USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1129 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 MET CE :methyl -110:sc= -1.26 (180deg=0) USER MOD Set 1.2: A 110 MET CE :methyl -156:sc= -4.78! (180deg=-2.67!) USER MOD Single : A 10 SER OG : rot -37:sc= 0.272 USER MOD Single : A 11 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.11) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -2.26 X(o=-2.3,f=-2.5) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 140:sc= 0.00514 (180deg=0) USER MOD Single : A 29 SER OG : rot 77:sc= 0.302 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot 30:sc= -0.244 USER MOD Single : A 43 MET CE :methyl -111:sc= -2.04 (180deg=-8.86!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 68:sc= 1.32 USER MOD Single : A 57 THR OG1 : rot -28:sc= -0.877 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -150:sc= -0.522 USER MOD Single : A 69 THR OG1 : rot -56:sc= 0.211 USER MOD Single : A 70 HIS : no HE2:sc= -0.209 X(o=-0.21,f=-0.52) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.0547 K(o=-0.055,f=-1.1) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 163:sc= -4.31 (180deg=-6.52!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.164 K(o=-0.16,f=-2.2!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 174:sc= -4.42! (180deg=-4.58!) USER MOD Single : A 100 THR OG1 : rot -81:sc= 0.0772 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -2.02 K(o=-2,f=-2.9!) USER MOD Single : A 104 GLN : amide:sc= -0.151 K(o=-0.15,f=-1.9!) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -3.94! C(o=-3.9!,f=-4.9!) USER MOD Single : A 122 LYS NZ :NH3+ 154:sc= 0.0239 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 130 GLN : amide:sc= -0.0788 K(o=-0.079,f=-0.93) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.650 6.875 -9.394 1.00 61.25 N ATOM 98 CA SER A 10 5.565 7.970 -9.695 1.00 60.35 C ATOM 99 C SER A 10 6.167 7.808 -11.088 1.00 73.41 C ATOM 100 O SER A 10 6.182 8.747 -11.883 1.00 33.53 O ATOM 101 CB SER A 10 6.680 8.033 -8.650 1.00 21.31 C ATOM 102 OG SER A 10 7.207 6.743 -8.388 1.00 13.53 O ATOM 0 HA SER A 10 4.999 8.901 -9.669 1.00 60.35 H new ATOM 0 HB2 SER A 10 7.476 8.690 -9.002 1.00 21.31 H new ATOM 0 HB3 SER A 10 6.294 8.466 -7.727 1.00 21.31 H new ATOM 0 HG SER A 10 6.484 6.082 -8.418 1.00 13.53 H new ATOM 108 N ASN A 11 6.662 6.608 -11.376 1.00 2.32 N ATOM 109 CA ASN A 11 7.266 6.322 -12.672 1.00 22.31 C ATOM 110 C ASN A 11 6.273 6.573 -13.802 1.00 72.34 C ATOM 111 O ASN A 11 6.664 6.851 -14.936 1.00 61.21 O ATOM 112 CB ASN A 11 7.756 4.873 -12.721 1.00 31.04 C ATOM 113 CG ASN A 11 7.986 4.388 -14.139 1.00 20.21 C ATOM 114 OD1 ASN A 11 7.437 3.367 -14.554 1.00 65.12 O ATOM 115 ND2 ASN A 11 8.801 5.120 -14.889 1.00 61.34 N ATOM 0 H ASN A 11 6.657 5.819 -10.730 1.00 2.32 H new ATOM 0 HA ASN A 11 8.116 6.991 -12.804 1.00 22.31 H new ATOM 0 HB2 ASN A 11 8.684 4.787 -12.156 1.00 31.04 H new ATOM 0 HB3 ASN A 11 7.025 4.228 -12.234 1.00 31.04 H new ATOM 0 HD21 ASN A 11 8.994 4.843 -15.852 1.00 61.34 H new ATOM 0 HD22 ASN A 11 9.234 5.959 -14.503 1.00 61.34 H new ATOM 122 N ASP A 12 4.987 6.473 -13.485 1.00 53.12 N ATOM 123 CA ASP A 12 3.936 6.691 -14.473 1.00 64.02 C ATOM 124 C ASP A 12 3.485 8.148 -14.474 1.00 14.02 C ATOM 125 O ASP A 12 3.057 8.676 -15.500 1.00 54.42 O ATOM 126 CB ASP A 12 2.744 5.775 -14.192 1.00 64.42 C ATOM 127 CG ASP A 12 2.034 5.344 -15.460 1.00 53.12 C ATOM 128 OD1 ASP A 12 1.712 6.222 -16.288 1.00 14.42 O ATOM 129 OD2 ASP A 12 1.800 4.129 -15.626 1.00 23.35 O ATOM 0 H ASP A 12 4.647 6.242 -12.552 1.00 53.12 H new ATOM 0 HA ASP A 12 4.342 6.454 -15.457 1.00 64.02 H new ATOM 0 HB2 ASP A 12 3.087 4.892 -13.653 1.00 64.42 H new ATOM 0 HB3 ASP A 12 2.038 6.291 -13.541 1.00 64.42 H new ATOM 134 N LYS A 13 3.582 8.793 -13.316 1.00 72.30 N ATOM 135 CA LYS A 13 3.184 10.189 -13.181 1.00 72.05 C ATOM 136 C LYS A 13 4.027 11.084 -14.084 1.00 55.41 C ATOM 137 O LYS A 13 3.494 11.853 -14.885 1.00 70.43 O ATOM 138 CB LYS A 13 3.320 10.641 -11.726 1.00 11.51 C ATOM 139 CG LYS A 13 2.015 11.121 -11.114 1.00 22.15 C ATOM 140 CD LYS A 13 1.670 10.342 -9.855 1.00 63.13 C ATOM 141 CE LYS A 13 0.701 11.112 -8.971 1.00 63.11 C ATOM 142 NZ LYS A 13 -0.397 10.243 -8.464 1.00 41.31 N ATOM 0 H LYS A 13 3.933 8.370 -12.457 1.00 72.30 H new ATOM 0 HA LYS A 13 2.141 10.275 -13.485 1.00 72.05 H new ATOM 0 HB2 LYS A 13 3.708 9.813 -11.132 1.00 11.51 H new ATOM 0 HB3 LYS A 13 4.055 11.444 -11.671 1.00 11.51 H new ATOM 0 HG2 LYS A 13 2.092 12.182 -10.877 1.00 22.15 H new ATOM 0 HG3 LYS A 13 1.210 11.014 -11.841 1.00 22.15 H new ATOM 0 HD2 LYS A 13 1.231 9.383 -10.128 1.00 63.13 H new ATOM 0 HD3 LYS A 13 2.582 10.128 -9.297 1.00 63.13 H new ATOM 0 HE2 LYS A 13 1.242 11.543 -8.128 1.00 63.11 H new ATOM 0 HE3 LYS A 13 0.276 11.942 -9.535 1.00 63.11 H new ATOM 0 HZ1 LYS A 13 -1.036 10.805 -7.866 1.00 41.31 H new ATOM 0 HZ2 LYS A 13 -0.929 9.852 -9.267 1.00 41.31 H new ATOM 0 HZ3 LYS A 13 0.006 9.465 -7.904 1.00 41.31 H new ATOM 156 N VAL A 14 5.345 10.979 -13.950 1.00 51.31 N ATOM 157 CA VAL A 14 6.261 11.778 -14.755 1.00 62.45 C ATOM 158 C VAL A 14 6.012 11.565 -16.244 1.00 41.24 C ATOM 159 O VAL A 14 5.896 12.524 -17.008 1.00 60.01 O ATOM 160 CB VAL A 14 7.730 11.437 -14.438 1.00 55.42 C ATOM 161 CG1 VAL A 14 8.666 12.410 -15.138 1.00 5.12 C ATOM 162 CG2 VAL A 14 7.965 11.445 -12.935 1.00 50.03 C ATOM 0 H VAL A 14 5.802 10.348 -13.292 1.00 51.31 H new ATOM 0 HA VAL A 14 6.075 12.822 -14.504 1.00 62.45 H new ATOM 0 HB VAL A 14 7.942 10.435 -14.810 1.00 55.42 H new ATOM 0 HG11 VAL A 14 9.699 12.154 -14.903 1.00 5.12 H new ATOM 0 HG12 VAL A 14 8.514 12.350 -16.216 1.00 5.12 H new ATOM 0 HG13 VAL A 14 8.457 13.424 -14.798 1.00 5.12 H new ATOM 0 HG21 VAL A 14 9.007 11.202 -12.728 1.00 50.03 H new ATOM 0 HG22 VAL A 14 7.737 12.433 -12.536 1.00 50.03 H new ATOM 0 HG23 VAL A 14 7.319 10.705 -12.462 1.00 50.03 H new ATOM 172 N TYR A 15 5.930 10.303 -16.651 1.00 4.24 N ATOM 173 CA TYR A 15 5.697 9.964 -18.049 1.00 53.03 C ATOM 174 C TYR A 15 4.292 10.372 -18.481 1.00 55.03 C ATOM 175 O TYR A 15 4.023 10.549 -19.669 1.00 41.10 O ATOM 176 CB TYR A 15 5.895 8.464 -18.272 1.00 64.21 C ATOM 177 CG TYR A 15 5.423 7.985 -19.626 1.00 40.03 C ATOM 178 CD1 TYR A 15 5.851 8.606 -20.793 1.00 41.10 C ATOM 179 CD2 TYR A 15 4.549 6.911 -19.739 1.00 21.41 C ATOM 180 CE1 TYR A 15 5.421 8.172 -22.032 1.00 44.32 C ATOM 181 CE2 TYR A 15 4.115 6.469 -20.974 1.00 2.10 C ATOM 182 CZ TYR A 15 4.554 7.103 -22.117 1.00 52.55 C ATOM 183 OH TYR A 15 4.124 6.668 -23.350 1.00 65.51 O ATOM 0 H TYR A 15 6.022 9.498 -16.032 1.00 4.24 H new ATOM 0 HA TYR A 15 6.418 10.513 -18.655 1.00 53.03 H new ATOM 0 HB2 TYR A 15 6.953 8.225 -18.160 1.00 64.21 H new ATOM 0 HB3 TYR A 15 5.361 7.916 -17.496 1.00 64.21 H new ATOM 0 HD1 TYR A 15 6.531 9.442 -20.730 1.00 41.10 H new ATOM 0 HD2 TYR A 15 4.203 6.413 -18.846 1.00 21.41 H new ATOM 0 HE1 TYR A 15 5.762 8.667 -22.929 1.00 44.32 H new ATOM 0 HE2 TYR A 15 3.436 5.632 -21.044 1.00 2.10 H new ATOM 0 HH TYR A 15 3.519 5.906 -23.235 1.00 65.51 H new ATOM 193 N GLU A 16 3.399 10.520 -17.507 1.00 23.40 N ATOM 194 CA GLU A 16 2.021 10.907 -17.786 1.00 64.41 C ATOM 195 C GLU A 16 1.915 12.411 -18.017 1.00 0.31 C ATOM 196 O GLU A 16 1.389 12.858 -19.035 1.00 71.13 O ATOM 197 CB GLU A 16 1.108 10.491 -16.631 1.00 74.13 C ATOM 198 CG GLU A 16 -0.290 11.080 -16.719 1.00 11.33 C ATOM 199 CD GLU A 16 -1.376 10.030 -16.587 1.00 64.31 C ATOM 200 OE1 GLU A 16 -1.296 9.002 -17.291 1.00 64.24 O ATOM 201 OE2 GLU A 16 -2.305 10.236 -15.779 1.00 12.10 O ATOM 0 H GLU A 16 3.605 10.378 -16.518 1.00 23.40 H new ATOM 0 HA GLU A 16 1.703 10.394 -18.694 1.00 64.41 H new ATOM 0 HB2 GLU A 16 1.035 9.404 -16.610 1.00 74.13 H new ATOM 0 HB3 GLU A 16 1.564 10.798 -15.690 1.00 74.13 H new ATOM 0 HG2 GLU A 16 -0.415 11.827 -15.935 1.00 11.33 H new ATOM 0 HG3 GLU A 16 -0.403 11.596 -17.672 1.00 11.33 H new ATOM 208 N ASN A 17 2.418 13.187 -17.063 1.00 3.55 N ATOM 209 CA ASN A 17 2.379 14.642 -17.160 1.00 42.15 C ATOM 210 C ASN A 17 2.944 15.113 -18.497 1.00 72.44 C ATOM 211 O ASN A 17 2.442 16.065 -19.095 1.00 71.32 O ATOM 212 CB ASN A 17 3.167 15.273 -16.011 1.00 24.22 C ATOM 213 CG ASN A 17 2.497 15.063 -14.667 1.00 2.12 C ATOM 214 OD1 ASN A 17 2.884 14.182 -13.898 1.00 51.44 O ATOM 215 ND2 ASN A 17 1.486 15.874 -14.377 1.00 61.11 N ATOM 0 H ASN A 17 2.858 12.833 -16.213 1.00 3.55 H new ATOM 0 HA ASN A 17 1.338 14.957 -17.093 1.00 42.15 H new ATOM 0 HB2 ASN A 17 4.170 14.847 -15.985 1.00 24.22 H new ATOM 0 HB3 ASN A 17 3.280 16.341 -16.195 1.00 24.22 H new ATOM 0 HD21 ASN A 17 0.996 15.781 -13.487 1.00 61.11 H new ATOM 0 HD22 ASN A 17 1.199 16.590 -15.044 1.00 61.11 H new ATOM 222 N VAL A 18 3.991 14.438 -18.962 1.00 1.24 N ATOM 223 CA VAL A 18 4.624 14.786 -20.229 1.00 35.54 C ATOM 224 C VAL A 18 3.595 14.874 -21.350 1.00 52.02 C ATOM 225 O VAL A 18 3.771 15.623 -22.312 1.00 74.31 O ATOM 226 CB VAL A 18 5.703 13.758 -20.617 1.00 43.11 C ATOM 227 CG1 VAL A 18 6.326 14.118 -21.958 1.00 15.25 C ATOM 228 CG2 VAL A 18 6.767 13.668 -19.533 1.00 51.12 C ATOM 0 H VAL A 18 4.419 13.647 -18.480 1.00 1.24 H new ATOM 0 HA VAL A 18 5.093 15.760 -20.093 1.00 35.54 H new ATOM 0 HB VAL A 18 5.231 12.780 -20.713 1.00 43.11 H new ATOM 0 HG11 VAL A 18 7.086 13.381 -22.216 1.00 15.25 H new ATOM 0 HG12 VAL A 18 5.554 14.127 -22.727 1.00 15.25 H new ATOM 0 HG13 VAL A 18 6.785 15.105 -21.893 1.00 15.25 H new ATOM 0 HG21 VAL A 18 7.522 12.937 -19.824 1.00 51.12 H new ATOM 0 HG22 VAL A 18 7.237 14.643 -19.403 1.00 51.12 H new ATOM 0 HG23 VAL A 18 6.305 13.360 -18.595 1.00 51.12 H new ATOM 238 N THR A 19 2.518 14.104 -21.221 1.00 4.52 N ATOM 239 CA THR A 19 1.461 14.095 -22.223 1.00 73.14 C ATOM 240 C THR A 19 0.402 15.147 -21.915 1.00 53.24 C ATOM 241 O THR A 19 0.021 15.932 -22.783 1.00 61.44 O ATOM 242 CB THR A 19 0.785 12.714 -22.314 1.00 32.32 C ATOM 243 OG1 THR A 19 1.748 11.720 -22.680 1.00 24.33 O ATOM 244 CG2 THR A 19 -0.346 12.730 -23.331 1.00 41.13 C ATOM 0 H THR A 19 2.356 13.479 -20.432 1.00 4.52 H new ATOM 0 HA THR A 19 1.931 14.325 -23.179 1.00 73.14 H new ATOM 0 HB THR A 19 0.369 12.473 -21.336 1.00 32.32 H new ATOM 0 HG1 THR A 19 1.310 10.845 -22.734 1.00 24.33 H new ATOM 0 HG21 THR A 19 -0.808 11.744 -23.377 1.00 41.13 H new ATOM 0 HG22 THR A 19 -1.092 13.467 -23.034 1.00 41.13 H new ATOM 0 HG23 THR A 19 0.051 12.991 -24.312 1.00 41.13 H new ATOM 252 N GLY A 20 -0.071 15.159 -20.673 1.00 21.34 N ATOM 253 CA GLY A 20 -1.082 16.120 -20.272 1.00 62.12 C ATOM 254 C GLY A 20 -0.697 17.544 -20.620 1.00 12.44 C ATOM 255 O GLY A 20 -1.485 18.281 -21.214 1.00 73.24 O ATOM 0 H GLY A 20 0.228 14.520 -19.937 1.00 21.34 H new ATOM 0 HA2 GLY A 20 -2.026 15.873 -20.757 1.00 62.12 H new ATOM 0 HA3 GLY A 20 -1.246 16.043 -19.197 1.00 62.12 H new ATOM 259 N LEU A 21 0.516 17.935 -20.247 1.00 4.32 N ATOM 260 CA LEU A 21 1.004 19.283 -20.521 1.00 61.41 C ATOM 261 C LEU A 21 0.906 19.605 -22.009 1.00 24.32 C ATOM 262 O LEU A 21 0.630 20.742 -22.392 1.00 31.52 O ATOM 263 CB LEU A 21 2.452 19.428 -20.050 1.00 63.32 C ATOM 264 CG LEU A 21 3.520 18.831 -20.968 1.00 74.32 C ATOM 265 CD1 LEU A 21 3.986 19.861 -21.985 1.00 73.33 C ATOM 266 CD2 LEU A 21 4.696 18.314 -20.153 1.00 33.43 C ATOM 0 H LEU A 21 1.180 17.338 -19.754 1.00 4.32 H new ATOM 0 HA LEU A 21 0.378 19.988 -19.974 1.00 61.41 H new ATOM 0 HB2 LEU A 21 2.666 20.489 -19.919 1.00 63.32 H new ATOM 0 HB3 LEU A 21 2.542 18.961 -19.069 1.00 63.32 H new ATOM 0 HG LEU A 21 3.080 17.992 -21.507 1.00 74.32 H new ATOM 0 HD11 LEU A 21 4.746 19.418 -22.629 1.00 73.33 H new ATOM 0 HD12 LEU A 21 3.139 20.183 -22.591 1.00 73.33 H new ATOM 0 HD13 LEU A 21 4.408 20.721 -21.465 1.00 73.33 H new ATOM 0 HD21 LEU A 21 5.446 17.893 -20.823 1.00 33.43 H new ATOM 0 HD22 LEU A 21 5.135 19.135 -19.587 1.00 33.43 H new ATOM 0 HD23 LEU A 21 4.351 17.543 -19.465 1.00 33.43 H new ATOM 278 N VAL A 22 1.133 18.596 -22.844 1.00 23.52 N ATOM 279 CA VAL A 22 1.068 18.770 -24.290 1.00 14.12 C ATOM 280 C VAL A 22 -0.354 19.083 -24.742 1.00 34.15 C ATOM 281 O VAL A 22 -0.568 19.907 -25.631 1.00 34.00 O ATOM 282 CB VAL A 22 1.565 17.514 -25.030 1.00 1.31 C ATOM 283 CG1 VAL A 22 1.458 17.704 -26.535 1.00 61.03 C ATOM 284 CG2 VAL A 22 2.995 17.190 -24.626 1.00 22.55 C ATOM 0 H VAL A 22 1.364 17.649 -22.543 1.00 23.52 H new ATOM 0 HA VAL A 22 1.718 19.609 -24.537 1.00 14.12 H new ATOM 0 HB VAL A 22 0.932 16.673 -24.748 1.00 1.31 H new ATOM 0 HG11 VAL A 22 1.814 16.807 -27.041 1.00 61.03 H new ATOM 0 HG12 VAL A 22 0.418 17.885 -26.806 1.00 61.03 H new ATOM 0 HG13 VAL A 22 2.066 18.556 -26.838 1.00 61.03 H new ATOM 0 HG21 VAL A 22 3.331 16.300 -25.158 1.00 22.55 H new ATOM 0 HG22 VAL A 22 3.643 18.029 -24.878 1.00 22.55 H new ATOM 0 HG23 VAL A 22 3.037 17.008 -23.552 1.00 22.55 H new ATOM 294 N LYS A 23 -1.325 18.420 -24.122 1.00 73.14 N ATOM 295 CA LYS A 23 -2.729 18.627 -24.458 1.00 41.33 C ATOM 296 C LYS A 23 -3.135 20.080 -24.228 1.00 64.41 C ATOM 297 O LYS A 23 -3.925 20.641 -24.986 1.00 70.42 O ATOM 298 CB LYS A 23 -3.616 17.700 -23.625 1.00 15.44 C ATOM 299 CG LYS A 23 -3.215 16.238 -23.707 1.00 22.14 C ATOM 300 CD LYS A 23 -3.436 15.676 -25.101 1.00 42.21 C ATOM 301 CE LYS A 23 -2.430 14.583 -25.427 1.00 71.23 C ATOM 302 NZ LYS A 23 -2.843 13.786 -26.616 1.00 32.14 N ATOM 0 H LYS A 23 -1.165 17.734 -23.384 1.00 73.14 H new ATOM 0 HA LYS A 23 -2.862 18.394 -25.514 1.00 41.33 H new ATOM 0 HB2 LYS A 23 -3.583 18.019 -22.583 1.00 15.44 H new ATOM 0 HB3 LYS A 23 -4.649 17.804 -23.958 1.00 15.44 H new ATOM 0 HG2 LYS A 23 -2.165 16.132 -23.433 1.00 22.14 H new ATOM 0 HG3 LYS A 23 -3.793 15.660 -22.985 1.00 22.14 H new ATOM 0 HD2 LYS A 23 -4.447 15.276 -25.177 1.00 42.21 H new ATOM 0 HD3 LYS A 23 -3.354 16.478 -25.835 1.00 42.21 H new ATOM 0 HE2 LYS A 23 -1.454 15.031 -25.611 1.00 71.23 H new ATOM 0 HE3 LYS A 23 -2.320 13.922 -24.567 1.00 71.23 H new ATOM 0 HZ1 LYS A 23 -2.009 13.579 -27.202 1.00 32.14 H new ATOM 0 HZ2 LYS A 23 -3.276 12.894 -26.303 1.00 32.14 H new ATOM 0 HZ3 LYS A 23 -3.532 14.328 -27.175 1.00 32.14 H new ATOM 316 N ALA A 24 -2.587 20.683 -23.178 1.00 33.31 N ATOM 317 CA ALA A 24 -2.890 22.071 -22.851 1.00 22.54 C ATOM 318 C ALA A 24 -2.158 23.027 -23.786 1.00 3.24 C ATOM 319 O ALA A 24 -2.726 24.017 -24.247 1.00 73.22 O ATOM 320 CB ALA A 24 -2.526 22.363 -21.403 1.00 24.35 C ATOM 0 H ALA A 24 -1.931 20.232 -22.540 1.00 33.31 H new ATOM 0 HA ALA A 24 -3.961 22.225 -22.983 1.00 22.54 H new ATOM 0 HB1 ALA A 24 -2.757 23.403 -21.172 1.00 24.35 H new ATOM 0 HB2 ALA A 24 -3.098 21.709 -20.745 1.00 24.35 H new ATOM 0 HB3 ALA A 24 -1.461 22.186 -21.253 1.00 24.35 H new ATOM 326 N VAL A 25 -0.893 22.726 -24.061 1.00 5.23 N ATOM 327 CA VAL A 25 -0.083 23.559 -24.941 1.00 45.52 C ATOM 328 C VAL A 25 -0.715 23.675 -26.324 1.00 23.23 C ATOM 329 O VAL A 25 -0.747 24.755 -26.914 1.00 62.34 O ATOM 330 CB VAL A 25 1.345 23.000 -25.087 1.00 2.13 C ATOM 331 CG1 VAL A 25 2.162 23.861 -26.038 1.00 51.20 C ATOM 332 CG2 VAL A 25 2.021 22.905 -23.727 1.00 52.10 C ATOM 0 H VAL A 25 -0.407 21.911 -23.687 1.00 5.23 H new ATOM 0 HA VAL A 25 -0.033 24.547 -24.483 1.00 45.52 H new ATOM 0 HB VAL A 25 1.282 21.996 -25.508 1.00 2.13 H new ATOM 0 HG11 VAL A 25 3.168 23.450 -26.128 1.00 51.20 H new ATOM 0 HG12 VAL A 25 1.686 23.873 -27.018 1.00 51.20 H new ATOM 0 HG13 VAL A 25 2.219 24.878 -25.650 1.00 51.20 H new ATOM 0 HG21 VAL A 25 3.029 22.508 -23.849 1.00 52.10 H new ATOM 0 HG22 VAL A 25 2.073 23.896 -23.277 1.00 52.10 H new ATOM 0 HG23 VAL A 25 1.446 22.242 -23.080 1.00 52.10 H new ATOM 342 N ILE A 26 -1.217 22.555 -26.834 1.00 2.32 N ATOM 343 CA ILE A 26 -1.850 22.531 -28.146 1.00 41.25 C ATOM 344 C ILE A 26 -3.266 23.094 -28.084 1.00 62.13 C ATOM 345 O ILE A 26 -3.688 23.838 -28.969 1.00 64.42 O ATOM 346 CB ILE A 26 -1.902 21.103 -28.720 1.00 61.03 C ATOM 347 CG1 ILE A 26 -0.492 20.517 -28.817 1.00 3.10 C ATOM 348 CG2 ILE A 26 -2.575 21.105 -30.085 1.00 33.55 C ATOM 349 CD1 ILE A 26 -0.472 19.014 -28.989 1.00 12.45 C ATOM 0 H ILE A 26 -1.197 21.653 -26.358 1.00 2.32 H new ATOM 0 HA ILE A 26 -1.242 23.155 -28.801 1.00 41.25 H new ATOM 0 HB ILE A 26 -2.490 20.478 -28.047 1.00 61.03 H new ATOM 0 HG12 ILE A 26 0.027 20.978 -29.658 1.00 3.10 H new ATOM 0 HG13 ILE A 26 0.064 20.779 -27.917 1.00 3.10 H new ATOM 0 HG21 ILE A 26 -2.604 20.089 -30.478 1.00 33.55 H new ATOM 0 HG22 ILE A 26 -3.592 21.486 -29.989 1.00 33.55 H new ATOM 0 HG23 ILE A 26 -2.012 21.742 -30.767 1.00 33.55 H new ATOM 0 HD11 ILE A 26 0.560 18.669 -29.050 1.00 12.45 H new ATOM 0 HD12 ILE A 26 -0.962 18.544 -28.136 1.00 12.45 H new ATOM 0 HD13 ILE A 26 -1.000 18.745 -29.904 1.00 12.45 H new ATOM 361 N GLU A 27 -3.994 22.735 -27.032 1.00 21.33 N ATOM 362 CA GLU A 27 -5.363 23.205 -26.854 1.00 4.11 C ATOM 363 C GLU A 27 -5.433 24.726 -26.961 1.00 34.25 C ATOM 364 O GLU A 27 -6.143 25.267 -27.808 1.00 63.44 O ATOM 365 CB GLU A 27 -5.909 22.752 -25.499 1.00 34.14 C ATOM 366 CG GLU A 27 -6.665 21.435 -25.557 1.00 25.34 C ATOM 367 CD GLU A 27 -6.797 20.778 -24.196 1.00 70.23 C ATOM 368 OE1 GLU A 27 -6.557 21.463 -23.180 1.00 64.52 O ATOM 369 OE2 GLU A 27 -7.142 19.578 -24.148 1.00 42.35 O ATOM 0 H GLU A 27 -3.659 22.120 -26.290 1.00 21.33 H new ATOM 0 HA GLU A 27 -5.975 22.773 -27.646 1.00 4.11 H new ATOM 0 HB2 GLU A 27 -5.081 22.655 -24.797 1.00 34.14 H new ATOM 0 HB3 GLU A 27 -6.571 23.524 -25.107 1.00 34.14 H new ATOM 0 HG2 GLU A 27 -7.658 21.608 -25.971 1.00 25.34 H new ATOM 0 HG3 GLU A 27 -6.151 20.755 -26.236 1.00 25.34 H new ATOM 376 N MET A 28 -4.693 25.409 -26.093 1.00 73.14 N ATOM 377 CA MET A 28 -4.671 26.867 -26.090 1.00 54.02 C ATOM 378 C MET A 28 -4.251 27.407 -27.453 1.00 41.42 C ATOM 379 O MET A 28 -4.834 28.367 -27.958 1.00 75.51 O ATOM 380 CB MET A 28 -3.719 27.382 -25.009 1.00 34.43 C ATOM 381 CG MET A 28 -2.302 26.850 -25.144 1.00 21.44 C ATOM 382 SD MET A 28 -1.439 26.764 -23.563 1.00 4.41 S ATOM 383 CE MET A 28 -0.491 28.283 -23.613 1.00 5.23 C ATOM 0 H MET A 28 -4.101 24.976 -25.384 1.00 73.14 H new ATOM 0 HA MET A 28 -5.679 27.220 -25.874 1.00 54.02 H new ATOM 0 HB2 MET A 28 -3.695 28.471 -25.047 1.00 34.43 H new ATOM 0 HB3 MET A 28 -4.110 27.106 -24.030 1.00 34.43 H new ATOM 0 HG2 MET A 28 -2.332 25.857 -25.592 1.00 21.44 H new ATOM 0 HG3 MET A 28 -1.741 27.490 -25.825 1.00 21.44 H new ATOM 0 HE1 MET A 28 0.567 28.048 -23.731 1.00 5.23 H new ATOM 0 HE2 MET A 28 -0.824 28.892 -24.453 1.00 5.23 H new ATOM 0 HE3 MET A 28 -0.638 28.835 -22.684 1.00 5.23 H new ATOM 393 N SER A 29 -3.235 26.786 -28.044 1.00 1.14 N ATOM 394 CA SER A 29 -2.734 27.208 -29.346 1.00 60.25 C ATOM 395 C SER A 29 -3.823 27.095 -30.409 1.00 44.34 C ATOM 396 O SER A 29 -3.736 27.713 -31.471 1.00 3.04 O ATOM 397 CB SER A 29 -1.523 26.363 -29.749 1.00 14.33 C ATOM 398 OG SER A 29 -0.466 26.511 -28.817 1.00 11.12 O ATOM 0 H SER A 29 -2.743 25.989 -27.641 1.00 1.14 H new ATOM 0 HA SER A 29 -2.430 28.252 -29.270 1.00 60.25 H new ATOM 0 HB2 SER A 29 -1.812 25.314 -29.812 1.00 14.33 H new ATOM 0 HB3 SER A 29 -1.182 26.660 -30.741 1.00 14.33 H new ATOM 0 HG SER A 29 -0.660 25.981 -28.016 1.00 11.12 H new ATOM 404 N SER A 30 -4.848 26.302 -30.116 1.00 23.41 N ATOM 405 CA SER A 30 -5.952 26.104 -31.047 1.00 74.00 C ATOM 406 C SER A 30 -6.909 27.292 -31.014 1.00 74.35 C ATOM 407 O SER A 30 -7.148 27.940 -32.033 1.00 52.34 O ATOM 408 CB SER A 30 -6.707 24.817 -30.710 1.00 34.23 C ATOM 409 OG SER A 30 -7.319 24.267 -31.864 1.00 25.42 O ATOM 0 H SER A 30 -4.937 25.786 -29.241 1.00 23.41 H new ATOM 0 HA SER A 30 -5.537 26.021 -32.052 1.00 74.00 H new ATOM 0 HB2 SER A 30 -6.019 24.090 -30.278 1.00 34.23 H new ATOM 0 HB3 SER A 30 -7.466 25.024 -29.956 1.00 34.23 H new ATOM 0 HG SER A 30 -7.794 23.444 -31.622 1.00 25.42 H new ATOM 415 N LYS A 31 -7.455 27.571 -29.836 1.00 13.32 N ATOM 416 CA LYS A 31 -8.386 28.681 -29.667 1.00 42.21 C ATOM 417 C LYS A 31 -7.660 29.930 -29.177 1.00 41.14 C ATOM 418 O LYS A 31 -8.262 30.805 -28.554 1.00 21.44 O ATOM 419 CB LYS A 31 -9.491 28.301 -28.680 1.00 35.03 C ATOM 420 CG LYS A 31 -8.983 28.018 -27.277 1.00 12.55 C ATOM 421 CD LYS A 31 -9.771 26.902 -26.612 1.00 61.44 C ATOM 422 CE LYS A 31 -9.323 26.681 -25.176 1.00 4.53 C ATOM 423 NZ LYS A 31 -10.284 27.264 -24.199 1.00 73.12 N ATOM 0 H LYS A 31 -7.269 27.044 -28.983 1.00 13.32 H new ATOM 0 HA LYS A 31 -8.833 28.899 -30.637 1.00 42.21 H new ATOM 0 HB2 LYS A 31 -10.221 29.109 -28.637 1.00 35.03 H new ATOM 0 HB3 LYS A 31 -10.012 27.420 -29.053 1.00 35.03 H new ATOM 0 HG2 LYS A 31 -7.929 27.745 -27.319 1.00 12.55 H new ATOM 0 HG3 LYS A 31 -9.054 28.923 -26.674 1.00 12.55 H new ATOM 0 HD2 LYS A 31 -10.833 27.145 -26.629 1.00 61.44 H new ATOM 0 HD3 LYS A 31 -9.646 25.979 -27.179 1.00 61.44 H new ATOM 0 HE2 LYS A 31 -9.218 25.612 -24.989 1.00 4.53 H new ATOM 0 HE3 LYS A 31 -8.340 27.128 -25.029 1.00 4.53 H new ATOM 0 HZ1 LYS A 31 -9.943 27.092 -23.232 1.00 73.12 H new ATOM 0 HZ2 LYS A 31 -10.365 28.288 -24.361 1.00 73.12 H new ATOM 0 HZ3 LYS A 31 -11.216 26.819 -24.321 1.00 73.12 H new ATOM 437 N ILE A 32 -6.365 30.007 -29.465 1.00 40.31 N ATOM 438 CA ILE A 32 -5.559 31.151 -29.056 1.00 61.30 C ATOM 439 C ILE A 32 -6.087 32.443 -29.670 1.00 4.14 C ATOM 440 O ILE A 32 -6.133 33.481 -29.010 1.00 22.24 O ATOM 441 CB ILE A 32 -4.083 30.971 -29.456 1.00 64.15 C ATOM 442 CG1 ILE A 32 -3.268 32.201 -29.051 1.00 52.23 C ATOM 443 CG2 ILE A 32 -3.966 30.721 -30.953 1.00 14.23 C ATOM 444 CD1 ILE A 32 -3.288 32.476 -27.564 1.00 23.31 C ATOM 0 H ILE A 32 -5.852 29.291 -29.980 1.00 40.31 H new ATOM 0 HA ILE A 32 -5.627 31.213 -27.970 1.00 61.30 H new ATOM 0 HB ILE A 32 -3.683 30.104 -28.930 1.00 64.15 H new ATOM 0 HG12 ILE A 32 -2.236 32.065 -29.373 1.00 52.23 H new ATOM 0 HG13 ILE A 32 -3.655 33.073 -29.579 1.00 52.23 H new ATOM 0 HG21 ILE A 32 -2.917 30.596 -31.220 1.00 14.23 H new ATOM 0 HG22 ILE A 32 -4.517 29.818 -31.215 1.00 14.23 H new ATOM 0 HG23 ILE A 32 -4.380 31.570 -31.497 1.00 14.23 H new ATOM 0 HD11 ILE A 32 -2.690 33.362 -27.350 1.00 23.31 H new ATOM 0 HD12 ILE A 32 -4.315 32.644 -27.239 1.00 23.31 H new ATOM 0 HD13 ILE A 32 -2.874 31.621 -27.030 1.00 23.31 H new ATOM 456 N GLN A 33 -6.485 32.371 -30.936 1.00 10.24 N ATOM 457 CA GLN A 33 -7.011 33.536 -31.638 1.00 20.23 C ATOM 458 C GLN A 33 -8.275 34.055 -30.960 1.00 4.31 C ATOM 459 O GLN A 33 -8.333 35.191 -30.488 1.00 52.13 O ATOM 460 CB GLN A 33 -7.308 33.187 -33.097 1.00 65.22 C ATOM 461 CG GLN A 33 -6.304 33.771 -34.078 1.00 53.35 C ATOM 462 CD GLN A 33 -6.969 34.518 -35.218 1.00 15.55 C ATOM 463 OE1 GLN A 33 -7.320 33.930 -36.241 1.00 24.32 O ATOM 464 NE2 GLN A 33 -7.148 35.823 -35.046 1.00 2.11 N ATOM 0 H GLN A 33 -6.453 31.519 -31.496 1.00 10.24 H new ATOM 0 HA GLN A 33 -6.255 34.320 -31.606 1.00 20.23 H new ATOM 0 HB2 GLN A 33 -7.323 32.103 -33.207 1.00 65.22 H new ATOM 0 HB3 GLN A 33 -8.305 33.547 -33.352 1.00 65.22 H new ATOM 0 HG2 GLN A 33 -5.634 34.447 -33.547 1.00 53.35 H new ATOM 0 HG3 GLN A 33 -5.689 32.968 -34.484 1.00 53.35 H new ATOM 0 HE21 GLN A 33 -6.842 36.270 -34.182 1.00 2.11 H new ATOM 0 HE22 GLN A 33 -7.592 36.378 -35.778 1.00 2.11 H new ATOM 473 N PRO A 34 -9.311 33.206 -30.909 1.00 74.04 N ATOM 474 CA PRO A 34 -10.593 33.558 -30.291 1.00 73.52 C ATOM 475 C PRO A 34 -10.492 33.678 -28.774 1.00 43.05 C ATOM 476 O PRO A 34 -11.440 34.096 -28.111 1.00 31.33 O ATOM 477 CB PRO A 34 -11.505 32.389 -30.675 1.00 25.01 C ATOM 478 CG PRO A 34 -10.578 31.244 -30.898 1.00 32.32 C ATOM 479 CD PRO A 34 -9.312 31.837 -31.451 1.00 71.23 C ATOM 0 HA PRO A 34 -10.955 34.529 -30.629 1.00 73.52 H new ATOM 0 HB2 PRO A 34 -12.222 32.170 -29.884 1.00 25.01 H new ATOM 0 HB3 PRO A 34 -12.080 32.614 -31.573 1.00 25.01 H new ATOM 0 HG2 PRO A 34 -10.385 30.711 -29.967 1.00 32.32 H new ATOM 0 HG3 PRO A 34 -11.008 30.524 -31.594 1.00 32.32 H new ATOM 0 HD2 PRO A 34 -8.433 31.278 -31.131 1.00 71.23 H new ATOM 0 HD3 PRO A 34 -9.311 31.836 -32.541 1.00 71.23 H new ATOM 487 N ALA A 35 -9.336 33.310 -28.232 1.00 65.13 N ATOM 488 CA ALA A 35 -9.110 33.379 -26.794 1.00 43.30 C ATOM 489 C ALA A 35 -9.552 34.727 -26.233 1.00 71.33 C ATOM 490 O ALA A 35 -8.907 35.755 -26.441 1.00 75.35 O ATOM 491 CB ALA A 35 -7.643 33.130 -26.477 1.00 64.24 C ATOM 0 H ALA A 35 -8.541 32.961 -28.768 1.00 65.13 H new ATOM 0 HA ALA A 35 -9.710 32.602 -26.320 1.00 43.30 H new ATOM 0 HB1 ALA A 35 -7.489 33.185 -25.399 1.00 64.24 H new ATOM 0 HB2 ALA A 35 -7.356 32.141 -26.835 1.00 64.24 H new ATOM 0 HB3 ALA A 35 -7.031 33.886 -26.970 1.00 64.24 H new ATOM 497 N PRO A 36 -10.679 34.724 -25.505 1.00 44.52 N ATOM 498 CA PRO A 36 -11.232 35.939 -24.900 1.00 12.32 C ATOM 499 C PRO A 36 -10.374 36.457 -23.751 1.00 12.15 C ATOM 500 O PRO A 36 -9.468 35.779 -23.266 1.00 44.15 O ATOM 501 CB PRO A 36 -12.600 35.487 -24.384 1.00 35.31 C ATOM 502 CG PRO A 36 -12.456 34.020 -24.164 1.00 11.45 C ATOM 503 CD PRO A 36 -11.498 33.536 -25.217 1.00 33.35 C ATOM 0 HA PRO A 36 -11.280 36.763 -25.612 1.00 12.32 H new ATOM 0 HB2 PRO A 36 -12.865 36.002 -23.460 1.00 35.31 H new ATOM 0 HB3 PRO A 36 -13.387 35.704 -25.106 1.00 35.31 H new ATOM 0 HG2 PRO A 36 -12.075 33.811 -23.164 1.00 11.45 H new ATOM 0 HG3 PRO A 36 -13.419 33.516 -24.251 1.00 11.45 H new ATOM 0 HD2 PRO A 36 -10.890 32.707 -24.856 1.00 33.35 H new ATOM 0 HD3 PRO A 36 -12.022 33.184 -26.106 1.00 33.35 H new ATOM 511 N PRO A 37 -10.665 37.687 -23.301 1.00 40.03 N ATOM 512 CA PRO A 37 -9.932 38.322 -22.202 1.00 43.34 C ATOM 513 C PRO A 37 -10.212 37.659 -20.858 1.00 70.25 C ATOM 514 O PRO A 37 -9.440 37.805 -19.911 1.00 53.23 O ATOM 515 CB PRO A 37 -10.458 39.760 -22.209 1.00 62.22 C ATOM 516 CG PRO A 37 -11.812 39.665 -22.823 1.00 21.41 C ATOM 517 CD PRO A 37 -11.732 38.552 -23.831 1.00 53.03 C ATOM 0 HA PRO A 37 -8.853 38.247 -22.336 1.00 43.34 H new ATOM 0 HB2 PRO A 37 -10.509 40.168 -21.199 1.00 62.22 H new ATOM 0 HB3 PRO A 37 -9.807 40.417 -22.786 1.00 62.22 H new ATOM 0 HG2 PRO A 37 -12.569 39.454 -22.068 1.00 21.41 H new ATOM 0 HG3 PRO A 37 -12.091 40.604 -23.300 1.00 21.41 H new ATOM 0 HD2 PRO A 37 -12.678 38.017 -23.915 1.00 53.03 H new ATOM 0 HD3 PRO A 37 -11.489 38.927 -24.825 1.00 53.03 H new ATOM 525 N GLU A 38 -11.321 36.929 -20.784 1.00 23.03 N ATOM 526 CA GLU A 38 -11.702 36.244 -19.554 1.00 63.54 C ATOM 527 C GLU A 38 -11.034 34.874 -19.465 1.00 41.34 C ATOM 528 O GLU A 38 -10.946 34.284 -18.389 1.00 53.51 O ATOM 529 CB GLU A 38 -13.222 36.087 -19.482 1.00 11.34 C ATOM 530 CG GLU A 38 -13.895 37.098 -18.568 1.00 42.11 C ATOM 531 CD GLU A 38 -13.929 38.492 -19.165 1.00 72.41 C ATOM 532 OE1 GLU A 38 -12.846 39.031 -19.474 1.00 61.32 O ATOM 533 OE2 GLU A 38 -15.038 39.043 -19.323 1.00 34.11 O ATOM 0 H GLU A 38 -11.970 36.797 -21.560 1.00 23.03 H new ATOM 0 HA GLU A 38 -11.366 36.849 -18.712 1.00 63.54 H new ATOM 0 HB2 GLU A 38 -13.637 36.184 -20.485 1.00 11.34 H new ATOM 0 HB3 GLU A 38 -13.459 35.081 -19.135 1.00 11.34 H new ATOM 0 HG2 GLU A 38 -14.914 36.771 -18.359 1.00 42.11 H new ATOM 0 HG3 GLU A 38 -13.368 37.128 -17.615 1.00 42.11 H new ATOM 540 N GLU A 39 -10.565 34.376 -20.605 1.00 74.33 N ATOM 541 CA GLU A 39 -9.907 33.076 -20.656 1.00 61.31 C ATOM 542 C GLU A 39 -8.406 33.217 -20.423 1.00 25.35 C ATOM 543 O GLU A 39 -7.702 32.226 -20.223 1.00 44.40 O ATOM 544 CB GLU A 39 -10.163 32.402 -22.006 1.00 32.23 C ATOM 545 CG GLU A 39 -11.442 31.582 -22.044 1.00 12.52 C ATOM 546 CD GLU A 39 -11.366 30.341 -21.176 1.00 51.30 C ATOM 547 OE1 GLU A 39 -11.611 30.453 -19.957 1.00 4.33 O ATOM 548 OE2 GLU A 39 -11.062 29.258 -21.717 1.00 70.42 O ATOM 0 H GLU A 39 -10.629 34.853 -21.505 1.00 74.33 H new ATOM 0 HA GLU A 39 -10.324 32.455 -19.863 1.00 61.31 H new ATOM 0 HB2 GLU A 39 -10.208 33.167 -22.782 1.00 32.23 H new ATOM 0 HB3 GLU A 39 -9.319 31.755 -22.245 1.00 32.23 H new ATOM 0 HG2 GLU A 39 -12.276 32.201 -21.714 1.00 12.52 H new ATOM 0 HG3 GLU A 39 -11.651 31.289 -23.073 1.00 12.52 H new ATOM 555 N TYR A 40 -7.922 34.454 -20.449 1.00 75.25 N ATOM 556 CA TYR A 40 -6.505 34.725 -20.244 1.00 3.31 C ATOM 557 C TYR A 40 -6.115 34.509 -18.785 1.00 5.00 C ATOM 558 O TYR A 40 -5.071 33.927 -18.489 1.00 2.22 O ATOM 559 CB TYR A 40 -6.172 36.157 -20.666 1.00 1.44 C ATOM 560 CG TYR A 40 -5.117 36.241 -21.746 1.00 1.04 C ATOM 561 CD1 TYR A 40 -5.452 36.087 -23.085 1.00 41.21 C ATOM 562 CD2 TYR A 40 -3.785 36.475 -21.426 1.00 60.11 C ATOM 563 CE1 TYR A 40 -4.491 36.162 -24.075 1.00 11.12 C ATOM 564 CE2 TYR A 40 -2.818 36.553 -22.409 1.00 64.23 C ATOM 565 CZ TYR A 40 -3.176 36.395 -23.732 1.00 44.20 C ATOM 566 OH TYR A 40 -2.216 36.472 -24.715 1.00 63.11 O ATOM 0 H TYR A 40 -8.491 35.285 -20.610 1.00 75.25 H new ATOM 0 HA TYR A 40 -5.935 34.030 -20.860 1.00 3.31 H new ATOM 0 HB2 TYR A 40 -7.081 36.643 -21.020 1.00 1.44 H new ATOM 0 HB3 TYR A 40 -5.831 36.714 -19.793 1.00 1.44 H new ATOM 0 HD1 TYR A 40 -6.481 35.906 -23.357 1.00 41.21 H new ATOM 0 HD2 TYR A 40 -3.501 36.598 -20.391 1.00 60.11 H new ATOM 0 HE1 TYR A 40 -4.768 36.039 -25.112 1.00 11.12 H new ATOM 0 HE2 TYR A 40 -1.787 36.737 -22.144 1.00 64.23 H new ATOM 0 HH TYR A 40 -2.619 36.814 -25.540 1.00 63.11 H new ATOM 576 N VAL A 41 -6.962 34.982 -17.876 1.00 62.23 N ATOM 577 CA VAL A 41 -6.708 34.840 -16.448 1.00 33.34 C ATOM 578 C VAL A 41 -6.451 33.383 -16.077 1.00 54.33 C ATOM 579 O VAL A 41 -5.409 33.032 -15.523 1.00 54.14 O ATOM 580 CB VAL A 41 -7.889 35.370 -15.613 1.00 31.44 C ATOM 581 CG1 VAL A 41 -8.007 34.600 -14.306 1.00 0.23 C ATOM 582 CG2 VAL A 41 -7.730 36.860 -15.351 1.00 61.31 C ATOM 0 H VAL A 41 -7.830 35.467 -18.104 1.00 62.23 H new ATOM 0 HA VAL A 41 -5.820 35.431 -16.224 1.00 33.34 H new ATOM 0 HB VAL A 41 -8.808 35.220 -16.179 1.00 31.44 H new ATOM 0 HG11 VAL A 41 -8.847 34.988 -13.729 1.00 0.23 H new ATOM 0 HG12 VAL A 41 -8.171 33.544 -14.520 1.00 0.23 H new ATOM 0 HG13 VAL A 41 -7.088 34.716 -13.731 1.00 0.23 H new ATOM 0 HG21 VAL A 41 -8.573 37.217 -14.760 1.00 61.31 H new ATOM 0 HG22 VAL A 41 -6.803 37.037 -14.805 1.00 61.31 H new ATOM 0 HG23 VAL A 41 -7.699 37.395 -16.300 1.00 61.31 H new ATOM 592 N PRO A 42 -7.423 32.513 -16.390 1.00 0.00 N ATOM 593 CA PRO A 42 -7.325 31.079 -16.100 1.00 40.42 C ATOM 594 C PRO A 42 -6.285 30.382 -16.971 1.00 33.24 C ATOM 595 O PRO A 42 -5.680 29.393 -16.558 1.00 61.13 O ATOM 596 CB PRO A 42 -8.728 30.556 -16.420 1.00 4.34 C ATOM 597 CG PRO A 42 -9.276 31.524 -17.411 1.00 70.40 C ATOM 598 CD PRO A 42 -8.692 32.862 -17.051 1.00 22.40 C ATOM 0 HA PRO A 42 -7.009 30.891 -15.074 1.00 40.42 H new ATOM 0 HB2 PRO A 42 -8.690 29.547 -16.831 1.00 4.34 H new ATOM 0 HB3 PRO A 42 -9.348 30.512 -15.525 1.00 4.34 H new ATOM 0 HG2 PRO A 42 -9.002 31.239 -18.427 1.00 70.40 H new ATOM 0 HG3 PRO A 42 -10.365 31.550 -17.370 1.00 70.40 H new ATOM 0 HD2 PRO A 42 -8.529 33.480 -17.934 1.00 22.40 H new ATOM 0 HD3 PRO A 42 -9.350 33.422 -16.387 1.00 22.40 H new ATOM 606 N MET A 43 -6.083 30.904 -18.176 1.00 71.30 N ATOM 607 CA MET A 43 -5.115 30.331 -19.104 1.00 24.13 C ATOM 608 C MET A 43 -3.754 30.162 -18.434 1.00 54.52 C ATOM 609 O MET A 43 -3.185 29.071 -18.429 1.00 1.01 O ATOM 610 CB MET A 43 -4.979 31.216 -20.344 1.00 54.12 C ATOM 611 CG MET A 43 -5.675 30.652 -21.572 1.00 72.32 C ATOM 612 SD MET A 43 -5.956 31.897 -22.845 1.00 41.33 S ATOM 613 CE MET A 43 -7.311 31.155 -23.752 1.00 2.51 C ATOM 0 H MET A 43 -6.576 31.722 -18.533 1.00 71.30 H new ATOM 0 HA MET A 43 -5.477 29.348 -19.406 1.00 24.13 H new ATOM 0 HB2 MET A 43 -5.390 32.201 -20.124 1.00 54.12 H new ATOM 0 HB3 MET A 43 -3.921 31.354 -20.567 1.00 54.12 H new ATOM 0 HG2 MET A 43 -5.073 29.844 -21.987 1.00 72.32 H new ATOM 0 HG3 MET A 43 -6.630 30.219 -21.276 1.00 72.32 H new ATOM 0 HE1 MET A 43 -6.964 30.848 -24.738 1.00 2.51 H new ATOM 0 HE2 MET A 43 -7.678 30.284 -23.209 1.00 2.51 H new ATOM 0 HE3 MET A 43 -8.117 31.881 -23.861 1.00 2.51 H new ATOM 623 N VAL A 44 -3.238 31.250 -17.870 1.00 54.14 N ATOM 624 CA VAL A 44 -1.945 31.222 -17.197 1.00 53.14 C ATOM 625 C VAL A 44 -1.936 30.198 -16.068 1.00 65.12 C ATOM 626 O VAL A 44 -0.901 29.603 -15.763 1.00 15.41 O ATOM 627 CB VAL A 44 -1.581 32.605 -16.625 1.00 24.32 C ATOM 628 CG1 VAL A 44 -2.285 32.836 -15.297 1.00 