USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 972 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 111 SER OG : rot -103:sc= 0.903 USER MOD Set 1.2: A 123 TYR OH : rot 30:sc= 0.783 USER MOD Set 2.1: A 34 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0141) USER MOD Set 2.2: A 77 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 37 LYS NZ :NH3+ 173:sc= 0.861 (180deg=0) USER MOD Set 3.2: A 68 GLN : amide:sc= 1.31 K(o=2.2,f=-0.99) USER MOD Set 4.1: A 14 SER OG : rot 148:sc= 0.00803 USER MOD Set 4.2: A 48 TYR OH : rot 180:sc= 0.00704 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -159:sc= -0.152 (180deg=-0.622) USER MOD Single : A 5 LYS NZ :NH3+ 140:sc= 1.25 (180deg=0.967) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 69:sc= 1.15 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 75:sc= 1.69 USER MOD Single : A 17 THR OG1 : rot -123:sc= 0.907 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -168:sc=-0.00259 (180deg=-0.115) USER MOD Single : A 23 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0626) USER MOD Single : A 25 ASN : amide:sc= -0.257 X(o=-0.26,f=-0.035) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00689) USER MOD Single : A 31 SER OG : rot 145:sc= 1.39 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 69:sc= 1.22 USER MOD Single : A 47 MET CE :methyl -146:sc= 0 (180deg=-0.121) USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00581) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 42:sc= 0.129 USER MOD Single : A 57 GLN : amide:sc= 0.336 K(o=0.34,f=-2.1!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.0824 X(o=-0.082,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc=-0.00468 USER MOD Single : A 75 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.17) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 84 SER OG : rot 180:sc= -0.328 USER MOD Single : A 88 SER OG : rot 180:sc= -0.192 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 170:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 173:sc= 0.0805 USER MOD Single : A 101 GLN : amide:sc= -0.923 K(o=-0.92,f=-1.7) USER MOD Single : A 102 MET CE :methyl 158:sc= -0.0949 (180deg=-0.317) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -0.4 X(o=-0.4,f=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN :FLIP amide:sc= -0.49 F(o=-2.2,f=-0.49) USER MOD Single : A 120 HIS : no HD1:sc= -0.0547 X(o=-0.055,f=-0.011) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot -93:sc= 1.29 USER MOD Single : A 126 HIS : no HE2:sc= -0.304 K(o=-0.3,f=-1.8) USER MOD Single : A 128 ASN : amide:sc= 0.526 K(o=0.53,f=-0.018) USER MOD Single : A 135 ASN : amide:sc= 0.189 X(o=0.19,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -175:sc= 1.11 (180deg=1.02) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 164:sc= -0.022 (180deg=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.792 -23.287 -11.715 1.00 33.32 N ATOM 2 CA GLY A 1 -5.954 -22.094 -11.861 1.00 24.34 C ATOM 3 C GLY A 1 -4.794 -22.168 -10.893 1.00 64.33 C ATOM 4 O GLY A 1 -5.006 -22.304 -9.687 1.00 52.02 O ATOM 0 H1 GLY A 1 -7.589 -23.235 -12.381 1.00 33.32 H new ATOM 0 H2 GLY A 1 -6.226 -24.136 -11.918 1.00 33.32 H new ATOM 0 H3 GLY A 1 -7.156 -23.338 -10.742 1.00 33.32 H new ATOM 0 HA2 GLY A 1 -5.584 -22.020 -12.883 1.00 24.34 H new ATOM 0 HA3 GLY A 1 -6.544 -21.197 -11.670 1.00 24.34 H new ATOM 8 N MET A 2 -3.564 -22.107 -11.403 1.00 71.53 N ATOM 9 CA MET A 2 -2.342 -22.196 -10.616 1.00 65.14 C ATOM 10 C MET A 2 -1.319 -21.245 -11.230 1.00 42.43 C ATOM 11 O MET A 2 -0.665 -21.586 -12.218 1.00 62.34 O ATOM 12 CB MET A 2 -1.861 -23.655 -10.578 1.00 31.21 C ATOM 13 CG MET A 2 -0.626 -23.858 -9.687 1.00 72.14 C ATOM 14 SD MET A 2 -0.812 -25.087 -8.362 1.00 4.32 S ATOM 15 CE MET A 2 -2.010 -24.225 -7.305 1.00 3.12 C ATOM 0 H MET A 2 -3.389 -21.991 -12.401 1.00 71.53 H new ATOM 0 HA MET A 2 -2.505 -21.897 -9.580 1.00 65.14 H new ATOM 0 HB2 MET A 2 -2.671 -24.289 -10.217 1.00 31.21 H new ATOM 0 HB3 MET A 2 -1.628 -23.981 -11.592 1.00 31.21 H new ATOM 0 HG2 MET A 2 0.212 -24.154 -10.319 1.00 72.14 H new ATOM 0 HG3 MET A 2 -0.363 -22.901 -9.237 1.00 72.14 H new ATOM 0 HE1 MET A 2 -2.239 -24.842 -6.436 1.00 3.12 H new ATOM 0 HE2 MET A 2 -1.587 -23.276 -6.974 1.00 3.12 H new ATOM 0 HE3 MET A 2 -2.924 -24.038 -7.869 1.00 3.12 H new ATOM 23 N ALA A 3 -1.242 -20.028 -10.699 1.00 51.24 N ATOM 24 CA ALA A 3 -0.148 -19.089 -10.876 1.00 5.54 C ATOM 25 C ALA A 3 -0.310 -18.001 -9.826 1.00 31.33 C ATOM 26 O ALA A 3 -1.243 -17.192 -9.910 1.00 31.12 O ATOM 27 CB ALA A 3 -0.129 -18.448 -12.269 1.00 25.42 C ATOM 0 H ALA A 3 -1.981 -19.655 -10.104 1.00 51.24 H new ATOM 0 HA ALA A 3 0.792 -19.630 -10.769 1.00 5.54 H new ATOM 0 HB1 ALA A 3 0.711 -17.757 -12.340 1.00 25.42 H new ATOM 0 HB2 ALA A 3 -0.024 -19.225 -13.026 1.00 25.42 H new ATOM 0 HB3 ALA A 3 -1.060 -17.906 -12.433 1.00 25.42 H new ATOM 33 N LYS A 4 0.590 -17.955 -8.847 1.00 64.23 N ATOM 34 CA LYS A 4 0.736 -16.777 -8.015 1.00 52.11 C ATOM 35 C LYS A 4 1.569 -15.769 -8.785 1.00 23.11 C ATOM 36 O LYS A 4 2.613 -16.130 -9.330 1.00 52.11 O ATOM 37 CB LYS A 4 1.384 -17.146 -6.682 1.00 53.54 C ATOM 38 CG LYS A 4 0.449 -18.095 -5.927 1.00 74.42 C ATOM 39 CD LYS A 4 0.905 -18.310 -4.483 1.00 74.21 C ATOM 40 CE LYS A 4 1.964 -19.400 -4.304 1.00 53.25 C ATOM 41 NZ LYS A 4 1.515 -20.693 -4.858 1.00 54.34 N ATOM 0 H LYS A 4 1.224 -18.720 -8.616 1.00 64.23 H new ATOM 0 HA LYS A 4 -0.236 -16.342 -7.782 1.00 52.11 H new ATOM 0 HB2 LYS A 4 2.350 -17.622 -6.851 1.00 53.54 H new ATOM 0 HB3 LYS A 4 1.570 -16.249 -6.091 1.00 53.54 H new ATOM 0 HG2 LYS A 4 -0.563 -17.689 -5.932 1.00 74.42 H new ATOM 0 HG3 LYS A 4 0.410 -19.054 -6.443 1.00 74.42 H new ATOM 0 HD2 LYS A 4 1.301 -17.371 -4.097 1.00 74.21 H new ATOM 0 HD3 LYS A 4 0.036 -18.563 -3.875 1.00 74.21 H new ATOM 0 HE2 LYS A 4 2.888 -19.094 -4.796 1.00 53.25 H new ATOM 0 HE3 LYS A 4 2.191 -19.517 -3.244 1.00 53.25 H new ATOM 0 HZ1 LYS A 4 2.062 -21.465 -4.425 1.00 54.34 H new ATOM 0 HZ2 LYS A 4 0.504 -20.827 -4.652 1.00 54.34 H new ATOM 0 HZ3 LYS A 4 1.662 -20.699 -5.888 1.00 54.34 H new ATOM 51 N LYS A 5 1.096 -14.528 -8.840 1.00 43.23 N ATOM 52 CA LYS A 5 1.811 -13.385 -9.389 1.00 45.55 C ATOM 53 C LYS A 5 1.976 -12.401 -8.250 1.00 50.53 C ATOM 54 O LYS A 5 1.317 -12.510 -7.216 1.00 72.42 O ATOM 55 CB LYS A 5 1.073 -12.685 -10.546 1.00 25.12 C ATOM 56 CG LYS A 5 0.689 -13.528 -11.758 1.00 14.23 C ATOM 57 CD LYS A 5 -0.307 -14.620 -11.420 1.00 65.12 C ATOM 58 CE LYS A 5 -1.270 -14.914 -12.573 1.00 72.43 C ATOM 59 NZ LYS A 5 -2.558 -14.230 -12.378 1.00 21.43 N ATOM 0 H LYS A 5 0.170 -14.284 -8.490 1.00 43.23 H new ATOM 0 HA LYS A 5 2.756 -13.735 -9.804 1.00 45.55 H new ATOM 0 HB2 LYS A 5 0.162 -12.243 -10.143 1.00 25.12 H new ATOM 0 HB3 LYS A 5 1.699 -11.863 -10.894 1.00 25.12 H new ATOM 0 HG2 LYS A 5 0.265 -12.881 -12.526 1.00 14.23 H new ATOM 0 HG3 LYS A 5 1.587 -13.979 -12.181 1.00 14.23 H new ATOM 0 HD2 LYS A 5 0.232 -15.531 -11.160 1.00 65.12 H new ATOM 0 HD3 LYS A 5 -0.879 -14.326 -10.540 1.00 65.12 H new ATOM 0 HE2 LYS A 5 -0.824 -14.593 -13.514 1.00 72.43 H new ATOM 0 HE3 LYS A 5 -1.434 -15.989 -12.648 1.00 72.43 H new ATOM 0 HZ1 LYS A 5 -2.894 -13.857 -13.289 1.00 21.43 H new ATOM 0 HZ2 LYS A 5 -3.255 -14.903 -12.001 1.00 21.43 H new ATOM 0 HZ3 LYS A 5 -2.436 -13.446 -11.706 1.00 21.43 H new ATOM 69 N THR A 6 2.761 -11.374 -8.503 1.00 34.43 N ATOM 70 CA THR A 6 3.048 -10.315 -7.546 1.00 34.24 C ATOM 71 C THR A 6 3.010 -8.971 -8.260 1.00 63.25 C ATOM 72 O THR A 6 3.465 -8.873 -9.398 1.00 73.42 O ATOM 73 CB THR A 6 4.399 -10.589 -6.857 1.00 4.54 C ATOM 74 OG1 THR A 6 4.354 -11.844 -6.202 1.00 64.01 O ATOM 75 CG2 THR A 6 4.819 -9.527 -5.838 1.00 21.00 C ATOM 0 H THR A 6 3.230 -11.246 -9.400 1.00 34.43 H new ATOM 0 HA THR A 6 2.292 -10.289 -6.761 1.00 34.24 H new ATOM 0 HB THR A 6 5.142 -10.572 -7.655 1.00 4.54 H new ATOM 0 HG1 THR A 6 5.215 -12.017 -5.766 1.00 64.01 H new ATOM 0 HG21 THR A 6 5.780 -9.800 -5.403 1.00 21.00 H new ATOM 0 HG22 THR A 6 4.907 -8.561 -6.335 1.00 21.00 H new ATOM 0 HG23 THR A 6 4.069 -9.462 -5.050 1.00 21.00 H new ATOM 83 N LEU A 7 2.494 -7.937 -7.597 1.00 61.04 N ATOM 84 CA LEU A 7 2.489 -6.563 -8.084 1.00 42.55 C ATOM 85 C LEU A 7 3.256 -5.698 -7.088 1.00 72.22 C ATOM 86 O LEU A 7 3.179 -5.945 -5.881 1.00 65.35 O ATOM 87 CB LEU A 7 1.038 -6.055 -8.218 1.00 21.20 C ATOM 88 CG LEU A 7 0.669 -5.416 -9.570 1.00 22.13 C ATOM 89 CD1 LEU A 7 -0.642 -4.639 -9.404 1.00 25.44 C ATOM 90 CD2 LEU A 7 1.697 -4.456 -10.176 1.00 31.44 C ATOM 0 H LEU A 7 2.056 -8.037 -6.681 1.00 61.04 H new ATOM 0 HA LEU A 7 2.962 -6.512 -9.065 1.00 42.55 H new ATOM 0 HB2 LEU A 7 0.363 -6.892 -8.038 1.00 21.20 H new ATOM 0 HB3 LEU A 7 0.856 -5.323 -7.431 1.00 21.20 H new ATOM 0 HG LEU A 7 0.604 -6.257 -10.261 1.00 22.13 H new ATOM 0 HD11 LEU A 7 -0.916 -4.181 -10.354 1.00 25.44 H new ATOM 0 HD12 LEU A 7 -1.432 -5.321 -9.089 1.00 25.44 H new ATOM 0 HD13 LEU A 7 -0.512 -3.862 -8.651 1.00 25.44 H new ATOM 0 HD21 LEU A 7 1.322 -4.073 -11.125 1.00 31.44 H new ATOM 0 HD22 LEU A 7 1.867 -3.625 -9.491 1.00 31.44 H new ATOM 0 HD23 LEU A 7 2.635 -4.986 -10.344 1.00 31.44 H new ATOM 101 N ILE A 8 3.959 -4.676 -7.579 1.00 25.21 N ATOM 102 CA ILE A 8 4.651 -3.672 -6.778 1.00 54.54 C ATOM 103 C ILE A 8 4.182 -2.308 -7.300 1.00 32.43 C ATOM 104 O ILE A 8 4.509 -1.934 -8.434 1.00 12.52 O ATOM 105 CB ILE A 8 6.191 -3.840 -6.870 1.00 24.32 C ATOM 106 CG1 ILE A 8 6.718 -5.248 -6.470 1.00 34.21 C ATOM 107 CG2 ILE A 8 6.914 -2.778 -6.027 1.00 31.02 C ATOM 108 CD1 ILE A 8 7.508 -6.003 -7.557 1.00 71.25 C ATOM 0 H ILE A 8 4.064 -4.522 -8.582 1.00 25.21 H new ATOM 0 HA ILE A 8 4.414 -3.776 -5.719 1.00 54.54 H new ATOM 0 HB ILE A 8 6.415 -3.711 -7.929 1.00 24.32 H new ATOM 0 HG12 ILE A 8 7.356 -5.141 -5.593 1.00 34.21 H new ATOM 0 HG13 ILE A 8 5.868 -5.862 -6.173 1.00 34.21 H new ATOM 0 HG21 ILE A 8 7.992 -2.919 -6.110 1.00 31.02 H new ATOM 0 HG22 ILE A 8 6.650 -1.784 -6.389 1.00 31.02 H new ATOM 0 HG23 ILE A 8 6.614 -2.876 -4.984 1.00 31.02 H new ATOM 0 HD11 ILE A 8 7.826 -6.971 -7.169 1.00 71.25 H new ATOM 0 HD12 ILE A 8 6.873 -6.153 -8.430 1.00 71.25 H new ATOM 0 HD13 ILE A 8 8.384 -5.420 -7.841 1.00 71.25 H new ATOM 119 N LEU A 9 3.427 -1.556 -6.492 1.00 44.32 N ATOM 120 CA LEU A 9 2.991 -0.192 -6.793 1.00 54.13 C ATOM 121 C LEU A 9 3.658 0.778 -5.823 1.00 30.21 C ATOM 122 O LEU A 9 3.372 0.748 -4.622 1.00 42.10 O ATOM 123 CB LEU A 9 1.459 -0.061 -6.702 1.00 54.51 C ATOM 124 CG LEU A 9 0.724 -0.537 -7.968 1.00 5.53 C ATOM 125 CD1 LEU A 9 -0.785 -0.607 -7.720 1.00 4.11 C ATOM 126 CD2 LEU A 9 0.974 0.444 -9.121 1.00 64.31 C ATOM 0 H LEU A 9 3.095 -1.890 -5.587 1.00 44.32 H new ATOM 0 HA LEU A 9 3.285 0.048 -7.815 1.00 54.13 H new ATOM 0 HB2 LEU A 9 1.104 -0.637 -5.847 1.00 54.51 H new ATOM 0 HB3 LEU A 9 1.202 0.981 -6.513 1.00 54.51 H new ATOM 0 HG LEU A 9 1.103 -1.527 -8.223 1.00 5.53 H new ATOM 0 HD11 LEU A 9 -1.287 -0.945 -8.626 1.00 4.11 H new ATOM 0 HD12 LEU A 9 -0.988 -1.307 -6.909 1.00 4.11 H new ATOM 0 HD13 LEU A 9 -1.155 0.381 -7.447 1.00 4.11 H new ATOM 0 HD21 LEU A 9 0.450 0.099 -10.012 1.00 64.31 H new ATOM 0 HD22 LEU A 9 0.607 1.432 -8.844 