0.912 1.00 0.34 C ATOM 1937 C ALA A 123 22.872 -16.178 -1.955 1.00 41.21 C ATOM 1938 O ALA A 123 23.936 -15.571 -1.832 1.00 1.10 O ATOM 1939 CB ALA A 123 22.983 -18.574 -1.248 1.00 74.41 C ATOM 0 H ALA A 123 20.573 -18.168 -0.986 1.00 53.10 H new ATOM 0 HA ALA A 123 22.825 -16.886 0.054 1.00 0.34 H new ATOM 0 HB1 ALA A 123 24.069 -18.521 -1.320 1.00 74.41 H new ATOM 0 HB2 ALA A 123 22.705 -19.279 -0.465 1.00 74.41 H new ATOM 0 HB3 ALA A 123 22.572 -18.909 -2.200 1.00 74.41 H new ATOM 1945 N VAL A 124 22.050 -15.994 -2.983 1.00 73.11 N ATOM 1946 CA VAL A 124 22.357 -15.047 -4.048 1.00 72.12 C ATOM 1947 C VAL A 124 21.813 -13.660 -3.724 1.00 62.11 C ATOM 1948 O VAL A 124 22.323 -12.652 -4.214 1.00 71.31 O ATOM 1949 CB VAL A 124 21.776 -15.512 -5.397 1.00 42.31 C ATOM 1950 CG1 VAL A 124 20.269 -15.691 -5.296 1.00 62.54 C ATOM 1951 CG2 VAL A 124 22.131 -14.524 -6.498 1.00 42.11 C ATOM 0 H VAL A 124 21.166 -16.489 -3.101 1.00 73.11 H new ATOM 0 HA VAL A 124 23.443 -14.999 -4.126 1.00 72.12 H new ATOM 0 HB VAL A 124 22.216 -16.477 -5.650 1.00 42.31 H new ATOM 0 HG11 VAL A 124 19.876 -16.020 -6.258 1.00 62.54 H new ATOM 0 HG12 VAL A 124 20.042 -16.439 -4.537 1.00 62.54 H new ATOM 0 HG13 VAL A 124 19.808 -14.743 -5.021 1.00 62.54 H new ATOM 0 HG21 VAL A 124 21.713 -14.868 -7.444 1.00 42.11 H new ATOM 0 HG22 VAL A 124 21.720 -13.544 -6.254 1.00 42.11 H new ATOM 0 HG23 VAL A 124 23.215 -14.451 -6.586 1.00 42.11 H new ATOM 1961 N ASP A 125 20.776 -13.616 -2.895 1.00 60.33 N ATOM 1962 CA ASP A 125 20.163 -12.352 -2.504 1.00 22.34 C ATOM 1963 C ASP A 125 21.204 -11.402 -1.919 1.00 53.03 C ATOM 1964 O ASP A 125 21.089 -10.184 -2.053 1.00 1.02 O ATOM 1965 CB ASP A 125 19.048 -12.596 -1.486 1.00 11.53 C ATOM 1966 CG ASP A 125 18.213 -11.355 -1.235 1.00 34.53 C ATOM 1967 OD1 ASP A 125 17.653 -10.809 -2.209 1.00 25.12 O ATOM 1968 OD2 ASP A 125 18.117 -10.932 -0.064 1.00 43.20 O ATOM 0 H ASP A 125 20.342 -14.441 -2.481 1.00 60.33 H new ATOM 0 HA ASP A 125 19.737 -11.891 -3.395 1.00 22.34 H new ATOM 0 HB2 ASP A 125 18.403 -13.399 -1.843 1.00 11.53 H new ATOM 0 HB3 ASP A 125 19.485 -12.933 -0.546 1.00 11.53 H new ATOM 1973 N GLN A 126 22.217 -11.968 -1.271 1.00 52.22 N ATOM 1974 CA GLN A 126 23.276 -11.170 -0.665 1.00 62.11 C ATOM 1975 C GLN A 126 24.474 -11.053 -1.602 1.00 75.05 C ATOM 1976 O GLN A 126 25.103 -10.000 -1.692 1.00 3.40 O ATOM 1977 CB GLN A 126 23.713 -11.789 0.664 1.00 15.20 C ATOM 1978 CG GLN A 126 22.636 -11.747 1.737 1.00 63.21 C ATOM 1979 CD GLN A 126 22.616 -10.433 2.492 1.00 21.15 