20.54 C ATOM 629 CG2 VAL A 44 -0.073 32.735 -16.468 1.00 11.10 C ATOM 0 H VAL A 44 -3.696 32.161 -17.866 1.00 54.14 H new ATOM 0 HA VAL A 44 -1.204 30.940 -17.945 1.00 53.14 H new ATOM 0 HB VAL A 44 -1.919 33.369 -17.325 1.00 24.32 H new ATOM 0 HG11 VAL A 44 -2.016 33.818 -14.908 1.00 20.54 H new ATOM 0 HG12 VAL A 44 -3.364 32.787 -15.444 1.00 20.54 H new ATOM 0 HG13 VAL A 44 -1.981 32.068 -14.586 1.00 20.54 H new ATOM 0 HG21 VAL A 44 0.167 33.718 -16.063 1.00 11.10 H new ATOM 0 HG22 VAL A 44 0.290 31.964 -15.789 1.00 11.10 H new ATOM 0 HG23 VAL A 44 0.406 32.616 -17.440 1.00 11.10 H new ATOM 639 N LYS A 45 -3.094 29.995 -15.451 1.00 13.45 N ATOM 640 CA LYS A 45 -3.222 29.041 -14.355 1.00 44.42 C ATOM 641 C LYS A 45 -2.841 27.636 -14.811 1.00 11.24 C ATOM 642 O LYS A 45 -2.052 26.955 -14.157 1.00 45.42 O ATOM 643 CB LYS A 45 -4.653 29.043 -13.814 1.00 0.44 C ATOM 644 CG LYS A 45 -4.735 29.262 -12.313 1.00 11.21 C ATOM 645 CD LYS A 45 -4.887 30.735 -11.972 1.00 2.14 C ATOM 646 CE LYS A 45 -4.158 31.087 -10.684 1.00 23.10 C ATOM 647 NZ LYS A 45 -3.316 32.306 -10.838 1.00 61.44 N ATOM 0 H LYS A 45 -3.959 30.479 -15.691 1.00 13.45 H new ATOM 0 HA LYS A 45 -2.540 29.344 -13.560 1.00 44.42 H new ATOM 0 HB2 LYS A 45 -5.222 29.824 -14.318 1.00 0.44 H new ATOM 0 HB3 LYS A 45 -5.127 28.093 -14.061 1.00 0.44 H new ATOM 0 HG2 LYS A 45 -5.580 28.705 -11.909 1.00 11.21 H new ATOM 0 HG3 LYS A 45 -3.837 28.868 -11.837 1.00 11.21 H new ATOM 0 HD2 LYS A 45 -4.497 31.341 -12.790 1.00 2.14 H new ATOM 0 HD3 LYS A 45 -5.945 30.979 -11.871 1.00 2.14 H new ATOM 0 HE2 LYS A 45 -4.885 31.246 -9.887 1.00 23.10 H new ATOM 0 HE3 LYS A 45 -3.531 30.249 -10.381 1.00 23.10 H new ATOM 0 HZ1 LYS A 45 -2.836 32.512 -9.939 1.00 61.44 H new ATOM 0 HZ2 LYS A 45 -2.606 32.146 -11.581 1.00 61.44 H new ATOM 0 HZ3 LYS A 45 -3.917 33.112 -11.102 1.00 61.44 H new ATOM 661 N GLU A 46 -3.407 27.210 -15.936 1.00 30.15 N ATOM 662 CA GLU A 46 -3.125 25.886 -16.477 1.00 74.23 C ATOM 663 C GLU A 46 -1.642 25.735 -16.803 1.00 52.53 C ATOM 664 O GLU A 46 -1.018 24.732 -16.458 1.00 4.43 O ATOM 665 CB GLU A 46 -3.963 25.636 -17.733 1.00 63.43 C ATOM 666 CG GLU A 46 -5.461 25.721 -17.493 1.00 44.02 C ATOM 667 CD GLU A 46 -6.264 25.604 -18.774 1.00 13.32 C ATOM 668 OE1 GLU A 46 -6.363 24.481 -19.311 1.00 51.21 O ATOM 669 OE2 GLU A 46 -6.794 26.635 -19.239 1.00 1.14 O ATOM 0 H GLU A 46 -4.062 27.762 -16.489 1.00 30.15 H new ATOM 0 HA GLU A 46 -3.389 25.148 -15.719 1.00 74.23 H new ATOM 0 HB2 GLU A 46 -3.684 26.363 -18.496 1.00 63.43 H new ATOM 0 HB3 GLU A 46 -3.723 24.649 -18.129 1.00 63.43 H new ATOM 0 HG2 GLU A 46 -5.761 24.929 -16.807 1.00 44.02 H new ATOM 0 HG3 GLU A 46 -5.694 26.669 -17.007 1.00 44.02 H new ATOM 676 N VAL A 47 -1.084 26.740 -17.472 1.00 15.03 N ATOM 677 CA VAL A 47 0.325 26.721 -17.845 1.00 11.14 C ATOM 678 C VAL A 47 1.216 26.573 -16.617 1.00 23.33 C ATOM 679 O VAL A 47 2.156 25.779 -16.611 1.00 61.21 O ATOM 680 CB VAL A 47 0.722 28.002 -18.602 1.00 64.11 C ATOM 681 CG1 VAL A 47 2.155 27.904 -19.103 1.00 24.45 C ATOM 682 CG2 VAL A 47 -0.237 28.258 -19.755 1.00 10.25 C ATOM 0 H VAL A 47 -1.587 27.577 -17.766 1.00 15.03 H new ATOM 0 HA VAL A 47 0.468 25.862 -18.500 1.00 11.14 H new ATOM 0 HB VAL A 47 0.660 28.844 -17.913 1.00 64.11 H new ATOM 0 HG11 VAL A 47 2.418 28.818 -19.635 1.00 24.45 H new ATOM 0 HG12 VAL A 47 2.828 27.771 -18.256 1.00 24.45 H new ATOM 0 HG13 VAL A 47 2.247 27.052 -19.777 1.00 24.45 H new ATOM 0 HG21 VAL A 47 0.058 29.167 -20.279 1.00 10.25 H new ATOM 0 HG22 VAL A 47 -0.209 27.415 -20.446 1.00 10.25 H new ATOM 0 HG23 VAL A 47 -1.249 28.375 -19.367 1.00 10.25 H new ATOM 692 N GLY A 48 0.914 27.343 -15.576 1.00 11.01 N ATOM 693 CA GLY A 48 1.697 27.282 -14.356 1.00 10.04 C ATOM 694 C GLY A 48 1.602 25.932 -13.673 1.00 2.13 C ATOM 695 O GLY A 48 2.521 25.522 -12.962 1.00 73.50 O ATOM 0 H GLY A 48 0.141 28.008 -15.556 1.00 11.01 H new ATOM 0 HA2 GLY A 48 2.741 27.496 -14.587 1.00 10.04 H new ATOM 0 HA3 GLY A 48 1.356 28.058 -13.670 1.00 10.04 H new ATOM 699 N LEU A 49 0.489 25.240 -13.886 1.00 74.01 N ATOM 700 CA LEU A 49 0.276 23.928 -13.284 1.00 51.23 C ATOM 701 C LEU A 49 1.271 22.910 -13.831 1.00 43.25 C ATOM 702 O LEU A 49 1.883 22.156 -13.075 1.00 13.52 O ATOM 703 CB LEU A 49 -1.154 23.451 -13.545 1.00 40.41 C ATOM 704 CG LEU A 49 -1.729 22.465 -12.528 1.00 25.21 C ATOM 705 CD1 LEU A 49 -2.302 23.206 -11.330 1.00 54.25 C ATOM 706 CD2 LEU A 49 -2.792 21.590 -13.176 1.00 21.25 C ATOM 0 H LEU A 49 -0.281 25.565 -14.471 1.00 74.01 H new ATOM 0 HA LEU A 49 0.432 24.020 -12.209 1.00 51.23 H new ATOM 0 HB2 LEU A 49 -1.806 24.324 -13.583 1.00 40.41 H new ATOM 0 HB3 LEU A 49 -1.186 22.986 -14.530 1.00 40.41 H new ATOM 0 HG LEU A 49 -0.922 21.822 -12.178 1.00 25.21 H new ATOM 0 HD11 LEU A 49 -2.707 22.487 -10.617 1.00 54.25 H new ATOM 0 HD12 LEU A 49 -1.514 23.788 -10.851 1.00 54.25 H new ATOM 0 HD13 LEU A 49 -3.096 23.875 -11.662 1.00 54.25 H new ATOM 0 HD21 LEU A 49 -3.190 20.894 -12.438 1.00 21.25 H new ATOM 0 HD22 LEU A 49 -3.598 22.218 -13.555 1.00 21.25 H new ATOM 0 HD23 LEU A 49 -2.350 21.030 -14.000 1.00 21.25 H new ATOM 718 N ALA A 50 1.430 22.896 -15.151 1.00 21.21 N ATOM 719 CA ALA A 50 2.354 21.974 -15.799 1.00 65.20 C ATOM 720 C ALA A 50 3.782 22.194 -15.311 1.00 43.21 C ATOM 721 O ALA A 50 4.490 21.242 -14.979 1.00 51.21 O ATOM 722 CB ALA A 50 2.281 22.129 -17.311 1.00 24.01 C ATOM 0 H ALA A 50 0.931 23.513 -15.792 1.00 21.21 H new ATOM 0 HA ALA A 50 2.060 20.958 -15.534 1.00 65.20 H new ATOM 0 HB1 ALA A 50 2.976 21.434 -17.782 1.00 24.01 H new ATOM 0 HB2 ALA A 50 1.268 21.914 -17.650 1.00 24.01 H new ATOM 0 HB3 ALA A 50 2.547 23.150 -17.585 1.00 24.01 H new ATOM 728 N LEU A 51 4.201 23.454 -15.270 1.00 55.44 N ATOM 729 CA LEU A 51 5.545 23.800 -14.823 1.00 44.13 C ATOM 730 C LEU A 51 5.753 23.405 -13.365 1.00 31.42 C ATOM 731 O LEU A 51 6.669 22.649 -13.041 1.00 4.24 O ATOM 732 CB LEU A 51 5.792 25.300 -14.997 1.00 21.21 C ATOM 733 CG LEU A 51 6.179 25.758 -16.404 1.00 33.04 C ATOM 734 CD1 LEU A 51 5.298 26.915 -16.849 1.00 71.11 C ATOM 735 CD2 LEU A 51 7.647 26.154 -16.451 1.00 2.44 C ATOM 0 H LEU A 51 3.628 24.253 -15.541 1.00 55.44 H new ATOM 0 HA LEU A 51 6.258 23.247 -15.435 1.00 44.13 H new ATOM 0 HB2 LEU A 51 4.890 25.833 -14.698 1.00 21.21 H new ATOM 0 HB3 LEU A 51 6.582 25.600 -14.309 1.00 21.21 H new ATOM 0 HG LEU A 51 6.026 24.926 -17.092 1.00 33.04 H new ATOM 0 HD11 LEU A 51 5.588 27.228 -17.852 1.00 71.11 H new ATOM 0 HD12 LEU A 51 4.255 26.597 -16.855 1.00 71.11 H new ATOM 0 HD13 LEU A 51 5.419 27.750 -16.159 1.00 71.11 H new ATOM 0 HD21 LEU A 51 7.905 26.477 -17.460 1.00 2.44 H new ATOM 0 HD22 LEU A 51 7.826 26.971 -15.752 1.00 2.44 H new ATOM 0 HD23 LEU A 51 8.264 25.298 -16.176 1.00 2.44 H new ATOM 747 N ARG A 52 4.894 23.918 -12.490 1.00 5.31 N ATOM 748 CA ARG A 52 4.983 23.618 -11.066 1.00 61.21 C ATOM 749 C ARG A 52 4.994 22.111 -10.828 1.00 61.41 C ATOM 750 O ARG A 52 5.727 21.611 -9.974 1.00 64.32 O ATOM 751 CB ARG A 52 3.813 24.255 -10.315 1.00 35.11 C ATOM 752 CG ARG A 52 3.755 23.878 -8.844 1.00 24.34 C ATOM 753 CD ARG A 52 2.475 23.128 -8.510 1.00 11.30 C ATOM 754 NE ARG A 52 1.414 24.028 -8.066 1.00 10.32 N ATOM 755 CZ ARG A 52 0.174 23.630 -7.803 1.00 63.12 C ATOM 756 NH1 ARG A 52 -0.158 22.354 -7.939 1.00 72.42 N ATOM 757 NH2 ARG A 52 -0.736 24.509 -7.403 1.00 63.12 N ATOM 0 H ARG A 52 4.129 24.543 -12.742 1.00 5.31 H new ATOM 0 HA ARG A 52 5.917 24.035 -10.690 1.00 61.21 H new ATOM 0 HB2 ARG A 52 3.885 25.339 -10.401 1.00 35.11 H new ATOM 0 HB3 ARG A 52 2.880 23.958 -10.794 1.00 35.11 H new ATOM 0 HG2 ARG A 52 4.616 23.260 -8.592 1.00 24.34 H new ATOM 0 HG3 ARG A 52 3.820 24.779 -8.234 1.00 24.34 H new ATOM 0 HD2 ARG A 52 2.139 22.576 -9.388 1.00 11.30 H new ATOM 0 HD3 ARG A 52 2.678 22.394 -7.730 1.00 11.30 H new ATOM 0 HE ARG A 52 1.637 25.017 -7.951 1.00 10.32 H new ATOM 0 HH11 ARG A 52 0.539 21.676 -8.246 1.00 72.42 H new ATOM 0 HH12 ARG A 52 -1.111 22.050 -7.737 1.00 72.42 H new ATOM 0 HH21 ARG A 52 -0.484 25.492 -7.297 1.00 63.12 H new ATOM 0 HH22 ARG A 52 -1.688 24.202 -7.201 1.00 63.12 H new ATOM 771 N THR A 53 4.175 21.390 -11.589 1.00 5.42 N ATOM 772 CA THR A 53 4.089 19.941 -11.460 1.00 44.30 C ATOM 773 C THR A 53 5.339 19.265 -12.012 1.00 2.12 C ATOM 774 O THR A 53 5.797 18.253 -11.479 1.00 12.21 O ATOM 775 CB THR A 53 2.853 19.385 -12.191 1.00 62.22 C ATOM 776 OG1 THR A 53 1.663 19.982 -11.665 1.00 52.12 O ATOM 777 CG2 THR A 53 2.774 17.872 -12.047 1.00 3.53 C ATOM 0 H THR A 53 3.562 21.787 -12.301 1.00 5.42 H new ATOM 0 HA THR A 53 4.001 19.723 -10.396 1.00 44.30 H new ATOM 0 HB THR A 53 2.944 19.629 -13.249 1.00 62.22 H new ATOM 0 HG1 THR A 53 1.639 20.931 -11.907 1.00 52.12 H new ATOM 0 HG21 THR A 53 1.893 17.502 -12.571 1.00 3.53 H new ATOM 0 HG22 THR A 53 3.668 17.419 -12.475 1.00 3.53 H new ATOM 0 HG23 THR A 53 2.704 17.610 -10.991 1.00 3.53 H new ATOM 785 N LEU A 54 5.888 19.830 -13.082 1.00 22.24 N ATOM 786 CA LEU A 54 7.087 19.281 -13.706 1.00 2.41 C ATOM 787 C LEU A 54 8.210 19.127 -12.685 1.00 62.43 C ATOM 788 O LEU A 54 8.957 18.148 -12.712 1.00 23.51 O ATOM 789 CB LEU A 54 7.546 20.183 -14.853 1.00 63.45 C ATOM 790 CG LEU A 54 7.866 19.479 -16.173 1.00 22.12 C ATOM 791 CD1 LEU A 54 6.660 18.694 -16.665 1.00 41.44 C ATOM 792 CD2 LEU A 54 8.313 20.488 -17.221 1.00 32.22 C ATOM 0 H LEU A 54 5.522 20.667 -13.535 1.00 22.24 H new ATOM 0 HA LEU A 54 6.843 18.295 -14.102 1.00 2.41 H new ATOM 0 HB2 LEU A 54 6.769 20.925 -15.039 1.00 63.45 H new ATOM 0 HB3 LEU A 54 8.434 20.726 -14.529 1.00 63.45 H new ATOM 0 HG LEU A 54 8.683 18.779 -16.001 1.00 22.12 H new ATOM 0 HD11 LEU A 54 6.906 18.200 -17.605 1.00 41.44 H new ATOM 0 HD12 LEU A 54 6.386 17.945 -15.922 1.00 41.44 H new ATOM 0 HD13 LEU A 54 5.822 19.374 -16.821 1.00 41.44 H new ATOM 0 HD21 LEU A 54 8.536 19.969 -18.153 1.00 32.22 H new ATOM 0 HD22 LEU A 54 7.517 21.213 -17.391 1.00 32.22 H new ATOM 0 HD23 LEU A 54 9.206 21.005 -16.870 1.00 32.22 H new ATOM 804 N LEU A 55 8.323 20.097 -11.785 1.00 53.24 N ATOM 805 CA LEU A 55 9.353 20.068 -10.753 1.00 43.24 C ATOM 806 C LEU A 55 9.181 18.855 -9.846 1.00 32.34 C ATOM 807 O LEU A 55 10.147 18.160 -9.531 1.00 12.21 O ATOM 808 CB LEU A 55 9.307 21.352 -9.923 1.00 22.35 C ATOM 809 CG LEU A 55 10.658 21.909 -9.473 1.00 22.14 C ATOM 810 CD1 LEU A 55 10.558 23.403 -9.208 1.00 50.35 C ATOM 811 CD2 LEU A 55 11.150 21.178 -8.232 1.00 21.02 C ATOM 0 H LEU A 55 7.713 20.914 -11.749 1.00 53.24 H new ATOM 0 HA LEU A 55 10.323 19.995 -11.244 1.00 43.24 H new ATOM 0 HB2 LEU A 55 8.796 22.119 -10.505 1.00 22.35 H new ATOM 0 HB3 LEU A 55 8.700 21.167 -9.037 1.00 22.35 H new ATOM 0 HG LEU A 55 11.380 21.750 -10.274 1.00 22.14 H new ATOM 0 HD11 LEU A 55 11.529 23.782 -8.889 1.00 50.35 H new ATOM 0 HD12 LEU A 55 10.251 23.915 -10.120 1.00 50.35 H new ATOM 0 HD13 LEU A 55 9.822 23.585 -8.425 1.00 50.35 H new ATOM 0 HD21 LEU A 55 12.113 21.588 -7.926 1.00 21.02 H new ATOM 0 HD22 LEU A 55 10.429 21.305 -7.425 1.00 21.02 H new ATOM 0 HD23 LEU A 55 11.262 20.117 -8.455 1.00 21.02 H new ATOM 823 N ALA A 56 7.944 18.604 -9.430 1.00 14.43 N ATOM 824 CA ALA A 56 7.644 17.472 -8.562 1.00 12.42 C ATOM 825 C ALA A 56 7.810 16.151 -9.305 1.00 45.41 C ATOM 826 O ALA A 56 8.436 15.218 -8.802 1.00 32.45 O ATOM 827 CB ALA A 56 6.233 17.593 -8.006 1.00 34.13 C ATOM 0 H ALA A 56 7.133 19.170 -9.680 1.00 14.43 H new ATOM 0 HA ALA A 56 8.352 17.484 -7.733 1.00 12.42 H new ATOM 0 HB1 ALA A 56 6.022 16.741 -7.360 1.00 34.13 H new ATOM 0 HB2 ALA A 56 6.146 18.515 -7.431 1.00 34.13 H new ATOM 0 HB3 ALA A 56 5.518 17.610 -8.829 1.00 34.13 H new ATOM 833 N THR A 57 7.246 16.078 -10.507 1.00 4.51 N ATOM 834 CA THR A 57 7.331 14.871 -11.319 1.00 10.21 C ATOM 835 C THR A 57 8.776 14.412 -11.472 1.00 64.22 C ATOM 836 O THR A 57 9.136 13.311 -11.055 1.00 2.04 O ATOM 837 CB THR A 57 6.723 15.091 -12.717 1.00 60.10 C ATOM 838 OG1 THR A 57 7.364 16.197 -13.362 1.00 24.11 O ATOM 839 CG2 THR A 57 5.227 15.351 -12.622 1.00 22.41 C ATOM 0 H THR A 57 6.725 16.841 -10.939 1.00 4.51 H new ATOM 0 HA THR A 57 6.761 14.100 -10.800 1.00 10.21 H new ATOM 0 HB THR A 57 6.882 14.187 -13.304 1.00 60.10 H new ATOM 0 HG1 THR A 57 7.693 16.824 -12.685 1.00 24.11 H new ATOM 0 HG21 THR A 57 4.820 15.503 -13.622 1.00 22.41 H new ATOM 0 HG22 THR A 57 4.738 14.495 -12.158 1.00 22.41 H new ATOM 0 HG23 THR A 57 5.050 16.241 -12.019 1.00 22.41 H new ATOM 847 N VAL A 58 9.602 15.262 -12.073 1.00 43.53 N ATOM 848 CA VAL A 58 11.010 14.944 -12.280 1.00 1.20 C ATOM 849 C VAL A 58 11.709 14.657 -10.956 1.00 11.32 C ATOM 850 O VAL A 58 12.613 13.824 -10.887 1.00 13.32 O ATOM 851 CB VAL A 58 11.745 16.092 -12.998 1.00 23.41 C ATOM 852 CG1 VAL A 58 13.220 15.758 -13.166 1.00 51.42 C ATOM 853 CG2 VAL A 58 11.098 16.379 -14.344 1.00 61.43 C ATOM 0 H VAL A 58 9.320 16.177 -12.425 1.00 43.53 H new ATOM 0 HA VAL A 58 11.044 14.053 -12.906 1.00 1.20 H new ATOM 0 HB VAL A 58 11.668 16.990 -12.385 1.00 23.41 H new ATOM 0 HG11 VAL A 58 13.723 16.580 -13.675 1.00 51.42 H new ATOM 0 HG12 VAL A 58 13.673 15.606 -12.186 1.00 51.42 H new ATOM 0 HG13 VAL A 58 13.322 14.848 -13.757 1.00 51.42 H new ATOM 0 HG21 VAL A 58 11.630 17.193 -14.837 1.00 61.43 H new ATOM 0 HG22 VAL A 58 11.143 15.486 -14.967 1.00 61.43 H new ATOM 0 HG23 VAL A 58 10.057 16.665 -14.194 1.00 61.43 H new ATOM 863 N ASP A 59 11.284 15.352 -9.906 1.00 50.34 N ATOM 864 CA ASP A 59 11.868 15.171 -8.582 1.00 52.43 C ATOM 865 C ASP A 59 11.890 13.696 -8.195 1.00 44.04 C ATOM 866 O ASP A 59 12.906 13.184 -7.726 1.00 70.30 O ATOM 867 CB ASP A 59 11.083 15.972 -7.542 1.00 3.40 C ATOM 868 CG ASP A 59 11.917 17.066 -6.904 1.00 23.22 C ATOM 869 OD1 ASP A 59 12.191 18.077 -7.584 1.00 14.43 O ATOM 870 OD2 ASP A 59 12.296 16.910 -5.724 1.00 40.52 O ATOM 0 H ASP A 59 10.537 16.046 -9.946 1.00 50.34 H new ATOM 0 HA ASP A 59 12.895 15.536 -8.611 1.00 52.43 H new ATOM 0 HB2 ASP A 59 10.207 16.416 -8.015 1.00 3.40 H new ATOM 0 HB3 ASP A 59 10.719 15.298 -6.767 1.00 3.40 H new ATOM 875 N GLU A 60 10.763 13.020 -8.395 1.00 25.32 N ATOM 876 CA GLU A 60 10.655 11.604 -8.065 1.00 34.45 C ATOM 877 C GLU A 60 11.193 10.737 -9.199 1.00 43.24 C ATOM 878 O GLU A 60 11.381 9.531 -9.039 1.00 11.33 O ATOM 879 CB GLU A 60 9.198 11.235 -7.774 1.00 41.33 C ATOM 880 CG GLU A 60 8.245 11.586 -8.905 1.00 31.45 C ATOM 881 CD GLU A 60 6.825 11.128 -8.633 1.00 70.32 C ATOM 882 OE1 GLU A 60 6.525 10.781 -7.472 1.00 74.50 O ATOM 883 OE2 GLU A 60 6.014 11.117 -9.583 1.00 41.10 O ATOM 0 H GLU A 60 9.913 13.429 -8.783 1.00 25.32 H new ATOM 0 HA GLU A 60 11.255 11.419 -7.174 1.00 34.45 H new ATOM 0 HB2 GLU A 60 9.135 10.165 -7.576 1.00 41.33 H new ATOM 0 HB3 GLU A 60 8.876 11.747 -6.867 1.00 41.33 H new ATOM 0 HG2 GLU A 60 8.252 12.665 -9.059 1.00 31.45 H new ATOM 0 HG3 GLU A 60 8.600 11.129 -9.829 1.00 31.45 H new ATOM 890 N SER A 61 11.439 11.361 -10.347 1.00 3.31 N ATOM 891 CA SER A 61 11.952 10.648 -11.511 1.00 21.45 C ATOM 892 C SER A 61 13.415 10.262 -11.311 1.00 12.55 C ATOM 893 O SER A 61 13.896 9.286 -11.887 1.00 45.41 O ATOM 894 CB SER A 61 11.807 11.508 -12.767 1.00 73.55 C ATOM 895 OG SER A 61 11.757 10.703 -13.933 1.00 21.11 O ATOM 0 H SER A 61 11.291 12.359 -10.496 1.00 3.31 H new ATOM 0 HA SER A 61 11.367 9.736 -11.634 1.00 21.45 H new ATOM 0 HB2 SER A 61 10.901 12.109 -12.697 1.00 73.55 H new ATOM 0 HB3 SER A 61 12.645 12.201 -12.836 1.00 73.55 H new ATOM 0 HG SER A 61 11.663 11.276 -14.722 1.00 21.11 H new ATOM 901 N LEU A 62 14.117 11.036 -10.490 1.00 34.03 N ATOM 902 CA LEU A 62 15.525 10.777 -10.212 1.00 42.30 C ATOM 903 C LEU A 62 15.749 9.313 -9.850 1.00 72.41 C ATOM 904 O LEU A 62 16.479 8.586 -10.524 1.00 24.32 O ATOM 905 CB LEU A 62 16.015 11.676 -9.075 1.00 34.11 C ATOM 906 CG LEU A 62 16.846 12.890 -9.490 1.00 1.35 C ATOM 907 CD1 LEU A 62 17.111 13.790 -8.292 1.00 63.42 C ATOM 908 CD2 LEU A 62 18.155 12.448 -10.127 1.00 23.22 C ATOM 0 H LEU A 62 13.734 11.848 -10.006 1.00 34.03 H new ATOM 0 HA LEU A 62 16.094 11.000 -11.114 1.00 42.30 H new ATOM 0 HB2 LEU A 62 