1.00 64.31 H new ATOM 0 HD23 LEU A 9 2.043 0.499 -9.327 1.00 64.31 H new ATOM 137 N TYR A 10 4.497 1.683 -6.329 1.00 23.35 N ATOM 138 CA TYR A 10 5.240 2.639 -5.519 1.00 74.04 C ATOM 139 C TYR A 10 4.907 4.038 -6.003 1.00 61.14 C ATOM 140 O TYR A 10 5.243 4.420 -7.129 1.00 65.00 O ATOM 141 CB TYR A 10 6.753 2.369 -5.563 1.00 50.41 C ATOM 142 CG TYR A 10 7.403 2.173 -4.215 1.00 34.04 C ATOM 143 CD1 TYR A 10 7.062 3.001 -3.130 1.00 22.02 C ATOM 144 CD2 TYR A 10 8.426 1.221 -4.071 1.00 62.31 C ATOM 145 CE1 TYR A 10 7.731 2.862 -1.905 1.00 25.05 C ATOM 146 CE2 TYR A 10 9.079 1.074 -2.839 1.00 42.42 C ATOM 147 CZ TYR A 10 8.707 1.864 -1.737 1.00 64.01 C ATOM 148 OH TYR A 10 9.257 1.669 -0.513 1.00 21.04 O ATOM 0 H TYR A 10 4.680 1.771 -7.329 1.00 23.35 H new ATOM 0 HA TYR A 10 4.946 2.535 -4.475 1.00 74.04 H new ATOM 0 HB2 TYR A 10 6.931 1.481 -6.169 1.00 50.41 H new ATOM 0 HB3 TYR A 10 7.242 3.202 -6.068 1.00 50.41 H new ATOM 0 HD1 TYR A 10 6.285 3.743 -3.240 1.00 22.02 H new ATOM 0 HD2 TYR A 10 8.710 0.602 -4.910 1.00 62.31 H new ATOM 0 HE1 TYR A 10 7.495 3.525 -1.086 1.00 25.05 H new ATOM 0 HE2 TYR A 10 9.873 0.349 -2.736 1.00 42.42 H new ATOM 0 HH TYR A 10 8.582 1.301 0.094 1.00 21.04 H new ATOM 157 N TYR A 11 4.174 4.787 -5.182 1.00 50.32 N ATOM 158 CA TYR A 11 3.816 6.158 -5.505 1.00 63.30 C ATOM 159 C TYR A 11 5.018 7.052 -5.124 1.00 52.21 C ATOM 160 O TYR A 11 5.811 6.660 -4.264 1.00 33.21 O ATOM 161 CB TYR A 11 2.469 6.513 -4.870 1.00 10.21 C ATOM 162 CG TYR A 11 2.225 7.975 -4.615 1.00 72.31 C ATOM 163 CD1 TYR A 11 1.807 8.779 -5.688 1.00 51.43 C ATOM 164 CD2 TYR A 11 2.420 8.534 -3.342 1.00 63.34 C ATOM 165 CE1 TYR A 11 1.569 10.144 -5.490 1.00 73.42 C ATOM 166 CE2 TYR A 11 2.157 9.899 -3.127 1.00 54.34 C ATOM 167 CZ TYR A 11 1.736 10.710 -4.206 1.00 5.21 C ATOM 168 OH TYR A 11 1.556 12.039 -4.022 1.00 3.32 O ATOM 0 H TYR A 11 3.817 4.461 -4.284 1.00 50.32 H new ATOM 0 HA TYR A 11 3.642 6.318 -6.569 1.00 63.30 H new ATOM 0 HB2 TYR A 11 1.675 6.140 -5.517 1.00 10.21 H new ATOM 0 HB3 TYR A 11 2.385 5.980 -3.923 1.00 10.21 H new ATOM 0 HD1 TYR A 11 1.669 8.344 -6.667 1.00 51.43 H new ATOM 0 HD2 TYR A 11 2.772 7.917 -2.529 1.00 63.34 H new ATOM 0 HE1 TYR A 11 1.258 10.764 -6.318 1.00 73.42 H new ATOM 0 HE2 TYR A 11 2.276 10.326 -2.142 1.00 54.34 H new ATOM 0 HH TYR A 11 1.709 12.262 -3.080 1.00 3.32 H new ATOM 177 N SER A 12 5.143 8.248 -5.714 1.00 74.41 N ATOM 178 CA SER A 12 6.223 9.212 -5.469 1.00 10.34 C ATOM 179 C SER A 12 7.630 8.649 -5.687 1.00 10.51 C ATOM 180 O SER A 12 8.262 8.143 -4.758 1.00 2.45 O ATOM 181 CB SER A 12 6.061 9.865 -4.092 1.00 13.54 C ATOM 182 OG SER A 12 4.855 10.607 -4.065 1.00 45.40 O ATOM 0 H SER A 12 4.468 8.583 -6.402 1.00 74.41 H new ATOM 0 HA SER A 12 6.123 9.985 -6.231 1.00 10.34 H new ATOM 0 HB2 SER A 12 6.049 9.102 -3.314 1.00 13.54 H new ATOM 0 HB3 SER A 12 6.908 10.519 -3.885 1.00 13.54 H new ATOM 0 HG SER A 12 4.095 9.993 -3.996 1.00 45.40 H new ATOM 187 N TRP A 13 8.141 8.776 -6.919 1.00 2.32 N ATOM 188 CA TRP A 13 9.408 8.191 -7.350 1.00 42.51 C ATOM 189 C TRP A 13 10.452 9.230 -7.773 1.00 42.12 C ATOM 190 O TRP A 13 11.252 8.973 -8.676 1.00 12.11 O ATOM 191 CB TRP A 13 9.153 7.045 -8.349 1.00 64.41 C ATOM 192 CG TRP A 13 8.293 7.313 -9.549 1.00 11.31 C ATOM 193 CD1 TRP A 13 6.963 7.080 -9.611 1.00 25.05 C ATOM 194 CD2 TRP A 13 8.677 7.771 -10.886 1.00 45.20 C ATOM 195 NE1 TRP A 13 6.491 7.417 -10.863 1.00 51.54 N ATOM 196 CE2 TRP A 13 7.504 7.837 -11.695 1.00 10.22 C ATOM 197 CE3 TRP A 13 9.892 8.131 -11.505 1.00 14.21 C ATOM 198 CZ2 TRP A 13 7.535 8.266 -13.031 1.00 32.34 C ATOM 199 CZ3 TRP A 13 9.935 8.586 -12.838 1.00 71.22 C ATOM 200 CH2 TRP A 13 8.757 8.658 -13.600 1.00 70.10 C ATOM 0 H TRP A 13 7.671 9.301 -7.657 1.00 2.32 H new ATOM 0 HA TRP A 13 9.890 7.731 -6.487 1.00 42.51 H new ATOM 0 HB2 TRP A 13 10.122 6.698 -8.708 1.00 64.41 H new ATOM 0 HB3 TRP A 13 8.703 6.220 -7.797 1.00 64.41 H new ATOM 0 HD1 TRP A 13 6.361 6.690 -8.804 1.00 25.05 H new ATOM 0 HE1 TRP A 13 5.510 7.362 -11.139 1.00 51.54 H new ATOM 0 HE3 TRP A 13 10.812 8.056 -10.944 1.00 14.21 H new ATOM 0 HZ2 TRP A 13 6.627 8.294 -13.616 1.00 32.34 H new ATOM 0 HZ3 TRP A 13 10.877 8.881 -13.276 1.00 71.22 H new ATOM 0 HH2 TRP A 13 8.791 9.013 -14.619 1.00 70.10 H new ATOM 210 N SER A 14 10.531 10.367 -7.069 1.00 44.54 N ATOM 211 CA SER A 14 11.654 11.310 -7.131 1.00 33.14 C ATOM 212 C SER A 14 12.944 10.700 -6.541 1.00 25.13 C ATOM 213 O SER A 14 13.456 11.155 -5.522 1.00 63.02 O ATOM 214 CB SER A 14 11.293 12.622 -6.414 1.00 11.53 C ATOM 215 OG SER A 14 10.186 13.264 -7.023 1.00 44.42 O ATOM 0 H SER A 14 9.797 10.663 -6.425 1.00 44.54 H new ATOM 0 HA SER A 14 11.848 11.528 -8.181 1.00 33.14 H new ATOM 0 HB2 SER A 14 11.064 12.414 -5.369 1.00 11.53 H new ATOM 0 HB3 SER A 14 12.153 13.291 -6.425 1.00 11.53 H new ATOM 0 HG SER A 14 9.670 13.743 -6.341 1.00 44.42 H new ATOM 220 N GLY A 15 13.467 9.643 -7.169 1.00 10.32 N ATOM 221 CA GLY A 15 14.772 9.045 -6.917 1.00 64.30 C ATOM 222 C GLY A 15 14.920 8.346 -5.566 1.00 51.11 C ATOM 223 O GLY A 15 16.010 7.847 -5.277 1.00 34.03 O ATOM 0 H GLY A 15 12.958 9.158 -7.908 1.00 10.32 H new ATOM 0 HA2 GLY A 15 14.981 8.323 -7.706 1.00 64.30 H new ATOM 0 HA3 GLY A 15 15.531 9.824 -6.989 1.00 64.30 H new ATOM 227 N GLU A 16 13.841 8.224 -4.790 1.00 51.10 N ATOM 228 CA GLU A 16 13.793 7.504 -3.523 1.00 4.51 C ATOM 229 C GLU A 16 13.294 6.073 -3.755 1.00 50.33 C ATOM 230 O GLU A 16 14.102 5.147 -3.828 1.00 11.53 O ATOM 231 CB GLU A 16 12.997 8.294 -2.464 1.00 63.04 C ATOM 232 CG GLU A 16 11.655 8.914 -2.905 1.00 14.54 C ATOM 233 CD GLU A 16 11.090 9.884 -1.860 1.00 13.35 C ATOM 234 OE1 GLU A 16 11.316 9.675 -0.640 1.00 51.21 O ATOM 235 OE2 GLU A 16 10.402 10.855 -2.245 1.00 30.02 O ATOM 0 H GLU A 16 12.944 8.641 -5.040 1.00 51.10 H new ATOM 0 HA GLU A 16 14.797 7.414 -3.109 1.00 4.51 H new ATOM 0 HB2 GLU A 16 12.801 7.628 -1.623 1.00 63.04 H new ATOM 0 HB3 GLU A 16 13.634 9.097 -2.093 1.00 63.04 H new ATOM 0 HG2 GLU A 16 11.794 9.441 -3.849 1.00 14.54 H new ATOM 0 HG3 GLU A 16 10.932 8.119 -3.087 1.00 14.54 H new ATOM 240 N THR A 17 11.990 5.876 -3.950 1.00 34.22 N ATOM 241 CA THR A 17 11.342 4.570 -4.087 1.00 61.01 C ATOM 242 C THR A 17 11.834 3.789 -5.320 1.00 13.44 C ATOM 243 O THR A 17 11.961 2.567 -5.257 1.00 54.54 O ATOM 244 CB THR A 17 9.820 4.804 -4.149 1.00 45.23 C ATOM 245 OG1 THR A 17 9.574 5.796 -5.118 1.00 10.35 O ATOM 246 CG2 THR A 17 9.214 5.296 -2.823 1.00 43.24 C ATOM 0 H THR A 17 11.330 6.651 -4.020 1.00 34.22 H new ATOM 0 HA THR A 17 11.602 3.952 -3.227 1.00 61.01 H new ATOM 0 HB THR A 17 9.359 3.845 -4.384 1.00 45.23 H new ATOM 0 HG1 THR A 17 9.078 6.536 -4.710 1.00 10.35 H new ATOM 0 HG21 THR A 17 8.140 5.438 -2.944 1.00 43.24 H new ATOM 0 HG22 THR A 17 9.396 4.557 -2.043 1.00 43.24 H new ATOM 0 HG23 THR A 17 9.676 6.242 -2.541 1.00 43.24 H new ATOM 254 N LYS A 18 12.163 4.490 -6.417 1.00 74.01 N ATOM 255 CA LYS A 18 12.464 3.933 -7.742 1.00 12.22 C ATOM 256 C LYS A 18 13.399 2.723 -7.678 1.00 12.21 C ATOM 257 O LYS A 18 13.027 1.631 -8.107 1.00 71.40 O ATOM 258 CB LYS A 18 12.948 5.058 -8.686 1.00 21.04 C ATOM 259 CG LYS A 18 13.348 4.510 -10.069 1.00 74.44 C ATOM 260 CD LYS A 18 13.237 5.568 -11.175 1.00 11.53 C ATOM 261 CE LYS A 18 13.669 4.949 -12.510 1.00 24.31 C ATOM 262 NZ LYS A 18 13.246 5.744 -13.680 1.00 14.11 N ATOM 0 H LYS A 18 12.229 5.508 -6.402 1.00 74.01 H new ATOM 0 HA LYS A 18 11.546 3.529 -8.168 1.00 12.22 H new ATOM 0 HB2 LYS A 18 12.158 5.799 -8.803 1.00 21.04 H new ATOM 0 HB3 LYS A 18 13.800 5.568 -8.237 1.00 21.04 H new ATOM 0 HG2 LYS A 18 14.372 4.139 -10.027 1.00 74.44 H new ATOM 0 HG3 LYS A 18 12.711 3.661 -10.318 1.00 74.44 H new ATOM 0 HD2 LYS A 18 12.212 5.933 -11.244 1.00 11.53 H new ATOM 0 HD3 LYS A 18 13.866 6.426 -10.938 1.00 11.53 H new ATOM 0 HE2 LYS A 18 14.754 4.845 -12.522 1.00 24.31 H new ATOM 0 HE3 LYS A 18 13.252 3.945 -12.590 1.00 24.31 H new ATOM 0 HZ1 LYS A 18 13.566 5.276 -14.552 1.00 14.11 H new ATOM 0 HZ2 LYS A 18 12.209 5.822 -13.690 1.00 14.11 H new ATOM 0 HZ3 LYS A 18 13.664 6.694 -13.624 1.00 14.11 H new ATOM 272 N LYS A 19 14.599 2.881 -7.113 1.00 24.23 N ATOM 273 CA LYS A 19 15.558 1.791 -6.947 1.00 70.04 C ATOM 274 C LYS A 19 14.936 0.561 -6.314 1.00 30.31 C ATOM 275 O LYS A 19 15.176 -0.548 -6.780 1.00 44.20 O ATOM 276 CB LYS A 19 16.759 2.224 -6.097 1.00 44.22 C ATOM 277 CG LYS A 19 16.461 2.874 -4.729 1.00 72.42 C ATOM 278 CD LYS A 19 17.069 2.146 -3.519 1.00 50.33 C ATOM 279 CE LYS A 19 18.529 2.554 -3.305 1.00 33.34 C ATOM 280 NZ LYS A 19 19.504 1.839 -4.156 1.00 70.04 N ATOM 0 H LYS A 19 14.933 3.776 -6.756 1.00 24.23 H new ATOM 0 HA LYS A 19 15.890 1.536 -7.953 1.00 70.04 H new ATOM 0 HB2 LYS A 19 17.384 1.348 -5.925 1.00 44.22 H new ATOM 0 HB3 LYS A 19 17.351 2.927 -6.683 1.00 44.22 H new ATOM 0 HG2 LYS A 19 16.832 3.899 -4.742 1.00 72.42 H new ATOM 0 HG3 LYS A 19 15.380 2.928 -4.597 1.00 72.42 H new ATOM 0 HD2 LYS A 19 16.490 2.375 -2.625 1.00 50.33 H new ATOM 0 HD3 LYS A 19 17.008 1.068 -3.671 1.00 50.33 H new ATOM 0 HE2 LYS A 19 18.623 3.624 -3.489 1.00 33.34 H new ATOM 0 HE3 LYS A 19 18.789 2.387 -2.260 1.00 33.34 H new ATOM 0 HZ1 LYS A 19 20.464 2.178 -3.944 1.00 70.04 H new ATOM 0 HZ2 LYS A 19 19.448 0.818 -3.966 1.00 70.04 H new ATOM 0 HZ3 LYS A 19 19.287 2.017 -5.157 1.00 70.04 H new ATOM 290 N MET A 20 14.194 0.760 -5.230 1.00 12.52 N ATOM 291 CA MET A 20 13.637 -0.288 -4.409 1.00 11.13 C ATOM 292 C MET A 20 12.642 -1.106 -5.230 1.00 12.23 C ATOM 293 O MET A 20 12.589 -2.321 -5.091 1.00 63.30 O ATOM 294 CB MET A 20 12.974 0.391 -3.199 1.00 71.34 C ATOM 295 CG MET A 20 13.320 -0.263 -1.873 1.00 23.01 C ATOM 296 SD MET A 20 14.866 0.387 -1.175 1.00 5.51 S ATOM 297 CE MET A 20 15.928 -1.041 -1.453 1.00 24.21 C ATOM 0 H MET A 20 13.960 1.694 -4.894 1.00 12.52 H new ATOM 0 HA MET A 20 14.401 -0.982 -4.058 1.00 11.13 H new ATOM 0 HB2 MET A 20 13.277 1.438 -3.169 1.00 71.34 H new ATOM 0 HB3 MET A 20 11.892 0.376 -3.331 1.00 71.34 H new ATOM 0 HG2 MET A 20 12.507 -0.101 -1.166 1.00 23.01 H new ATOM 0 HG3 MET A 20 13.410 -1.340 -2.013 1.00 23.01 H new ATOM 0 HE1 MET A 20 16.860 -0.915 -0.901 1.00 24.21 H new ATOM 0 HE2 MET A 20 15.422 -1.943 -1.109 1.00 24.21 H new ATOM 0 HE3 MET A 20 16.146 -1.131 -2.517 1.00 24.21 H new ATOM 305 N ALA A 21 11.896 -0.453 -6.127 1.00 4.21 N ATOM 306 CA ALA A 21 10.915 -1.141 -6.960 1.00 23.35 C ATOM 307 C ALA A 21 11.645 -2.083 -7.918 1.00 50.51 C ATOM 308 O ALA A 21 11.330 -3.269 -8.015 1.00 11.44 O ATOM 309 CB ALA A 21 10.056 -0.124 -7.727 1.00 23.22 C ATOM 0 H ALA A 21 11.956 0.552 -6.292 1.00 4.21 H new ATOM 0 HA ALA A 21 10.245 -1.728 -6.331 1.00 23.35 H new ATOM 0 HB1 ALA A 21 9.329 -0.653 -8.344 1.00 23.22 H new ATOM 0 HB2 ALA A 21 9.532 0.517 -7.018 1.00 23.22 H new ATOM 0 HB3 ALA A 21 10.696 0.486 -8.364 1.00 23.22 H new ATOM 315 N GLU A 22 12.621 -1.535 -8.640 1.00 4.25 N ATOM 316 CA GLU A 22 13.343 -2.223 -9.703 1.00 2.22 C ATOM 317 C GLU A 22 14.219 -3.335 -9.151 1.00 64.35 C ATOM 318 O GLU A 22 14.415 -4.356 -9.816 1.00 54.13 O ATOM 319 CB GLU A 22 14.233 -1.215 -10.428 1.00 25.25 C ATOM 320 CG GLU A 22 13.414 -0.131 -11.128 1.00 25.25 C ATOM 321 CD GLU A 22 12.611 -0.615 -12.340 1.00 1.54 C ATOM 322 OE1 GLU A 22 12.838 -1.728 -12.859 1.00 52.34 O ATOM 323 OE2 GLU A 22 11.777 0.179 -12.835 1.00 43.53 O ATOM 0 H GLU A 22 12.938 -0.576 -8.496 1.00 4.25 H new ATOM 0 HA GLU A 22 12.613 -2.663 -10.383 1.00 2.22 H new ATOM 0 HB2 GLU A 22 14.913 -0.751 -9.713 1.00 25.25 H new ATOM 0 HB3 GLU A 22 14.848 -1.736 -11.162 1.00 25.25 H new ATOM 0 HG2 GLU A 22 12.726 0.308 -10.406 1.00 25.25 H new ATOM 0 HG3 GLU A 22 14.088 0.663 -11.450 1.00 25.25 H new ATOM 328 N LYS A 23 14.791 -3.138 -7.959 1.00 53.11 N ATOM 329 CA LYS A 23 15.462 -4.208 -7.235 1.00 4.34 C ATOM 330 C LYS A 23 14.468 -5.347 -7.041 1.00 32.44 C ATOM 331 O LYS A 23 14.658 -6.395 -7.647 1.00 51.45 O ATOM 332 CB LYS A 23 16.008 -3.745 -5.879 1.00 73.31 C ATOM 333 CG LYS A 23 17.527 -3.589 -5.779 1.00 10.41 C ATOM 334 CD LYS A 23 18.008 -2.146 -5.916 1.00 22.13 C ATOM 335 CE LYS A 23 18.235 -1.753 -7.375 1.00 3.21 C ATOM 336 NZ LYS A 23 19.471 -2.358 -7.914 1.00 74.00 N ATOM 0 H LYS A 23 14.799 -2.239 -7.477 1.00 53.11 H new ATOM 0 HA LYS A 23 16.322 -4.537 -7.819 1.00 4.34 H new ATOM 0 HB2 LYS A 23 15.549 -2.787 -5.634 1.00 73.31 H new ATOM 0 HB3 LYS A 23 15.686 -4.457 -5.119 1.00 73.31 H new ATOM 0 HG2 LYS A 23 17.861 -3.984 -4.820 1.00 10.41 H new ATOM 0 HG3 LYS A 23 17.997 -4.194 -6.554 1.00 10.41 H new ATOM 0 HD2 LYS A 23 17.273 -1.475 -5.470 1.00 22.13 H new ATOM 0 HD3 LYS A 23 18.936 -2.019 -5.358 1.00 22.13 H new ATOM 0 HE2 LYS A 23 17.382 -2.070 -7.975 1.00 3.21 H new ATOM 0 HE3 LYS A 23 18.295 -0.668 -7.455 1.00 3.21 H new ATOM 0 HZ1 LYS A 23 19.713 -1.905 -8.818 1.00 74.00 H new ATOM 0 HZ2 LYS A 23 20.249 -2.219 -7.238 1.00 74.00 H new ATOM 0 HZ3 LYS A 23 19.322 -3.376 -8.066 1.00 74.00 H new ATOM 346 N ILE A 24 13.413 -5.133 -6.248 1.00 3.54 N ATOM 347 CA ILE A 24 12.519 -6.193 -5.799 1.00 71.03 C ATOM 348 C ILE A 24 11.911 -6.929 -6.993 1.00 74.22 C ATOM 349 O ILE A 24 11.736 -8.146 -6.941 1.00 10.43 O ATOM 350 CB ILE A 24 11.449 -5.595 -4.865 1.00 62.41 C ATOM 351 CG1 ILE A 24 12.091 -5.086 -3.552 1.00 3.23 C ATOM 352 CG2 ILE A 24 10.353 -6.617 -4.528 1.00 21.01 C ATOM 353 CD1 ILE A 24 11.095 -4.381 -2.635 1.00 50.30 C ATOM 0 H ILE A 24 13.158 -4.209 -5.899 1.00 3.54 H new ATOM 0 HA ILE A 24 13.080 -6.936 -5.233 1.00 71.03 H new ATOM 0 HB ILE A 24 10.993 -4.760 -5.397 1.00 62.41 H new ATOM 0 HG12 ILE A 24 12.533 -5.928 -3.020 1.00 3.23 H new ATOM 0 HG13 ILE A 24 12.903 -4.400 -3.793 1.00 3.23 H new ATOM 0 HG21 ILE A 24 9.618 -6.157 -3.868 1.00 21.01 H new ATOM 0 HG22 ILE A 24 9.863 -6.942 -5.446 1.00 21.01 H new ATOM 0 HG23 ILE A 24 10.799 -7.478 -4.031 1.00 21.01 H new ATOM 0 HD11 ILE A 24 11.605 -4.047 -1.732 1.00 50.30 H new ATOM 0 HD12 ILE A 24 10.671 -3.520 -3.152 1.00 50.30 H new ATOM 0 HD13 ILE A 24 10.296 -5.072 -2.366 1.00 50.30 H new ATOM 364 N ASN A 25 11.577 -6.219 -8.077 1.00 41.23 N ATOM 365 CA ASN A 25 11.078 -6.849 -9.296 1.00 1.43 C ATOM 366 C ASN A 25 11.979 -8.016 -9.742 1.00 65.23 C ATOM 367 O ASN A 25 11.459 -9.037 -10.191 1.00 12.13 O ATOM 368 CB ASN A 25 10.992 -5.822 -10.435 1.00 43.42 C ATOM 369 CG ASN A 25 10.618 -6.473 -11.760 1.00 51.11 C ATOM 370 OD1 ASN A 25 11.303 -6.325 -12.766 1.00 64.31 O ATOM 371 ND2 ASN A 25 9.521 -7.205 -11.812 1.00 42.33 N ATOM 0 H ASN A 25 11.645 -5.203 -8.130 1.00 41.23 H new ATOM 0 HA ASN A 25 10.085 -7.239 -9.072 1.00 1.43 H new ATOM 0 HB2 ASN A 25 10.253 -5.061 -10.183 1.00 43.42 H new ATOM 0 HB3 ASN A 25 11.950 -5.313 -10.538 1.00 43.42 H new ATOM 0 HD21 ASN A 25 9.244 -7.647 -12.689 1.00 42.33 H new ATOM 0 HD22 ASN A 25 8.950 -7.329 -10.976 1.00 42.33 H new ATOM 377 N SER A 26 13.300 -7.876 -9.607 1.00 12.14 N ATOM 378 CA SER A 26 14.303 -8.848 -10.016 1.00 53.35 C ATOM 379 C SER A 26 14.467 -10.005 -9.023 1.00 32.02 C ATOM 380 O SER A 26 14.920 -11.077 -9.429 1.00 10.52 O ATOM 381 CB SER A 26 15.630 -8.090 -10.178 1.00 61.31 C ATOM 382 OG SER A 26 16.626 -8.869 -10.807 1.00 73.33 O ATOM 0 H SER A 26 13.713 -7.042 -9.190 1.00 12.14 H new ATOM 0 HA SER A 26 13.984 -9.310 -10.950 1.00 53.35 H new ATOM 0 HB2 SER A 26 15.459 -7.185 -10.762 1.00 61.31 H new ATOM 0 HB3 SER A 26 15.986 -7.774 -9.197 1.00 61.31 H new ATOM 0 HG SER A 26 17.449 -8.344 -10.889 1.00 73.33 H new ATOM 387 N GLU A 27 14.125 -9.829 -7.745 1.00 43.24 N ATOM 388 CA GLU A 27 14.418 -10.806 -6.689 1.00 21.30 C ATOM 389 C GLU A 27 13.248 -11.777 -6.450 1.00 22.24 C ATOM 390 O GLU A 27 13.354 -12.678 -5.609 1.00 43.31 O ATOM 391 CB GLU A 27 14.970 -10.144 -5.405 1.00 22.34 C ATOM 392 CG GLU A 27 14.585 -8.725 -5.111 1.00 3.20 C ATOM 393 CD GLU A 27 15.317 -8.069 -3.923 1.00 1.50 C ATOM 394 OE1 GLU A 27 16.291 -8.642 -3.376 1.00 65.14 O ATOM 395 OE2 GLU A 27 14.915 -6.966 -3.491 1.00 71.31 O ATOM 0 H GLU A 27 13.634 -9.000 -7.410 1.00 43.24 H new ATOM 0 HA GLU A 27 15.234 -11.432 -7.049 1.00 21.30 H new ATOM 0 HB2 GLU A 27 14.659 -10.755 -4.557 1.00 22.34 H new ATOM 0 HB3 GLU A 27 16.058 -10.190 -5.449 1.00 22.34 H new ATOM 0 HG2 GLU A 27 14.767 -8.126 -6.003 1.00 3.20 H new ATOM 0 HG3 GLU A 27 13.513 -8.691 -4.918 1.00 3.20 H new ATOM 400 N ILE A 28 12.165 -11.641 -7.223 1.00 32.21 N ATOM 401 CA ILE A 28 10.956 -12.458 -7.180 1.00 43.12 C ATOM 402 C ILE A 28 10.816 -13.163 -8.536 1.00 31.02 C ATOM 403 O ILE A 28 11.402 -12.732 -9.536 1.00 32.44 O ATOM 404 CB ILE A 28 9.750 -11.558 -6.808 1.00 32.12 C ATOM 405 CG1 ILE A 28 9.989 -10.926 -5.415 1.00 3.31 C ATOM 406 CG2 ILE A 28 8.411 -12.319 -6.820 1.00 30.31 C ATOM 407 CD1 ILE A 28 8.837 -10.046 -4.938 1.00 13.10 C ATOM 0 H ILE A 28 12.110 -10.914 -7.936 1.00 32.21 H new ATOM 0 HA ILE A 28 11.003 -13.233 -6.414 1.00 43.12 H new ATOM 0 HB ILE A 28 9.677 -10.781 -7.568 1.00 32.12 H new ATOM 0 HG12 ILE A 28 10.153 -11.721 -4.688 1.00 3.31 H new ATOM 0 HG13 ILE A 28 10.901 -10.330 -5.447 1.00 3.31 H new ATOM 0 HG21 ILE A 28 7.603 -11.638 -6.552 1.00 30.31 H new ATOM 0 HG22 ILE A 28 8.230 -12.722 -7.817 1.00 30.31 H new ATOM 0 HG23 ILE A 28 8.451 -13.136 -6.100 1.00 30.31 H new ATOM 0 HD11 ILE A 28 9.074 -9.637 -3.956 1.00 13.10 H new ATOM 0 HD12 ILE A 28 8.686 -9.229 -5.644 1.00 13.10 H new ATOM 0 HD13 ILE A 28 7.927 -10.642 -4.873 1.00 13.10 H new ATOM 418 N LYS A 29 10.046 -14.253 -8.589 1.00 43.25 N ATOM 419 CA LYS A 29 9.652 -14.912 -9.829 1.00 3.43 C ATOM 420 C LYS A 29 8.196 -14.556 -10.102 1.00 12.51 C ATOM 421 O LYS A 29 7.374 -14.665 -9.195 1.00 62.41 O ATOM 422 CB LYS A 29 9.832 -16.435 -9.681 1.00 31.21 C ATOM 423 CG LYS A 29 10.371 -17.085 -10.959 1.00 14.53 C ATOM 424 CD LYS A 29 11.895 -16.905 -11.049 1.00 30.21 C ATOM 425 CE LYS A 29 12.484 -17.387 -12.376 1.00 2.03 C ATOM 426 NZ LYS A 29 12.137 -18.780 -12.705 1.00 61.13 N ATOM 0 H LYS A 29 9.674 -14.707 -7.755 1.00 43.25 H new ATOM 0 HA LYS A 29 10.271 -14.582 -10.664 1.00 3.43 H new ATOM 0 HB2 LYS A 29 10.515 -16.639 -8.857 1.00 31.21 H new ATOM 0 HB3 LYS A 29 8.875 -16.888 -9.422 1.00 31.21 H new ATOM 0 HG2 LYS A 29 10.122 -18.146 -10.968 1.00 14.53 H new ATOM 0 HG3 LYS A 29 9.893 -16.639 -11.831 1.00 14.53 H new ATOM 0 HD2 LYS A 29 12.138 -15.851 -10.913 1.00 30.21 H new ATOM 0 HD3 LYS A 29 12.367 -17.449 -10.231 1.00 30.21 H new ATOM 0 HE2 LYS A 29 12.134 -16.736 -13.177 1.00 2.03 H new ATOM 0 HE3 LYS A 29 13.569 -17.291 -12.338 1.00 2.03 H new ATOM 0 HZ1 LYS A 29 12.596 -19.050 -13.598 1.00 61.13 H new ATOM 0 HZ2 LYS A 29 12.464 -19.408 -11.943 1.00 61.13 H new ATOM 0 HZ3 LYS A 29 11.106 -18.866 -12.806 1.00 61.13 H new ATOM 436 N ASP A 30 7.866 -14.185 -11.338 1.00 33.44 N ATOM 437 CA ASP A 30 6.519 -13.776 -11.759 1.00 43.24 C ATOM 438 C ASP A 30 6.032 -12.519 -11.006 1.00 45.44 C ATOM 439 O ASP A 30 4.906 -12.433 -10.506 1.00 14.14 O ATOM 440 CB ASP A 30 5.537 -14.969 -11.752 1.00 71.33 C ATOM 441 CG ASP A 30 4.588 -14.915 -12.954 1.00 32.23 C ATOM 442 OD1 ASP A 30 3.872 -13.906 -13.130 1.00 31.01 O ATOM 443 OD2 ASP A 30 4.659 -15.820 -13.821 1.00 51.32 O ATOM 0 H ASP A 30 8.545 -14.159 -12.099 1.00 33.44 H new ATOM 0 HA ASP A 30 6.565 -13.460 -12.801 1.00 43.24 H new ATOM 0 HB2 ASP A 30 6.097 -15.904 -11.770 1.00 71.33 H new ATOM 0 HB3 ASP A 30 4.958 -14.961 -10.828 1.00 71.33 H new ATOM 447 N SER A 31 6.929 -11.547 -10.844 1.00 43.45 N ATOM 448 CA SER A 31 6.690 -10.203 -10.333 1.00 3.53 C ATOM 449 C SER A 31 6.347 -9.237 -11.475 1.00 43.34 C ATOM 450 O SER A 31 6.929 -9.312 -12.555 1.00 1.43 O ATOM 451 CB SER A 31 7.983 -9.740 -9.630 1.00 71.33 C ATOM 452 OG SER A 31 9.127 -10.409 -10.161 1.00 42.44 O ATOM 0 H SER A 31 7.910 -11.691 -11.084 1.00 43.45 H new ATOM 0 HA SER A 31 5.848 -10.211 -9.641 1.00 3.53 H new ATOM 0 HB2 SER A 31 8.100 -8.663 -9.750 1.00 71.33 H new ATOM 0 HB3 SER A 31 7.908 -9.935 -8.560 1.00 71.33 H new ATOM 0 HG SER A 31 9.892 -9.797 -10.163 1.00 42.44 H new ATOM 457 N GLU A 32 5.510 -8.234 -11.215 1.00 65.02 N ATOM 458 CA GLU A 32 5.225 -7.139 -12.128 1.00 44.31 C ATOM 459 C GLU A 32 5.343 -5.802 -11.428 1.00 11.52 C ATOM 460 O GLU A 32 5.099 -5.680 -10.227 1.00 32.00 O ATOM 461 CB GLU A 32 3.799 -7.276 -12.712 1.00 10.50 C ATOM 462 CG GLU A 32 3.747 -7.635 -14.202 1.00 24.34 C ATOM 463 CD GLU A 32 3.814 -9.123 -14.572 1.00 24.20 C ATOM 464 OE1 GLU A 32 3.355 -9.983 -13.794 1.00 1.52 O ATOM 465 OE2 GLU A 32 4.262 -9.456 -15.701 1.00 42.14 O ATOM 0 H GLU A 32 4.998 -8.163 -10.336 1.00 65.02 H new ATOM 0 HA GLU A 32 5.957 -7.186 -12.934 1.00 44.31 H new ATOM 0 HB2 GLU A 32 3.263 -8.040 -12.149 1.00 10.50 H new ATOM 0 HB3 GLU A 32 3.267 -6.337 -12.560 1.00 10.50 H new ATOM 0 HG2 GLU A 32 2.825 -7.226 -14.615 1.00 24.34 H new ATOM 0 HG3 GLU A 32 4.572 -7.126 -14.700 1.00 24.34 H new ATOM 470 N LEU A 33 5.686 -4.800 -12.239 1.00 25.30 N ATOM 471 CA LEU A 33 5.941 -3.423 -11.863 1.00 65.02 C ATOM 472 C LEU A 33 4.994 -2.551 -12.656 1.00 5.35 C ATOM 473 O LEU A 33 4.642 -2.890 -13.788 1.00 13.34 O ATOM 474 CB LEU A 33 7.425 -3.086 -12.139 1.00 23.21 C ATOM 475 CG LEU A 33 8.199 -2.878 -10.851 1.00 74.21 C ATOM 476 CD1 LEU A 33 8.073 -4.178 -10.080 1.00 33.02 C ATOM 477 CD2 LEU A 33 9.658 -2.516 -11.145 1.00 51.21 C ATOM 0 H LEU A 33 5.799 -4.947 -13.242 1.00 25.30 H new ATOM 0 HA LEU A 33 5.767 -3.252 -10.801 1.00 65.02 H new ATOM 0 HB2 LEU A 33 7.881 -3.893 -12.712 1.00 23.21 H new ATOM 0 HB3 LEU A 33 7.487 -2.186 -12.751 1.00 23.21 H new ATOM 0 HG LEU A 33 7.805 -2.047 -10.267 1.00 74.21 H new ATOM 0 HD11 LEU A 33 8.612 -4.095 -9.136 1.00 33.02 H new ATOM 0 HD12 LEU A 33 7.021 -4.382 -9.881 1.00 33.02 H new ATOM 0 HD13 LEU A 33 8.496 -4.992 -10.668 1.00 33.02 H new ATOM 0 HD21 LEU A 33 10.193 -2.372 -10.207 1.00 51.21 H new ATOM 0 HD22 LEU A 33 10.126 -3.322 -11.709 1.00 51.21 H new ATOM 0 HD23 LEU A 33 9.694 -1.596 -11.729 1.00 51.21 H new ATOM 488 N LYS A 34 4.508 -1.489 -12.030 1.00 50.44 N ATOM 489 CA LYS A 34 3.442 -0.640 -12.543 1.00 25.11 C ATOM 490 C LYS A 34 3.538 0.699 -11.805 1.00 21.43 C ATOM 491 O LYS A 34 4.322 0.809 -10.858 1.00 13.54 O ATOM 492 CB LYS A 34 2.119 -1.379 -12.266 1.00 23.33 C ATOM 493 CG LYS A 34 1.103 -1.358 -13.407 1.00 63.11 C ATOM 494 CD LYS A 34 1.405 -2.294 -14.588 1.00 2.54 C ATOM 495 CE LYS A 34 1.282 -3.792 -14.243 1.00 11.32 C ATOM 496 NZ LYS