C ATOM 1980 OE1 GLN A 126 23.509 -10.149 3.291 1.00 23.12 O ATOM 1981 NE2 GLN A 126 21.594 -9.623 2.244 1.00 41.53 N ATOM 0 H GLN A 126 22.327 -12.975 -1.152 1.00 52.22 H new ATOM 0 HA GLN A 126 22.882 -10.170 -0.481 1.00 62.11 H new ATOM 0 HB2 GLN A 126 24.005 -12.825 0.494 1.00 15.20 H new ATOM 0 HB3 GLN A 126 24.597 -11.264 1.027 1.00 15.20 H new ATOM 0 HG2 GLN A 126 21.662 -11.912 1.276 1.00 63.21 H new ATOM 0 HG3 GLN A 126 22.797 -12.564 2.441 1.00 63.21 H new ATOM 0 HE21 GLN A 126 20.876 -9.898 1.574 1.00 41.53 H new ATOM 0 HE22 GLN A 126 21.527 -8.725 2.723 1.00 41.53 H new ATOM 1990 N ALA A 127 24.782 -12.142 -2.299 1.00 22.11 N ATOM 1991 CA ALA A 127 25.903 -12.161 -3.231 1.00 10.24 C ATOM 1992 C ALA A 127 25.804 -11.014 -4.231 1.00 25.00 C ATOM 1993 O ALA A 127 26.773 -10.288 -4.457 1.00 31.04 O ATOM 1994 CB ALA A 127 25.962 -13.495 -3.959 1.00 33.41 C ATOM 0 H ALA A 127 24.271 -13.022 -2.236 1.00 22.11 H new ATOM 0 HA ALA A 127 26.822 -12.032 -2.659 1.00 10.24 H new ATOM 0 HB1 ALA A 127 26.804 -13.495 -4.651 1.00 33.41 H new ATOM 0 HB2 ALA A 127 26.088 -14.300 -3.235 1.00 33.41 H new ATOM 0 HB3 ALA A 127 25.036 -13.648 -4.513 1.00 33.41 H new ATOM 2000 N LYS A 128 24.629 -10.856 -4.829 1.00 74.32 N ATOM 2001 CA LYS A 128 24.402 -9.797 -5.806 1.00 23.53 C ATOM 2002 C LYS A 128 24.558 -8.423 -5.164 1.00 2.34 C ATOM 2003 O LYS A 128 24.907 -7.450 -5.833 1.00 12.14 O ATOM 2004 CB LYS A 128 23.006 -9.931 -6.419 1.00 3.55 C ATOM 2005 CG LYS A 128 22.928 -9.462 -7.861 1.00 41.31 C ATOM 2006 CD LYS A 128 23.602 -10.444 -8.804 1.00 71.31 C ATOM 2007 CE LYS A 128 22.729 -11.664 -9.055 1.00 32.21 C ATOM 2008 NZ LYS A 128 21.684 -11.397 -10.082 1.00 0.22 N ATOM 0 H LYS A 128 23.817 -11.449 -4.654 1.00 74.32 H new ATOM 0 HA LYS A 128 25.149 -9.897 -6.594 1.00 23.53 H new ATOM 0 HB2 LYS A 128 22.694 -10.974 -6.368 1.00 3.55 H new ATOM 0 HB3 LYS A 128 22.299 -9.357 -5.820 1.00 3.55 H new ATOM 0 HG2 LYS A 128 21.884 -9.339 -8.148 1.00 41.31 H new ATOM 0 HG3 LYS A 128 23.402 -8.485 -7.953 1.00 41.31 H new ATOM 0 HD2 LYS A 128 23.820 -9.950 -9.751 1.00 71.31 H new ATOM 0 HD3 LYS A 128 24.556 -10.759 -8.382 1.00 71.31 H new ATOM 0 HE2 LYS A 128 23.353 -12.496 -9.380 1.00 32.21 H new ATOM 0 HE3 LYS A 128 22.253 -11.968 -8.123 1.00 32.21 H new ATOM 0 HZ1 LYS A 128 21.110 -12.253 -10.224 1.00 0.22 H new ATOM 0 HZ2 LYS A 128 21.072 -10.620 -9.761 1.00 0.22 H new ATOM 0 HZ3 LYS A 128 22.139 -11.132 -10.979 1.00 0.22 H new ATOM 2022 N VAL A 129 24.299 -8.350 -3.862 1.00 1.32 N ATOM 2023 CA VAL