15.147 12.028 -8.517 1.00 34.11 H new ATOM 0 HB3 LEU A 62 16.609 11.071 -8.391 1.00 34.11 H new ATOM 0 HG LEU A 62 16.280 13.459 -10.228 1.00 1.35 H new ATOM 0 HD11 LEU A 62 17.704 14.649 -8.606 1.00 63.42 H new ATOM 0 HD12 LEU A 62 16.163 14.135 -7.879 1.00 63.42 H new ATOM 0 HD13 LEU A 62 17.656 13.232 -7.531 1.00 63.42 H new ATOM 0 HD21 LEU A 62 18.733 13.325 -10.416 1.00 23.22 H new ATOM 0 HD22 LEU A 62 18.726 11.856 -9.412 1.00 23.22 H new ATOM 0 HD23 LEU A 62 17.944 11.845 -11.010 1.00 23.22 H new ATOM 920 N PRO A 63 15.104 8.867 -8.762 1.00 20.52 N ATOM 921 CA PRO A 63 15.215 7.484 -8.287 1.00 74.03 C ATOM 922 C PRO A 63 14.527 6.494 -9.221 1.00 32.20 C ATOM 923 O PRO A 63 14.975 5.358 -9.377 1.00 32.24 O ATOM 924 CB PRO A 63 14.509 7.517 -6.929 1.00 53.45 C ATOM 925 CG PRO A 63 13.555 8.658 -7.027 1.00 33.55 C ATOM 926 CD PRO A 63 14.217 9.677 -7.911 1.00 52.41 C ATOM 0 HA PRO A 63 16.252 7.153 -8.235 1.00 74.03 H new ATOM 0 HB2 PRO A 63 13.988 6.581 -6.731 1.00 53.45 H new ATOM 0 HB3 PRO A 63 15.220 7.664 -6.116 1.00 53.45 H new ATOM 0 HG2 PRO A 63 12.603 8.335 -7.449 1.00 33.55 H new ATOM 0 HG3 PRO A 63 13.343 9.075 -6.042 1.00 33.55 H new ATOM 0 HD2 PRO A 63 13.487 10.230 -8.503 1.00 52.41 H new ATOM 0 HD3 PRO A 63 14.777 10.410 -7.330 1.00 52.41 H new ATOM 934 N VAL A 64 13.436 6.932 -9.841 1.00 53.11 N ATOM 935 CA VAL A 64 12.687 6.085 -10.761 1.00 73.41 C ATOM 936 C VAL A 64 13.609 5.442 -11.791 1.00 21.11 C ATOM 937 O VAL A 64 13.402 4.298 -12.199 1.00 14.24 O ATOM 938 CB VAL A 64 11.593 6.883 -11.495 1.00 72.42 C ATOM 939 CG1 VAL A 64 11.041 6.082 -12.665 1.00 21.43 C ATOM 940 CG2 VAL A 64 10.481 7.271 -10.533 1.00 33.04 C ATOM 0 H VAL A 64 13.051 7.869 -9.723 1.00 53.11 H new ATOM 0 HA VAL A 64 12.217 5.305 -10.161 1.00 73.41 H new ATOM 0 HB VAL A 64 12.037 7.797 -11.889 1.00 72.42 H new ATOM 0 HG11 VAL A 64 10.269 6.662 -13.171 1.00 21.43 H new ATOM 0 HG12 VAL A 64 11.846 5.859 -13.366 1.00 21.43 H new ATOM 0 HG13 VAL A 64 10.612 5.150 -12.298 1.00 21.43 H new ATOM 0 HG21 VAL A 64 9.717 7.834 -11.068 1.00 33.04 H new ATOM 0 HG22 VAL A 64 10.037 6.371 -10.108 1.00 33.04 H new ATOM 0 HG23 VAL A 64 10.891 7.887 -9.732 1.00 33.04 H new ATOM 950 N LEU A 65 14.629 6.184 -12.208 1.00 71.00 N ATOM 951 CA LEU A 65 15.585 5.687 -13.191 1.00 24.31 C ATOM 952 C LEU A 65 16.977 5.558 -12.580 1.00 31.53 C ATOM 953 O LEU A 65 17.331 6.254 -11.628 1.00 40.24 O ATOM 954 CB LEU A 65 15.633 6.619 -14.403 1.00 13.13 C ATOM 955 CG LEU A 65 14.302 6.859 -15.117 1.00 43.22 C ATOM 956 CD1 LEU A 65 13.493 5.573 -15.186 1.00 4.24 C ATOM 957 CD2 LEU A 65 13.510 7.953 -14.416 1.00 21.01 C ATOM 0 H LEU A 65 14.815 7.132 -11.881 1.00 71.00 H new ATOM 0 HA LEU A 65 15.256 4.699 -13.513 1.00 24.31 H new ATOM 0 HB2 LEU A 65 16.028 7.582 -14.080 1.00 13.13 H new ATOM 0 HB3 LEU A 65 16.341 6.209 -15.124 1.00 13.13 H new ATOM 0 HG LEU A 65 14.512 7.186 -16.135 1.00 43.22 H new ATOM 0 HD11 LEU A 65 12.549 5.764 -15.697 1.00 4.24 H new ATOM 0 HD12 LEU A 65 14.056 4.818 -15.734 1.00 4.24 H new ATOM 0 HD13 LEU A 65 13.292 5.215 -14.176 1.00 4.24 H new ATOM 0 HD21 LEU A 65 12.566 8.110 -14.938 1.00 21.01 H new ATOM 0 HD22 LEU A 65 13.310 7.655 -13.387 1.00 21.01 H new ATOM 0 HD23 LEU A 65 14.086 8.879 -14.421 1.00 21.01 H new ATOM 969 N PRO A 66 17.787 4.646 -13.139 1.00 51.51 N ATOM 970 CA PRO A 66 19.154 4.407 -12.667 1.00 32.50 C ATOM 971 C PRO A 66 20.087 5.571 -12.978 1.00 45.31 C ATOM 972 O PRO A 66 19.934 6.248 -13.994 1.00 74.03 O ATOM 973 CB PRO A 66 19.582 3.157 -13.440 1.00 70.23 C ATOM 974 CG PRO A 66 18.746 3.170 -14.673 1.00 61.54 C ATOM 975 CD PRO A 66 17.431 3.781 -14.276 1.00 20.10 C ATOM 0 HA PRO A 66 19.197 4.291 -11.584 1.00 32.50 H new ATOM 0 HB2 PRO A 66 20.644 3.185 -13.682 1.00 70.23 H new ATOM 0 HB3 PRO A 66 19.412 2.253 -12.856 1.00 70.23 H new ATOM 0 HG2 PRO A 66 19.224 3.751 -15.462 1.00 61.54 H new ATOM 0 HG3 PRO A 66 18.606 2.161 -15.060 1.00 61.54 H new ATOM 0 HD2 PRO A 66 16.990 4.352 -15.093 1.00 20.10 H new ATOM 0 HD3 PRO A 66 16.704 3.020 -13.990 1.00 20.10 H new ATOM 983 N ALA A 67 21.056 5.799 -12.097 1.00 12.22 N ATOM 984 CA ALA A 67 22.016 6.881 -12.279 1.00 73.32 C ATOM 985 C ALA A 67 22.778 6.723 -13.590 1.00 64.42 C ATOM 986 O ALA A 67 23.399 5.689 -13.838 1.00 32.34 O ATOM 987 CB ALA A 67 22.983 6.931 -11.106 1.00 65.12 C ATOM 0 H ALA A 67 21.197 5.249 -11.250 1.00 12.22 H new ATOM 0 HA ALA A 67 21.465 7.820 -12.321 1.00 73.32 H new ATOM 0 HB1 ALA A 67 23.694 7.743 -11.255 1.00 65.12 H new ATOM 0 HB2 ALA A 67 22.428 7.100 -10.183 1.00 65.12 H new ATOM 0 HB3 ALA A 67 23.521 5.986 -11.038 1.00 65.12 H new ATOM 993 N SER A 68 22.727 7.754 -14.427 1.00 61.24 N ATOM 994 CA SER A 68 23.410 7.727 -15.716 1.00 13.13 C ATOM 995 C SER A 68 23.155 9.016 -16.492 1.00 61.51 C ATOM 996 O SER A 68 24.017 9.489 -17.233 1.00 43.30 O ATOM 997 CB SER A 68 22.946 6.523 -16.538 1.00 30.15 C ATOM 998 OG SER A 68 21.693 6.045 -16.080 1.00 54.40 O ATOM 0 H SER A 68 22.220 8.618 -14.236 1.00 61.24 H new ATOM 0 HA SER A 68 24.481 7.640 -15.531 1.00 13.13 H new ATOM 0 HB2 SER A 68 22.870 6.804 -17.589 1.00 30.15 H new ATOM 0 HB3 SER A 68 23.688 5.727 -16.474 1.00 30.15 H new ATOM 0 HG SER A 68 21.632 5.080 -16.242 1.00 54.40 H new ATOM 1004 N THR A 69 21.964 9.579 -16.317 1.00 53.02 N ATOM 1005 CA THR A 69 21.593 10.811 -17.001 1.00 43.51 C ATOM 1006 C THR A 69 21.457 11.967 -16.016 1.00 40.14 C ATOM 1007 O THR A 69 20.712 12.917 -16.258 1.00 14.12 O ATOM 1008 CB THR A 69 20.270 10.650 -17.772 1.00 54.11 C ATOM 1009 OG1 THR A 69 19.974 11.850 -18.495 1.00 45.23 O ATOM 1010 CG2 THR A 69 19.125 10.330 -16.822 1.00 5.31 C ATOM 0 H THR A 69 21.239 9.201 -15.707 1.00 53.02 H new ATOM 0 HA THR A 69 22.392 11.032 -17.709 1.00 43.51 H new ATOM 0 HB THR A 69 20.383 9.823 -18.473 1.00 54.11 H new ATOM 0 HG1 THR A 69 19.956 12.609 -17.876 1.00 45.23 H new ATOM 0 HG21 THR A 69 18.201 10.221 -17.390 1.00 5.31 H new ATOM 0 HG22 THR A 69 19.339 9.400 -16.295 1.00 5.31 H new ATOM 0 HG23 THR A 69 19.014 11.139 -16.100 1.00 5.31 H new ATOM 1018 N HIS A 70 22.182 11.881 -14.906 1.00 21.34 N ATOM 1019 CA HIS A 70 22.143 12.921 -13.884 1.00 53.10 C ATOM 1020 C HIS A 70 22.437 14.290 -14.491 1.00 23.42 C ATOM 1021 O HIS A 70 21.829 15.291 -14.113 1.00 32.13 O ATOM 1022 CB HIS A 70 23.149 12.615 -12.775 1.00 24.42 C ATOM 1023 CG HIS A 70 22.513 12.159 -11.498 1.00 22.41 C ATOM 1024 ND1 HIS A 70 23.011 12.479 -10.253 1.00 24.34 N ATOM 1025 CD2 HIS A 70 21.412 11.404 -11.278 1.00 35.40 C ATOM 1026 CE1 HIS A 70 22.245 11.939 -9.322 1.00 53.00 C ATOM 1027 NE2 HIS A 70 21.266 11.282 -9.918 1.00 23.41 N ATOM 0 H HIS A 70 22.804 11.102 -14.691 1.00 21.34 H new ATOM 0 HA HIS A 70 21.140 12.939 -13.458 1.00 53.10 H new ATOM 0 HB2 HIS A 70 23.838 11.845 -13.123 1.00 24.42 H new ATOM 0 HB3 HIS A 70 23.742 13.508 -12.577 1.00 24.42 H new ATOM 0 HD1 HIS A 70 23.842 13.045 -10.078 1.00 24.34 H new ATOM 0 HD2 HIS A 70 20.768 10.977 -12.032 1.00 35.40 H new ATOM 0 HE1 HIS A 70 22.394 12.021 -8.255 1.00 53.00 H new ATOM 1035 N ARG A 71 23.374 14.325 -15.432 1.00 64.34 N ATOM 1036 CA ARG A 71 23.751 15.570 -16.090 1.00 11.54 C ATOM 1037 C ARG A 71 22.520 16.298 -16.622 1.00 13.24 C ATOM 1038 O ARG A 71 22.297 17.468 -16.312 1.00 50.00 O ATOM 1039 CB ARG A 71 24.727 15.293 -17.235 1.00 11.25 C ATOM 1040 CG ARG A 71 26.185 15.497 -16.855 1.00 34.31 C ATOM 1041 CD ARG A 71 27.108 14.653 -17.719 1.00 44.14 C ATOM 1042 NE ARG A 71 26.965 13.226 -17.443 1.00 3.34 N ATOM 1043 CZ ARG A 71 27.510 12.274 -18.192 1.00 11.11 C ATOM 1044 NH1 ARG A 71 28.230 12.595 -19.258 1.00 4.34 N ATOM 1045 NH2 ARG A 71 27.335 10.998 -17.875 1.00 72.53 N ATOM 0 H ARG A 71 23.887 13.505 -15.756 1.00 64.34 H new ATOM 0 HA ARG A 71 24.239 16.207 -15.353 1.00 11.54 H new ATOM 0 HB2 ARG A 71 24.590 14.268 -17.578 1.00 11.25 H new ATOM 0 HB3 ARG A 71 24.484 15.945 -18.074 1.00 11.25 H new ATOM 0 HG2 ARG A 71 26.446 16.550 -16.962 1.00 34.31 H new ATOM 0 HG3 ARG A 71 26.329 15.238 -15.806 1.00 34.31 H new ATOM 0 HD2 ARG A 71 26.893 14.842 -18.771 1.00 44.14 H new ATOM 0 HD3 ARG A 71 28.141 14.954 -17.546 1.00 44.14 H new ATOM 0 HE ARG A 71 26.416 12.945 -16.630 1.00 3.34 H new ATOM 0 HH11 ARG A 71 28.367 13.575 -19.505 1.00 4.34 H new ATOM 0 HH12 ARG A 71 28.647 11.862 -19.831 1.00 4.34 H new ATOM 0 HH21 ARG A 71 26.782 10.747 -17.056 1.00 72.53 H new ATOM 0 HH22 ARG A 71 27.754 10.267 -18.451 1.00 72.53 H new ATOM 1059 N GLU A 72 21.725 15.597 -17.424 1.00 35.13 N ATOM 1060 CA GLU A 72 20.517 16.177 -17.999 1.00 41.43 C ATOM 1061 C GLU A 72 19.464 16.421 -16.922 1.00 51.42 C ATOM 1062 O GLU A 72 18.805 17.462 -16.908 1.00 24.22 O ATOM 1063 CB GLU A 72 19.950 15.259 -19.084 1.00 10.12 C ATOM 1064 CG GLU A 72 20.837 15.149 -20.313 1.00 34.11 C ATOM 1065 CD GLU A 72 20.100 14.592 -21.515 1.00 61.35 C ATOM 1066 OE1 GLU A 72 18.851 14.602 -21.503 1.00 2.52 O ATOM 1067 OE2 GLU A 72 20.772 14.145 -22.469 1.00 34.24 O ATOM 0 H GLU A 72 21.896 14.627 -17.690 1.00 35.13 H new ATOM 0 HA GLU A 72 20.783 17.135 -18.446 1.00 41.43 H new ATOM 0 HB2 GLU A 72 19.800 14.264 -18.664 1.00 10.12 H new ATOM 0 HB3 GLU A 72 18.970 15.629 -19.385 1.00 10.12 H new ATOM 0 HG2 GLU A 72 21.234 16.134 -20.559 1.00 34.11 H new ATOM 0 HG3 GLU A 72 21.689 14.509 -20.085 1.00 34.11 H new ATOM 1074 N ILE A 73 19.311 15.455 -16.023 1.00 52.12 N ATOM 1075 CA ILE A 73 18.339 15.565 -14.943 1.00 32.24 C ATOM 1076 C ILE A 73 18.537 16.855 -14.154 1.00 74.01 C ATOM 1077 O ILE A 73 17.593 17.616 -13.944 1.00 73.02 O ATOM 1078 CB ILE A 73 18.432 14.368 -13.978 1.00 74.42 C ATOM 1079 CG1 ILE A 73 18.093 13.068 -14.710 1.00 73.53 C ATOM 1080 CG2 ILE A 73 17.503 14.571 -12.791 1.00 34.14 C ATOM 1081 CD1 ILE A 73 18.655 11.833 -14.041 1.00 34.11 C ATOM 0 H ILE A 73 19.848 14.588 -16.021 1.00 52.12 H new ATOM 0 HA ILE A 73 17.352 15.573 -15.406 1.00 32.24 H new ATOM 0 HB ILE A 73 19.454 14.298 -13.606 1.00 74.42 H new ATOM 0 HG12 ILE A 73 17.009 12.972 -14.780 1.00 73.53 H new ATOM 0 HG13 ILE A 73 18.475 13.125 -15.729 1.00 73.53 H new ATOM 0 HG21 ILE A 73 17.580 13.717 -12.118 1.00 34.14 H new ATOM 0 HG22 ILE A 73 17.786 15.479 -12.258 1.00 34.14 H new ATOM 0 HG23 ILE A 73 16.476 14.663 -13.144 1.00 34.14 H new ATOM 0 HD11 ILE A 73 18.375 10.949 -14.615 1.00 34.11 H new ATOM 0 HD12 ILE A 73 19.742 11.907 -13.995 1.00 34.11 H new ATOM 0 HD13 ILE A 73 18.254 11.752 -13.031 1.00 34.11 H new ATOM 1093 N GLU A 74 19.771 17.095 -13.722 1.00 34.44 N ATOM 1094 CA GLU A 74 20.092 18.294 -12.957 1.00 70.10 C ATOM 1095 C GLU A 74 19.786 19.552 -13.764 1.00 42.15 C ATOM 1096 O GLU A 74 19.110 20.461 -13.284 1.00 52.24 O ATOM 1097 CB GLU A 74 21.566 18.284 -12.546 1.00 52.01 C ATOM 1098 CG GLU A 74 21.797 18.683 -11.098 1.00 52.23 C ATOM 1099 CD GLU A 74 22.748 19.856 -10.961 1.00 63.22 C ATOM 1100 OE1 GLU A 74 22.534 20.878 -11.646 1.00 61.31 O ATOM 1101 OE2 GLU A 74 23.707 19.751 -10.168 1.00 4.10 O ATOM 0 H GLU A 74 20.564 16.476 -13.889 1.00 34.44 H new ATOM 0 HA GLU A 74 19.472 18.299 -12.060 1.00 70.10 H new ATOM 0 HB2 GLU A 74 21.973 17.286 -12.708 1.00 52.01 H new ATOM 0 HB3 GLU A 74 22.120 18.963 -13.194 1.00 52.01 H new ATOM 0 HG2 GLU A 74 20.842 18.939 -10.639 1.00 52.23 H new ATOM 0 HG3 GLU A 74 22.196 17.830 -10.549 1.00 52.23 H new ATOM 1108 N MET A 75 20.290 19.596 -14.993 1.00 42.44 N ATOM 1109 CA MET A 75 20.071 20.742 -15.868 1.00 53.41 C ATOM 1110 C MET A 75 18.583 20.939 -16.144 1.00 23.13 C ATOM 1111 O MET A 75 18.143 22.042 -16.466 1.00 71.35 O ATOM 1112 CB MET A 75 20.825 20.557 -17.186 1.00 43.20 C ATOM 1113 CG MET A 75 20.983 21.843 -17.982 1.00 22.42 C ATOM 1114 SD MET A 75 21.573 21.552 -19.661 1.00 4.24 S ATOM 1115 CE MET A 75 23.340 21.746 -19.437 1.00 11.12 C ATOM 0 H MET A 75 20.853 18.852 -15.405 1.00 42.44 H new ATOM 0 HA MET A 75 20.450 21.630 -15.363 1.00 53.41 H new ATOM 0 HB2 MET A 75 21.812 20.146 -16.976 1.00 43.20 H new ATOM 0 HB3 MET A 75 20.298 19.824 -17.797 1.00 43.20 H new ATOM 0 HG2 MET A 75 20.025 22.361 -18.022 1.00 22.42 H new ATOM 0 HG3 MET A 75 21.680 22.502 -17.465 1.00 22.42 H new ATOM 0 HE1 MET A 75 23.846 21.595 -20.390 1.00 11.12 H new ATOM 0 HE2 MET A 75 23.552 22.750 -19.068 1.00 11.12 H new ATOM 0 HE3 MET A 75 23.698 21.011 -18.716 1.00 11.12 H new ATOM 1125 N ALA A 76 17.815 19.862 -16.015 1.00 12.45 N ATOM 1126 CA ALA A 76 16.377 19.918 -16.248 1.00 61.31 C ATOM 1127 C ALA A 76 15.665 20.650 -15.116 1.00 32.22 C ATOM 1128 O ALA A 76 14.667 21.335 -15.339 1.00 43.12 O ATOM 1129 CB ALA A 76 15.814 18.513 -16.408 1.00 11.23 C ATOM 0 H ALA A 76 18.164 18.941 -15.751 1.00 12.45 H new ATOM 0 HA ALA A 76 16.204 20.474 -17.169 1.00 61.31 H new ATOM 0 HB1 ALA A 76 14.739 18.569 -16.581 1.00 11.23 H new ATOM 0 HB2 ALA A 76 16.293 18.023 -17.256 1.00 11.23 H new ATOM 0 HB3 ALA A 76 16.006 17.939 -15.502 1.00 11.23 H new ATOM 1135 N GLN A 77 16.183 20.499 -13.901 1.00 62.13 N ATOM 1136 CA GLN A 77 15.595 21.145 -12.734 1.00 53.34 C ATOM 1137 C GLN A 77 15.645 22.664 -12.870 1.00 22.43 C ATOM 1138 O GLN A 77 14.610 23.325 -12.956 1.00 23.03 O ATOM 1139 CB GLN A 77 16.324 20.710 -11.462 1.00 51.31 C ATOM 1140 CG GLN A 77 15.868 19.361 -10.931 1.00 64.30 C ATOM 1141 CD GLN A 77 16.223 19.158 -9.471 1.00 51.20 C ATOM 1142 OE1 GLN A 77 17.387 18.956 -9.125 1.00 43.12 O ATOM 1143 NE2 GLN A 77 15.218 19.212 -8.605 1.00 30.53 N ATOM 0 H GLN A 77 17.009 19.935 -13.700 1.00 62.13 H new ATOM 0 HA GLN A 77 14.551 20.839 -12.668 1.00 53.34 H new ATOM 0 HB2 GLN A 77 17.395 20.669 -11.663 1.00 51.31 H new ATOM 0 HB3 GLN A 77 16.173 21.465 -10.690 1.00 51.31 H new ATOM 0 HG2 GLN A 77 14.789 19.272 -11.054 1.00 64.30 H new ATOM 0 HG3 GLN A 77 16.323 18.568 -11.525 1.00 64.30 H new ATOM 0 HE21 GLN A 77 14.268 19.382 -8.936 1.00 30.53 H new ATOM 0 HE22 GLN A 77 15.396 19.084 -7.609 1.00 30.53 H new ATOM 1152 N LYS A 78 16.856 23.211 -12.888 1.00 12.05 N ATOM 1153 CA LYS A 78 17.043 24.652 -13.013 1.00 71.42 C ATOM 1154 C LYS A 78 16.364 25.180 -14.273 1.00 5.42 C ATOM 1155 O LYS A 78 15.709 26.223 -14.246 1.00 41.12 O ATOM 1156 CB LYS A 78 18.535 24.992 -13.043 1.00 55.22 C ATOM 1157 CG LYS A 78 19.127 25.252 -11.669 1.00 31.52 C ATOM 1158 CD LYS A 78 20.540 24.705 -11.559 1.00 24.03 C ATOM 1159 CE LYS A 78 21.511 25.765 -11.060 1.00 54.03 C ATOM 1160 NZ LYS A 78 22.911 25.473 -11.474 1.00 3.35 N ATOM 0 H LYS A 78 17.723 22.678 -12.818 1.00 12.05 H new ATOM 0 HA LYS A 78 16.585 25.130 -12.147 1.00 71.42 H new ATOM 0 HB2 LYS A 78 19.077 24.171 -13.513 1.00 55.22 H new ATOM 0 HB3 LYS A 78 18.686 25.873 -13.667 1.00 55.22 H new ATOM 0 HG2 LYS A 78 19.134 26.324 -11.472 1.00 31.52 H new ATOM 0 HG3 LYS A 78 18.497 24.792 -10.907 1.00 31.52 H new ATOM 0 HD2 LYS A 78 20.549 23.853 -10.880 1.00 24.03 H new ATOM 0 HD3 LYS A 78 20.867 24.340 -12.533 1.00 24.03 H new ATOM 0 HE2 LYS A 78 21.214 26.740 -11.446 1.00 54.03 H new ATOM 0 HE3 LYS A 78 21.458 25.823 -9.973 1.00 54.03 H new ATOM 0 HZ1 LYS A 78 23.542 26.218 -11.115 1.00 3.35 H new ATOM 0 HZ2 LYS A 78 23.204 24.554 -11.085 1.00 3.35 H new ATOM 0 HZ3 LYS A 78 22.967 25.443 -12.512 1.00 3.35 H new ATOM 1174 N LEU A 79 16.524 24.455 -15.374 1.00 44.22 N ATOM 1175 CA LEU A 79 15.926 24.851 -16.644 1.00 73.34 C ATOM 1176 C LEU A 79 14.426 25.084 -16.490 1.00 42.23 C ATOM 1177 O LEU A 79 13.895 26.098 -16.945 1.00 51.21 O ATOM 1178 CB LEU A 79 16.180 23.779 -17.706 1.00 41.42 C ATOM 1179 CG LEU A 79 15.325 23.871 -18.971 1.00 2.23 C ATOM 1180 CD1 LEU A 79 16.188 23.705 -20.212 1.00 23.12 C ATOM 1181 CD2 LEU A 79 14.219 22.826 -18.944 1.00 4.21 C ATOM 0 H LEU A 79 17.063 23.590 -15.413 1.00 44.22 H new ATOM 0 HA LEU A 79 16.390 25.785 -16.961 1.00 73.34 H new ATOM 0 HB2 LEU A 79 17.229 23.826 -17.997 1.00 41.42 H new ATOM 0 HB3 LEU A 79 16.018 22.801 -17.252 1.00 41.42 H new ATOM 0 HG LEU A 79 14.864 24.858 -19.004 1.00 2.23 H new ATOM 0 HD11 LEU A 79 15.562 23.773 -21.102 1.00 23.12 H new ATOM 0 HD12 LEU A 79 16.943 24.491 -20.238 1.00 23.12 H new ATOM 0 HD13 LEU A 79 16.678 22.732 -20.187 1.00 23.12 H new ATOM 0 HD21 