A 34 1.571 -4.665 -15.410 1.00 1.41 N ATOM 0 H LYS A 34 4.856 -1.184 -11.121 1.00 50.44 H new ATOM 0 HA LYS A 34 3.510 -0.441 -13.613 1.00 25.11 H new ATOM 0 HB2 LYS A 34 2.347 -2.417 -12.024 1.00 23.33 H new ATOM 0 HB3 LYS A 34 1.656 -0.940 -11.382 1.00 23.33 H new ATOM 0 HG2 LYS A 34 0.125 -1.618 -13.002 1.00 63.11 H new ATOM 0 HG3 LYS A 34 1.030 -0.338 -13.785 1.00 63.11 H new ATOM 0 HD2 LYS A 34 0.724 -2.062 -15.407 1.00 2.54 H new ATOM 0 HD3 LYS A 34 2.415 -2.095 -14.948 1.00 2.54 H new ATOM 0 HE2 LYS A 34 1.969 -4.033 -13.432 1.00 11.32 H new ATOM 0 HE3 LYS A 34 0.275 -3.997 -13.879 1.00 11.32 H new ATOM 0 HZ1 LYS A 34 1.410 -5.659 -15.149 1.00 1.41 H new ATOM 0 HZ2 LYS A 34 0.944 -4.409 -16.199 1.00 1.41 H new ATOM 0 HZ3 LYS A 34 2.562 -4.540 -15.700 1.00 1.41 H new ATOM 506 N GLU A 35 2.713 1.694 -12.143 1.00 32.15 N ATOM 507 CA GLU A 35 2.746 2.990 -11.470 1.00 3.13 C ATOM 508 C GLU A 35 1.404 3.369 -10.858 1.00 44.53 C ATOM 509 O GLU A 35 0.332 2.871 -11.222 1.00 52.43 O ATOM 510 CB GLU A 35 3.198 4.108 -12.425 1.00 24.45 C ATOM 511 CG GLU A 35 4.722 4.250 -12.567 1.00 63.13 C ATOM 512 CD GLU A 35 5.231 3.529 -13.807 1.00 14.11 C ATOM 513 OE1 GLU A 35 5.119 4.111 -14.914 1.00 5.41 O ATOM 514 OE2 GLU A 35 5.699 2.377 -13.688 1.00 62.33 O ATOM 0 H GLU A 35 2.013 1.624 -12.881 1.00 32.15 H new ATOM 0 HA GLU A 35 3.471 2.885 -10.663 1.00 3.13 H new ATOM 0 HB2 GLU A 35 2.770 3.922 -13.410 1.00 24.45 H new ATOM 0 HB3 GLU A 35 2.789 5.055 -12.074 1.00 24.45 H new ATOM 0 HG2 GLU A 35 4.987 5.306 -12.623 1.00 63.13 H new ATOM 0 HG3 GLU A 35 5.211 3.845 -11.681 1.00 63.13 H new ATOM 519 N VAL A 36 1.497 4.313 -9.935 1.00 54.44 N ATOM 520 CA VAL A 36 0.484 5.076 -9.244 1.00 2.31 C ATOM 521 C VAL A 36 0.777 6.578 -9.386 1.00 73.43 C ATOM 522 O VAL A 36 1.924 7.002 -9.226 1.00 41.30 O ATOM 523 CB VAL A 36 0.519 4.578 -7.785 1.00 45.41 C ATOM 524 CG1 VAL A 36 1.938 4.389 -7.304 1.00 33.12 C ATOM 525 CG2 VAL A 36 -0.401 5.437 -6.908 1.00 45.40 C ATOM 0 H VAL A 36 2.422 4.597 -9.612 1.00 54.44 H new ATOM 0 HA VAL A 36 -0.516 4.938 -9.654 1.00 2.31 H new ATOM 0 HB VAL A 36 0.099 3.575 -7.711 1.00 45.41 H new ATOM 0 HG11 VAL A 36 1.929 4.037 -6.272 1.00 33.12 H new ATOM 0 HG12 VAL A 36 2.441 3.654 -7.933 1.00 33.12 H new ATOM 0 HG13 VAL A 36 2.470 5.339 -7.359 1.00 33.12 H new ATOM 0 HG21 VAL A 36 -0.367 5.075 -5.881 1.00 45.40 H new ATOM 0 HG22 VAL A 36 -0.068 6.474 -6.938 1.00 45.40 H new ATOM 0 HG23 VAL A 36 -1.423 5.373 -7.281 1.00 45.40 H new ATOM 535 N LYS A 37 -0.256 7.411 -9.568 1.00 44.41 N ATOM 536 CA LYS A 37 -0.206 8.850 -9.279 1.00 32.11 C ATOM 537 C LYS A 37 -1.398 9.233 -8.386 1.00 74.01 C ATOM 538 O LYS A 37 -2.215 8.365 -8.074 1.00 1.13 O ATOM 539 CB LYS A 37 -0.063 9.687 -10.570 1.00 33.15 C ATOM 540 CG LYS A 37 -0.552 9.060 -11.886 1.00 23.45 C ATOM 541 CD LYS A 37 -0.894 10.158 -12.899 1.00 1.35 C ATOM 542 CE LYS A 37 -1.317 9.562 -14.245 1.00 74.44 C ATOM 543 NZ LYS A 37 -1.883 10.582 -15.151 1.00 44.31 N ATOM 0 H LYS A 37 -1.160 7.101 -9.924 1.00 44.41 H new ATOM 0 HA LYS A 37 0.694 9.088 -8.712 1.00 32.11 H new ATOM 0 HB2 LYS A 37 -0.602 10.623 -10.424 1.00 33.15 H new ATOM 0 HB3 LYS A 37 0.990 9.941 -10.690 1.00 33.15 H new ATOM 0 HG2 LYS A 37 0.218 8.405 -12.294 1.00 23.45 H new ATOM 0 HG3 LYS A 37 -1.430 8.441 -11.699 1.00 23.45 H new ATOM 0 HD2 LYS A 37 -1.698 10.781 -12.506 1.00 1.35 H new ATOM 0 HD3 LYS A 37 -0.029 10.806 -13.042 1.00 1.35 H new ATOM 0 HE2 LYS A 37 -0.455 9.094 -14.720 1.00 74.44 H new ATOM 0 HE3 LYS A 37 -2.055 8.777 -14.078 1.00 74.44 H new ATOM 0 HZ1 LYS A 37 -2.046 10.162 -16.088 1.00 44.31 H new ATOM 0 HZ2 LYS A 37 -2.785 10.927 -14.765 1.00 44.31 H new ATOM 0 HZ3 LYS A 37 -1.217 11.376 -15.238 1.00 44.31 H new ATOM 553 N VAL A 38 -1.446 10.479 -7.899 1.00 63.03 N ATOM 554 CA VAL A 38 -2.613 11.076 -7.231 1.00 73.44 C ATOM 555 C VAL A 38 -3.377 11.911 -8.274 1.00 71.33 C ATOM 556 O VAL A 38 -3.093 11.788 -9.467 1.00 42.23 O ATOM 557 CB VAL A 38 -2.214 11.891 -5.968 1.00 41.23 C ATOM 558 CG1 VAL A 38 -1.865 10.971 -4.795 1.00 50.23 C ATOM 559 CG2 VAL A 38 -1.051 12.871 -6.185 1.00 70.31 C ATOM 0 H VAL A 38 -0.654 11.118 -7.959 1.00 63.03 H new ATOM 0 HA VAL A 38 -3.269 10.292 -6.852 1.00 73.44 H new ATOM 0 HB VAL A 38 -3.100 12.483 -5.740 1.00 41.23 H new ATOM 0 HG11 VAL A 38 -1.591 11.574 -3.929 1.00 50.23 H new ATOM 0 HG12 VAL A 38 -2.728 10.353 -4.548 1.00 50.23 H new ATOM 0 HG13 VAL A 38 -1.027 10.331 -5.071 1.00 50.23 H new ATOM 0 HG21 VAL A 38 -0.840 13.397 -5.254 1.00 70.31 H new ATOM 0 HG22 VAL A 38 -0.165 12.320 -6.500 1.00 70.31 H new ATOM 0 HG23 VAL A 38 -1.322 13.593 -6.955 1.00 70.31 H new ATOM 569 N SER A 39 -4.337 12.749 -7.876 1.00 62.40 N ATOM 570 CA SER A 39 -4.670 13.961 -8.605 1.00 22.13 C ATOM 571 C SER A 39 -3.761 15.091 -8.088 1.00 5.41 C ATOM 572 O SER A 39 -3.240 15.063 -6.969 1.00 14.51 O ATOM 573 CB SER A 39 -6.170 14.252 -8.453 1.00 41.50 C ATOM 574 OG SER A 39 -6.542 15.447 -9.103 1.00 4.32 O ATOM 0 H SER A 39 -4.901 12.601 -7.039 1.00 62.40 H new ATOM 0 HA SER A 39 -4.490 13.859 -9.675 1.00 22.13 H new ATOM 0 HB2 SER A 39 -6.744 13.421 -8.863 1.00 41.50 H new ATOM 0 HB3 SER A 39 -6.421 14.321 -7.395 1.00 41.50 H new ATOM 0 HG SER A 39 -7.503 15.598 -8.986 1.00 4.32 H new ATOM 579 N GLU A 40 -3.563 16.094 -8.931 1.00 62.14 N ATOM 580 CA GLU A 40 -2.741 17.289 -8.760 1.00 14.45 C ATOM 581 C GLU A 40 -3.652 18.499 -9.015 1.00 74.31 C ATOM 582 O GLU A 40 -4.839 18.305 -9.284 1.00 65.32 O ATOM 583 CB GLU A 40 -1.510 17.195 -9.691 1.00 63.24 C ATOM 584 CG GLU A 40 -1.814 16.905 -11.170 1.00 45.10 C ATOM 585 CD GLU A 40 -1.614 18.095 -12.101 1.00 74.14 C ATOM 586 OE1 GLU A 40 -2.281 19.136 -11.907 1.00 32.23 O ATOM 587 OE2 GLU A 40 -0.889 17.945 -13.112 1.00 25.34 O ATOM 0 H GLU A 40 -4.018 16.093 -9.844 1.00 62.14 H new ATOM 0 HA GLU A 40 -2.332 17.393 -7.755 1.00 14.45 H new ATOM 0 HB2 GLU A 40 -0.958 18.133 -9.630 1.00 63.24 H new ATOM 0 HB3 GLU A 40 -0.851 16.413 -9.314 1.00 63.24 H new ATOM 0 HG2 GLU A 40 -1.177 16.086 -11.505 1.00 45.10 H new ATOM 0 HG3 GLU A 40 -2.845 16.562 -11.256 1.00 45.10 H new ATOM 592 N GLY A 41 -3.169 19.735 -8.907 1.00 10.54 N ATOM 593 CA GLY A 41 -3.978 20.895 -9.264 1.00 30.02 C ATOM 594 C GLY A 41 -3.594 22.127 -8.469 1.00 52.10 C ATOM 595 O GLY A 41 -4.203 22.398 -7.426 1.00 42.32 O ATOM 0 H GLY A 41 -2.229 19.957 -8.578 1.00 10.54 H new ATOM 0 HA2 GLY A 41 -3.864 21.101 -10.328 1.00 30.02 H new ATOM 0 HA3 GLY A 41 -5.030 20.668 -9.094 1.00 30.02 H new ATOM 599 N THR A 42 -2.611 22.871 -8.959 1.00 23.04 N ATOM 600 CA THR A 42 -2.094 24.081 -8.346 1.00 3.45 C ATOM 601 C THR A 42 -1.824 25.148 -9.414 1.00 11.21 C ATOM 602 O THR A 42 -2.376 25.100 -10.514 1.00 3.43 O ATOM 603 CB THR A 42 -0.886 23.768 -7.423 1.00 24.01 C ATOM 604 OG1 THR A 42 -0.632 22.391 -7.226 1.00 14.11 O ATOM 605 CG2 THR A 42 -1.181 24.376 -6.050 1.00 34.23 C ATOM 0 H THR A 42 -2.135 22.636 -9.830 1.00 23.04 H new ATOM 0 HA THR A 42 -2.848 24.509 -7.685 1.00 3.45 H new ATOM 0 HB THR A 42 -0.007 24.185 -7.914 1.00 24.01 H new ATOM 0 HG1 THR A 42 -0.304 21.996 -8.061 1.00 14.11 H new ATOM 0 HG21 THR A 42 -0.349 24.173 -5.376 1.00 34.23 H new ATOM 0 HG22 THR A 42 -1.313 25.453 -6.150 1.00 34.23 H new ATOM 0 HG23 THR A 42 -2.092 23.935 -5.645 1.00 34.23 H new ATOM 613 N PHE A 43 -1.064 26.179 -9.047 1.00 43.20 N ATOM 614 CA PHE A 43 -0.622 27.259 -9.906 1.00 1.52 C ATOM 615 C PHE A 43 0.895 27.368 -9.726 1.00 44.31 C ATOM 616 O PHE A 43 1.516 26.464 -9.166 1.00 44.52 O ATOM 617 CB PHE A 43 -1.390 28.534 -9.517 1.00 22.01 C ATOM 618 CG PHE A 43 -1.468 29.608 -10.585 1.00 41.54 C ATOM 619 CD1 PHE A 43 -2.079 29.317 -11.820 1.00 51.30 C ATOM 620 CD2 PHE A 43 -1.021 30.919 -10.325 1.00 43.50 C ATOM 621 CE1 PHE A 43 -2.260 30.328 -12.778 1.00 10.45 C ATOM 622 CE2 PHE A 43 -1.211 31.930 -11.284 1.00 33.12 C ATOM 623 CZ PHE A 43 -1.831 31.639 -12.511 1.00 61.34 C ATOM 0 H PHE A 43 -0.726 26.282 -8.090 1.00 43.20 H new ATOM 0 HA PHE A 43 -0.826 27.089 -10.963 1.00 1.52 H new ATOM 0 HB2 PHE A 43 -2.405 28.253 -9.236 1.00 22.01 H new ATOM 0 HB3 PHE A 43 -0.921 28.962 -8.631 1.00 22.01 H new ATOM 0 HD1 PHE A 43 -2.410 28.311 -12.032 1.00 51.30 H new ATOM 0 HD2 PHE A 43 -0.533 31.147 -9.389 1.00 43.50 H new ATOM 0 HE1 PHE A 43 -2.730 30.097 -13.722 1.00 10.45 H new ATOM 0 HE2 PHE A 43 -0.878 32.936 -11.076 1.00 33.12 H new ATOM 0 HZ PHE A 43 -1.977 32.418 -13.244 1.00 61.34 H new ATOM 632 N ASP A 44 1.494 28.475 -10.167 1.00 14.44 N ATOM 633 CA ASP A 44 2.923 28.764 -9.992 1.00 63.32 C ATOM 634 C ASP A 44 3.806 27.658 -10.593 1.00 50.12 C ATOM 635 O ASP A 44 4.795 27.227 -9.999 1.00 25.22 O ATOM 636 CB ASP A 44 3.238 29.083 -8.513 1.00 21.02 C ATOM 637 CG ASP A 44 4.605 29.752 -8.318 1.00 70.14 C ATOM 638 OD1 ASP A 44 5.092 30.406 -9.267 1.00 33.04 O ATOM 639 OD2 ASP A 44 5.140 29.734 -7.180 1.00 51.53 O ATOM 0 H ASP A 44 0.993 29.211 -10.665 1.00 14.44 H new ATOM 0 HA ASP A 44 3.170 29.662 -10.558 1.00 63.32 H new ATOM 0 HB2 ASP A 44 2.461 29.736 -8.115 1.00 21.02 H new ATOM 0 HB3 ASP A 44 3.206 28.160 -7.934 1.00 21.02 H new ATOM 643 N ALA A 45 3.428 27.228 -11.804 1.00 72.12 N ATOM 644 CA ALA A 45 3.895 26.076 -12.570 1.00 13.21 C ATOM 645 C ALA A 45 3.322 24.780 -11.995 1.00 5.54 C ATOM 646 O ALA A 45 2.498 24.161 -12.662 1.00 21.01 O ATOM 647 CB ALA A 45 5.416 26.051 -12.763 1.00 50.54 C ATOM 0 H ALA A 45 2.711 27.736 -12.322 1.00 72.12 H new ATOM 0 HA ALA A 45 3.506 26.174 -13.584 1.00 13.21 H new ATOM 0 HB1 ALA A 45 5.695 25.169 -13.340 1.00 50.54 H new ATOM 0 HB2 ALA A 45 5.730 26.948 -13.296 1.00 50.54 H new ATOM 0 HB3 ALA A 45 5.906 26.018 -11.790 1.00 50.54 H new ATOM 653 N ASP A 46 3.735 24.361 -10.797 1.00 10.22 N ATOM 654 CA ASP A 46 3.010 23.399 -9.957 1.00 1.51 C ATOM 655 C ASP A 46 3.694 23.323 -8.590 1.00 44.43 C ATOM 656 O ASP A 46 4.711 23.987 -8.360 1.00 50.13 O ATOM 657 CB ASP A 46 2.920 21.979 -10.567 1.00 73.42 C ATOM 658 CG ASP A 46 1.547 21.353 -10.285 1.00 21.41 C ATOM 659 OD1 ASP A 46 1.006 21.494 -9.159 1.00 23.44 O ATOM 660 OD2 ASP A 46 0.970 20.754 -11.217 1.00 52.20 O ATOM 0 H ASP A 46 4.603 24.687 -10.372 1.00 10.22 H new ATOM 0 HA ASP A 46 1.985 23.761 -9.872 1.00 1.51 H new ATOM 0 HB2 ASP A 46 3.088 22.029 -11.643 1.00 73.42 H new ATOM 0 HB3 ASP A 46 3.705 21.348 -10.150 1.00 73.42 H new ATOM 664 N MET A 47 3.185 22.484 -7.692 1.00 12.53 N ATOM 665 CA MET A 47 3.816 22.079 -6.444 1.00 33.04 C ATOM 666 C MET A 47 3.199 20.754 -5.992 1.00 22.13 C ATOM 667 O MET A 47 2.222 20.285 -6.581 1.00 53.33 O ATOM 668 CB MET A 47 3.663 23.196 -5.394 1.00 11.42 C ATOM 669 CG MET A 47 2.211 23.614 -5.121 1.00 62.04 C ATOM 670 SD MET A 47 1.987 25.309 -4.502 1.00 61.00 S ATOM 671 CE MET A 47 2.228 26.245 -6.033 1.00 65.41 C ATOM 0 H MET A 47 2.273 22.047 -7.824 1.00 12.53 H new ATOM 0 HA MET A 47 4.886 21.922 -6.581 1.00 33.04 H new ATOM 0 HB2 MET A 47 4.115 22.864 -4.459 1.00 11.42 H new ATOM 0 HB3 MET A 47 4.224 24.070 -5.726 1.00 11.42 H new ATOM 0 HG2 MET A 47 1.640 23.504 -6.043 1.00 62.04 H new ATOM 0 HG3 MET A 47 1.782 22.922 -4.396 1.00 62.04 H new ATOM 0 HE1 MET A 47 2.712 27.195 -5.806 1.00 65.41 H new ATOM 0 HE2 