A 129 24.413 -7.095 -3.129 1.00 4.52 C ATOM 2024 C VAL A 129 25.874 -6.736 -2.878 1.00 14.25 C ATOM 2025 O VAL A 129 26.269 -5.576 -2.999 1.00 43.32 O ATOM 2026 CB VAL A 129 23.673 -7.163 -1.780 1.00 25.14 C ATOM 2027 CG1 VAL A 129 23.838 -5.860 -1.013 1.00 42.43 C ATOM 2028 CG2 VAL A 129 22.202 -7.482 -1.995 1.00 72.22 C ATOM 0 H VAL A 129 24.009 -9.146 -3.293 1.00 1.32 H new ATOM 0 HA VAL A 129 23.954 -6.324 -3.748 1.00 4.52 H new ATOM 0 HB VAL A 129 24.112 -7.964 -1.185 1.00 25.14 H new ATOM 0 HG11 VAL A 129 23.308 -5.928 -0.063 1.00 42.43 H new ATOM 0 HG12 VAL A 129 24.897 -5.679 -0.826 1.00 42.43 H new ATOM 0 HG13 VAL A 129 23.428 -5.038 -1.600 1.00 42.43 H new ATOM 0 HG21 VAL A 129 21.695 -7.526 -1.031 1.00 72.22 H new ATOM 0 HG22 VAL A 129 21.747 -6.705 -2.609 1.00 72.22 H new ATOM 0 HG23 VAL A 129 22.108 -8.444 -2.499 1.00 72.22 H new ATOM 2038 N LEU A 130 26.671 -7.738 -2.527 1.00 23.53 N ATOM 2039 CA LEU A 130 28.090 -7.530 -2.258 1.00 50.44 C ATOM 2040 C LEU A 130 28.868 -7.346 -3.557 1.00 45.31 C ATOM 2041 O LEU A 130 29.888 -6.657 -3.589 1.00 54.31 O ATOM 2042 CB LEU A 130 28.660 -8.711 -1.472 1.00 32.41 C ATOM 2043 CG LEU A 130 27.926 -9.075 -0.181 1.00 35.01 C ATOM 2044 CD1 LEU A 130 28.688 -10.147 0.583 1.00 54.21 C ATOM 2045 CD2 LEU A 130 27.726 -7.840 0.685 1.00 4.14 C ATOM 0 H LEU A 130 26.359 -8.703 -2.422 1.00 23.53 H new ATOM 0 HA LEU A 130 28.192 -6.623 -1.662 1.00 50.44 H new ATOM 0 HB2 LEU A 130 28.665 -9.586 -2.122 1.00 32.41 H new ATOM 0 HB3 LEU A 130 29.699 -8.490 -1.226 1.00 32.41 H new ATOM 0 HG LEU A 130 26.946 -9.473 -0.443 1.00 35.01 H new ATOM 0 HD11 LEU A 130 28.150 -10.393 1.499 1.00 54.21 H new ATOM 0 HD12 LEU A 130 28.778 -11.040 -0.036 1.00 54.21 H new ATOM 0 HD13 LEU A 130 29.682 -9.778 0.834 1.00 54.21 H new ATOM 0 HD21 LEU A 130 27.202 -8.118 1.600 1.00 4.14 H new ATOM 0 HD22 LEU A 130 28.696 -7.412 0.938 1.00 4.14 H new ATOM 0 HD23 LEU A 130 27.136 -7.104 0.138 1.00 4.14 H new ATOM 2057 N ALA A 131 28.380 -7.965 -4.627 1.00 12.13 N ATOM 2058 CA ALA A 131 29.027 -7.866 -5.929 1.00 1.01 C ATOM 2059 C ALA A 131 29.241 -6.409 -6.326 1.00 60.44 C ATOM 2060 O ALA A 131 30.162 -6.090 -7.077 1.00 72.00 O ATOM 2061 CB ALA A 131 28.202 -8.588 -6.984 1.00 44.55 C ATOM 0 H ALA A 131 27.538 -8.541 -4.617 1.00 12.13 H new ATOM 0 HA ALA A 131 30.005 -8.343 -5.859 1.00 1.01 H new ATOM 0 HB1 ALA A 131 28.697 -8.506 -7.952 1.00 44.55 H new ATOM 0 HB2 ALA A 131 28.105 -9.640 -6.714 1.00 44.55 H new ATOM 0 HB3 ALA A 131 27.212 -8.136 -7.043 1.00 44.55 H new