LEU A 79 13.621 22.906 -19.852 1.00 4.21 H new ATOM 0 HD22 LEU A 79 14.660 21.831 -18.887 1.00 4.21 H new ATOM 0 HD23 LEU A 79 13.583 22.992 -18.074 1.00 4.21 H new ATOM 1193 N LEU A 80 13.749 24.141 -15.845 1.00 23.02 N ATOM 1194 CA LEU A 80 12.310 24.245 -15.628 1.00 23.50 C ATOM 1195 C LEU A 80 11.954 25.570 -14.964 1.00 12.54 C ATOM 1196 O LEU A 80 11.057 26.281 -15.416 1.00 3.21 O ATOM 1197 CB LEU A 80 11.820 23.081 -14.765 1.00 74.43 C ATOM 1198 CG LEU A 80 10.433 23.245 -14.143 1.00 35.50 C ATOM 1199 CD1 LEU A 80 9.365 23.302 -15.225 1.00 64.40 C ATOM 1200 CD2 LEU A 80 10.147 22.110 -13.169 1.00 43.34 C ATOM 0 H LEU A 80 14.173 23.296 -15.463 1.00 23.02 H new ATOM 0 HA LEU A 80 11.817 24.203 -16.599 1.00 23.50 H new ATOM 0 HB2 LEU A 80 11.818 22.178 -15.375 1.00 74.43 H new ATOM 0 HB3 LEU A 80 12.540 22.922 -13.962 1.00 74.43 H new ATOM 0 HG LEU A 80 10.413 24.185 -13.591 1.00 35.50 H new ATOM 0 HD11 LEU A 80 8.385 23.419 -14.763 1.00 64.40 H new ATOM 0 HD12 LEU A 80 9.559 24.149 -15.884 1.00 64.40 H new ATOM 0 HD13 LEU A 80 9.385 22.379 -15.805 1.00 64.40 H new ATOM 0 HD21 LEU A 80 9.156 22.243 -12.736 1.00 43.34 H new ATOM 0 HD22 LEU A 80 10.187 21.158 -13.698 1.00 43.34 H new ATOM 0 HD23 LEU A 80 10.894 22.115 -12.375 1.00 43.34 H new ATOM 1212 N ASN A 81 12.664 25.898 -13.889 1.00 31.32 N ATOM 1213 CA ASN A 81 12.423 27.140 -13.163 1.00 23.51 C ATOM 1214 C ASN A 81 12.440 28.335 -14.110 1.00 51.42 C ATOM 1215 O ASN A 81 11.486 29.112 -14.163 1.00 70.53 O ATOM 1216 CB ASN A 81 13.476 27.327 -12.069 1.00 1.05 C ATOM 1217 CG ASN A 81 12.929 28.061 -10.860 1.00 31.15 C ATOM 1218 OD1 ASN A 81 12.797 29.285 -10.870 1.00 24.15 O ATOM 1219 ND2 ASN A 81 12.607 27.314 -9.810 1.00 21.12 N ATOM 0 H ASN A 81 13.411 25.321 -13.502 1.00 31.32 H new ATOM 0 HA ASN A 81 11.437 27.078 -12.703 1.00 23.51 H new ATOM 0 HB2 ASN A 81 13.852 26.352 -11.759 1.00 1.05 H new ATOM 0 HB3 ASN A 81 14.323 27.881 -12.474 1.00 1.05 H new ATOM 0 HD21 ASN A 81 12.234 27.752 -8.968 1.00 21.12 H new ATOM 0 HD22 ASN A 81 12.733 26.302 -9.846 1.00 21.12 H new ATOM 1226 N SER A 82 13.530 28.477 -14.857 1.00 63.30 N ATOM 1227 CA SER A 82 13.673 29.579 -15.800 1.00 50.54 C ATOM 1228 C SER A 82 12.472 29.650 -16.739 1.00 2.31 C ATOM 1229 O SER A 82 11.837 30.696 -16.874 1.00 42.25 O ATOM 1230 CB SER A 82 14.960 29.421 -16.612 1.00 22.11 C ATOM 1231 OG SER A 82 15.831 30.520 -16.406 1.00 63.43 O ATOM 0 H SER A 82 14.328 27.842 -14.827 1.00 63.30 H new ATOM 0 HA SER A 82 13.723 30.507 -15.230 1.00 50.54 H new ATOM 0 HB2 SER A 82 15.462 28.496 -16.327 1.00 22.11 H new ATOM 0 HB3 SER A 82 14.718 29.339 -17.671 1.00 22.11 H new ATOM 0 HG SER A 82 16.647 30.394 -16.934 1.00 63.43 H new ATOM 1237 N ASP A 83 12.167 28.530 -17.385 1.00 3.15 N ATOM 1238 CA ASP A 83 11.042 28.463 -18.310 1.00 44.01 C ATOM 1239 C ASP A 83 9.767 28.980 -17.653 1.00 55.51 C ATOM 1240 O ASP A 83 8.916 29.582 -18.311 1.00 63.43 O ATOM 1241 CB ASP A 83 10.836 27.026 -18.792 1.00 50.22 C ATOM 1242 CG ASP A 83 12.132 26.368 -19.223 1.00 40.55 C ATOM 1243 OD1 ASP A 83 13.084 27.101 -19.565 1.00 13.11 O ATOM 1244 OD2 ASP A 83 12.194 25.121 -19.220 1.00 64.04 O ATOM 0 H ASP A 83 12.683 27.656 -17.285 1.00 3.15 H new ATOM 0 HA ASP A 83 11.270 29.096 -19.167 1.00 44.01 H new ATOM 0 HB2 ASP A 83 10.382 26.439 -17.993 1.00 50.22 H new ATOM 0 HB3 ASP A 83 10.135 27.023 -19.627 1.00 50.22 H new ATOM 1249 N LEU A 84 9.639 28.742 -16.353 1.00 14.45 N ATOM 1250 CA LEU A 84 8.466 29.183 -15.606 1.00 14.43 C ATOM 1251 C LEU A 84 8.311 30.699 -15.679 1.00 43.24 C ATOM 1252 O LEU A 84 7.330 31.208 -16.221 1.00 20.54 O ATOM 1253 CB LEU A 84 8.570 28.740 -14.145 1.00 40.43 C ATOM 1254 CG LEU A 84 7.262 28.721 -13.354 1.00 55.35 C ATOM 1255 CD1 LEU A 84 7.205 27.503 -12.446 1.00 13.22 C ATOM 1256 CD2 LEU A 84 7.109 30.001 -12.545 1.00 21.33 C ATOM 0 H LEU A 84 10.333 28.246 -15.794 1.00 14.45 H new ATOM 0 HA LEU A 84 7.586 28.724 -16.057 1.00 14.43 H new ATOM 0 HB2 LEU A 84 9.001 27.739 -14.120 1.00 40.43 H new ATOM 0 HB3 LEU A 84 9.270 29.402 -13.635 1.00 40.43 H new ATOM 0 HG LEU A 84 6.434 28.661 -14.060 1.00 55.35 H new ATOM 0 HD11 LEU A 84 6.267 27.507 -11.891 1.00 13.22 H new ATOM 0 HD12 LEU A 84 7.267 26.597 -13.049 1.00 13.22 H new ATOM 0 HD13 LEU A 84 8.040 27.531 -11.747 1.00 13.22 H new ATOM 0 HD21 LEU A 84 6.172 29.970 -11.988 1.00 21.33 H new ATOM 0 HD22 LEU A 84 7.942 30.093 -11.848 1.00 21.33 H new ATOM 0 HD23 LEU A 84 7.103 30.858 -13.218 1.00 21.33 H new ATOM 1268 N ALA A 85 9.289 31.415 -15.133 1.00 55.42 N ATOM 1269 CA ALA A 85 9.263 32.873 -15.141 1.00 25.21 C ATOM 1270 C ALA A 85 9.143 33.412 -16.562 1.00 44.31 C ATOM 1271 O ALA A 85 8.465 34.411 -16.801 1.00 32.42 O ATOM 1272 CB ALA A 85 10.511 33.426 -14.468 1.00 62.41 C ATOM 0 H ALA A 85 10.108 31.010 -14.680 1.00 55.42 H new ATOM 0 HA ALA A 85 8.386 33.200 -14.582 1.00 25.21 H new ATOM 0 HB1 ALA A 85 10.479 34.515 -14.481 1.00 62.41 H new ATOM 0 HB2 ALA A 85 10.553 33.076 -13.436 1.00 62.41 H new ATOM 0 HB3 ALA A 85 11.396 33.083 -15.004 1.00 62.41 H new ATOM 1278 N GLU A 86 9.807 32.746 -17.501 1.00 61.34 N ATOM 1279 CA GLU A 86 9.775 33.161 -18.899 1.00 31.21 C ATOM 1280 C GLU A 86 8.367 33.032 -19.472 1.00 54.43 C ATOM 1281 O GLU A 86 7.864 33.948 -20.125 1.00 71.13 O ATOM 1282 CB GLU A 86 10.752 32.323 -19.726 1.00 24.34 C ATOM 1283 CG GLU A 86 11.755 33.153 -20.509 1.00 53.41 C ATOM 1284 CD GLU A 86 13.190 32.850 -20.125 1.00 41.35 C ATOM 1285 OE1 GLU A 86 13.644 31.714 -20.374 1.00 41.15 O ATOM 1286 OE2 GLU A 86 13.859 33.750 -19.576 1.00 44.42 O ATOM 0 H GLU A 86 10.373 31.917 -17.320 1.00 61.34 H new ATOM 0 HA GLU A 86 10.075 34.208 -18.947 1.00 31.21 H new ATOM 0 HB2 GLU A 86 11.292 31.648 -19.061 1.00 24.34 H new ATOM 0 HB3 GLU A 86 10.187 31.701 -20.420 1.00 24.34 H new ATOM 0 HG2 GLU A 86 11.621 32.967 -21.575 1.00 53.41 H new ATOM 0 HG3 GLU A 86 11.554 34.211 -20.342 1.00 53.41 H new ATOM 1293 N LEU A 87 7.735 31.890 -19.224 1.00 43.22 N ATOM 1294 CA LEU A 87 6.385 31.640 -19.716 1.00 14.14 C ATOM 1295 C LEU A 87 5.384 32.591 -19.067 1.00 3.34 C ATOM 1296 O LEU A 87 4.680 33.331 -19.755 1.00 22.04 O ATOM 1297 CB LEU A 87 5.981 30.191 -19.440 1.00 35.23 C ATOM 1298 CG LEU A 87 5.060 29.542 -20.474 1.00 14.31 C ATOM 1299 CD1 LEU A 87 3.734 30.284 -20.547 1.00 72.43 C ATOM 1300 CD2 LEU A 87 5.731 29.509 -21.839 1.00 54.33 C ATOM 0 H LEU A 87 8.136 31.122 -18.685 1.00 43.22 H new ATOM 0 HA LEU A 87 6.379 31.814 -20.792 1.00 14.14 H new ATOM 0 HB2 LEU A 87 6.887 29.591 -19.363 1.00 35.23 H new ATOM 0 HB3 LEU A 87 5.488 30.151 -18.468 1.00 35.23 H new ATOM 0 HG LEU A 87 4.862 28.516 -20.164 1.00 14.31 H new ATOM 0 HD11 LEU A 87 3.091 29.808 -21.288 1.00 72.43 H new ATOM 0 HD12 LEU A 87 3.247 30.256 -19.572 1.00 72.43 H new ATOM 0 HD13 LEU A 87 3.912 31.320 -20.833 1.00 72.43 H new ATOM 0 HD21 LEU A 87 5.061 29.044 -22.562 1.00 54.33 H new ATOM 0 HD22 LEU A 87 5.959 30.526 -22.157 1.00 54.33 H new ATOM 0 HD23 LEU A 87 6.654 28.933 -21.777 1.00 54.33 H new ATOM 1312 N ILE A 88 5.329 32.568 -17.739 1.00 72.33 N ATOM 1313 CA ILE A 88 4.417 33.430 -16.998 1.00 3.41 C ATOM 1314 C ILE A 88 4.615 34.894 -17.377 1.00 3.13 C ATOM 1315 O ILE A 88 3.669 35.680 -17.375 1.00 33.24 O ATOM 1316 CB ILE A 88 4.607 33.275 -15.477 1.00 52.14 C ATOM 1317 CG1 ILE A 88 4.422 31.813 -15.065 1.00 14.40 C ATOM 1318 CG2 ILE A 88 3.631 34.170 -14.728 1.00 4.31 C ATOM 1319 CD1 ILE A 88 3.024 31.289 -15.308 1.00 54.34 C ATOM 0 H ILE A 88 5.905 31.962 -17.155 1.00 72.33 H new ATOM 0 HA ILE A 88 3.406 33.122 -17.263 1.00 3.41 H new ATOM 0 HB ILE A 88 5.621 33.580 -15.219 1.00 52.14 H new ATOM 0 HG12 ILE A 88 5.133 31.196 -15.615 1.00 14.40 H new ATOM 0 HG13 ILE A 88 4.661 31.709 -14.007 1.00 14.40 H new ATOM 0 HG21 ILE A 88 3.777 34.050 -13.655 1.00 4.31 H new ATOM 0 HG22 ILE A 88 3.806 35.210 -15.004 1.00 4.31 H new ATOM 0 HG23 ILE A 88 2.610 33.893 -14.988 1.00 4.31 H new ATOM 0 HD11 ILE A 88 2.966 30.247 -14.993 1.00 54.34 H new ATOM 0 HD12 ILE A 88 2.309 31.881 -14.737 1.00 54.34 H new ATOM 0 HD13 ILE A 88 2.788 31.360 -16.370 1.00 54.34 H new ATOM 1331 N ASN A 89 5.853 35.253 -17.703 1.00 73.04 N ATOM 1332 CA ASN A 89 6.175 36.623 -18.086 1.00 63.33 C ATOM 1333 C ASN A 89 5.432 37.022 -19.358 1.00 23.53 C ATOM 1334 O ASN A 89 4.629 37.954 -19.354 1.00 14.20 O ATOM 1335 CB ASN A 89 7.684 36.774 -18.295 1.00 15.22 C ATOM 1336 CG ASN A 89 8.050 38.107 -18.920 1.00 32.52 C ATOM 1337 OD1 ASN A 89 7.542 39.154 -18.518 1.00 25.32 O ATOM 1338 ND2 ASN A 89 8.935 38.072 -19.909 1.00 50.31 N ATOM 0 H ASN A 89 6.649 34.615 -17.710 1.00 73.04 H new ATOM 0 HA ASN A 89 5.858 37.284 -17.279 1.00 63.33 H new ATOM 0 HB2 ASN A 89 8.193 36.673 -17.336 1.00 15.22 H new ATOM 0 HB3 ASN A 89 8.043 35.966 -18.933 1.00 15.22 H new ATOM 0 HD21 ASN A 89 9.220 38.937 -20.369 1.00 50.31 H new ATOM 0 HD22 ASN A 89 9.330 37.181 -20.209 1.00 50.31 H new ATOM 1345 N LYS A 90 5.706 36.308 -20.445 1.00 10.23 N ATOM 1346 CA LYS A 90 5.063 36.585 -21.724 1.00 21.21 C ATOM 1347 C LYS A 90 3.546 36.482 -21.604 1.00 10.22 C ATOM 1348 O LYS A 90 2.818 37.375 -22.036 1.00 2.50 O ATOM 1349 CB LYS A 90 5.568 35.612 -22.792 1.00 53.45 C ATOM 1350 CG LYS A 90 7.082 35.566 -22.907 1.00 14.43 C ATOM 1351 CD LYS A 90 7.649 36.907 -23.341 1.00 1.42 C ATOM 1352 CE LYS A 90 8.412 36.792 -24.652 1.00 35.01 C ATOM 1353 NZ LYS A 90 9.111 38.060 -25.000 1.00 62.41 N ATOM 0 H LYS A 90 6.369 35.533 -20.466 1.00 10.23 H new ATOM 0 HA LYS A 90 5.318 37.603 -22.018 1.00 21.21 H new ATOM 0 HB2 LYS A 90 5.199 34.612 -22.564 1.00 53.45 H new ATOM 0 HB3 LYS A 90 5.147 35.895 -23.757 1.00 53.45 H new ATOM 0 HG2 LYS A 90 7.512 35.282 -21.947 1.00 14.43 H new ATOM 0 HG3 LYS A 90 7.370 34.798 -23.625 1.00 14.43 H new ATOM 0 HD2 LYS A 90 6.838 37.627 -23.453 1.00 1.42 H new ATOM 0 HD3 LYS A 90 8.312 37.291 -22.566 1.00 1.42 H new ATOM 0 HE2 LYS A 90 9.140 35.984 -24.579 1.00 35.01 H new ATOM 0 HE3 LYS A 90 7.721 36.527 -25.452 1.00 35.01 H new ATOM 0 HZ1 LYS A 90 9.619 37.941 -25.900 1.00 62.41 H new ATOM 0 HZ2 LYS A 90 8.414 38.826 -25.095 1.00 62.41 H new ATOM 0 HZ3 LYS A 90 9.789 38.300 -24.249 1.00 62.41 H new ATOM 1367 N MET A 91 3.076 35.388 -21.013 1.00 43.22 N ATOM 1368 CA MET A 91 1.645 35.171 -20.834 1.00 44.22 C ATOM 1369 C MET A 91 1.009 36.336 -20.083 1.00 53.20 C ATOM 1370 O MET A 91 0.044 36.940 -20.554 1.00 64.52 O ATOM 1371 CB MET A 91 1.397 33.865 -20.078 1.00 74.31 C ATOM 1372 CG MET A 91 0.470 32.907 -20.809 1.00 32.31 C ATOM 1373 SD MET A 91 -1.180 32.848 -20.084 1.00 52.11 S ATOM 1374 CE MET A 91 -1.555 34.595 -19.953 1.00 62.32 C ATOM 0 H MET A 91 3.665 34.638 -20.650 1.00 43.22 H new ATOM 0 HA MET A 91 1.186 35.104 -21.820 1.00 44.22 H new ATOM 0 HB2 MET A 91 2.352 33.370 -19.901 1.00 74.31 H new ATOM 0 HB3 MET A 91 0.972 34.095 -19.101 1.00 74.31 H new ATOM 0 HG2 MET A 91 0.393 33.208 -21.854 1.00 32.31 H new ATOM 0 HG3 MET A 91 0.904 31.907 -20.797 1.00 32.31 H new ATOM 0 HE1 MET A 91 -2.628 34.727 -19.813 1.00 62.32 H new ATOM 0 HE2 MET A 91 -1.023 35.018 -19.101 1.00 62.32 H new ATOM 0 HE3 MET A 91 -1.243 35.104 -20.865 1.00 62.32 H new ATOM 1384 N LYS A 92 1.554 36.648 -18.912 1.00 34.31 N ATOM 1385 CA LYS A 92 1.040 37.741 -18.095 1.00 60.11 C ATOM 1386 C LYS A 92 1.155 39.071 -18.832 1.00 53.34 C ATOM 1387 O LYS A 92 0.316 39.958 -18.668 1.00 11.20 O ATOM 1388 CB LYS A 92 1.799 37.814 -16.768 1.00 63.14 C ATOM 1389 CG LYS A 92 1.185 38.778 -15.768 1.00 74.51 C ATOM 1390 CD LYS A 92 2.217 39.751 -15.224 1.00 62.43 C ATOM 1391 CE LYS A 92 1.566 40.853 -14.403 1.00 61.01 C ATOM 1392 NZ LYS A 92 2.375 41.202 -13.203 1.00 21.25 N ATOM 0 H LYS A 92 2.352 36.159 -18.507 1.00 34.31 H new ATOM 0 HA LYS A 92 -0.013 37.547 -17.894 1.00 60.11 H new ATOM 0 HB2 LYS A 92 1.836 36.819 -16.325 1.00 63.14 H new ATOM 0 HB3 LYS A 92 2.828 38.114 -16.964 1.00 63.14 H new ATOM 0 HG2 LYS A 92 0.377 39.333 -16.245 1.00 74.51 H new ATOM 0 HG3 LYS A 92 0.743 38.217 -14.944 1.00 74.51 H new ATOM 0 HD2 LYS A 92 2.936 39.213 -14.607 1.00 62.43 H new ATOM 0 HD3 LYS A 92 2.774 40.192 -16.051 1.00 62.43 H new ATOM 0 HE2 LYS A 92 1.436 41.740 -15.024 1.00 61.01 H new ATOM 0 HE3 LYS A 92 0.572 40.534 -14.090 1.00 61.01 H new ATOM 0 HZ1 LYS A 92 1.898 41.957 -12.670 1.00 21.25 H new ATOM 0 HZ2 LYS A 92 2.478 40.363 -12.598 1.00 21.25 H new ATOM 0 HZ3 LYS A 92 3.315 41.531 -13.502 1.00 21.25 H new ATOM 1406 N LEU A 93 2.196 39.204 -19.646 1.00 64.50 N ATOM 1407 CA LEU A 93 2.420 40.426 -20.410 1.00 71.25 C ATOM 1408 C LEU A 93 1.330 40.618 -21.460 1.00 41.51 C ATOM 1409 O LEU A 93 0.678 41.661 -21.508 1.00 33.24 O ATOM 1410 CB LEU A 93 3.792 40.385 -21.085 1.00 42.11 C ATOM 1411 CG LEU A 93 4.914 41.141 -20.371 1.00 74.25 C ATOM 1412 CD1 LEU A 93 6.273 40.680 -20.875 1.00 55.13 C ATOM 1413 CD2 LEU A 93 4.752 42.642 -20.564 1.00 60.32 C ATOM 0 H LEU A 93 2.899 38.480 -19.794 1.00 64.50 H new ATOM 0 HA LEU A 93 2.387 41.269 -19.719 1.00 71.25 H new ATOM 0 HB2 LEU A 93 4.092 39.342 -21.189 1.00 42.11 H new ATOM 0 HB3 LEU A 93 3.692 40.790 -22.092 1.00 42.11 H new ATOM 0 HG LEU A 93 4.852 40.923 -19.305 1.00 74.25 H new ATOM 0 HD11 LEU A 93 7.059 41.229 -20.356 1.00 55.13 H new ATOM 0 HD12 LEU A 93 6.389 39.613 -20.685 1.00 55.13 H new ATOM 0 HD13 LEU A 93 6.347 40.867 -21.946 1.00 55.13 H new ATOM 0 HD21 LEU A 93 5.559 43.164 -20.049 1.00 60.32 H new ATOM 0 HD22 LEU A 93 4.787 42.878 -21.628 1.00 60.32 H new ATOM 0 HD23 LEU A 93 3.794 42.960 -20.153 1.00 60.32 H new ATOM 1425 N ALA A 94 1.137 39.605 -22.298 1.00 44.44 N ATOM 1426 CA ALA A 94 0.124 39.662 -23.344 1.00 73.44 C ATOM 1427 C ALA A 94 -1.241 40.024 -22.768 1.00 4.22 C ATOM 1428 O ALA A 94 -2.008 40.763 -23.384 1.00 42.12 O ATOM 1429 CB ALA A 94 0.051 38.332 -24.081 1.00 42.30 C ATOM 0 H ALA A 94 1.669 38.735 -22.273 1.00 44.44 H new ATOM 0 HA ALA A 94 0.410 40.442 -24.050 1.00 73.44 H new ATOM 0 HB1 ALA A 94 -0.710 38.389 -24.860 1.00 42.30 H new ATOM 0 HB2 ALA A 94 1.018 38.113 -24.534 1.00 42.30 H new ATOM 0 HB3 ALA A 94 -0.208 37.540 -23.378 1.00 42.30 H new ATOM 1435 N GLN A 95 -1.536 39.499 -21.583 1.00 42.01 N ATOM 1436 CA GLN A 95 -2.809 39.767 -20.925 1.00 40.20 C ATOM 1437 C GLN A 95 -3.007 41.264 -20.711 1.00 44.33 C ATOM 1438 O GLN A 95 -4.137 41.746 -20.640 1.00 42.12 O ATOM 1439 CB GLN A 95 -2.878 39.035 -19.584 1.00 31.03 C ATOM 1440 CG GLN A 95 -4.297 38.740 -19.124 1.00 63.52 C ATOM 1441 CD GLN A 95 -4.889 39.865 -18.300 1.00 14.22 C ATOM 1442 OE1 GLN A 95 -4.168 40.719 -17.784 1.00 44.11 O ATOM 1443 NE2 GLN A 95 -6.211 39.873 -18.171 1.00 71.32 N ATOM 0 H GLN A 95 -0.911 38.886 -21.059 1.00 42.01 H new ATOM 0 HA GLN A 95 -3.607 39.402 -21.572 1.00 40.20 H new ATOM 0 HB2 GLN A 95 -2.328 38.097 -19.663 1.00 31.03 H new ATOM 0 HB3 GLN A 95 -2.376 39.636 -18.825 1.00 31.03 H new ATOM 0 HG2 GLN A 95 -4.928 38.562 -19.995 1.00 63.52 H new ATOM 0 HG3 GLN A 95 -4.301 37.823 -18.535 1.00 63.52 H new ATOM 0 HE21 GLN A 95 -6.771 39.146 -18.616 1.00 71.32 H new ATOM 0 HE22 GLN A 95 -6.666 40.606 -17.627 1.00 71.32 H new ATOM 1452 N GLN A 96 -1.900 41.994 -20.609 1.00 72.42 N ATOM 1453 CA GLN A 96 -1.953 43.436 -20.402 1.00 60.04 C ATOM 1454 C GLN A 96 -1.704 44.183 -21.709 1.00 22.33 C ATOM 1455 O GLN A 96 -2.148 45.318 -21.881 1.00 2.24 O ATOM 1456 CB GLN A 96 -0.923 43.860 -19.354 1.00 42.22 C ATOM 1457 CG GLN A 96 -1.479 44.806 -18.302 1.00 34.30 C ATOM 1458 CD GLN A 96 -1.884 46.148 -18.879 1.00 2.01 C ATOM 1459 OE1 GLN A 96 -1.047 46.896 -19.386 1.00 75.14 O ATOM 1460 NE2 GLN A 96 -3.172 46.461 -18.804 1.00 71.13 N ATOM 0 H GLN A 96 -0.957 41.610 -20.666 1.00 72.42 H new ATOM 0 HA GLN A 96 -2.951 43.690 -20.044 1.00 60.04 H new ATOM 0 HB2 GLN A 96 -0.532 42.970 -18.860 1.00 42.22 H new ATOM 0 HB3 GLN A 96 -0.083 44.341 -19.856 1.00 42.22 H new ATOM 0 HG2 GLN A 96 -2.343 44.344 -17.824 1.00 34.30 H new ATOM 0 HG3 GLN A 96 -0.730 44.960 -17.525 1.00 34.30 H new ATOM 0 HE21 GLN A 96 -3.831 45.811 -18.375 1.00 71.13 H new ATOM 0 HE22 GLN A 96 -3.503 47.352 -19.175 1.00 71.13 H new ATOM 1469 N