MET A 47 2.855 25.671 -6.715 1.00 65.41 H new ATOM 0 HE3 MET A 47 1.261 26.433 -6.500 1.00 65.41 H new ATOM 679 N TYR A 48 3.743 20.143 -4.939 1.00 54.43 N ATOM 680 CA TYR A 48 3.087 19.013 -4.284 1.00 70.30 C ATOM 681 C TYR A 48 1.756 19.491 -3.677 1.00 25.32 C ATOM 682 O TYR A 48 1.603 20.676 -3.366 1.00 43.33 O ATOM 683 CB TYR A 48 4.012 18.418 -3.210 1.00 24.04 C ATOM 684 CG TYR A 48 5.114 17.496 -3.715 1.00 53.23 C ATOM 685 CD1 TYR A 48 6.119 17.956 -4.588 1.00 5.54 C ATOM 686 CD2 TYR A 48 5.147 16.159 -3.275 1.00 3.41 C ATOM 687 CE1 TYR A 48 7.142 17.090 -5.016 1.00 63.20 C ATOM 688 CE2 TYR A 48 6.153 15.282 -3.708 1.00 31.34 C ATOM 689 CZ TYR A 48 7.164 15.747 -4.576 1.00 13.31 C ATOM 690 OH TYR A 48 8.166 14.905 -4.959 1.00 72.23 O ATOM 0 H TYR A 48 4.635 20.412 -4.523 1.00 54.43 H new ATOM 0 HA TYR A 48 2.878 18.228 -5.011 1.00 70.30 H new ATOM 0 HB2 TYR A 48 4.475 19.239 -2.662 1.00 24.04 H new ATOM 0 HB3 TYR A 48 3.400 17.864 -2.498 1.00 24.04 H new ATOM 0 HD1 TYR A 48 6.104 18.980 -4.931 1.00 5.54 H new ATOM 0 HD2 TYR A 48 4.387 15.803 -2.595 1.00 3.41 H new ATOM 0 HE1 TYR A 48 7.912 17.452 -5.682 1.00 63.20 H new ATOM 0 HE2 TYR A 48 6.154 14.254 -3.378 1.00 31.34 H new ATOM 0 HH TYR A 48 8.020 14.021 -4.561 1.00 72.23 H new ATOM 699 N LYS A 49 0.793 18.592 -3.446 1.00 54.43 N ATOM 700 CA LYS A 49 -0.508 18.921 -2.846 1.00 45.20 C ATOM 701 C LYS A 49 -1.017 17.774 -1.958 1.00 11.24 C ATOM 702 O LYS A 49 -2.194 17.733 -1.618 1.00 3.13 O ATOM 703 CB LYS A 49 -1.505 19.294 -3.965 1.00 33.25 C ATOM 704 CG LYS A 49 -2.644 20.231 -3.512 1.00 34.43 C ATOM 705 CD LYS A 49 -2.412 21.706 -3.874 1.00 22.45 C ATOM 706 CE LYS A 49 -1.308 22.397 -3.064 1.00 62.24 C ATOM 707 NZ LYS A 49 -1.684 22.596 -1.651 1.00 22.35 N ATOM 0 H LYS A 49 0.895 17.603 -3.673 1.00 54.43 H new ATOM 0 HA LYS A 49 -0.400 19.784 -2.189 1.00 45.20 H new ATOM 0 HB2 LYS A 49 -0.959 19.772 -4.778 1.00 33.25 H new ATOM 0 HB3 LYS A 49 -1.941 18.380 -4.368 1.00 33.25 H new ATOM 0 HG2 LYS A 49 -3.578 19.898 -3.964 1.00 34.43 H new ATOM 0 HG3 LYS A 49 -2.765 20.146 -2.432 1.00 34.43 H new ATOM 0 HD2 LYS A 49 -2.162 21.771 -4.933 1.00 22.45 H new ATOM 0 HD3 LYS A 49 -3.345 22.252 -3.732 1.00 22.45 H new ATOM 0 HE2 LYS A 49 -0.398 21.800 -3.114 1.00 62.24 H new ATOM 0 HE3 LYS A 49 -1.081 23.363 -3.516 1.00 62.24 H new ATOM 0 HZ1 LYS A 49 -0.926 23.111 -1.159 1.00 22.35 H new ATOM 0 HZ2 LYS A 49 -2.566 23.145 -1.600 1.00 22.35 H new ATOM 0 HZ3 LYS A 49 -1.826 21.672 -1.196 1.00 22.35 H new ATOM 717 N THR A 50 -0.136 16.847 -1.580 1.00 65.41 N ATOM 718 CA THR A 50 -0.429 15.738 -0.689 1.00 50.12 C ATOM 719 C THR A 50 0.660 15.712 0.396 1.00 53.20 C ATOM 720 O THR A 50 0.377 16.132 1.521 1.00 51.50 O ATOM 721 CB THR A 50 -0.610 14.451 -1.519 1.00 4.15 C ATOM 722 OG1 THR A 50 -1.834 14.449 -2.212 1.00 52.14 O ATOM 723 CG2 THR A 50 -0.661 13.167 -0.676 1.00 2.23 C ATOM 0 H THR A 50 0.832 16.853 -1.900 1.00 65.41 H new ATOM 0 HA THR A 50 -1.375 15.843 -0.157 1.00 50.12 H new ATOM 0 HB THR A 50 0.260 14.454 -2.176 1.00 4.15 H new ATOM 0 HG1 THR A 50 -1.916 13.620 -2.729 1.00 52.14 H new ATOM 0 HG21 THR A 50 -0.790 12.306 -1.332 1.00 2.23 H new ATOM 0 HG22 THR A 50 0.269 13.061 -0.117 1.00 2.23 H new ATOM 0 HG23 THR A 50 -1.498 13.222 0.020 1.00 2.23 H new ATOM 731 N SER A 51 1.894 15.270 0.113 1.00 50.51 N ATOM 732 CA SER A 51 2.915 15.020 1.133 1.00 21.41 C ATOM 733 C SER A 51 4.058 16.033 1.055 1.00 11.54 C ATOM 734 O SER A 51 4.960 15.887 0.229 1.00 12.52 O ATOM 735 CB SER A 51 3.406 13.566 1.062 1.00 42.54 C ATOM 736 OG SER A 51 3.887 13.188 -0.221 1.00 10.34 O ATOM 0 H SER A 51 2.211 15.076 -0.837 1.00 50.51 H new ATOM 0 HA SER A 51 2.458 15.160 2.113 1.00 21.41 H new ATOM 0 HB2 SER A 51 4.200 13.424 1.795 1.00 42.54 H new ATOM 0 HB3 SER A 51 2.589 12.902 1.344 1.00 42.54 H new ATOM 0 HG SER A 51 4.429 13.914 -0.594 1.00 10.34 H new ATOM 741 N ASP A 52 4.043 17.039 1.929 1.00 63.03 N ATOM 742 CA ASP A 52 5.179 17.908 2.206 1.00 33.15 C ATOM 743 C ASP A 52 5.165 18.292 3.681 1.00 34.31 C ATOM 744 O ASP A 52 6.012 17.804 4.433 1.00 41.41 O ATOM 745 CB ASP A 52 5.196 19.144 1.305 1.00 50.51 C ATOM 746 CG ASP A 52 6.420 20.002 1.597 1.00 23.42 C ATOM 747 OD1 ASP A 52 6.351 20.884 2.480 1.00 61.14 O ATOM 748 OD2 ASP A 52 7.433 19.864 0.873 1.00 21.02 O ATOM 0 H ASP A 52 3.216 17.276 2.477 1.00 63.03 H new ATOM 0 HA ASP A 52 6.096 17.362 1.984 1.00 33.15 H new ATOM 0 HB2 ASP A 52 5.200 18.838 0.259 1.00 50.51 H new ATOM 0 HB3 ASP A 52 4.289 19.728 1.462 1.00 50.51 H new ATOM 752 N ILE A 53 4.191 19.111 4.099 1.00 45.14 N ATOM 753 CA ILE A 53 4.212 19.854 5.361 1.00 2.53 C ATOM 754 C ILE A 53 4.084 18.979 6.615 1.00 44.22 C ATOM 755 O ILE A 53 4.427 19.445 7.702 1.00 24.42 O ATOM 756 CB ILE A 53 3.137 20.972 5.351 1.00 10.14 C ATOM 757 CG1 ILE A 53 1.703 20.407 5.506 1.00 23.23 C ATOM 758 CG2 ILE A 53 3.296 21.877 4.112 1.00 74.20 C ATOM 759 CD1 ILE A 53 0.589 21.438 5.305 1.00 22.41 C ATOM 0 H ILE A 53 3.346 19.278 3.553 1.00 45.14 H new ATOM 0 HA ILE A 53 5.204 20.301 5.425 1.00 2.53 H new ATOM 0 HB ILE A 53 3.300 21.599 6.227 1.00 10.14 H new ATOM 0 HG12 ILE A 53 1.565 19.598 4.789 1.00 23.23 H new ATOM 0 HG13 ILE A 53 1.603 19.972 6.500 1.00 23.23 H new ATOM 0 HG21 ILE A 53 2.531 22.653 4.128 1.00 74.20 H new ATOM 0 HG22 ILE A 53 4.283 22.340 4.124 1.00 74.20 H new ATOM 0 HG23 ILE A 53 3.187 21.278 3.208 1.00 74.20 H new ATOM 0 HD11 ILE A 53 -0.380 20.956 5.432 1.00 22.41 H new ATOM 0 HD12 ILE A 53 0.696 22.237 6.039 1.00 22.41 H new ATOM 0 HD13 ILE A 53 0.657 21.857 4.301 1.00 22.41 H new ATOM 770 N ALA A 54 3.624 17.727 6.485 1.00 33.42 N ATOM 771 CA ALA A 54 3.234 16.825 7.572 1.00 4.35 C ATOM 772 C ALA A 54 1.968 17.303 8.281 1.00 61.03 C ATOM 773 O ALA A 54 1.857 18.469 8.665 1.00 25.14 O ATOM 774 CB ALA A 54 4.387 16.572 8.550 1.00 50.21 C ATOM 0 H ALA A 54 3.509 17.295 5.568 1.00 33.42 H new ATOM 0 HA ALA A 54 2.995 15.863 7.118 1.00 4.35 H new ATOM 0 HB1 ALA A 54 4.053 15.898 9.339 1.00 50.21 H new ATOM 0 HB2 ALA A 54 5.224 16.120 8.017 1.00 50.21 H new ATOM 0 HB3 ALA A 54 4.705 17.517 8.990 1.00 50.21 H new ATOM 780 N LEU A 55 1.080 16.343 8.553 1.00 61.02 N ATOM 781 CA LEU A 55 -0.193 16.434 9.228 1.00 23.32 C ATOM 782 C LEU A 55 -1.283 17.104 8.387 1.00 42.40 C ATOM 783 O LEU A 55 -2.352 17.401 8.917 1.00 74.14 O ATOM 784 CB LEU A 55 0.039 17.039 10.613 1.00 53.33 C ATOM 785 CG LEU A 55 -0.681 16.278 11.737 1.00 31.31 C ATOM 786 CD1 LEU A 55 0.214 16.278 12.977 1.00 34.25 C ATOM 787 CD2 LEU A 55 -2.048 16.861 12.096 1.00 54.54 C ATOM 0 H LEU A 55 1.268 15.382 8.269 1.00 61.02 H new ATOM 0 HA LEU A 55 -0.609 15.437 9.372 1.00 23.32 H new ATOM 0 HB2 LEU A 55 1.109 17.053 10.821 1.00 53.33 H new ATOM 0 HB3 LEU A 55 -0.299 18.075 10.611 1.00 53.33 H new ATOM 0 HG LEU A 55 -0.865 15.267 11.375 1.00 31.31 H new ATOM 0 HD11 LEU A 55 -0.283 15.741 13.785 1.00 34.25 H new ATOM 0 HD12 LEU A 55 1.159 15.788 12.744 1.00 34.25 H new ATOM 0 HD13 LEU A 55 0.405 17.305 13.288 1.00 34.25 H new ATOM 0 HD21 LEU A 55 -2.496 16.272 12.896 1.00 54.54 H new ATOM 0 HD22 LEU A 55 -1.928 17.892 12.428 1.00 54.54 H new ATOM 0 HD23 LEU A 55 -2.696 16.835 11.220 1.00 54.54 H new ATOM 798 N ASP A 56 -1.072 17.280 7.080 1.00 12.34 N ATOM 799 CA ASP A 56 -2.165 17.468 6.124 1.00 50.50 C ATOM 800 C ASP A 56 -2.889 16.128 5.927 1.00 65.30 C ATOM 801 O ASP A 56 -2.313 15.074 6.186 1.00 2.12 O ATOM 802 CB ASP A 56 -1.630 17.983 4.778 1.00 14.41 C ATOM 803 CG ASP A 56 -2.755 18.250 3.774 1.00 42.10 C ATOM 804 OD1 ASP A 56 -3.880 18.599 4.186 1.00 42.54 O ATOM 805 OD2 ASP A 56 -2.546 18.069 2.557 1.00 63.14 O ATOM 0 H ASP A 56 -0.144 17.296 6.657 1.00 12.34 H new ATOM 0 HA ASP A 56 -2.860 18.211 6.515 1.00 50.50 H new ATOM 0 HB2 ASP A 56 -1.065 18.901 4.941 1.00 14.41 H new ATOM 0 HB3 ASP A 56 -0.938 17.252 4.360 1.00 14.41 H new ATOM 809 N GLN A 57 -4.138 16.149 5.457 1.00 14.33 N ATOM 810 CA GLN A 57 -4.998 14.999 5.145 1.00 13.54 C ATOM 811 C GLN A 57 -5.295 14.077 6.347 1.00 14.42 C ATOM 812 O GLN A 57 -6.037 13.101 6.200 1.00 23.23 O ATOM 813 CB GLN A 57 -4.439 14.193 3.949 1.00 32.04 C ATOM 814 CG GLN A 57 -3.994 14.976 2.699 1.00 41.21 C ATOM 815 CD GLN A 57 -5.112 15.780 2.034 1.00 23.23 C ATOM 816 OE1 GLN A 57 -5.621 15.402 0.984 1.00 2.24 O ATOM 817 NE2 GLN A 57 -5.506 16.906 2.600 1.00 61.40 N ATOM 0 H GLN A 57 -4.612 17.033 5.270 1.00 14.33 H new ATOM 0 HA GLN A 57 -5.961 15.428 4.867 1.00 13.54 H new ATOM 0 HB2 GLN A 57 -3.585 13.616 4.304 1.00 32.04 H new ATOM 0 HB3 GLN A 57 -5.202 13.477 3.642 1.00 32.04 H new ATOM 0 HG2 GLN A 57 -3.189 15.656 2.977 1.00 41.21 H new ATOM 0 HG3 GLN A 57 -3.583 14.275 1.972 1.00 41.21 H new ATOM 0 HE21 GLN A 57 -5.079 17.215 3.473 1.00 61.40 H new ATOM 0 HE22 GLN A 57 -6.238 17.467 2.164 1.00 61.40 H new ATOM 824 N ILE A 58 -4.759 14.354 7.541 1.00 63.00 N ATOM 825 CA ILE A 58 -4.956 13.537 8.732 1.00 53.42 C ATOM 826 C ILE A 58 -6.184 14.085 9.477 1.00 43.42 C ATOM 827 O ILE A 58 -7.301 13.630 9.227 1.00 41.53 O ATOM 828 CB ILE A 58 -3.619 13.440 9.536 1.00 44.52 C ATOM 829 CG1 ILE A 58 -2.456 12.756 8.748 1.00 32.12 C ATOM 830 CG2 ILE A 58 -3.812 12.712 10.876 1.00 53.11 C ATOM 831 CD1 ILE A 58 -2.875 11.493 7.990 1.00 53.31 C ATOM 0 H ILE A 58 -4.166 15.168 7.704 1.00 63.00 H new ATOM 0 HA ILE A 58 -5.189 12.496 8.510 1.00 53.42 H new ATOM 0 HB ILE A 58 -3.331 14.476 9.715 1.00 44.52 H new ATOM 0 HG12 ILE A 58 -2.041 13.472 8.039 1.00 32.12 H new ATOM 0 HG13 ILE A 58 -1.659 12.501 9.446 1.00 32.12 H new ATOM 0 HG21 ILE A 58 -2.860 12.665 11.405 1.00 53.11 H new ATOM 0 HG22 ILE A 58 -4.538 13.253 11.483 1.00 53.11 H new ATOM 0 HG23 ILE A 58 -4.175 11.701 10.692 1.00 53.11 H new ATOM 0 HD11 ILE A 58 -2.012 11.078 7.469 1.00 53.31 H new ATOM 0 HD12 ILE A 58 -3.262 10.757 8.695 1.00 53.31 H new ATOM 0 HD13 ILE A 58 -3.650 11.744 7.266 1.00 53.31 H new ATOM 842 N GLN A 59 -6.025 15.089 10.338 1.00 1.33 N ATOM 843 CA GLN A 59 -7.055 15.589 11.226 1.00 21.13 C ATOM 844 C GLN A 59 -7.286 17.055 10.903 1.00 22.25 C ATOM 845 O GLN A 59 -6.342 17.775 10.572 1.00 51.12 O ATOM 846 CB GLN A 59 -6.649 15.356 12.683 1.00 64.43 C ATOM 847 CG GLN A 59 -5.215 15.763 13.028 1.00 4.53 C ATOM 848 CD GLN A 59 -4.872 15.496 14.486 1.00 24.33 C ATOM 849 OE1 GLN A 59 -4.618 16.431 15.245 1.00 75.14 O ATOM 850 NE2 GLN A 59 -4.805 14.240 14.896 1.00 21.22 N ATOM 0 H GLN A 59 -5.141 15.589 10.434 1.00 1.33 H new ATOM 0 HA GLN A 59 -7.995 15.056 11.082 1.00 21.13 H new ATOM 0 HB2 GLN A 59 -7.333 15.909 13.328 1.00 64.43 H new ATOM 0 HB3 GLN A 59 -6.776 14.299 12.915 1.00 64.43 H new ATOM 0 HG2 GLN A 59 -4.521 15.217 12.388 1.00 4.53 H new ATOM 0 HG3 GLN A 59 -5.079 16.823 12.814 1.00 4.53 H new ATOM 0 HE21 GLN A 59 -5.020 13.480 14.250 1.00 21.22 H new ATOM 0 HE22 GLN A 59 -4.539 14.031 15.858 1.00 21.22 H new ATOM 857 N GLY A 60 -8.530 17.510 10.983 1.00 64.24 N ATOM 858 CA GLY A 60 -8.926 18.877 10.682 1.00 75.02 C ATOM 859 C GLY A 60 -8.924 19.217 9.197 1.00 12.31 C ATOM 860 O GLY A 60 -9.602 20.177 8.826 1.00 34.02 O ATOM 0 H GLY A 60 -9.312 16.920 11.267 1.00 64.24 H new ATOM 0 HA2 GLY A 60 -9.925 19.050 11.081 1.00 75.02 H new ATOM 0 HA3 