TYR A 97 -0.991 43.538 -22.626 1.00 12.31 N ATOM 1470 CA TYR A 97 -0.680 44.143 -23.916 1.00 35.31 C ATOM 1471 C TYR A 97 -1.682 43.702 -24.979 1.00 52.51 C ATOM 1472 O TYR A 97 -1.373 43.683 -26.171 1.00 3.35 O ATOM 1473 CB TYR A 97 0.738 43.769 -24.350 1.00 31.34 C ATOM 1474 CG TYR A 97 1.806 44.664 -23.763 1.00 62.50 C ATOM 1475 CD1 TYR A 97 2.190 44.540 -22.433 1.00 63.14 C ATOM 1476 CD2 TYR A 97 2.431 45.633 -24.538 1.00 13.13 C ATOM 1477 CE1 TYR A 97 3.165 45.356 -21.893 1.00 24.32 C ATOM 1478 CE2 TYR A 97 3.408 46.452 -24.006 1.00 53.20 C ATOM 1479 CZ TYR A 97 3.771 46.310 -22.683 1.00 65.12 C ATOM 1480 OH TYR A 97 4.743 47.125 -22.149 1.00 63.14 O ATOM 0 H TYR A 97 -0.618 42.597 -22.500 1.00 12.31 H new ATOM 0 HA TYR A 97 -0.745 45.226 -23.807 1.00 35.31 H new ATOM 0 HB2 TYR A 97 0.939 42.738 -24.058 1.00 31.34 H new ATOM 0 HB3 TYR A 97 0.799 43.810 -25.438 1.00 31.34 H new ATOM 0 HD1 TYR A 97 1.718 43.793 -21.811 1.00 63.14 H new ATOM 0 HD2 TYR A 97 2.148 45.748 -25.574 1.00 13.13 H new ATOM 0 HE1 TYR A 97 3.451 45.247 -20.857 1.00 24.32 H new ATOM 0 HE2 TYR A 97 3.885 47.199 -24.623 1.00 53.20 H new ATOM 0 HH TYR A 97 5.068 47.741 -22.838 1.00 63.14 H new ATOM 1490 N VAL A 98 -2.886 43.350 -24.539 1.00 22.51 N ATOM 1491 CA VAL A 98 -3.935 42.911 -25.451 1.00 72.11 C ATOM 1492 C VAL A 98 -5.046 43.950 -25.551 1.00 34.13 C ATOM 1493 O VAL A 98 -5.671 44.107 -26.599 1.00 70.33 O ATOM 1494 CB VAL A 98 -4.542 41.568 -25.004 1.00 61.43 C ATOM 1495 CG1 VAL A 98 -5.057 41.663 -23.576 1.00 75.04 C ATOM 1496 CG2 VAL A 98 -5.652 41.143 -25.954 1.00 32.05 C ATOM 0 H VAL A 98 -3.159 43.360 -23.556 1.00 22.51 H new ATOM 0 HA VAL A 98 -3.471 42.784 -26.429 1.00 72.11 H new ATOM 0 HB VAL A 98 -3.761 40.808 -25.032 1.00 61.43 H new ATOM 0 HG11 VAL A 98 -5.482 40.705 -23.278 1.00 75.04 H new ATOM 0 HG12 VAL A 98 -4.234 41.918 -22.909 1.00 75.04 H new ATOM 0 HG13 VAL A 98 -5.825 42.435 -23.517 1.00 75.04 H new ATOM 0 HG21 VAL A 98 -6.070 40.192 -25.623 1.00 32.05 H new ATOM 0 HG22 VAL A 98 -6.435 41.901 -25.960 1.00 32.05 H new ATOM 0 HG23 VAL A 98 -5.247 41.031 -26.960 1.00 32.05 H new ATOM 1506 N MET A 99 -5.287 44.658 -24.452 1.00 71.10 N ATOM 1507 CA MET A 99 -6.323 45.684 -24.416 1.00 44.23 C ATOM 1508 C MET A 99 -5.977 46.838 -25.352 1.00 4.43 C ATOM 1509 O MET A 99 -6.858 47.570 -25.804 1.00 44.33 O ATOM 1510 CB MET A 99 -6.505 46.206 -22.990 1.00 21.44 C ATOM 1511 CG MET A 99 -5.259 46.863 -22.419 1.00 41.42 C ATOM 1512 SD MET A 99 -5.561 48.548 -21.852 1.00 44.21 S ATOM 1513 CE MET A 99 -4.522 49.476 -22.979 1.00 30.34 C ATOM 0 H MET A 99 -4.779 44.540 -23.575 1.00 71.10 H new ATOM 0 HA MET A 99 -7.257 45.234 -24.752 1.00 44.23 H new ATOM 0 HB2 MET A 99 -7.323 46.926 -22.977 1.00 21.44 H new ATOM 0 HB3 MET A 99 -6.798 45.379 -22.344 1.00 21.44 H new ATOM 0 HG2 MET A 99 -4.886 46.265 -21.587 1.00 41.42 H new ATOM 0 HG3 MET A 99 -4.478 46.874 -23.179 1.00 41.42 H new ATOM 0 HE1 MET A 99 -4.681 50.543 -22.826 1.00 30.34 H new ATOM 0 HE2 MET A 99 -3.476 49.235 -22.792 1.00 30.34 H new ATOM 0 HE3 MET A 99 -4.776 49.215 -24.006 1.00 30.34 H new ATOM 1523 N THR A 100 -4.688 46.997 -25.638 1.00 30.41 N ATOM 1524 CA THR A 100 -4.226 48.062 -26.518 1.00 2.41 C ATOM 1525 C THR A 100 -4.476 47.715 -27.981 1.00 25.41 C ATOM 1526 O THR A 100 -5.379 48.262 -28.613 1.00 63.35 O ATOM 1527 CB THR A 100 -2.725 48.345 -26.318 1.00 62.41 C ATOM 1528 OG1 THR A 100 -2.099 47.232 -25.668 1.00 54.43 O ATOM 1529 CG2 THR A 100 -2.516 49.604 -25.491 1.00 54.31 C ATOM 0 H THR A 100 -3.946 46.401 -25.272 1.00 30.41 H new ATOM 0 HA THR A 100 -4.794 48.955 -26.258 1.00 2.41 H new ATOM 0 HB THR A 100 -2.273 48.495 -27.298 1.00 62.41 H new ATOM 0 HG1 THR A 100 -2.260 47.284 -24.703 1.00 54.43 H new ATOM 0 HG21 THR A 100 -1.448 49.783 -25.364 1.00 54.31 H new ATOM 0 HG22 THR A 100 -2.968 50.454 -26.002 1.00 54.31 H new ATOM 0 HG23 THR A 100 -2.982 49.479 -24.514 1.00 54.31 H new ATOM 1537 N SER A 101 -3.670 46.801 -28.513 1.00 41.01 N ATOM 1538 CA SER A 101 -3.802 46.382 -29.904 1.00 0.44 C ATOM 1539 C SER A 101 -2.765 45.318 -30.251 1.00 53.44 C ATOM 1540 O SER A 101 -3.033 44.407 -31.036 1.00 3.21 O ATOM 1541 CB SER A 101 -3.648 47.585 -30.837 1.00 74.31 C ATOM 1542 OG SER A 101 -3.183 47.183 -32.114 1.00 20.12 O ATOM 0 H SER A 101 -2.919 46.337 -28.002 1.00 41.01 H new ATOM 0 HA SER A 101 -4.795 45.953 -30.037 1.00 0.44 H new ATOM 0 HB2 SER A 101 -4.606 48.095 -30.939 1.00 74.31 H new ATOM 0 HB3 SER A 101 -2.951 48.301 -30.401 1.00 74.31 H new ATOM 0 HG SER A 101 -3.094 47.969 -32.692 1.00 20.12 H new ATOM 1548 N LEU A 102 -1.581 45.441 -29.662 1.00 60.24 N ATOM 1549 CA LEU A 102 -0.502 44.490 -29.909 1.00 11.23 C ATOM 1550 C LEU A 102 -0.744 43.185 -29.158 1.00 34.12 C ATOM 1551 O LEU A 102 -0.015 42.851 -28.225 1.00 30.43 O ATOM 1552 CB LEU A 102 0.840 45.092 -29.489 1.00 21.15 C ATOM 1553 CG LEU A 102 1.089 46.540 -29.913 1.00 70.41 C ATOM 1554 CD1 LEU A 102 2.386 47.057 -29.311 1.00 12.25 C ATOM 1555 CD2 LEU A 102 1.121 46.652 -31.430 1.00 44.43 C ATOM 0 H LEU A 102 -1.343 46.189 -29.011 1.00 60.24 H new ATOM 0 HA LEU A 102 -0.478 44.274 -30.977 1.00 11.23 H new ATOM 0 HB2 LEU A 102 0.917 45.034 -28.403 1.00 21.15 H new ATOM 0 HB3 LEU A 102 1.638 44.472 -29.899 1.00 21.15 H new ATOM 0 HG LEU A 102 0.270 47.154 -29.540 1.00 70.41 H new ATOM 0 HD11 LEU A 102 2.546 48.089 -29.624 1.00 12.25 H new ATOM 0 HD12 LEU A 102 2.325 47.013 -28.224 1.00 12.25 H new ATOM 0 HD13 LEU A 102 3.217 46.441 -29.654 1.00 12.25 H new ATOM 0 HD21 LEU A 102 1.299 47.689 -31.715 1.00 44.43 H new ATOM 0 HD22 LEU A 102 1.921 46.025 -31.824 1.00 44.43 H new ATOM 0 HD23 LEU A 102 0.166 46.322 -31.839 1.00 44.43 H new ATOM 1567 N GLN A 103 -1.772 42.451 -29.573 1.00 41.23 N ATOM 1568 CA GLN A 103 -2.109 41.182 -28.940 1.00 63.54 C ATOM 1569 C GLN A 103 -1.460 40.016 -29.679 1.00 65.11 C ATOM 1570 O GLN A 103 -0.752 39.206 -29.080 1.00 13.52 O ATOM 1571 CB GLN A 103 -3.626 40.994 -28.901 1.00 33.02 C ATOM 1572 CG GLN A 103 -4.056 39.606 -28.455 1.00 34.13 C ATOM 1573 CD GLN A 103 -4.112 38.615 -29.601 1.00 41.51 C ATOM 1574 OE1 GLN A 103 -4.472 38.968 -30.725 1.00 1.34 O ATOM 1575 NE2 GLN A 103 -3.754 37.367 -29.323 1.00 55.22 N ATOM 0 H GLN A 103 -2.385 42.714 -30.345 1.00 41.23 H new ATOM 0 HA GLN A 103 -1.726 41.201 -27.920 1.00 63.54 H new ATOM 0 HB2 GLN A 103 -4.058 41.733 -28.227 1.00 33.02 H new ATOM 0 HB3 GLN A 103 -4.034 41.190 -29.893 1.00 33.02 H new ATOM 0 HG2 GLN A 103 -3.362 39.241 -27.698 1.00 34.13 H new ATOM 0 HG3 GLN A 103 -5.037 39.668 -27.985 1.00 34.13 H new ATOM 0 HE21 GLN A 103 -3.462 37.119 -28.378 1.00 55.22 H new ATOM 0 HE22 GLN A 103 -3.771 36.657 -30.055 1.00 55.22 H new ATOM 1584 N GLN A 104 -1.705 39.937 -30.983 1.00 14.41 N ATOM 1585 CA GLN A 104 -1.145 38.870 -31.803 1.00 31.44 C ATOM 1586 C GLN A 104 0.365 38.771 -31.610 1.00 34.41 C ATOM 1587 O GLN A 104 0.935 37.681 -31.656 1.00 50.32 O ATOM 1588 CB GLN A 104 -1.468 39.108 -33.279 1.00 33.14 C ATOM 1589 CG GLN A 104 -0.866 40.388 -33.834 1.00 64.04 C ATOM 1590 CD GLN A 104 -1.634 40.925 -35.026 1.00 45.20 C ATOM 1591 OE1 GLN A 104 -2.815 40.627 -35.204 1.00 21.33 O ATOM 1592 NE2 GLN A 104 -0.965 41.723 -35.851 1.00 30.13 N ATOM 0 H GLN A 104 -2.288 40.600 -31.494 1.00 14.41 H new ATOM 0 HA GLN A 104 -1.596 37.929 -31.488 1.00 31.44 H new ATOM 0 HB2 GLN A 104 -1.105 38.262 -33.863 1.00 33.14 H new ATOM 0 HB3 GLN A 104 -2.550 39.141 -33.405 1.00 33.14 H new ATOM 0 HG2 GLN A 104 -0.844 41.145 -33.050 1.00 64.04 H new ATOM 0 HG3 GLN A 104 0.168 40.202 -34.126 1.00 64.04 H new ATOM 0 HE21 GLN A 104 0.013 41.944 -35.665 1.00 30.13 H new ATOM 0 HE22 GLN A 104 -1.430 42.115 -36.670 1.00 30.13 H new ATOM 1601 N GLU A 105 1.005 39.915 -31.394 1.00 41.33 N ATOM 1602 CA GLU A 105 2.449 39.956 -31.196 1.00 2.30 C ATOM 1603 C GLU A 105 2.868 39.031 -30.057 1.00 65.24 C ATOM 1604 O GLU A 105 3.453 37.972 -30.287 1.00 23.11 O ATOM 1605 CB GLU A 105 2.905 41.386 -30.900 1.00 3.53 C ATOM 1606 CG GLU A 105 4.407 41.519 -30.708 1.00 52.24 C ATOM 1607 CD GLU A 105 4.770 42.490 -29.602 1.00 4.11 C ATOM 1608 OE1 GLU A 105 4.750 43.713 -29.854 1.00 72.22 O ATOM 1609 OE2 GLU A 105 5.075 42.026 -28.483 1.00 44.41 O ATOM 0 H GLU A 105 0.547 40.825 -31.352 1.00 41.33 H new ATOM 0 HA GLU A 105 2.926 39.613 -32.114 1.00 2.30 H new ATOM 0 HB2 GLU A 105 2.593 42.035 -31.719 1.00 3.53 H new ATOM 0 HB3 GLU A 105 2.400 41.741 -30.002 1.00 3.53 H new ATOM 0 HG2 GLU A 105 4.828 40.540 -30.480 1.00 52.24 H new ATOM 0 HG3 GLU A 105 4.861 41.851 -31.642 1.00 52.24 H new ATOM 1616 N TYR A 106 2.566 39.438 -28.830 1.00 11.51 N ATOM 1617 CA TYR A 106 2.913 38.648 -27.655 1.00 5.42 C ATOM 1618 C TYR A 106 2.378 37.225 -27.777 1.00 51.13 C ATOM 1619 O TYR A 106 2.942 36.286 -27.216 1.00 64.33 O ATOM 1620 CB TYR A 106 2.360 39.306 -26.390 1.00 12.51 C ATOM 1621 CG TYR A 106 3.260 40.380 -25.822 1.00 42.21 C ATOM 1622 CD1 TYR A 106 4.268 40.064 -24.919 1.00 54.10 C ATOM 1623 CD2 TYR A 106 3.104 41.711 -26.190 1.00 0.13 C ATOM 1624 CE1 TYR A 106 5.092 41.042 -24.397 1.00 51.13 C ATOM 1625 CE2 TYR A 106 3.925 42.696 -25.674 1.00 72.42 C ATOM 1626 CZ TYR A 106 4.917 42.356 -24.778 1.00 52.20 C ATOM 1627 OH TYR A 106 5.737 43.333 -24.262 1.00 12.23 O ATOM 0 H TYR A 106 2.081 40.311 -28.623 1.00 11.51 H new ATOM 0 HA TYR A 106 4.000 38.603 -27.588 1.00 5.42 H new ATOM 0 HB2 TYR A 106 1.386 39.741 -26.613 1.00 12.51 H new ATOM 0 HB3 TYR A 106 2.201 38.539 -25.632 1.00 12.51 H new ATOM 0 HD1 TYR A 106 4.410 39.036 -24.620 1.00 54.10 H new ATOM 0 HD2 TYR A 106 2.328 41.980 -26.891 1.00 0.13 H new ATOM 0 HE1 TYR A 106 5.869 40.779 -23.694 1.00 51.13 H new ATOM 0 HE2 TYR A 106 3.791 43.726 -25.971 1.00 72.42 H new ATOM 0 HH TYR A 106 5.482 44.204 -24.633 1.00 12.23 H new ATOM 1637 N LYS A 107 1.284 37.073 -28.516 1.00 50.30 N ATOM 1638 CA LYS A 107 0.671 35.766 -28.716 1.00 34.30 C ATOM 1639 C LYS A 107 1.589 34.851 -29.520 1.00 23.14 C ATOM 1640 O LYS A 107 1.884 33.730 -29.105 1.00 32.30 O ATOM 1641 CB LYS A 107 -0.673 35.914 -29.433 1.00 12.20 C ATOM 1642 CG LYS A 107 -1.285 34.591 -29.859 1.00 64.33 C ATOM 1643 CD LYS A 107 -1.135 34.363 -31.354 1.00 53.32 C ATOM 1644 CE LYS A 107 -1.986 35.338 -32.154 1.00 34.30 C ATOM 1645 NZ LYS A 107 -2.608 34.687 -33.340 1.00 61.14 N ATOM 0 H LYS A 107 0.804 37.840 -28.987 1.00 50.30 H new ATOM 0 HA LYS A 107 0.506 35.317 -27.737 1.00 34.30 H new ATOM 0 HB2 LYS A 107 -1.371 36.432 -28.775 1.00 12.20 H new ATOM 0 HB3 LYS A 107 -0.538 36.542 -30.313 1.00 12.20 H new ATOM 0 HG2 LYS A 107 -0.806 33.776 -29.316 1.00 64.33 H new ATOM 0 HG3 LYS A 107 -2.342 34.575 -29.592 1.00 64.33 H new ATOM 0 HD2 LYS A 107 -0.088 34.475 -31.637 1.00 53.32 H new ATOM 0 HD3 LYS A 107 -1.424 33.341 -31.598 1.00 53.32 H new ATOM 0 HE2 LYS A 107 -2.767 35.749 -31.514 1.00 34.30 H new ATOM 0 HE3 LYS A 107 -1.369 36.175 -32.481 1.00 34.30 H new ATOM 0 HZ1 LYS A 107 -3.180 35.384 -33.859 1.00 61.14 H new ATOM 0 HZ2 LYS A 107 -1.863 34.317 -33.964 1.00 61.14 H new ATOM 0 HZ3 LYS A 107 -3.217 33.904 -33.027 1.00 61.14 H new ATOM 1659 N LYS A 108 2.041 35.337 -30.671 1.00 74.20 N ATOM 1660 CA LYS A 108 2.928 34.565 -31.532 1.00 65.23 C ATOM 1661 C LYS A 108 4.137 34.057 -30.753 1.00 2.45 C ATOM 1662 O LYS A 108 4.401 32.856 -30.714 1.00 5.15 O ATOM 1663 CB LYS A 108 3.393 35.417 -32.716 1.00 34.03 C ATOM 1664 CG LYS A 108 2.611 35.162 -33.993 1.00 33.14 C ATOM 1665 CD LYS A 108 3.288 35.794 -35.197 1.00 21.00 C ATOM 1666 CE LYS A 108 2.416 35.700 -36.440 1.00 2.22 C ATOM 1667 NZ LYS A 108 3.229 35.523 -37.675 1.00 54.32 N ATOM 0 H LYS A 108 1.807 36.263 -31.029 1.00 74.20 H new ATOM 0 HA LYS A 108 2.372 33.706 -31.906 1.00 65.23 H new ATOM 0 HB2 LYS A 108 3.306 36.471 -32.451 1.00 34.03 H new ATOM 0 HB3 LYS A 108 4.449 35.221 -32.901 1.00 34.03 H new ATOM 0 HG2 LYS A 108 2.512 34.088 -34.152 1.00 33.14 H new ATOM 0 HG3 LYS A 108 1.603 35.563 -33.889 1.00 33.14 H new ATOM 0 HD2 LYS A 108 3.509 36.840 -34.984 1.00 21.00 H new ATOM 0 HD3 LYS A 108 4.241 35.298 -35.382 1.00 21.00 H new ATOM 0 HE2 LYS A 108 1.725 34.863 -36.337 1.00 2.22 H new ATOM 0 HE3 LYS A 108 1.812 36.603 -36.529 1.00 2.22 H new ATOM 0 HZ1 LYS A 108 2.599 35.463 -38.500 1.00 54.32 H new ATOM 0 HZ2 LYS A 108 3.870 36.334 -37.787 1.00 54.32 H new ATOM 0 HZ3 LYS A 108 3.787 34.648 -37.601 1.00 54.32 H new ATOM 1681 N GLN A 109 4.866 34.980 -30.133 1.00 12.23 N ATOM 1682 CA GLN A 109 6.046 34.625 -29.353 1.00 72.35 C ATOM 1683 C GLN A 109 5.710 33.565 -28.310 1.00 31.42 C ATOM 1684 O GLN A 109 6.548 32.733 -27.964 1.00 62.42 O ATOM 1685 CB GLN A 109 6.624 35.865 -28.670 1.00 64.11 C ATOM 1686 CG GLN A 109 7.771 36.504 -29.438 1.00 34.43 C ATOM 1687 CD GLN A 109 7.327 37.103 -30.757 1.00 54.24 C ATOM 1688 OE1 GLN A 109 6.265 37.721 -30.846 1.00 3.31 O ATOM 1689 NE2 GLN A 109 8.139 36.924 -31.792 1.00 72.35 N ATOM 0 H GLN A 109 4.660 35.979 -30.156 1.00 12.23 H new ATOM 0 HA GLN A 109 6.791 34.214 -30.034 1.00 72.35 H new ATOM 0 HB2 GLN A 109 5.831 36.601 -28.540 1.00 64.11 H new ATOM 0 HB3 GLN A 109 6.972 35.592 -27.674 1.00 64.11 H new ATOM 0 HG2 GLN A 109 8.225 37.282 -28.824 1.00 34.43 H new ATOM 0 HG3 GLN A 109 8.541 35.755 -29.624 1.00 34.43 H new ATOM 0 HE21 GLN A 109 9.009 36.405 -31.674 1.00 72.35 H new ATOM 0 HE22 GLN A 109 7.893 37.305 -32.705 1.00 72.35 H new ATOM 1698 N MET A 110 4.478 33.601 -27.811 1.00 45.43 N ATOM 1699 CA MET A 110 4.032 32.643 -26.807 1.00 71.32 C ATOM 1700 C MET A 110 4.077 31.220 -27.356 1.00 11.11 C ATOM 1701 O MET A 110 4.671 30.328 -26.749 1.00 3.33 O ATOM 1702 CB MET A 110 2.613 32.979 -26.346 1.00 14.14 C ATOM 1703 CG MET A 110 2.263 32.399 -24.985 1.00 13.23 C ATOM 1704 SD MET A 110 0.800 31.346 -25.034 1.00 10.13 S ATOM 1705 CE MET A 110 1.514 29.801 -25.592 1.00 13.00 C ATOM 0 H MET A 110 3.772 34.283 -28.086 1.00 45.43 H new ATOM 0 HA MET A 110 4.708 32.706 -25.954 1.00 71.32 H new ATOM 0 HB2 MET A 110 2.498 34.062 -26.311 1.00 14.14 H new ATOM 0 HB3 MET A 110 1.902 32.607 -27.084 1.00 14.14 H new ATOM 0 HG2 MET A 110 3.109 31.822 -24.612 1.00 13.23 H new ATOM 0 HG3 MET A 110 2.097 33.213 -24.279 1.00 13.23 H new ATOM 0 HE1 MET A 110 0.744 29.197 -26.072 1.00 13.00 H new ATOM 0 HE2 MET A 110 2.312 30.006 -26.306 1.00 13.00 H new ATOM 0 HE3 MET A 110 1.921 29.259 -24.738 1.00 13.00 H new ATOM 1715 N LEU A 111 3.445 31.014 -28.506 1.00 45.44 N ATOM 1716 CA LEU A 111 3.413 29.699 -29.137 1.00 4.30 C ATOM 1717 C LEU A 111 4.820 29.126 -29.273 1.00 43.22 C ATOM 1718 O LEU A 111 5.051 27.946 -29.007 1.00 11.11 O ATOM 1719 CB LEU A 111 2.751 29.788 -30.513 1.00 31.31 C ATOM 1720 CG LEU A 111 2.547 28.461 -31.246 1.00 15.50 C ATOM 1721 CD1 LEU A 111 1.069 28.225 -31.520 1.00 45.33 C ATOM 1722 CD2 LEU A 111 3.342 28.441 -32.543 1.00 52.12 C ATOM 0 H LEU A 111 2.948 31.741 -29.021 1.00 45.44 H new ATOM 0 HA LEU A 111 2.829 29.033 -28.502 1.00 4.30 H new ATOM 0 HB2 LEU A 111 1.780 30.269 -30.397 1.00 31.31 H new ATOM 0 HB3 LEU A 111 3.356 30.439 -31.144 1.00 31.31 H new ATOM 0 HG LEU A 111 2.910 27.655 -30.608 1.00 15.50 H new ATOM 0 HD11 LEU A 111 0.943 27.277 -32.042 1.00 45.33 H new ATOM 0 HD12 LEU A 111 0.524 28.195 -30.576 1.00 45.33 H new ATOM 0 HD13 LEU A 111 0.680 29.034 -32.138 1.00 45.33 H new ATOM 0 HD21 LEU A 111 3.185 27.490 -33.051 1.00 52.12 H new ATOM 0 HD22 LEU A 111 3.009 29.255 -33.186 1.00 52.12 H new ATOM 0 HD23 LEU A 111 4.402 28.564 -32.322 1.00 52.12 H new ATOM 1734 N THR A 112 5.760 29.970 -29.688 1.00 41.20 N ATOM 1735 CA THR A 112 7.145 29.549 -29.859 1.00 33.44 C ATOM 1736 C THR A 112 7.672 28.870 -28.600 1.00 32.25 C ATOM 1737 O THR A 112 8.114 27.722 -28.641 1.00 13.04 O ATOM 1738 CB THR A 112 8.056 30.741 -30.205 1.00 63.12 C ATOM 1739 OG1 THR A 112 7.614 31.359 -31.419 1.00 10.23 O ATOM 1740 CG2 THR A 112 9.502 30.291 -30.357 1.00 75.10 C ATOM 0 H THR A 112 5.587 30.950 -29.912 1.00 41.20 H new ATOM 0 HA THR A 112 7.160 28.839 -30.686 1.00 33.44 H new ATOM 0 HB THR A 112 8.000 31.462 -29.389 1.00 63.12 H new ATOM 0 HG1 THR A 112 8.197 32.117 -31.631 1.00 10.23 H new ATOM 0 HG21 THR A 112 10.127 31.150 -30.601 1.00 75.10 H new ATOM 0 HG22 THR A 112 9.845 29.847 -29.422 1.00 75.10 H new ATOM 0 HG23 THR A 112 9.571 29.553 -31.156 1.00 75.10 H new ATOM 1748 N ALA A 113 7.622 29.586 -27.481 1.00 54.33 N ATOM 1749 CA ALA A 113 8.092 29.051 -26.210 1.00 13.44 C ATOM 1750 C ALA A 113 7.305 27.807 -25.813 1.00 61.42 C ATOM 1751 O ALA A 113 7.885 26.784 -25.449 1.00 0.22 O ATOM 1752 CB ALA A 113 7.991 30.110 -25.122 1.00 12.51 C ATOM 0 H ALA A 113 7.260 30.538 -27.430 1.00 54.33 H new ATOM 0 HA ALA A 113 9.137 28.766 -26.329 1.00 13.44 H new ATOM 0 HB1 ALA A 113 8.345 29.697 -24.178 1.00 12.51 H new ATOM 0 HB2 ALA A 113 8.603 30.970 -25.394 1.00 12.51 H new ATOM 0 HB3 ALA A 113 6.952 30.423 -25.014 1.00 12.51 H new ATOM 1758 N ALA A 114 5.981 27.901 -25.886 1.00 64.30 N ATOM 1759 CA ALA A 114 5.116 26.782 -25.536 1.00 34.50 C ATOM 1760 C ALA A 114 5.506 25.524 -26.305 1.00 70.11 C ATOM 1761 O ALA A 114 5.429 24.413 -25.779 1.00 3.33 O ATOM 1762 CB ALA A 114 3.660 27.136 -25.804 1.00 4.11 C ATOM 0 H ALA A 114 5.485 28.741 -26.184 1.00 64.30 H new ATOM 0 HA ALA A 114 5.240 26.579 -24.472 1.00 34.50 H new ATOM 0 HB1 ALA A 114 3.025 26.291 -25.538 1.00 4.11 H new ATOM 0 HB2 ALA A 114 3.380 28.003 -25.205 1.00 4.11 H new ATOM 0 HB3 ALA A 114 3.531 27.368 -26.861 1.00 4.11 H new ATOM 1768 N HIS A 115 5.924 25.705 -27.554 1.00 1.32 N ATOM 1769 CA HIS A 115 6.327 24.584 -28.396 1.00 15.33 C ATOM 1770 C HIS A 115 7.545 23.876 -27.811 1.00 40.04 C ATOM 1771 O HIS A 115 7.514 22.671 -27.561 1.00 40.54 O ATOM 1772 CB HIS A 115 6.634 25.068 -29.813 1.00 3.30 C ATOM 1773 CG HIS A 115 7.042 23.970 -30.746 1.00 23.23 C ATOM 1774 ND1 HIS A 115 8.270 23.346 -30.682 1.00 22.41 N ATOM 1775 CD2 HIS A 115 6.376 23.383 -31.768 1.00 4.23 C ATOM 1776 CE1 HIS A 115 8.343 22.424 -31.625 1.00 73.24 C ATOM 1777 NE2 HIS A 115 7.206 22.426 -32.298 1.00 50.02 N ATOM 0 H HIS A 115 5.992 26.617 -28.005 1.00 1.32 H new ATOM 0 HA HIS A 115 5.501 23.874 -28.434 1.00 15.33 H new ATOM 0 HB2 HIS A 115 5.753 25.568 -30.216 1.00 3.30 H new ATOM 0 HB3 HIS A 115 7.430 25.811 -29.770 1.00 3.30 H new ATOM 0 HD2 HIS A 115 5.378 23.623 -32.104 1.00 4.23 H new ATOM 0 HE1 HIS A 115 9.188 21.779 -31.814 1.00 73.24 H new ATOM 0 HE2 HIS A 115 6.981 21.816 -33.084 1.00 50.02 H new ATOM 1785 N ALA A 116 8.617 24.632 -27.597 1.00 53.22 N ATOM 1786 CA ALA A 116 9.845 24.077 -27.042 1.00 14.05 C ATOM 1787 C ALA A 116 9.590 23.430 -25.685 1.00 35.44 C ATOM 1788 O ALA A 116 10.244 22.452 -25.319 1.00 10.33 O ATOM 1789 CB ALA A 116 10.906 25.160 -26.920 1.00 41.44 C ATOM 0 H ALA A 116 8.660 25.631 -27.800 1.00 53.22 H new ATOM 0 HA ALA A 116 10.205 23.305 -27.722 1.00 14.05 H new ATOM 0 HB1 ALA A 116 11.818 24.731 -26.504 1.00 41.44 H new ATOM 0 HB2 ALA A 116 11.117 25.575 -27.905 1.00 41.44 H new ATOM 0 HB3 ALA A 116 10.545 25.951 -26.263 1.00 41.44 H new ATOM 1795 N LEU A 117 8.636 23.980 -24.942 1.00 13.02 N ATOM 1796 CA LEU A 117 8.294 23.456 -23.624 1.00 3.22 C ATOM 1797 C LEU A 117 7.812 22.012 -23.720 1.00 10.32 C ATOM 1798 O LEU A 117 8.302 21.135 -23.010 1.00 3.25 O ATOM 1799 CB LEU A 117 7.216 24.324 -22.972 1.00 22.20 C ATOM 1800 CG LEU A 117 7.703 25.610 -22.304 1.00 10.03 C ATOM 1801 CD1 LEU A 117 6.528 26.403 -21.753 1.00 0.11 C ATOM 1802 CD2 LEU A 117 8.700 25.293 -21.198 1.00 75.43 C ATOM 0 H LEU A 117 8.085 24.789 -25.230 1.00 13.02 H new ATOM 0 HA LEU A 117 9.192 23.479 -23.007 1.00 3.22 H new ATOM 0 HB2 LEU A 117 6.482 24.589 -23.733 1.00 22.20 H new ATOM 0 HB3 LEU A 117 6.698 23.724 -22.224 1.00 22.20 H new ATOM 0 HG LEU A 117 8.206 26.219 -23.055 1.00 10.03 H new ATOM 0 HD11 LEU A 117 6.894 27.315 -21.281 1.00 0.11 H new ATOM 0 HD12 LEU A 117 5.850 26.662 -22.567 1.00 0.11 H new ATOM 0 HD13 LEU A 117 5.997 25.801 -21.016 1.00 0.11 H new ATOM 0 HD21 LEU A 117 9.036 26.220 -20.734 1.00 75.43 H new ATOM 0 HD22 LEU A 117 8.222 24.664 -20.447 1.00 75.43 H new ATOM 0 HD23 LEU A 117 9.557 24.768 -21.620 1.00 75.43 H new ATOM 1814 N ALA A 118 6.850 21.773 -24.605 1.00 14.04 N ATOM 1815 CA ALA A 118 6.304 20.435 -24.797 1.00 1.11 C ATOM 1816 C ALA A 118 7.411 19.427 -25.083 1.00 65.34 C ATOM 1817 O ALA A 118 7.522 18.403 -24.409 1.00 61.41 O ATOM 1818 CB ALA A 118 5.285 20.438 -25.927 1.00 30.04 C ATOM 0 H ALA A 118 6.433 22.488 -25.200 1.00 14.04 H new ATOM 0 HA ALA A 118 5.806 20.136 -23.875 1.00 1.11 H new ATOM 0 HB1 ALA A 118 4.886 19.433 -26.059 1.00 30.04 H new ATOM 0 HB2 ALA A 118 4.472 21.122 -25.682 1.00 30.04 H new ATOM 0 HB3 ALA A 118 5.766 20.762 -26.850 1.00 30.04 H new ATOM 1824 N VAL A 119 8.230 19.723 -26.088 1.00 74.45 N ATOM 1825 CA VAL A 119 9.329 18.842 -26.464 1.00 60.30 C ATOM 1826 C VAL A 119 10.294 18.640 -25.301 1.00 12.41 C ATOM 1827 O VAL A 119 10.850 17.557 -25.123 1.00 64.21 O ATOM 1828 CB VAL A 119 10.107 19.398 -27.671 1.00 52.34 C ATOM 1829 CG1 VAL A 119 11.265 18.480 -28.030 1.00 21.01 C ATOM 1830 CG2 VAL A 119 9.178 19.588 -28.861 1.00 41.22 C ATOM 0 H VAL A 119 8.153 20.567 -26.656 1.00 74.45 H new ATOM 0 HA VAL A 119 8.887 17.884 -26.737 1.00 60.30 H new ATOM 0 HB VAL A 119 10.517 20.371 -27.400 1.00 52.34 H new ATOM 0 HG11 VAL A 119 11.803 18.890 -28.885 1.00 21.01 H new ATOM 0 HG12 VAL A 119 11.943 18.400 -27.180 1.00 21.01 H new ATOM 0 HG13 VAL A 119 10.881 17.492 -28.283 1.00 21.01 H new ATOM 0 HG21 VAL A 119 9.744 19.982 -29.705 1.00 41.22 H new ATOM 0 HG22 VAL A 119 8.737 18.630 -29.135 1.00 41.22 H new ATOM 0 HG23 VAL A 119 8.387 20.289 -28.596 1.00 41.22 H new ATOM 1840 N ASP A 120 10.487 19.691 -24.511 1.00 51.02 N ATOM 1841 CA ASP A 120 11.384 19.630 -23.363 1.00 33.22 C ATOM 1842 C ASP A 120 10.981 18.501 -22.419 1.00 1.45 C ATOM 1843 O ASP A 120 11.747 17.565 -22.192 1.00 50.13 O ATOM 1844 CB ASP A 120 11.380 20.964 -22.614 1.00 62.44 C ATOM 1845 CG ASP A 120 12.764 21.367 -22.144 1.00 52.22 C ATOM 1846 OD1 ASP A 120 13.502 20.489 -21.651 1.00 11.22 O ATOM 1847 OD2 ASP A 120 13.108 22.561 -22.269 1.00 4.33 O ATOM 0 H ASP A 120 10.034 20.595 -24.645 1.00 51.02 H new ATOM 0 HA ASP A 120 12.391 19.431 -23.730 1.00 33.22 H new ATOM 0 HB2 ASP A 120 10.979 21.742 -23.264 1.00 62.44 H new ATOM 0 HB3 ASP A 120 10.714 20.893 -21.754 1.00 62.44 H new ATOM 1852 N ALA A 121 9.775 18.598 -21.869 1.00 53.24 N ATOM 1853 CA ALA A 121 9.270 17.586 -20.950 1.00 62.44 C ATOM 1854 C ALA A 121 9.320 16.198 -21.581 1.00 50.12 C ATOM 1855 O ALA A 121 9.409 15.189 -20.881 1.00 44.13 O ATOM 1856 CB ALA A 121 7.849 17.922 -20.522 1.00 44.24 C ATOM 0 H ALA A 121 9.129 19.368 -22.044 1.00 53.24 H new ATOM 0 HA ALA A 121 9.911 17.580 -20.068 1.00 62.44 H new ATOM 0 HB1 ALA A 121 7.485 17.157 -19.836 1.00 44.24 H new ATOM 0 HB2 ALA A 121 7.839 18.891 -20.024 1.00 44.24 H new ATOM 0 HB3 ALA A 121 7.204 17.958 -21.400 1.00 44.24 H new ATOM 1862 N LYS A 122 9.261 16.154 -22.908 1.00 12.02 N ATOM 1863 CA LYS A 122 9.300 14.890 -23.634 1.00 54.44 C ATOM 1864 C LYS A 122 10.711 14.312 -23.645 1.00 30.02 C ATOM 1865 O LYS A 122 10.948 13.220 -23.129 1.00 41.44 O ATOM 1866 CB LYS A 122 8.808 15.088 -25.070 1.00 14.51 C ATOM 1867 CG LYS A 122 8.737 13.801 -25.872 1.00 24.40 C ATOM 1868 CD LYS A 122 10.047 13.518 -26.589 1.00 21.14 C ATOM 1869 CE LYS A 122 9.875 12.460 -27.667 1.00 60.35 C ATOM 1870 NZ LYS A 122 9.988 13.038 -29.035 1.00 1.20 N ATOM 0 H LYS A 122 9.186 16.979 -23.503 1.00 12.02 H new ATOM 0 HA LYS A 122 8.642 14.186 -23.124 1.00 54.44 H new ATOM 0 HB2 LYS A 122 7.819 15.546 -25.046 1.00 14.51 H new ATOM 0 HB3 LYS A 122 9.471 15.787 -25.579 1.00 14.51 H new ATOM 0 HG2 LYS A 122 8.498 12.970 -25.208 1.00 24.40 H new ATOM 0 HG3 LYS A 122 7.930 13.869 -26.601 1.00 24.40 H new ATOM 0 HD2 LYS A 122 10.424 14.437 -27.037 1.00 21.14 H new ATOM 0 HD3 LYS A 122 10.793 13.186 -25.868 1.00 21.14 H new ATOM 0 HE2 LYS A 122 10.629 11.684 -27.537 1.00 60.35 H new ATOM 0 HE3 LYS A 122 8.902 11.981 -27.554 1.00 60.35 H new ATOM 0 HZ1 LYS A 122 10.304 12.302 -29.698 1.00 1.20 H new ATOM 0 HZ2 LYS A 122 9.061 13.401 -29.336 1.00 1.20 H new ATOM 0 HZ3 LYS A 122 10.678 13.816 -29.027 1.00 1.20 H new ATOM 1884 N ASN A 123 11.645 15.052 -24.234 1.00 14.11 N ATOM 1885 CA ASN A 123 13.033 14.612 -24.310 1.00 41.41 C ATOM 1886 C ASN A 123 13.554 14.214 -22.933 1.00 31.05 C ATOM 1887 O ASN A 123 14.419 13.346 -22.811 1.00 22.21 O ATOM 1888 CB ASN A 123 13.909 15.720 -24.898 1.00 42.41 C ATOM 1889 CG ASN A 123 15.267 15.210 -25.341 1.00 53.14 C ATOM 1890 OD1 ASN A 123 15.386 14.541 -26.368 1.00 51.31 O ATOM 1891 ND2 ASN A 123 16.299 15.524 -24.567 1.00 15.34 N ATOM 0 H ASN A 123 11.466 15.959 -24.665 1.00 14.11 H new ATOM 0 HA ASN A 123 13.076 13.739 -24.961 1.00 41.41 H new ATOM 0 HB2 ASN A 123 13.398 16.170 -25.749 1.00 42.41 H new ATOM 0 HB3 ASN A 123 14.044 16.506 -24.155 1.00 42.41 H new ATOM 0 HD21 ASN A 123 17.237 15.209 -24.815 1.00 15.34 H new ATOM 0 HD22 ASN A 123 16.154 16.081 -23.725 1.00 15.34 H new ATOM 1898 N LEU A 124 13.021 14.853 -21.897 1.00 42.42 N ATOM 1899 CA LEU A 124 13.431 14.566 -20.527 1.00 21.10 C ATOM 1900 C LEU A 124 13.307 13.076 -20.223 1.00 13.55 C ATOM 1901 O LEU A 124 14.281 12.426 -19.842 1.00 10.13 O ATOM 1902 CB LEU A 124 12.584 15.372 -19.541 1.00 4.24 C ATOM 1903 CG LEU A 124 13.348 16.337 -18.633 1.00 41.20 C ATOM 1904 CD1 LEU A 124 12.408 16.977 -17.623 1.00 41.33 C ATOM 1905 CD2 LEU A 124 14.485 15.616 -17.924 1.00 34.34 C ATOM 0 H LEU A 124 12.304 15.573 -21.980 1.00 42.42 H new ATOM 0 HA LEU A 124 14.476 14.855 -20.418 1.00 21.10 H new ATOM 0 HB2 LEU A 124 11.848 15.943 -20.107 1.00 4.24 H new ATOM 0 HB3 LEU A 124 12.031 14.674 -18.912 1.00 4.24 H new ATOM 0 HG LEU A 124 13.775 17.126 -19.252 1.00 41.20 H new ATOM 0 HD11 LEU A 124 12.969 17.660 -16.986 1.00 41.33 H new ATOM 0 HD12 LEU A 124 11.629 17.529 -18.150 1.00 41.33 H new ATOM 0 HD13 LEU A 124 11.951 16.201 -17.009 1.00 41.33 H new ATOM 0 HD21 LEU A 124 15.017 16.318 -17.283 1.00 34.34 H new ATOM 0 HD22 LEU A 124 14.080 14.806 -17.318 1.00 34.34 H new ATOM 0 HD23 LEU A 124 15.173 15.207 -18.663 1.00 34.34 H new ATOM 1917 N LEU A 125 12.103 12.541 -20.395 1.00 0.43 N ATOM 1918 CA LEU A 125 11.851 11.127 -20.141 1.00 10.13 C ATOM 1919 C LEU A 125 12.491 10.258 -21.218 1.00 64.20 C ATOM 1920 O LEU A 125 12.966 9.156 -20.940 1.00 52.31 O ATOM 1921 CB LEU A 125 10.346 10.860 -20.081 1.00 60.33 C ATOM 1922 CG LEU A 125 9.864 9.994 -18.917 1.00 15.22 C ATOM 1923 CD1 LEU A 125 8.923 10.783 -18.019 1.00 75.05 C ATOM 1924 CD2 LEU A 125 9.181 8.736 -19.434 1.00 52.52 C ATOM 0 H LEU A 125 11.286 13.065 -20.709 1.00 0.43 H new ATOM 0 HA LEU A 125 12.298 10.870 -19.181 1.00 10.13 H new ATOM 0 HB2 LEU A 125 9.829 11.818 -20.033 1.00 60.33 H new ATOM 0 HB3 LEU A 125 10.045 10.381 -21.013 1.00 60.33 H new ATOM 0 HG LEU A 125 10.731 9.696 -18.328 1.00 15.22 H new ATOM 0 HD11 LEU A 125 8.590 10.151 -17.196 1.00 75.05 H new ATOM 0 HD12 LEU A 125 9.445 11.653 -17.620 1.00 75.05 H new ATOM 0 HD13 LEU A 125 8.059 11.112 -18.597 1.00 75.05 H new ATOM 0 HD21 LEU A 125 8.845 8.132 -18.591 1.00 52.52 H new ATOM 0 HD22 LEU A 125 8.323 9.013 -20.047 1.00 52.52 H new ATOM 0 HD23 LEU A 125 9.885 8.160 -20.035 1.00 52.52 H new ATOM 1936 N ASP A 126 12.503 10.761 -22.447 1.00 40.13 N ATOM 1937 CA ASP A 126 13.088 10.032 -23.567 1.00 4.15 C ATOM 1938 C ASP A 126 14.555 9.709 -23.297 1.00 73.21 C ATOM 1939 O ASP A 126 15.012 8.594 -23.548 1.00 33.50 O ATOM 1940 CB ASP A 126 12.961 10.846 -24.855 1.00 62.23 C ATOM 1941 CG ASP A 126 11.989 10.224 -25.839 1.00 11.43 C ATOM 1942 OD1 ASP A 126 10.790 10.126 -25.505 1.00 53.40 O ATOM 1943 OD2 ASP A 126 12.427 9.835 -26.942 1.00 3.43 O ATOM 0 H ASP A 126 12.114 11.671 -22.694 1.00 40.13 H new ATOM 0 HA ASP A 126 12.543 9.095 -23.684 1.00 4.15 H new ATOM 0 HB2 ASP A 126 12.631 11.856 -24.612 1.00 62.23 H new ATOM 0 HB3 ASP A 126 13.941 10.935 -25.324 1.00 62.23 H new ATOM 1948 N VAL A 127 15.288 10.692 -22.785 1.00 40.44 N ATOM 1949 CA VAL A 127 16.703 10.513 -22.482 1.00 33.12 C ATOM 1950 C VAL A 127 16.901 9.489 -21.370 1.00 34.11 C ATOM 1951 O VAL A 127 17.545 8.459 -21.569 1.00 21.33 O ATOM 1952 CB VAL A 127 17.360 11.842 -22.064 1.00 20.31 C ATOM 1953 CG1 VAL A 127 18.815 11.620 -21.679 1.00 51.12 C ATOM 1954 CG2 VAL A 127 17.246 12.867 -23.182 1.00 31.10 C ATOM 0 H VAL A 127 14.925 11.621 -22.571 1.00 40.44 H new ATOM 0 HA VAL A 127 17.179 10.152 -23.394 1.00 33.12 H new ATOM 0 HB VAL A 127 16.833 12.230 -21.192 1.00 20.31 H new ATOM 0 HG11 VAL A 127 19.263 12.570 -21.387 1.00 51.12 H new ATOM 0 HG12 VAL A 127 18.868 10.921 -20.844 1.00 51.12 H new ATOM 0 HG13 VAL A 127 19.358 11.210 -22.530 1.00 51.12 H new ATOM 0 HG21 VAL A 127 17.715 13.800 -22.870 1.00 31.10 H new ATOM 0 HG22 VAL A 127 17.747 12.490 -24.074 1.00 31.10 H new ATOM 0 HG23 VAL A 127 16.194 13.047 -23.405 1.00 31.10 H new ATOM 1964 N ILE A 128 16.342 9.779 -20.200 1.00 32.12 N ATOM 1965 CA ILE A 128 16.456 8.882 -19.056 1.00 55.14 C ATOM 1966 C ILE A 128 15.951 7.485 -19.401 1.00 51.01 C ATOM 1967 O ILE A 128 16.343 6.500 -18.775 1.00 10.21 O ATOM 1968 CB ILE A 128 15.670 9.415 -17.843 1.00 63.51 C ATOM 1969 CG1 ILE A 128 14.165 9.316 -18.099 1.00 41.32 C ATOM 1970 CG2 ILE A 128 16.069 10.852 -17.543 1.00 65.41 C ATOM 1971 CD1 ILE A 128 13.323 9.888 -16.980 1.00 62.10 C ATOM 0 H ILE A 128 15.806 10.628 -20.019 1.00 32.12 H new ATOM 0 HA ILE A 128 17.514 8.830 -18.799 1.00 55.14 H new ATOM 0 HB ILE A 128 15.912 8.803 -16.974 1.00 63.51 H new ATOM 0 HG12 ILE A 128 13.927 9.839 -19.025 1.00 41.32 H new ATOM 0 HG13 ILE A 128 13.898 8.270 -18.246 1.00 41.32 H new ATOM 0 HG21 ILE A 128 15.505 11.214 -16.683 1.00 65.41 H new ATOM 0 HG22 ILE A 128 17.135 10.895 -17.322 1.00 65.41 H new ATOM 0 HG23 ILE A 128 15.853 11.478 -18.409 1.00 65.41 H new ATOM 0 HD11 ILE A 128 12.267 9.784 -17.229 1.00 62.10 H new ATOM 0 HD12 ILE A 128 13.532 9.350 -16.056 1.00 62.10 H new ATOM 0 HD13 ILE A 128 13.562 10.943 -16.848 1.00 62.10 H new ATOM 1983 N ASP A 129 15.081 7.407 -20.402 1.00 33.33 N ATOM 1984 CA ASP A 129 14.524 6.129 -20.833 1.00 1.54 C ATOM 1985 C ASP A 129 15.634 5.143 -21.182 1.00 1.11 C ATOM 1986 O ASP A 129 15.549 3.959 -20.858 1.00 31.03 O ATOM 1987 CB ASP A 129 13.605 6.330 -22.039 1.00 1.34 C ATOM 1988 CG ASP A 129 12.201 5.817 -21.788 1.00 72.33 C ATOM 1989 OD1 ASP A 129 12.056 4.621 -21.457 1.00 42.00 O ATOM 1990 OD2 ASP A 129 11.246 6.610 -21.923 1.00 4.53 O ATOM 0 H ASP A 129 14.746 8.213 -20.930 1.00 33.33 H new ATOM 0 HA ASP A 129 13.943 5.717 -20.008 1.00 1.54 H new ATOM 0 HB2 ASP A 129 13.562 7.391 -22.287 1.00 1.34 H new ATOM 0 HB3 ASP A 129 14.027 5.817 -22.903 1.00 1.34 H new ATOM 1995 N GLN A 130 16.673 5.640 -21.845 1.00 60.14 N ATOM 1996 CA GLN A 130 17.799 4.801 -22.240 1.00 54.11 C ATOM 1997 C GLN A 130 18.437 4.139 -21.024 1.00 34.44 C ATOM 1998 O GLN A 130 19.006 3.052 -21.124 1.00 5.52 O ATOM 1999 CB GLN A 130 18.842 5.631 -22.990 1.00 2.24 C ATOM 2000 CG GLN A 130 20.112 4.862 -23.315 1.00 22.20 C ATOM 2001 CD GLN A 130 21.146 5.715 -24.023 1.00 61.22 C ATOM 2002 OE1 GLN A 130 21.038 6.941 -24.058 1.00 73.12 O ATOM 2003 NE2 GLN A 130 22.157 5.069 -24.593 1.00 1.12 N ATOM 0 H GLN A 130 16.759 6.618 -22.120 1.00 60.14 H new ATOM 0 HA GLN A 130 17.423 4.020 -22.901 1.00 54.11 H new ATOM 0 HB2 GLN A 130 18.403 5.999 -23.917 1.00 2.24 H new ATOM 0 HB3 GLN A 130 19.099 6.504 -22.390 1.00 2.24 H new ATOM 0 HG2 GLN A 130 20.540 4.469 -22.393 1.00 22.20 H new ATOM 0 HG3 GLN A 130 19.863 4.005 -23.941 1.00 22.20 H new ATOM 0 HE21 GLN A 130 22.207 4.052 -24.540 1.00 1.12 H new ATOM 0 HE22 GLN A 130 22.883 5.590 -25.084 1.00 1.12 H new ATOM 2012 N ALA A 131 18.337 4.800 -19.875 1.00 41.33 N ATOM 2013 CA ALA A 131 18.903 4.275 -18.639 1.00 60.42 C ATOM 2014 C ALA A 131 18.063 3.123 -18.097 1.00 0.21 C ATOM 2015 O ALA A 131 18.595 2.081 -17.715 1.00 32.30 O ATOM 2016 CB ALA A 131 19.020 5.380 -17.600 1.00 40.14 C ATOM 0 H ALA A 131 17.869 5.701 -19.775 1.00 41.33 H new ATOM 0 HA ALA A 131 19.900 3.892 -18.859 1.00 60.42 H new ATOM 0 HB1 ALA A 131 19.444 4.973 -16.682 