GLY A 60 -8.253 19.560 11.200 1.00 75.02 H new ATOM 864 N ASN A 61 -8.238 18.445 8.350 1.00 53.54 N ATOM 865 CA ASN A 61 -8.628 18.330 6.948 1.00 41.23 C ATOM 866 C ASN A 61 -9.660 17.216 6.848 1.00 74.40 C ATOM 867 O ASN A 61 -9.857 16.436 7.788 1.00 2.24 O ATOM 868 CB ASN A 61 -7.422 18.044 6.044 1.00 14.44 C ATOM 869 CG ASN A 61 -6.589 19.302 5.886 1.00 12.43 C ATOM 870 OD1 ASN A 61 -6.991 20.240 5.206 1.00 42.44 O ATOM 871 ND2 ASN A 61 -5.466 19.362 6.572 1.00 74.11 N ATOM 0 H ASN A 61 -7.418 17.896 8.610 1.00 53.54 H new ATOM 0 HA ASN A 61 -9.050 19.274 6.604 1.00 41.23 H new ATOM 0 HB2 ASN A 61 -6.815 17.246 6.473 1.00 14.44 H new ATOM 0 HB3 ASN A 61 -7.761 17.697 5.068 1.00 14.44 H new ATOM 0 HD21 ASN A 61 -4.899 20.209 6.549 1.00 74.11 H new ATOM 0 HD22 ASN A 61 -5.164 18.561 7.127 1.00 74.11 H new ATOM 877 N LYS A 62 -10.307 17.121 5.697 1.00 35.25 N ATOM 878 CA LYS A 62 -11.191 16.036 5.314 1.00 2.53 C ATOM 879 C LYS A 62 -11.064 15.888 3.804 1.00 55.33 C ATOM 880 O LYS A 62 -10.534 16.793 3.159 1.00 33.25 O ATOM 881 CB LYS A 62 -12.635 16.377 5.744 1.00 1.22 C ATOM 882 CG LYS A 62 -13.259 15.265 6.604 1.00 44.20 C ATOM 883 CD LYS A 62 -14.185 15.808 7.700 1.00 44.23 C ATOM 884 CE LYS A 62 -13.368 16.541 8.772 1.00 40.22 C ATOM 885 NZ LYS A 62 -14.166 16.816 9.981 1.00 51.53 N ATOM 0 H LYS A 62 -10.225 17.833 4.971 1.00 35.25 H new ATOM 0 HA LYS A 62 -10.930 15.096 5.799 1.00 2.53 H new ATOM 0 HB2 LYS A 62 -12.635 17.312 6.305 1.00 1.22 H new ATOM 0 HB3 LYS A 62 -13.249 16.537 4.858 1.00 1.22 H new ATOM 0 HG2 LYS A 62 -13.822 14.588 5.961 1.00 44.20 H new ATOM 0 HG3 LYS A 62 -12.464 14.679 7.065 1.00 44.20 H new ATOM 0 HD2 LYS A 62 -14.917 16.487 7.263 1.00 44.23 H new ATOM 0 HD3 LYS A 62 -14.742 14.988 8.154 1.00 44.23 H new ATOM 0 HE2 LYS A 62 -12.499 15.940 9.040 1.00 40.22 H new ATOM 0 HE3 LYS A 62 -12.993 17.479 8.364 1.00 40.22 H new ATOM 0 HZ1 LYS A 62 -13.577 17.312 10.680 1.00 51.53 H new ATOM 0 HZ2 LYS A 62 -14.982 17.411 9.731 1.00 51.53 H new ATOM 0 HZ3 LYS A 62 -14.503 15.919 10.386 1.00 51.53 H new ATOM 895 N ASP A 63 -11.611 14.800 3.271 1.00 53.42 N ATOM 896 CA ASP A 63 -11.615 14.453 1.851 1.00 73.30 C ATOM 897 C ASP A 63 -10.220 14.005 1.411 1.00 55.12 C ATOM 898 O ASP A 63 -9.309 14.815 1.268 1.00 32.14 O ATOM 899 CB ASP A 63 -12.223 15.576 0.979 1.00 23.04 C ATOM 900 CG ASP A 63 -13.228 15.022 -0.023 1.00 60.24 C ATOM 901 OD1 ASP A 63 -14.114 14.246 0.413 1.00 20.14 O ATOM 902 OD2 ASP A 63 -13.150 15.364 -1.223 1.00 14.41 O ATOM 0 H ASP A 63 -12.086 14.102 3.843 1.00 53.42 H new ATOM 0 HA ASP A 63 -12.277 13.601 1.699 1.00 73.30 H new ATOM 0 HB2 ASP A 63 -12.712 16.310 1.619 1.00 23.04 H new ATOM 0 HB3 ASP A 63 -11.427 16.097 0.447 1.00 23.04 H new ATOM 906 N PHE A 64 -10.026 12.687 1.301 1.00 14.14 N ATOM 907 CA PHE A 64 -8.763 12.097 0.860 1.00 42.50 C ATOM 908 C PHE A 64 -8.463 12.449 -0.607 1.00 2.54 C ATOM 909 O PHE A 64 -9.391 12.734 -1.366 1.00 53.12 O ATOM 910 CB PHE A 64 -8.837 10.568 1.022 1.00 51.31 C ATOM 911 CG PHE A 64 -8.812 10.096 2.461 1.00 1.42 C ATOM 912 CD1 PHE A 64 -7.593 9.979 3.156 1.00 22.14 C ATOM 913 CD2 PHE A 64 -10.016 9.775 3.108 1.00 4.31 C ATOM 914 CE1 PHE A 64 -7.581 9.545 4.495 1.00 14.42 C ATOM 915 CE2 PHE A 64 -10.005 9.350 4.446 1.00 1.55 C ATOM 916 CZ PHE A 64 -8.791 9.232 5.141 1.00 23.15 C ATOM 0 H PHE A 64 -10.746 11.998 1.517 1.00 14.14 H new ATOM 0 HA PHE A 64 -7.958 12.502 1.474 1.00 42.50 H new ATOM 0 HB2 PHE A 64 -9.750 10.207 0.548 1.00 51.31 H new ATOM 0 HB3 PHE A 64 -8.001 10.116 0.488 1.00 51.31 H new ATOM 0 HD1 PHE A 64 -6.665 10.223 2.660 1.00 22.14 H new ATOM 0 HD2 PHE A 64 -10.952 9.855 2.576 1.00 4.31 H new ATOM 0 HE1 PHE A 64 -6.645 9.452 5.025 1.00 14.42 H new ATOM 0 HE2 PHE A 64 -10.934 9.113 4.943 1.00 1.55 H new ATOM 0 HZ PHE A 64 -8.786 8.902 6.169 1.00 23.15 H new ATOM 925 N PRO A 65 -7.191 12.340 -1.042 1.00 24.45 N ATOM 926 CA PRO A 65 -6.811 12.489 -2.443 1.00 44.23 C ATOM 927 C PRO A 65 -7.460 11.408 -3.327 1.00 72.12 C ATOM 928 O PRO A 65 -8.011 10.421 -2.837 1.00 11.12 O ATOM 929 CB PRO A 65 -5.275 12.428 -2.458 1.00 45.33 C ATOM 930 CG PRO A 65 -4.920 11.651 -1.198 1.00 12.53 C ATOM 931 CD PRO A 65 -6.013 12.074 -0.225 1.00 52.34 C ATOM 0 HA PRO A 65 -7.165 13.431 -2.863 1.00 44.23 H new ATOM 0 HB2 PRO A 65 -4.905 11.927 -3.352 1.00 45.33 H new ATOM 0 HB3 PRO A 65 -4.837 13.426 -2.447 1.00 45.33 H new ATOM 0 HG2 PRO A 65 -4.926 10.575 -1.371 1.00 12.53 H new ATOM 0 HG3 PRO A 65 -3.927 11.909 -0.829 1.00 12.53 H new ATOM 0 HD2 PRO A 65 -6.212 11.289 0.505 1.00 52.34 H new ATOM 0 HD3 PRO A 65 -5.717 12.961 0.334 1.00 52.34 H new ATOM 936 N GLU A 66 -7.323 11.546 -4.642 1.00 11.52 N ATOM 937 CA GLU A 66 -7.658 10.552 -5.664 1.00 41.20 C ATOM 938 C GLU A 66 -6.394 9.776 -6.030 1.00 31.44 C ATOM 939 O GLU A 66 -5.294 10.124 -5.588 1.00 5.51 O ATOM 940 CB GLU A 66 -8.198 11.281 -6.903 1.00 72.02 C ATOM 941 CG GLU A 66 -9.645 11.739 -6.713 1.00 41.24 C ATOM 942 CD GLU A 66 -10.149 12.490 -7.944 1.00 4.33 C ATOM 943 OE1 GLU A 66 -10.166 11.908 -9.055 1.00 62.32 O ATOM 944 OE2 GLU A 66 -10.543 13.666 -7.813 1.00 14.41 O ATOM 0 H GLU A 66 -6.953 12.405 -5.050 1.00 11.52 H new ATOM 0 HA GLU A 66 -8.413 9.860 -5.290 1.00 41.20 H new ATOM 0 HB2 GLU A 66 -7.569 12.145 -7.118 1.00 72.02 H new ATOM 0 HB3 GLU A 66 -8.137 10.620 -7.768 1.00 72.02 H new ATOM 0 HG2 GLU A 66 -10.282 10.875 -6.524 1.00 41.24 H new ATOM 0 HG3 GLU A 66 -9.714 12.383 -5.836 1.00 41.24 H new ATOM 949 N ILE A 67 -6.539 8.734 -6.844 1.00 74.12 N ATOM 950 CA ILE A 67 -5.458 8.105 -7.594 1.00 53.13 C ATOM 951 C ILE A 67 -5.683 8.361 -9.088 1.00 11.35 C ATOM 952 O ILE A 67 -6.747 8.827 -9.509 1.00 33.23 O ATOM 953 CB ILE A 67 -5.369 6.587 -7.303 1.00 64.04 C ATOM 954 CG1 ILE A 67 -6.730 5.905 -7.539 1.00 51.10 C ATOM 955 CG2 ILE A 67 -4.854 6.306 -5.890 1.00 30.24 C ATOM 956 CD1 ILE A 67 -6.615 4.386 -7.595 1.00 61.22 C ATOM 0 H ILE A 67 -7.443 8.290 -7.004 1.00 74.12 H new ATOM 0 HA ILE A 67 -4.509 8.542 -7.282 1.00 53.13 H new ATOM 0 HB ILE A 67 -4.646 6.163 -8.000 1.00 64.04 H new ATOM 0 HG12 ILE A 67 -7.418 6.186 -6.741 1.00 51.10 H new ATOM 0 HG13 ILE A 67 -7.159 6.269 -8.472 1.00 51.10 H new ATOM 0 HG21 ILE A 67 -4.807 5.229 -5.727 1.00 30.24 H new ATOM 0 HG22 ILE A 67 -3.858 6.734 -5.774 1.00 30.24 H new ATOM 0 HG23 ILE A 67 -5.529 6.754 -5.161 1.00 30.24 H new ATOM 0 HD11 ILE A 67 -7.601 3.952 -7.763 1.00 61.22 H new ATOM 0 HD12 ILE A 67 -5.950 4.101 -8.410 1.00 61.22 H new ATOM 0 HD13 ILE A 67 -6.212 4.017 -6.652 1.00 61.22 H new ATOM 967 N GLN A 68 -4.684 7.992 -9.883 1.00 52.52 N ATOM 968 CA GLN A 68 -4.745 7.777 -11.319 1.00 73.00 C ATOM 969 C GLN A 68 -3.833 6.579 -11.601 1.00 25.22 C ATOM 970 O GLN A 68 -2.801 6.445 -10.931 1.00 21.34 O ATOM 971 CB GLN A 68 -4.221 9.027 -12.035 1.00 50.13 C ATOM 972 CG GLN A 68 -5.224 10.178 -12.124 1.00 72.23 C ATOM 973 CD GLN A 68 -4.577 11.387 -12.789 1.00 74.04 C ATOM 974 OE1 GLN A 68 -4.432 11.452 -14.006 1.00 4.54 O ATOM 975 NE2 GLN A 68 -4.081 12.324 -12.006 1.00 61.21 N ATOM 0 H GLN A 68 -3.748 7.825 -9.513 1.00 52.52 H new ATOM 0 HA GLN A 68 -5.760 7.589 -11.668 1.00 73.00 H new ATOM 0 HB2 GLN A 68 -3.329 9.379 -11.517 1.00 50.13 H new ATOM 0 HB3 GLN A 68 -3.915 8.750 -13.044 1.00 50.13 H new ATOM 0 HG2 GLN A 68 -6.099 9.865 -12.694 1.00 72.23 H new ATOM 0 HG3 GLN A 68 -5.572 10.445 -11.126 1.00 72.23 H new ATOM 0 HE21 GLN A 68 -4.206 12.263 -10.995 1.00 61.21 H new ATOM 0 HE22 GLN A 68 -3.572 13.110 -12.411 1.00 61.21 H new ATOM 982 N LEU A 69 -4.201 5.716 -12.556 1.00 51.33 N ATOM 983 CA LEU A 69 -3.411 4.566 -13.006 1.00 34.04 C ATOM 984 C LEU A 69 -3.968 3.998 -14.325 1.00 65.20 C ATOM 985 O LEU A 69 -4.967 4.497 -14.845 1.00 13.43 O ATOM 986 CB LEU A 69 -3.300 3.479 -11.911 1.00 50.32 C ATOM 987 CG LEU A 69 -4.482 2.499 -11.788 1.00 71.34 C ATOM 988 CD1 LEU A 69 -4.204 1.504 -10.655 1.00 52.30 C ATOM 989 CD2 LEU A 69 -5.820 3.192 -11.509 1.00 63.23 C ATOM 0 H LEU A 69 -5.087 5.803 -13.053 1.00 51.33 H new ATOM 0 HA LEU A 69 -2.397 4.917 -13.200 1.00 34.04 H new ATOM 0 HB2 LEU A 69 -2.395 2.900 -12.097 1.00 50.32 H new ATOM 0 HB3 LEU A 69 -3.168 3.976 -10.950 1.00 50.32 H new ATOM 0 HG LEU A 69 -4.568 1.996 -12.751 1.00 71.34 H new ATOM 0 HD11 LEU A 69 -5.040 0.810 -10.567 1.00 52.30 H new ATOM 0 HD12 LEU A 69 -3.292 0.948 -10.874 1.00 52.30 H new ATOM 0 HD13 LEU A 69 -4.082 2.046 -9.717 1.00 52.30 H new ATOM 0 HD21 LEU A 69 -6.609 2.443 -11.434 1.00 63.23 H new ATOM 0 HD22 LEU A 69 -5.755 3.745 -10.572 1.00 63.23 H new ATOM 0 HD23 LEU A 69 -6.049 3.881 -12.322 1.00 63.23 H new ATOM 1000 N ASP A 70 -3.293 2.973 -14.855 1.00 34.34 N ATOM 1001 CA ASP A 70 -3.566 2.207 -16.084 1.00 14.21 C ATOM 1002 C ASP A 70 -4.759 1.246 -15.941 1.00 62.24 C ATOM 1003 O ASP A 70 -5.399 1.178 -14.888 1.00 45.12 O ATOM 1004 CB ASP A 70 -2.292 1.418 -16.416 1.00 12.24 C ATOM 1005 CG ASP A 70 -2.021 1.152 -17.902 1.00 51.21 C ATOM 1006 OD1 ASP A 70 -2.949 0.848 -18.682 1.00 62.32 O ATOM 1007 OD2 ASP A 70 -0.818 1.131 -18.255 1.00 23.21 O ATOM 0 H ASP A 70 -2.457 2.621 -14.390 1.00 34.34 H new ATOM 0 HA ASP A 70 -3.835 2.901 -16.881 1.00 14.21 H new ATOM 0 HB2 ASP A 70 -1.439 1.958 -16.005 1.00 12.24 H new ATOM 0 HB3 ASP A 70 -2.340 0.459 -15.901 1.00 12.24 H new ATOM 1011 N ASN A 71 -5.062 0.466 -16.981 1.00 73.34 N ATOM 1012 CA ASN A 71 -5.912 -0.709 -16.925 1.00 71.22 C ATOM 1013 C ASN A 71 -5.140 -1.832 -16.227 1.00 3.34 C ATOM 1014 O ASN A 71 -4.410 -2.608 -16.847 1.00 71.00 O ATOM 1015 CB ASN A 71 -6.348 -1.114 -18.343 1.00 71.41 C ATOM 1016 CG ASN A 71 -7.809 -0.808 -18.629 1.00 22.31 C ATOM 1017 OD1 ASN A 71 -8.116 -0.091 -19.580 1.00 31.44 O ATOM 1018 ND2 ASN A 71 -8.736 -1.308 -17.829 1.00 42.34 N ATOM 0 H ASN A 71 -4.704 0.649 -17.919 1.00 73.34 H new ATOM 0 HA ASN A 71 -6.819 -0.499 -16.358 1.00 71.22 H new ATOM 0 HB2 ASN A 71 -5.725 -0.594 -19.070 1.00 71.41 H new ATOM 0 HB3 ASN A 71 -6.173 -2.181 -18.479 1.00 71.41 H new ATOM 0 HD21 ASN A 71 -9.720 -1.100 -17.997 1.00 42.34 H new ATOM 0 HD22 ASN A 71 -8.466 -1.901 -17.044 1.00 42.34 H new ATOM 1024 N ILE A 72 -5.264 -1.884 -14.908 1.00 22.04 N ATOM 1025 CA ILE A 72 -4.760 -2.945 -14.043 1.00 10.53 C ATOM 1026 C ILE A 72 -5.989 -3.569 -13.386 1.00 62.10 C ATOM 1027 O ILE A 72 -6.977 -2.869 -13.155 1.00 53.11 O ATOM 1028 CB ILE A 72 -3.784 -2.320 -13.026 1.00 1.52 C ATOM 1029 CG1 ILE A 72 -2.612 -1.624 -13.754 1.00 71.01 C ATOM 1030 CG2 ILE A 72 -3.230 -3.331 -12.010 1.00 25.33 C ATOM 1031 CD1 ILE A 72 -2.156 -0.359 -13.024 1.00 3.32 C ATOM 0 H ILE A 72 -5.743 -1.151 -14.385 1.00 22.04 H new ATOM 0 HA ILE A 72 -4.207 -3.719 -14.574 1.00 10.53 H new ATOM 0 HB ILE A 72 -4.365 -1.588 -12.465 1.00 1.52 H new ATOM 0 HG12 ILE A 72 -1.774 -2.316 -13.838 1.00 71.01 H new ATOM 0 HG13 ILE A 72 -2.916 -1.368 -14.769 1.00 71.01 H new ATOM 0 HG21 ILE A 72 -2.551 -2.824 -11.325 1.00 25.33 H new ATOM 0 HG22 ILE A 72 -4.054 -3.769 -11.446 1.00 25.33 H new ATOM 0 HG23 ILE A 72 -2.692 -4.119 -12.537 1.00 25.33 H new ATOM 0 HD11 ILE A 72 -1.331 0.099 -13.570 1.00 3.32 H new ATOM 0 HD12 ILE A 72 -2.986 0.345 -12.963 1.00 3.32 H new ATOM 0 HD13 ILE A 72 -1.826 -0.618 -12.018 1.00 3.32 H new ATOM 1042 N ASP A 73 -5.955 -4.869 -13.093 1.00 63.42 N ATOM 1043 CA ASP A 73 -7.067 -5.579 -12.472 1.00 52.11 C ATOM 1044 C ASP A 73 -6.522 -6.478 -11.365 1.00 61.24 C ATOM 1045 O ASP A 73 -5.849 -7.476 -11.627 1.00 45.55 O ATOM 1046 CB ASP A 73 -7.860 -6.355 -13.527 1.00 24.32 C ATOM 1047 CG ASP A 73 -9.064 -7.028 -12.879 1.00 44.42 C ATOM 1048 OD1 ASP A 73 -9.889 -6.315 -12.249 1.00 3.12 O ATOM 1049 OD2 ASP A 73 -9.196 -8.262 -12.967 1.00 11.31 O ATOM 0 H ASP A 73 -5.147 -5.462 -13.283 1.00 63.42 H new ATOM 0 HA ASP A 73 -7.764 -4.873 -12.020 1.00 52.11 H new ATOM 0 HB2 ASP A 73 -8.191 -5.679 -14.316 1.00 24.32 H new ATOM 0 HB3 ASP A 73 -7.222 -7.104 -13.996 1.00 24.32 H new ATOM 1053 N TYR A 74 -6.725 -6.063 -10.111 1.00 65.02 N ATOM 1054 CA TYR A 74 -6.091 -6.647 -8.926 1.00 50.52 C ATOM 1055 C TYR A 74 -6.365 -8.142 -8.738 1.00 21.30 C ATOM 1056 O TYR A 74 -5.565 -8.817 -8.092 1.00 72.21 O ATOM 1057 CB TYR A 74 -6.527 -5.878 -7.672 1.00 71.24 C ATOM 1058 CG TYR A 74 -6.323 -4.379 -7.766 1.00 64.10 C ATOM 1059 CD1 TYR A 74 -5.028 -3.842 -7.921 1.00 72.20 C ATOM 1060 CD2 TYR A 74 -7.440 -3.526 -7.751 1.00 14.52 C ATOM 1061 CE1 TYR A 74 -4.858 -2.457 -8.105 1.00 63.32 C ATOM 1062 CE2 TYR A 74 -7.272 -2.145 -7.912 1.00 14.23 C ATOM 1063 CZ TYR A 74 -5.986 -1.608 -8.127 1.00 42.21 C ATOM 1064 OH TYR A 74 -5.849 -0.289 -8.414 1.00 41.44 O ATOM 0 H TYR A 74 -7.352 -5.290 -9.886 1.00 65.02 H new ATOM 0 HA TYR A 74 -5.016 -6.555 -9.084 1.00 50.52 H new ATOM 0 HB2 TYR A 74 -7.581 -6.080 -7.483 1.00 71.24 H new ATOM 0 HB3 TYR A 74 -5.971 -6.257 -6.814 1.00 71.24 H new ATOM 0 HD1 TYR A 74 -4.167 -4.494 -7.898 1.00 72.20 H new ATOM 0 HD2 TYR A 74 -8.430 -3.936 -7.615 1.00 14.52 H new ATOM 0 HE1 TYR A 74 -3.868 -2.045 -8.229 1.00 63.32 H new ATOM 0 HE2 TYR A 74 -8.130 -1.490 -7.871 1.00 14.23 H new ATOM 0 HH TYR A 74 -6.727 0.145 -8.386 1.00 41.44 H new ATOM 1073 N ASN A 75 -7.447 -8.685 -9.302 1.00 2.34 N ATOM 1074 CA ASN A 75 -7.748 -10.120 -9.291 1.00 62.14 C ATOM 1075 C ASN A 75 -6.573 -10.950 -9.786 1.00 4.20 C ATOM 1076 O ASN A 75 -6.355 -12.069 -9.320 1.00 70.35 O ATOM 1077 CB ASN A 75 -8.960 -10.425 -10.196 1.00 14.20 C ATOM 1078 CG ASN A 75 -10.240 -10.622 -9.423 1.00 51.51 C ATOM 1079 OD1 ASN A 75 -10.735 -11.739 -9.288 1.00 52.25 O ATOM 1080 ND2 ASN A 75 -10.810 -9.549 -8.914 1.00 14.12 N ATOM 0 H ASN A 75 -8.151 -8.130 -9.788 1.00 2.34 H new ATOM 0 HA ASN A 75 -7.964 -10.385 -8.256 1.00 62.14 H new ATOM 0 HB2 ASN A 75 -9.092 -9.607 -10.904 1.00 14.20 H new ATOM 0 HB3 ASN A 75 -8.753 -11.322 -10.780 1.00 14.20 H new ATOM 0 HD21 ASN A 75 -11.683 -9.634 -8.393 1.00 14.12 H new ATOM 0 HD22 ASN A 75 -10.378 -8.634 -9.041 1.00 14.12 H new ATOM 1086 N ASN A 76 -5.821 -10.409 -10.743 1.00 2.12 N ATOM 1087 CA ASN A 76 -4.773 -11.133 -11.440 1.00 72.44 C ATOM 1088 C ASN A 76 -3.470 -11.195 -10.650 1.00 11.54 C ATOM 1089 O ASN A 76 -2.514 -11.775 -11.166 1.00 32.12 O ATOM 1090 CB ASN A 76 -4.572 -10.515 -12.830 1.00 70.24 C ATOM 1091 CG ASN A 76 -5.825 -10.663 -13.663 1.00 53.52 C ATOM 1092 OD1 ASN A 76 -6.453 -11.720 -13.700 1.00 64.43 O ATOM 1093 ND2 ASN A 76 -6.212 -9.639 -14.384 1.00 25.13 N ATOM 0 H ASN A 76 -5.928 -9.444 -11.056 1.00 2.12 H new ATOM 0 HA ASN A 76 -5.091 -12.170 -11.551 1.00 72.44 H new ATOM 0 HB2 ASN A 76 -4.316 -9.460 -12.732 1.00 70.24 H new ATOM 0 HB3 ASN A 76 -3.735 -11.000 -13.332 1.00 70.24 H new ATOM 0 HD21 ASN A 76 -7.037 -9.717 -14.979 1.00 25.13 H new ATOM 0 HD22 ASN A 76 -5.688 -8.764 -14.350 1.00 25.13 H new ATOM 1099 N TYR A 77 -3.402 -10.648 -9.432 1.00 71.05 N ATOM 1100 CA TYR A 77 -2.172 -10.626 -8.649 1.00 53.31 C ATOM 1101 C TYR A 77 -2.426 -11.246 -7.283 1.00 73.15 C ATOM 1102 O TYR A 77 -3.176 -10.712 -6.470 1.00 74.35 O ATOM 1103 CB TYR A 77 -1.575 -9.215 -8.606 1.00 14.50 C ATOM 1104 CG TYR A 77 -1.136 -8.722 -9.975 1.00 1.30 C ATOM 1105 CD1 TYR A 77 0.042 -9.231 -10.556 1.00 41.44 C ATOM 1106 CD2 TYR A 77 -1.926 -7.804 -10.699 1.00 70.35 C ATOM 1107 CE1 TYR A 77 0.432 -8.831 -11.844 1.00 53.34 C ATOM 1108 CE2 TYR A 77 -1.529 -7.382 -11.983 1.00 63.45 C ATOM 1109 CZ TYR A 77 -0.348 -7.899 -12.564 1.00 11.20 C ATOM 1110 OH TYR A 77 0.017 -7.527 -13.822 1.00 41.32 O ATOM 0 H TYR A 77 -4.197 -10.211 -8.967 1.00 71.05 H new ATOM 0 HA TYR A 77 -1.408 -11.239 -9.128 1.00 53.31 H new ATOM 0 HB2 TYR A 77 -2.312 -8.525 -8.195 1.00 14.50 H new ATOM 0 HB3 TYR A 77 -0.720 -9.207 -7.930 1.00 14.50 H new ATOM 0 HD1 TYR A 77 0.650 -9.934 -10.006 1.00 41.44 H new ATOM 0 HD2 TYR A 77 -2.839 -7.423 -10.267 1.00 70.35 H new ATOM 0 HE1 TYR A 77 1.330 -9.237 -12.285 1.00 53.34 H new ATOM 0 HE2 TYR A 77 -2.127 -6.663 -12.524 1.00 63.45 H new ATOM 0 HH TYR A 77 -0.630 -6.880 -14.173 1.00 41.32 H new ATOM 1119 N ASP A 78 -1.817 -12.409 -7.049 1.00 51.52 N ATOM 1120 CA ASP A 78 -1.980 -13.185 -5.815 1.00 4.22 C ATOM 1121 C ASP A 78 -1.265 -12.519 -4.635 1.00 5.34 C ATOM 1122 O ASP A 78 -1.489 -12.866 -3.481 1.00 62.01 O ATOM 1123 CB ASP A 78 -1.443 -14.607 -6.027 1.00 34.21 C ATOM 1124 CG ASP A 78 -2.231 -15.644 -5.228 1.00 64.43 C ATOM 1125 OD1 ASP A 78 -3.319 -16.038 -5.705 1.00 21.44 O ATOM 1126 OD2 ASP A 78 -1.745 -16.184 -4.213 1.00 34.21 O ATOM 0 H ASP A 78 -1.186 -12.847 -7.721 1.00 51.52 H new ATOM 0 HA ASP A 78 -3.042 -13.228 -5.575 1.00 4.22 H new ATOM 0 HB2 ASP A 78 -1.487 -14.857 -7.087 1.00 34.21 H new ATOM 0 HB3 ASP A 78 -0.394 -14.645 -5.734 1.00 34.21 H new ATOM 1130 N LEU A 79 -0.418 -11.528 -4.909 1.00 22.10 N ATOM 1131 CA LEU A 79 0.374 -10.809 -3.931 1.00 34.22 C ATOM 1132 C LEU A 79 0.428 -9.357 -4.400 1.00 45.25 C ATOM 1133 O LEU A 79 0.768 -9.110 -5.560 1.00 34.41 O ATOM 1134 CB LEU A 79 1.786 -11.421 -3.909 1.00 43.24 C ATOM 1135 CG LEU A 79 2.489 -11.562 -2.553 1.00 5.30 C ATOM 1136 CD1 LEU A 79 2.089 -10.526 -1.498 1.00 52.15 C ATOM 1137 CD2 LEU A 79 2.333 -12.986 -2.013 1.00 42.24 C ATOM 0 H LEU A 79 -0.264 -11.196 -5.861 1.00 22.10 H new ATOM 0 HA LEU A 79 -0.047 -10.868 -2.928 1.00 34.22 H new ATOM 0 HB2 LEU A 79 1.727 -12.412 -4.359 1.00 43.24 H new ATOM 0 HB3 LEU A 79 2.423 -10.815 -4.554 1.00 43.24 H new ATOM 0 HG LEU A 79 3.540 -11.355 -2.754 1.00 5.30 H new ATOM 0 HD11 LEU A 79 2.641 -10.713 -0.577 1.00 52.15 H new ATOM 0 HD12 LEU A 79 2.321 -9.526 -1.864 1.00 52.15 H new ATOM 0 HD13 LEU A 79 1.020 -10.601 -1.301 1.00 52.15 H new ATOM 0 HD21 LEU A 79 2.838 -13.067 -1.050 1.00 42.24 H new ATOM 0 HD22 LEU A 79 1.274 -13.214 -1.888 1.00 42.24 H new ATOM 0 HD23 LEU A 79 2.775 -13.692 -2.716 1.00 42.24 H new ATOM 1148 N ILE A 80 0.088 -8.393 -3.551 1.00 21.13 N ATOM 1149 CA ILE A 80 -0.004 -6.987 -3.948 1.00 64.24 C ATOM 1150 C ILE A 80 0.743 -6.165 -2.904 1.00 54.32 C ATOM 1151 O ILE A 80 0.367 -6.131 -1.732 1.00 13.13 O ATOM 1152 CB ILE A 80 -1.484 -6.587 -4.162 1.00 65.32 C ATOM 1153 CG1 ILE A 80 -2.081 -7.435 -5.311 1.00 51.51 C ATOM 1154 CG2 ILE A 80 -1.596 -5.098 -4.505 1.00 52.11 C ATOM 1155 CD1 ILE A 80 -3.508 -7.077 -5.735 1.00 13.11 C ATOM 0 H ILE A 80 -0.132 -8.561 -2.569 1.00 21.13 H new ATOM 0 HA ILE A 80 0.470 -6.795 -4.910 1.00 64.24 H new ATOM 0 HB ILE A 80 -2.037 -6.771 -3.241 1.00 65.32 H new ATOM 0 HG12 ILE A 80 -1.430 -7.343 -6.181 1.00 51.51 H new ATOM 0 HG13 ILE A 80 -2.064 -8.483 -5.010 1.00 51.51 H new ATOM 0 HG21 ILE A 80 -2.644 -4.836 -4.652 1.00 52.11 H new ATOM 0 HG22 ILE A 80 -1.185 -4.505 -3.688 1.00 52.11 H new ATOM 0 HG23 ILE A 80 -1.039 -4.892 -5.419 1.00 52.11 H new ATOM 0 HD11 ILE A 80 -3.822 -7.734 -6.546 1.00 13.11 H new ATOM 0 HD12 ILE A 80 -4.181 -7.199 -4.887 1.00 13.11 H new ATOM 0 HD13 ILE A 80 -3.538 -6.042 -6.075 1.00 13.11 H new ATOM 1166 N LEU A 81 1.851 -5.550 -3.319 1.00 45.42 N ATOM 1167 CA LEU A 81 2.818 -4.919 -2.426 1.00 41.24 C ATOM 1168 C LEU A 81 2.936 -3.444 -2.784 1.00 64.10 C ATOM 1169 O LEU A 81 2.705 -3.043 -3.932 1.00 73.43 O ATOM 1170 CB LEU A 81 4.162 -5.674 -2.478 1.00 52.32 C ATOM 1171 CG LEU A 81 4.017 -7.150 -2.035 1.00 54.12 C ATOM 1172 CD1 LEU A 81 5.250 -7.993 -2.333 1.00 11.40 C ATOM 1173 CD2 LEU A 81 3.756 -7.240 -0.540 1.00 44.12 C ATOM 0 H LEU A 81 2.104 -5.476 -4.304 1.00 45.42 H new ATOM 0 HA LEU A 81 2.481 -4.974 -1.391 1.00 41.24 H new ATOM 0 HB2 LEU A 81 4.559 -5.638 -3.492 1.00 52.32 H new ATOM 0 HB3 LEU A 81 4.885 -5.172 -1.835 1.00 52.32 H new ATOM 0 HG LEU A 81 3.178 -7.541 -2.610 1.00 54.12 H new ATOM 0 HD11 LEU A 81 5.081 -9.016 -1.997 1.00 11.40 H new ATOM 0 HD12 LEU A 81 5.442 -7.990 -3.406 1.00 11.40 H new ATOM 0 HD13 LEU A 81 6.111 -7.577 -1.809 1.00 11.40 H new ATOM 0 HD21 LEU A 81 3.657 -8.286 -0.250 1.00 44.12 H new ATOM 0 HD22 LEU A 81 4.588 -6.790 0.002 1.00 44.12 H new ATOM 0 HD23 LEU A 81 2.836 -6.708 -0.299 1.00 44.12 H new ATOM 1184 N ILE A 82 3.205 -2.615 -1.776 1.00 22.13 N ATOM 1185 CA ILE A 82 2.946 -1.181 -1.829 1.00 13.34 C ATOM 1186 C ILE A 82 4.041 -0.463 -1.046 1.00 32.25 C ATOM 1187 O ILE A 82 4.492 -1.009 -0.045 1.00 63.01 O ATOM 1188 CB ILE A 82 1.564 -0.868 -1.188 1.00 34.25 C ATOM 1189 CG1 ILE A 82 0.438 -1.890 -1.496 1.00 64.24 C ATOM 1190 CG2 ILE A 82 1.161 0.542 -1.651 1.00 61.34 C ATOM 1191 CD1 ILE A 82 -0.858 -1.683 -0.700 1.00 71.20 C ATOM 0 H ILE A 82 3.612 -2.925 -0.894 1.00 22.13 H new ATOM 0 HA ILE A 82 2.939 -0.845 -2.866 1.00 13.34 H new ATOM 0 HB ILE A 82 1.682 -0.936 -0.106 1.00 34.25 H new ATOM 0 HG12 ILE A 82 0.205 -1.843 -2.560 1.00 64.24 H new ATOM 0 HG13 ILE A 82 0.814 -2.894 -1.296 1.00 64.24 H new ATOM 0 HG21 ILE A 82 0.193 0.803 -1.223 1.00 61.34 H new ATOM 0 HG22 ILE A 82 1.910 1.262 -1.320 1.00 61.34 H new ATOM 0 HG23 ILE A 82 1.094 0.562 -2.739 1.00 61.34 H new ATOM 0 HD11 ILE A 82 -1.585 -2.444 -0.983 1.00 71.20 H new ATOM 0 HD12 ILE A 82 -0.647 -1.762 0.366 1.00 71.20 H new ATOM 0 HD13 ILE A 82 -1.264 -0.695 -0.917 1.00 71.20 H new ATOM 1202 N GLY A 83 4.408 0.774 -1.396 1.00 65.43 N ATOM 1203 CA GLY A 83 5.241 1.593 -0.527 1.00 65.34 C ATOM 1204 C GLY A 83 4.869 3.071 -0.568 1.00 25.02 C ATOM 1205 O GLY A 83 4.168 3.524 -1.474 1.00 12.25 O ATOM 0 H GLY A 83 4.140 1.223 -2.272 1.00 65.43 H new ATOM 0 HA2 GLY A 83 5.155 1.230 0.497 1.00 65.34 H new ATOM 0 HA3 GLY A 83 6.285 1.478 -0.819 1.00 65.34 H new ATOM 1209 N SER A 84 5.327 3.822 0.439 1.00 70.21 N ATOM 1210 CA SER A 84 4.970 5.218 0.698 1.00 62.34 C ATOM 1211 C SER A 84 6.042 5.819 1.641 1.00 12.24 C ATOM 1212 O SER A 84 6.768 5.042 2.275 1.00 54.52 O ATOM 1213 CB SER A 84 3.565 5.144 1.353 1.00 70.32 C ATOM 1214 OG SER A 84 2.847 6.353 1.542 1.00 63.41 O ATOM 0 H SER A 84 5.986 3.455 1.126 1.00 70.21 H new ATOM 0 HA SER A 84 4.938 5.854 -0.187 1.00 62.34 H new ATOM 0 HB2 SER A 84 2.949 4.483 0.744 1.00 70.32 H new ATOM 0 HB3 SER A 84 3.677 4.668 2.327 1.00 70.32 H new ATOM 0 HG SER A 84 1.983 6.158 1.961 1.00 63.41 H new ATOM 1219 N PRO A 85 6.212 7.153 1.749 1.00 62.34 N ATOM 1220 CA PRO A 85 7.188 7.763 2.662 1.00 14.25 C ATOM 1221 C PRO A 85 6.673 7.759 4.108 1.00 5.23 C ATOM 1222 O PRO A 85 5.466 7.633 4.323 1.00 50.11 O ATOM 1223 CB PRO A 85 7.352 9.197 2.156 1.00 32.11 C ATOM 1224 CG PRO A 85 5.971 9.523 1.593 1.00 1.55 C ATOM 1225 CD PRO A 85 5.510 8.191 1.001 1.00 25.45 C ATOM 0 HA PRO A 85 8.130 7.215 2.673 1.00 14.25 H new ATOM 0 