1.00 40.14 H new ATOM 0 HB2 ALA A 131 19.668 6.170 -17.980 1.00 40.14 H new ATOM 0 HB3 ALA A 131 18.032 5.790 -17.392 1.00 40.14 H new ATOM 2022 N ARG A 132 16.749 3.319 -18.065 1.00 51.25 N ATOM 2023 CA ARG A 132 15.836 2.297 -17.568 1.00 12.42 C ATOM 2024 C ARG A 132 16.007 0.993 -18.340 1.00 70.41 C ATOM 2025 O ARG A 132 16.056 -0.088 -17.751 1.00 70.22 O ATOM 2026 CB ARG A 132 14.388 2.780 -17.676 1.00 3.30 C ATOM 2027 CG ARG A 132 13.517 2.362 -16.503 1.00 23.23 C ATOM 2028 CD ARG A 132 12.095 2.878 -16.653 1.00 32.11 C ATOM 2029 NE ARG A 132 11.111 1.801 -16.582 1.00 64.51 N ATOM 2030 CZ ARG A 132 9.859 1.920 -17.007 1.00 75.02 C ATOM 2031 NH1 ARG A 132 9.439 3.063 -17.531 1.00 51.41 N ATOM 2032 NH2 ARG A 132 9.023 0.894 -16.909 1.00 53.11 N ATOM 0 H ARG A 132 16.293 4.176 -18.377 1.00 51.25 H new ATOM 0 HA ARG A 132 16.073 2.112 -16.520 1.00 12.42 H new ATOM 0 HB2 ARG A 132 14.381 3.867 -17.753 1.00 3.30 H new ATOM 0 HB3 ARG A 132 13.953 2.393 -18.597 1.00 3.30 H new ATOM 0 HG2 ARG A 132 13.504 1.275 -16.427 1.00 23.23 H new ATOM 0 HG3 ARG A 132 13.947 2.741 -15.576 1.00 23.23 H new ATOM 0 HD2 ARG A 132 11.890 3.608 -15.870 1.00 32.11 H new ATOM 0 HD3 ARG A 132 11.996 3.397 -17.607 1.00 32.11 H new ATOM 0 HE ARG A 132 11.402 0.908 -16.184 1.00 64.51 H new ATOM 0 HH11 ARG A 132 10.078 3.854 -17.608 1.00 51.41 H new ATOM 0 HH12 ARG A 132 8.476 3.151 -17.857 1.00 51.41 H new ATOM 0 HH21 ARG A 132 9.342 0.013 -16.507 1.00 53.11 H new ATOM 0 HH22 ARG A 132 8.061 0.987 -17.236 1.00 53.11 H new ATOM 2046 N LEU A 133 16.097 1.101 -19.661 1.00 72.41 N ATOM 2047 CA LEU A 133 16.262 -0.071 -20.515 1.00 41.40 C ATOM 2048 C LEU A 133 17.675 -0.633 -20.401 1.00 3.14 C ATOM 2049 O LEU A 133 17.890 -1.837 -20.541 1.00 35.21 O ATOM 2050 CB LEU A 133 15.960 0.289 -21.971 1.00 22.41 C ATOM 2051 CG LEU A 133 14.495 0.192 -22.396 1.00 54.21 C ATOM 2052 CD1 LEU A 133 13.980 -1.228 -22.219 1.00 14.35 C ATOM 2053 CD2 LEU A 133 13.644 1.173 -21.603 1.00 14.21 C ATOM 0 H LEU A 133 16.059 1.987 -20.164 1.00 72.41 H new ATOM 0 HA LEU A 133 15.559 -0.835 -20.182 1.00 41.40 H new ATOM 0 HB2 LEU A 133 16.303 1.308 -22.151 1.00 22.41 H new ATOM 0 HB3 LEU A 133 16.548 -0.364 -22.615 1.00 22.41 H new ATOM 0 HG LEU A 133 14.425 0.452 -23.452 1.00 54.21 H new ATOM 0 HD11 LEU A 133 12.935 -1.277 -22.527 1.00 14.35 H new ATOM 0 HD12 LEU A 133 14.571 -1.908 -22.832 1.00 14.35 H new ATOM 0 HD13 LEU A 133 14.064 -1.517 -21.171 1.00 14.35 H new ATOM 0 HD21 LEU A 133 12.604 1.090 -21.919 1.00 14.21 H new ATOM 0 HD22 LEU A 133 13.720 0.944 -20.540 1.00 14.21 H new ATOM 0 HD23 LEU A 133 13.998 2.188 -21.782 1.00 14.21 H new ATOM 2065 N LYS A 134 18.637 0.247 -20.143 1.00 23.43 N ATOM 2066 CA LYS A 134 20.031 -0.161 -20.005 1.00 55.13 C ATOM 2067 C LYS A 134 20.183 -1.222 -18.920 1.00 14.32 C ATOM 2068 O LYS A 134 20.973 -2.155 -19.057 1.00 43.42 O ATOM 2069 CB LYS A 134 20.907 1.050 -19.677 1.00 24.52 C ATOM 2070 CG LYS A 134 21.805 1.480 -20.824 1.00 74.03 C ATOM 2071 CD LYS A 134 22.486 2.806 -20.532 1.00 51.30 C ATOM 2072 CE LYS A 134 23.324 3.274 -21.712 1.00 10.30 C ATOM 2073 NZ LYS A 134 24.077 4.520 -21.398 1.00 24.21 N ATOM 0 H LYS A 134 18.477 1.247 -20.025 1.00 23.43 H new ATOM 0 HA LYS A 134 20.354 -0.589 -20.954 1.00 55.13 H new ATOM 0 HB2 LYS A 134 20.266 1.886 -19.395 1.00 24.52 H new ATOM 0 HB3 LYS A 134 21.525 0.816 -18.810 1.00 24.52 H new ATOM 0 HG2 LYS A 134 22.560 0.714 -21.003 1.00 74.03 H new ATOM 0 HG3 LYS A 134 21.215 1.566 -21.737 1.00 74.03 H new ATOM 0 HD2 LYS A 134 21.733 3.559 -20.298 1.00 51.30 H new ATOM 0 HD3 LYS A 134 23.120 2.704 -19.651 1.00 51.30 H new ATOM 0 HE2 LYS A 134 24.024 2.488 -21.995 1.00 10.30 H new ATOM 0 HE3 LYS A 134 22.676 3.448 -22.571 1.00 10.30 H new ATOM 0 HZ1 LYS A 134 24.636 4.806 -22.227 1.00 24.21 H new ATOM 0 HZ2 LYS A 134 23.408 5.278 -21.153 1.00 24.21 H new ATOM 0 HZ3 LYS A 134 24.714 4.347 -20.594 1.00 24.21 H new ATOM 2087 N MET A 135 19.419 -1.073 -17.842 1.00 42.21 N ATOM 2088 CA MET A 135 19.468 -2.020 -16.735 1.00 20.34 C ATOM 2089 C MET A 135 18.685 -3.286 -17.067 1.00 74.23 C ATOM 2090 O MET A 135 19.178 -4.399 -16.883 1.00 24.00 O ATOM 2091 CB MET A 135 18.909 -1.380 -15.463 1.00 30.04 C ATOM 2092 CG MET A 135 19.204 -2.176 -14.202 1.00 13.04 C ATOM 2093 SD MET A 135 19.253 -1.144 -12.724 1.00 42.52 S ATOM 2094 CE MET A 135 17.773 -1.692 -11.878 1.00 53.22 C ATOM 0 H MET A 135 18.759 -0.306 -17.712 1.00 42.21 H new ATOM 0 HA MET A 135 20.510 -2.292 -16.569 1.00 20.34 H new ATOM 0 HB2 MET A 135 19.326 -0.379 -15.357 1.00 30.04 H new ATOM 0 HB3 MET A 135 17.830 -1.267 -15.567 1.00 30.04 H new ATOM 0 HG2 MET A 135 18.443 -2.947 -14.077 1.00 13.04 H new ATOM 0 HG3 MET A 135 20.160 -2.687 -14.315 1.00 13.04 H new ATOM 0 HE1 MET A 135 17.665 -1.144 -10.942 1.00 53.22 H new ATOM 0 HE2 MET A 135 16.904 -1.508 -12.509 1.00 53.22 H new ATOM 0 HE3 MET A 135 17.848 -2.759 -11.667 1.00 53.22 H new ATOM 2104 N ILE A 136 17.462 -3.109 -17.557 1.00 44.53 N ATOM 2105 CA ILE A 136 16.612 -4.237 -17.916 1.00 2.01 C ATOM 2106 C ILE A 136 17.333 -5.189 -18.864 1.00 42.13 C ATOM 2107 O ILE A 136 17.488 -6.374 -18.571 1.00 74.55 O ATOM 2108 CB ILE A 136 15.302 -3.768 -18.576 1.00 1.54 C ATOM 2109 CG1 ILE A 136 14.537 -2.835 -17.634 1.00 43.22 C ATOM 2110 CG2 ILE A 136 14.443 -4.964 -18.958 1.00 3.32 C ATOM 2111 CD1 ILE A 136 13.482 -2.005 -18.332 1.00 4.24 C ATOM 0 H ILE A 136 17.038 -2.195 -17.714 1.00 44.53 H new ATOM 0 HA ILE A 136 16.375 -4.760 -16.990 1.00 2.01 H new ATOM 0 HB ILE A 136 15.547 -3.217 -19.484 1.00 1.54 H new ATOM 0 HG12 ILE A 136 14.062 -3.429 -16.853 1.00 43.22 H new ATOM 0 HG13 ILE A 136 15.245 -2.169 -17.141 1.00 43.22 H new ATOM 0 HG21 ILE A 136 13.521 -4.616 -19.423 1.00 3.32 H new ATOM 0 HG22 ILE A 136 14.988 -5.594 -19.661 1.00 3.32 H new ATOM 0 HG23 ILE A 136 14.203 -5.540 -18.064 1.00 3.32 H new ATOM 0 HD11 ILE A 136 12.980 -1.368 -17.604 1.00 4.24 H new ATOM 0 HD12 ILE A 136 13.953 -1.384 -19.094 1.00 4.24 H new ATOM 0 HD13 ILE A 136 12.752 -2.664 -18.801 1.00 4.24 H new ATOM 2123 N SER A 137 17.774 -4.661 -20.002 1.00 4.14 N ATOM 2124 CA SER A 137 18.478 -5.464 -20.995 1.00 11.12 C ATOM 2125 C SER A 137 19.914 -5.734 -20.556 1.00 60.44 C ATOM 2126 O SER A 137 20.862 -5.216 -21.146 1.00 74.45 O ATOM 2127 CB SER A 137 18.471 -4.756 -22.351 1.00 65.22 C ATOM 2128 OG SER A 137 18.969 -5.605 -23.371 1.00 42.54 O ATOM 0 H SER A 137 17.656 -3.681 -20.259 1.00 4.14 H new ATOM 0 HA SER A 137 17.960 -6.419 -21.089 1.00 11.12 H new ATOM 0 HB2 SER A 137 17.456 -4.444 -22.597 1.00 65.22 H new ATOM 0 HB3 SER A 137 19.078 -3.853 -22.296 1.00 65.22 H new ATOM 0 HG SER A 137 18.953 -5.130 -24.228 1.00 42.54 H new ATOM 2272 N GLU A 162 3.556 10.835 -31.917 1.00 71.41 N ATOM 2273 CA GLU A 162 2.240 11.395 -31.633 1.00 72.41 C ATOM 2274 C GLU A 162 2.352 12.849 -31.187 1.00 3.52 C ATOM 2275 O GLU A 162 1.673 13.728 -31.719 1.00 11.41 O ATOM 2276 CB GLU A 162 1.533 10.572 -30.554 1.00 20.31 C ATOM 2277 CG GLU A 162 0.072 10.942 -30.366 1.00 15.24 C ATOM 2278 CD GLU A 162 -0.182 11.673 -29.062 1.00 4.54 C ATOM 2279 OE1 GLU A 162 0.335 11.223 -28.018 1.00 33.41 O ATOM 2280 OE2 GLU A 162 -0.896 12.697 -29.085 1.00 54.44 O ATOM 0 HA GLU A 162 1.653 11.359 -32.551 1.00 72.41 H new ATOM 0 HB2 GLU A 162 1.601 9.515 -30.812 1.00 20.31 H new ATOM 0 HB3 GLU A 162 2.057 10.703 -29.607 1.00 20.31 H new ATOM 0 HG2 GLU A 162 -0.250 11.568 -31.198 1.00 15.24 H new ATOM 0 HG3 GLU A 162 -0.535 10.037 -30.395 1.00 15.24 H new ATOM 2287 N LEU A 163 3.214 13.096 -30.206 1.00 51.22 N ATOM 2288 CA LEU A 163 3.416 14.444 -29.687 1.00 2.34 C ATOM 2289 C LEU A 163 4.114 15.326 -30.717 1.00 50.12 C ATOM 2290 O LEU A 163 3.894 16.536 -30.764 1.00 55.44 O ATOM 2291 CB LEU A 163 4.239 14.397 -28.398 1.00 41.20 C ATOM 2292 CG LEU A 163 3.508 13.894 -27.153 1.00 22.41 C ATOM 2293 CD1 LEU A 163 3.308 12.388 -27.224 1.00 70.30 C ATOM 2294 CD2 LEU A 163 4.275 14.273 -25.894 1.00 62.44 C ATOM 0 H LEU A 163 3.784 12.380 -29.755 1.00 51.22 H new ATOM 0 HA LEU A 163 2.438 14.874 -29.472 1.00 2.34 H new ATOM 0 HB2 LEU A 163 5.107 13.760 -28.568 1.00 41.20 H new ATOM 0 HB3 LEU A 163 4.615 15.400 -28.194 1.00 41.20 H new ATOM 0 HG LEU A 163 2.528 14.369 -27.114 1.00 22.41 H new ATOM 0 HD11 LEU A 163 2.786 12.048 -26.330 1.00 70.30 H new ATOM 0 HD12 LEU A 163 2.716 12.141 -28.105 1.00 70.30 H new ATOM 0 HD13 LEU A 163 4.278 11.895 -27.288 1.00 70.30 H new ATOM 0 HD21 LEU A 163 3.740 13.907 -25.018 1.00 62.44 H new ATOM 0 HD22 LEU A 163 5.269 13.826 -25.925 1.00 62.44 H new ATOM 0 HD23 LEU A 163 4.366 15.358 -25.836 1.00 62.44 H new ATOM 2306 N ASP A 164 4.954 14.711 -31.542 1.00 5.20 N ATOM 2307 CA ASP A 164 5.682 15.440 -32.575 1.00 24.54 C ATOM 2308 C ASP A 164 4.729 15.968 -33.642 1.00 33.04 C ATOM 2309 O ASP A 164 4.666 17.172 -33.890 1.00 53.04 O ATOM 2310 CB ASP A 164 6.737 14.538 -33.217 1.00 63.44 C ATOM 2311 CG ASP A 164 8.047 14.544 -32.454 1.00 43.34 C ATOM 2312 OD1 ASP A 164 8.073 14.035 -31.314 1.00 70.23 O ATOM 2313 OD2 ASP A 164 9.047 15.058 -32.998 1.00 1.33 O ATOM 0 H ASP A 164 5.148 13.710 -31.516 1.00 5.20 H new ATOM 0 HA ASP A 164 6.178 16.289 -32.105 1.00 24.54 H new ATOM 0 HB2 ASP A 164 6.355 13.518 -33.270 1.00 63.44 H new ATOM 0 HB3 ASP A 164 6.915 14.865 -34.241 1.00 63.44 H new ATOM 2318 N ARG A 165 3.989 15.060 -34.269 1.00 62.53 N ATOM 2319 CA ARG A 165 3.041 15.434 -35.311 1.00 75.11 C ATOM 2320 C ARG A 165 2.104 16.535 -34.823 1.00 54.01 C ATOM 2321 O ARG A 165 1.957 17.573 -35.471 1.00 21.45 O ATOM 2322 CB ARG A 165 2.227 14.216 -35.752 1.00 21.43 C ATOM 2323 CG ARG A 165 1.472 14.426 -37.054 1.00 33.03 C ATOM 2324 CD ARG A 165 0.250 13.524 -37.141 1.00 43.32 C ATOM 2325 NE ARG A 165 0.422 12.464 -38.131 1.00 42.41 N ATOM 2326 CZ ARG A 165 0.371 12.668 -39.443 1.00 15.43 C ATOM 2327 NH1 ARG A 165 0.154 13.886 -39.919 1.00 55.44 N ATOM 2328 NH2 ARG A 165 0.537 11.653 -40.280 1.00 73.14 N ATOM 0 H ARG A 165 4.028 14.060 -34.073 1.00 62.53 H new ATOM 0 HA ARG A 165 3.607 15.812 -36.163 1.00 75.11 H new ATOM 0 HB2 ARG A 165 2.897 13.363 -35.864 1.00 21.43 H new ATOM 0 HB3 ARG A 165 1.516 13.962 -34.966 1.00 21.43 H new ATOM 0 HG2 ARG A 165 1.163 15.468 -37.133 1.00 33.03 H new ATOM 0 HG3 ARG A 165 2.134 14.226 -37.896 1.00 33.03 H new ATOM 0 HD2 ARG A 165 0.057 13.080 -36.164 1.00 43.32 H new ATOM 0 HD3 ARG A 165 -0.624 14.122 -37.398 1.00 43.32 H new ATOM 0 HE ARG A 165 0.591 11.515 -37.797 1.00 42.41 H new ATOM 0 HH11 ARG A 165 0.026 14.669 -39.278 1.00 55.44 H new ATOM 0 HH12 ARG A 165 0.115 14.040 -40.927 1.00 55.44 H new ATOM 0 HH21 ARG A 165 0.704 10.715 -39.917 1.00 73.14 H new ATOM 0 HH22 ARG A 165 0.498 11.811 -41.287 1.00 73.14 H new ATOM 2342 N LEU A 166 1.471 16.302 -33.678 1.00 42.03 N ATOM 2343 CA LEU A 166 0.548 17.274 -33.103 1.00 34.30 C ATOM 2344 C LEU A 166 1.199 18.649 -33.000 1.00 13.22 C ATOM 2345 O LEU A 166 0.577 19.667 -33.308 1.00 20.12 O ATOM 2346 CB LEU A 166 0.085 16.811 -31.720 1.00 63.33 C ATOM 2347 CG LEU A 166 -1.416 16.567 -31.561 1.00 62.22 C ATOM 2348 CD1 LEU A 166 -2.205 17.791 -31.999 1.00 62.23 C ATOM 2349 CD2 LEU A 166 -1.844 15.341 -32.355 1.00 51.55 C ATOM 0 H LEU A 166 1.580 15.449 -33.130 1.00 42.03 H new ATOM 0 HA LEU A 166 -0.317 17.351 -33.762 1.00 34.30 H new ATOM 0 HB2 LEU A 166 0.611 15.889 -31.473 1.00 63.33 H new ATOM 0 HB3 LEU A 166 0.391 17.558 -30.988 1.00 63.33 H new ATOM 0 HG LEU A 166 -1.626 16.384 -30.507 1.00 62.22 H new ATOM 0 HD11 LEU A 166 -3.271 17.599 -31.879 1.00 62.23 H new ATOM 0 HD12 LEU A 166 -1.919 18.646 -31.387 1.00 62.23 H new ATOM 0 HD13 LEU A 166 -1.991 18.006 -33.046 1.00 62.23 H new ATOM 0 HD21 LEU A 166 -2.915 15.182 -32.230 1.00 51.55 H new ATOM 0 HD22 LEU A 166 -1.621 15.495 -33.411 1.00 51.55 H new ATOM 0 HD23 LEU A 166 -1.303 14.466 -31.993 1.00 51.55 H new ATOM 2361 N LEU A 167 2.454 18.672 -32.567 1.00 4.51 N ATOM 2362 CA LEU A 167 3.192 19.923 -32.425 1.00 52.23 C ATOM 2363 C LEU A 167 3.396 20.591 -33.781 1.00 43.32 C ATOM 2364 O LEU A 167 3.367 21.818 -33.892 1.00 23.32 O ATOM 2365 CB LEU A 167 4.546 19.668 -31.761 1.00 34.54 C ATOM 2366 CG LEU A 167 4.871 20.535 -30.544 1.00 53.43 C ATOM 2367 CD1 LEU A 167 3.918 20.228 -29.400 1.00 13.54 C ATOM 2368 CD2 LEU A 167 6.314 20.326 -30.110 1.00 30.30 C ATOM 0 H LEU A 167 2.983 17.839 -32.308 1.00 4.51 H new ATOM 0 HA LEU A 167 2.606 20.592 -31.795 1.00 52.23 H new ATOM 0 HB2 LEU A 167 4.588 18.622 -31.458 1.00 34.54 H new ATOM 0 HB3 LEU A 167 5.327 19.816 -32.506 1.00 34.54 H new ATOM 0 HG LEU A 167 4.745 21.581 -30.823 1.00 53.43 H new ATOM 0 HD11 LEU A 167 4.165 20.854 -28.543 1.00 13.54 H new ATOM 0 HD12 LEU A 167 2.894 20.431 -29.715 1.00 13.54 H new ATOM 0 HD13 LEU A 167 4.011 19.178 -29.121 1.00 13.54 H new ATOM 0 HD21 LEU A 167 6.527 20.951 -29.243 1.00 30.30 H new ATOM 0 HD22 LEU A 167 6.467 19.279 -29.849 1.00 30.30 H new ATOM 0 HD23 LEU A 167 6.983 20.598 -30.927 1.00 30.30 H new ATOM 2380 N LEU A 168 3.601 19.777 -34.811 1.00 0.31 N ATOM 2381 CA LEU A 168 3.808 20.289 -36.161 1.00 40.03 C ATOM 2382 C LEU A 168 2.659 21.200 -36.581 1.00 13.05 C ATOM 2383 O LEU A 168 2.879 22.319 -37.042 1.00 55.14 O ATOM 2384 CB LEU A 168 3.943 19.131 -37.152 1.00 3.05 C ATOM 2385 CG LEU A 168 4.437 19.499 -38.551 1.00 71.12 C ATOM 2386 CD1 LEU A 168 5.936 19.756 -38.538 1.00 72.33 C ATOM 2387 CD2 LEU A 168 4.091 18.400 -39.545 1.00 33.41 C ATOM 0 H LEU A 168 3.628 18.760 -34.737 1.00 0.31 H new ATOM 0 HA LEU A 168 4.729 20.872 -36.164 1.00 40.03 H new ATOM 0 HB2 LEU A 168 4.627 18.395 -36.729 1.00 3.05 H new ATOM 0 HB3 LEU A 168 2.972 18.646 -37.247 1.00 3.05 H new ATOM 0 HG LEU A 168 3.935 20.415 -38.863 1.00 71.12 H new ATOM 0 HD11 LEU A 168 6.269 20.016 -39.543 1.00 72.33 H new ATOM 0 HD12 LEU A 168 6.158 20.578 -37.857 1.00 72.33 H new ATOM 0 HD13 LEU A 168 6.456 18.858 -38.205 1.00 72.33 H new ATOM 0 HD21 LEU A 168 4.450 18.679 -40.536 1.00 33.41 H new ATOM 0 HD22 LEU A 168 4.565 17.468 -39.236 1.00 33.41 H new ATOM 0 HD23 LEU A 168 3.010 18.265 -39.576 1.00 33.41 H new ATOM 2399 N GLU A 169 1.433 20.713 -36.414 1.00 60.20 N ATOM 2400 CA GLU A 169 0.249 21.485 -36.774 1.00 65.53 C ATOM 2401 C GLU A 169 0.193 22.792 -35.989 1.00 35.30 C ATOM 2402 O GLU A 169 -0.112 23.849 -36.543 1.00 3.24 O ATOM 2403 CB GLU A 169 -1.018 20.667 -36.517 1.00 22.41 C ATOM 2404 CG GLU A 169 -1.139 19.437 -37.402 1.00 10.42 C ATOM 2405 CD GLU A 169 -1.580 19.775 -38.813 1.00 1.53 C ATOM 2406 OE1 GLU A 169 -2.430 20.676 -38.969 1.00 52.35 O ATOM 2407 OE2 GLU A 169 -1.074 19.139 -39.760 1.00 62.44 O ATOM 0 H GLU A 169 1.234 19.788 -36.032 1.00 60.20 H new ATOM 0 HA GLU A 169 0.310 21.722 -37.836 1.00 65.53 H new ATOM 0 HB2 GLU A 169 -1.034 20.356 -35.473 1.00 22.41 H new ATOM 0 HB3 GLU A 169 -1.889 21.303 -36.673 1.00 22.41 H new ATOM 0 HG2 GLU A 169 -0.178 18.924 -37.439 1.00 10.42 H new ATOM 0 HG3 GLU A 169 -1.853 18.744 -36.958 1.00 10.42 H new ATOM 2414 N LEU A 170 0.487 22.711 -34.696 1.00 54.30 N ATOM 2415 CA LEU A 170 0.469 23.887 -33.833 1.00 11.22 C ATOM 2416 C LEU A 170 1.325 25.006 -34.419 1.00 32.35 C ATOM 2417 O LEU A 170 0.937 26.173 -34.398 1.00 71.11 O ATOM 2418 CB LEU A 170 0.971 23.525 -32.434 1.00 35.11 C ATOM 2419 CG LEU A 170 1.358 24.699 -31.535 1.00 12.44 C ATOM 2420 CD1 LEU A 170 1.048 24.383 -30.080 1.00 22.52 C ATOM 2421 CD2 LEU A 170 2.831 25.040 -31.706 1.00 70.45 C ATOM 0 H LEU A 170 0.741 21.844 -34.222 1.00 54.30 H new ATOM 0 HA LEU A 170 -0.560 24.240 -33.763 1.00 11.22 H new ATOM 0 HB2 LEU A 170 0.196 22.948 -31.930 1.00 35.11 H new ATOM 0 HB3 LEU A 170 1.838 22.872 -32.538 1.00 35.11 H new ATOM 0 HG LEU A 170 0.768 25.567 -31.831 1.00 12.44 H new ATOM 0 HD11 LEU A 170 1.330 25.231 -29.455 1.00 22.52 H new ATOM 0 HD12 LEU A 170 -0.019 24.190 -29.969 1.00 22.52 H new ATOM 0 HD13 LEU A 170 1.610 23.502 -29.771 1.00 22.52 H new ATOM 0 HD21 LEU A 170 3.088 25.878 -31.058 1.00 70.45 H new ATOM 0 HD22 LEU A 170 3.438 24.175 -31.439 1.00 70.45 H new ATOM 0 HD23 LEU A 170 3.024 25.311 -32.744 1.00 70.45 H new