HB2 PRO A 85 7.632 9.879 2.959 1.00 32.11 H new ATOM 0 HB3 PRO A 85 8.126 9.269 1.392 1.00 32.11 H new ATOM 0 HG2 PRO A 85 5.292 9.874 2.370 1.00 1.55 H new ATOM 0 HG3 PRO A 85 6.020 10.305 0.835 1.00 1.55 H new ATOM 0 HD2 PRO A 85 4.430 8.076 1.094 1.00 25.45 H new ATOM 0 HD3 PRO A 85 5.747 8.134 -0.061 1.00 25.45 H new ATOM 1230 N VAL A 86 7.555 7.935 5.100 1.00 71.12 N ATOM 1231 CA VAL A 86 7.178 7.961 6.517 1.00 62.02 C ATOM 1232 C VAL A 86 8.095 8.920 7.267 1.00 52.52 C ATOM 1233 O VAL A 86 9.282 8.634 7.462 1.00 21.11 O ATOM 1234 CB VAL A 86 7.226 6.574 7.202 1.00 41.23 C ATOM 1235 CG1 VAL A 86 6.464 6.564 8.549 1.00 3.32 C ATOM 1236 CG2 VAL A 86 6.718 5.447 6.311 1.00 70.13 C ATOM 0 H VAL A 86 8.554 8.064 4.940 1.00 71.12 H new ATOM 0 HA VAL A 86 6.140 8.293 6.554 1.00 62.02 H new ATOM 0 HB VAL A 86 8.283 6.389 7.396 1.00 41.23 H new ATOM 0 HG11 VAL A 86 6.524 5.571 8.994 1.00 3.32 H new ATOM 0 HG12 VAL A 86 6.911 7.292 9.225 1.00 3.32 H new ATOM 0 HG13 VAL A 86 5.419 6.822 8.378 1.00 3.32 H new ATOM 0 HG21 VAL A 86 6.778 4.502 6.850 1.00 70.13 H new ATOM 0 HG22 VAL A 86 5.682 5.641 6.034 1.00 70.13 H new ATOM 0 HG23 VAL A 86 7.330 5.391 5.411 1.00 70.13 H new ATOM 1246 N TRP A 87 7.551 10.044 7.733 1.00 4.22 N ATOM 1247 CA TRP A 87 8.349 10.974 8.525 1.00 31.44 C ATOM 1248 C TRP A 87 7.563 11.673 9.638 1.00 51.32 C ATOM 1249 O TRP A 87 8.162 12.335 10.481 1.00 71.33 O ATOM 1250 CB TRP A 87 9.072 11.908 7.546 1.00 4.33 C ATOM 1251 CG TRP A 87 10.319 12.579 8.046 1.00 71.33 C ATOM 1252 CD1 TRP A 87 11.570 12.082 7.921 1.00 52.51 C ATOM 1253 CD2 TRP A 87 10.472 13.868 8.722 1.00 42.34 C ATOM 1254 NE1 TRP A 87 12.477 12.967 8.468 1.00 12.33 N ATOM 1255 CE2 TRP A 87 11.858 14.094 8.962 1.00 1.54 C ATOM 1256 CE3 TRP A 87 9.587 14.870 9.171 1.00 14.31 C ATOM 1257 CZ2 TRP A 87 12.331 15.248 9.604 1.00 54.34 C ATOM 1258 CZ3 TRP A 87 10.045 16.024 9.832 1.00 64.43 C ATOM 1259 CH2 TRP A 87 11.418 16.215 10.050 1.00 33.13 C ATOM 0 H TRP A 87 6.583 10.327 7.580 1.00 4.22 H new ATOM 0 HA TRP A 87 9.097 10.430 9.102 1.00 31.44 H new ATOM 0 HB2 TRP A 87 9.329 11.334 6.656 1.00 4.33 H new ATOM 0 HB3 TRP A 87 8.371 12.682 7.235 1.00 4.33 H new ATOM 0 HD1 TRP A 87 11.821 11.137 7.463 1.00 52.51 H new ATOM 0 HE1 TRP A 87 13.484 12.806 8.502 1.00 12.33 H new ATOM 0 HE3 TRP A 87 8.527 14.748 9.002 1.00 14.31 H new ATOM 0 HZ2 TRP A 87 13.391 15.391 9.754 1.00 54.34 H new ATOM 0 HZ3 TRP A 87 9.338 16.766 10.173 1.00 64.43 H new ATOM 0 HH2 TRP A 87 11.770 17.101 10.558 1.00 33.13 H new ATOM 1269 N SER A 88 6.242 11.486 9.725 1.00 72.24 N ATOM 1270 CA SER A 88 5.429 11.952 10.845 1.00 74.42 C ATOM 1271 C SER A 88 4.161 11.084 10.925 1.00 74.43 C ATOM 1272 O SER A 88 3.063 11.569 10.652 1.00 10.13 O ATOM 1273 CB SER A 88 5.095 13.450 10.681 1.00 25.15 C ATOM 1274 OG SER A 88 6.232 14.242 10.365 1.00 2.14 O ATOM 0 H SER A 88 5.703 11.000 9.008 1.00 72.24 H new ATOM 0 HA SER A 88 5.980 11.853 11.780 1.00 74.42 H new ATOM 0 HB2 SER A 88 4.349 13.566 9.895 1.00 25.15 H new ATOM 0 HB3 SER A 88 4.647 13.820 11.603 1.00 25.15 H new ATOM 0 HG SER A 88 5.962 15.179 10.271 1.00 2.14 H new ATOM 1279 N GLY A 89 4.314 9.791 11.231 1.00 32.25 N ATOM 1280 CA GLY A 89 3.303 8.722 11.257 1.00 21.22 C ATOM 1281 C GLY A 89 2.640 8.379 9.911 1.00 3.21 C ATOM 1282 O GLY A 89 2.602 7.210 9.521 1.00 72.30 O ATOM 0 H GLY A 89 5.232 9.431 11.491 1.00 32.25 H new ATOM 0 HA2 GLY A 89 3.770 7.818 11.649 1.00 21.22 H new ATOM 0 HA3 GLY A 89 2.521 9.007 11.961 1.00 21.22 H new ATOM 1286 N TYR A 90 2.197 9.398 9.177 1.00 74.23 N ATOM 1287 CA TYR A 90 1.299 9.435 8.032 1.00 70.33 C ATOM 1288 C TYR A 90 1.316 10.852 7.386 1.00 70.30 C ATOM 1289 O TYR A 90 0.326 11.566 7.457 1.00 4.14 O ATOM 1290 CB TYR A 90 -0.101 8.956 8.499 1.00 50.20 C ATOM 1291 CG TYR A 90 -0.605 9.370 9.890 1.00 30.25 C ATOM 1292 CD1 TYR A 90 -0.268 10.613 10.469 1.00 62.14 C ATOM 1293 CD2 TYR A 90 -1.432 8.490 10.619 1.00 23.43 C ATOM 1294 CE1 TYR A 90 -0.751 10.973 11.738 1.00 61.03 C ATOM 1295 CE2 TYR A 90 -1.903 8.834 11.902 1.00 23.31 C ATOM 1296 CZ TYR A 90 -1.562 10.081 12.470 1.00 4.31 C ATOM 1297 OH TYR A 90 -1.984 10.443 13.713 1.00 74.12 O ATOM 0 H TYR A 90 2.504 10.343 9.407 1.00 74.23 H new ATOM 0 HA TYR A 90 1.622 8.758 7.241 1.00 70.33 H new ATOM 0 HB2 TYR A 90 -0.829 9.306 7.768 1.00 50.20 H new ATOM 0 HB3 TYR A 90 -0.107 7.867 8.458 1.00 50.20 H new ATOM 0 HD1 TYR A 90 0.370 11.297 9.929 1.00 62.14 H new ATOM 0 HD2 TYR A 90 -1.708 7.539 10.188 1.00 23.43 H new ATOM 0 HE1 TYR A 90 -0.500 11.937 12.155 1.00 61.03 H new ATOM 0 HE2 TYR A 90 -2.525 8.143 12.451 1.00 23.31 H new ATOM 0 HH TYR A 90 -2.535 9.727 14.093 1.00 74.12 H new ATOM 1306 N PRO A 91 2.420 11.333 6.775 1.00 11.15 N ATOM 1307 CA PRO A 91 2.468 12.612 6.075 1.00 71.22 C ATOM 1308 C PRO A 91 1.792 12.535 4.702 1.00 62.13 C ATOM 1309 O PRO A 91 1.361 13.547 4.156 1.00 14.52 O ATOM 1310 CB PRO A 91 3.946 12.954 5.906 1.00 70.42 C ATOM 1311 CG PRO A 91 4.596 11.583 5.813 1.00 64.21 C ATOM 1312 CD PRO A 91 3.747 10.784 6.791 1.00 71.14 C ATOM 0 HA PRO A 91 1.934 13.372 6.645 1.00 71.22 H new ATOM 0 HB2 PRO A 91 4.124 13.549 5.010 1.00 70.42 H new ATOM 0 HB3 PRO A 91 4.328 13.527 6.750 1.00 70.42 H new ATOM 0 HG2 PRO A 91 4.553 11.175 4.803 1.00 64.21 H new ATOM 0 HG3 PRO A 91 5.646 11.605 6.103 1.00 64.21 H new ATOM 0 HD2 PRO A 91 3.728 9.732 6.508 1.00 71.14 H new ATOM 0 HD3 PRO A 91 4.170 10.837 7.794 1.00 71.14 H new ATOM 1317 N ALA A 92 1.732 11.339 4.117 1.00 14.32 N ATOM 1318 CA ALA A 92 1.099 11.091 2.845 1.00 45.44 C ATOM 1319 C ALA A 92 -0.159 10.288 3.137 1.00 45.40 C ATOM 1320 O ALA A 92 -0.157 9.458 4.053 1.00 13.12 O ATOM 1321 CB ALA A 92 2.080 10.308 1.950 1.00 41.34 C ATOM 0 H ALA A 92 2.136 10.501 4.535 1.00 14.32 H new ATOM 0 HA ALA A 92 0.835 12.009 2.321 1.00 45.44 H new ATOM 0 HB1 ALA A 92 1.615 10.113 0.984 1.00 41.34 H new ATOM 0 HB2 ALA A 92 2.987 10.895 1.804 1.00 41.34 H new ATOM 0 HB3 ALA A 92 2.333 9.362 2.428 1.00 41.34 H new ATOM 1327 N THR A 93 -1.150 10.388 2.253 1.00 53.21 N ATOM 1328 CA THR A 93 -2.293 9.491 2.282 1.00 30.04 C ATOM 1329 C THR A 93 -2.601 8.960 0.871 1.00 30.03 C ATOM 1330 O THR A 93 -3.740 9.050 0.410 1.00 1.14 O ATOM 1331 CB THR A 93 -3.497 10.232 2.883 1.00 21.11 C ATOM 1332 OG1 THR A 93 -3.840 11.347 2.087 1.00 71.13 O ATOM 1333 CG2 THR A 93 -3.214 10.783 4.285 1.00 12.45 C ATOM 0 H THR A 93 -1.180 11.084 1.508 1.00 53.21 H new ATOM 0 HA THR A 93 -2.067 8.627 2.907 1.00 30.04 H new ATOM 0 HB THR A 93 -4.299 9.495 2.927 1.00 21.11 H new ATOM 0 HG1 THR A 93 -4.698 11.712 2.388 1.00 71.13 H new ATOM 0 HG21 THR A 93 -4.099 11.296 4.660 1.00 12.45 H new ATOM 0 HG22 THR A 93 -2.960 9.961 4.955 1.00 12.45 H new ATOM 0 HG23 THR A 93 -2.380 11.484 4.239 1.00 12.45 H new ATOM 1341 N PRO A 94 -1.615 8.374 0.163 1.00 31.31 N ATOM 1342 CA PRO A 94 -1.810 7.831 -1.169 1.00 12.51 C ATOM 1343 C PRO A 94 -2.260 6.375 -1.169 1.00 23.45 C ATOM 1344 O PRO A 94 -2.648 5.862 -2.222 1.00 61.00 O ATOM 1345 CB PRO A 94 -0.435 7.958 -1.845 1.00 42.31 C ATOM 1346 CG PRO A 94 0.521 7.756 -0.673 1.00 53.33 C ATOM 1347 CD PRO A 94 -0.197 8.483 0.428 1.00 10.33 C ATOM 0 HA PRO A 94 -2.603 8.371 -1.686 1.00 12.51 H new ATOM 0 HB2 PRO A 94 -0.292 7.206 -2.621 1.00 42.31 H new ATOM 0 HB3 PRO A 94 -0.301 8.932 -2.316 1.00 42.31 H new ATOM 0 HG2 PRO A 94 0.668 6.701 -0.440 1.00 53.33 H new ATOM 0 HG3 PRO A 94 1.506 8.179 -0.870 1.00 53.33 H new ATOM 0 HD2 PRO A 94 0.047 8.049 1.398 1.00 10.33 H new ATOM 0 HD3 PRO A 94 0.108 9.529 0.461 1.00 10.33 H new ATOM 1352 N ILE A 95 -2.186 5.691 -0.029 1.00 4.24 N ATOM 1353 CA ILE A 95 -2.551 4.289 0.092 1.00 11.13 C ATOM 1354 C ILE A 95 -3.808 4.211 0.970 1.00 64.44 C ATOM 1355 O ILE A 95 -3.832 3.563 2.015 1.00 14.41 O ATOM 1356 CB ILE A 95 -1.361 3.455 0.608 1.00 1.14 C ATOM 1357 CG1 ILE A 95 0.053 3.853 0.103 1.00 41.41 C ATOM 1358 CG2 ILE A 95 -1.630 1.969 0.326 1.00 23.42 C ATOM 1359 CD1 ILE A 95 0.285 4.007 -1.414 1.00 50.53 C ATOM 0 H ILE A 95 -1.866 6.105 0.847 1.00 4.24 H new ATOM 0 HA ILE A 95 -2.791 3.850 -0.877 1.00 11.13 H new ATOM 0 HB ILE A 95 -1.315 3.670 1.675 1.00 1.14 H new ATOM 0 HG12 ILE A 95 0.318 4.799 0.575 1.00 41.41 H new ATOM 0 HG13 ILE A 95 0.757 3.106 0.470 1.00 41.41 H new ATOM 0 HG21 ILE A 95 -0.793 1.373 0.688 1.00 23.42 H new ATOM 0 HG22 ILE A 95 -2.542 1.661 0.837 1.00 23.42 H new ATOM 0 HG23 ILE A 95 -1.746 1.818 -0.747 1.00 23.42 H new ATOM 0 HD11 ILE A 95 1.322 4.287 -1.597 1.00 50.53 H new ATOM 0 HD12 ILE A 95 0.071 3.062 -1.913 1.00 50.53 H new ATOM 0 HD13 ILE A 95 -0.375 4.781 -1.806 1.00 50.53 H new ATOM 1370 N LYS A 96 -4.835 4.969 0.596 1.00 52.10 N ATOM 1371 CA LYS A 96 -6.203 4.859 1.092 1.00 25.14 C ATOM 1372 C LYS A 96 -7.127 4.490 -0.060 1.00 2.55 C ATOM 1373 O LYS A 96 -7.793 3.460 0.012 1.00 11.54 O ATOM 1374 CB LYS A 96 -6.615 6.179 1.774 1.00 33.41 C ATOM 1375 CG LYS A 96 -6.778 6.024 3.290 1.00 54.33 C ATOM 1376 CD LYS A 96 -8.109 5.360 3.653 1.00 51.12 C ATOM 1377 CE LYS A 96 -8.408 5.564 5.140 1.00 74.22 C ATOM 1378 NZ LYS A 96 -9.854 5.460 5.420 1.00 53.43 N ATOM 0 H LYS A 96 -4.730 5.712 -0.095 1.00 52.10 H new ATOM 0 HA LYS A 96 -6.275 4.070 1.841 1.00 25.14 H new ATOM 0 HB2 LYS A 96 -5.864 6.942 1.568 1.00 33.41 H new ATOM 0 HB3 LYS A 96 -7.553 6.530 1.344 1.00 33.41 H new ATOM 0 HG2 LYS A 96 -5.955 5.429 3.685 1.00 54.33 H new ATOM 0 HG3 LYS A 96 -6.719 7.004 3.764 1.00 54.33 H new ATOM 0 HD2 LYS A 96 -8.912 5.784 3.051 1.00 51.12 H new ATOM 0 HD3 LYS A 96 -8.068 4.295 3.425 1.00 51.12 H new ATOM 0 HE2 LYS A 96 -7.868 4.820 5.726 1.00 74.22 H new ATOM 0 HE3 LYS A 96 -8.045 6.542 5.454 1.00 74.22 H new ATOM 0 HZ1 LYS A 96 -10.022 5.603 6.436 1.00 53.43 H new ATOM 0 HZ2 LYS A 96 -10.365 6.186 4.879 1.00 53.43 H new ATOM 0 HZ3 LYS A 96 -10.194 4.517 5.142 1.00 53.43 H new ATOM 1388 N THR A 97 -7.145 5.268 -1.141 1.00 53.13 N ATOM 1389 CA THR A 97 -8.105 5.056 -2.221 1.00 52.50 C ATOM 1390 C THR A 97 -7.881 3.689 -2.870 1.00 30.21 C ATOM 1391 O THR A 97 -8.831 2.932 -3.041 1.00 11.11 O ATOM 1392 CB THR A 97 -7.978 6.221 -3.215 1.00 50.23 C ATOM 1393 OG1 THR A 97 -8.169 7.429 -2.503 1.00 45.33 O ATOM 1394 CG2 THR A 97 -8.973 6.136 -4.373 1.00 3.13 C ATOM 0 H THR A 97 -6.507 6.049 -1.291 1.00 53.13 H new ATOM 0 HA THR A 97 -9.126 5.045 -1.839 1.00 52.50 H new ATOM 0 HB THR A 97 -6.986 6.175 -3.664 1.00 50.23 H new ATOM 0 HG1 THR A 97 -7.976 8.189 -3.091 1.00 45.33 H new ATOM 0 HG21 THR A 97 -8.831 6.988 -5.038 1.00 3.13 H new ATOM 0 HG22 THR A 97 -8.809 5.212 -4.927 1.00 3.13 H new ATOM 0 HG23 THR A 97 -9.990 6.148 -3.981 1.00 3.13 H new ATOM 1402 N LEU A 98 -6.622 3.341 -3.169 1.00 52.24 N ATOM 1403 CA LEU A 98 -6.250 2.110 -3.871 1.00 34.45 C ATOM 1404 C LEU A 98 -6.857 0.881 -3.198 1.00 42.31 C ATOM 1405 O LEU A 98 -7.446 0.038 -3.857 1.00 3.33 O ATOM 1406 CB LEU A 98 -4.711 1.990 -3.893 1.00 32.03 C ATOM 1407 CG LEU A 98 -4.084 1.362 -5.157 1.00 30.35 C ATOM 1408 CD1 LEU A 98 -4.404 -0.123 -5.293 1.00 2.53 C ATOM 1409 CD2 LEU A 98 -4.423 2.085 -6.458 1.00 21.32 C ATOM 0 H LEU A 98 -5.819 3.921 -2.924 1.00 52.24 H new ATOM 0 HA LEU A 98 -6.638 2.158 -4.888 1.00 34.45 H new ATOM 0 HB2 LEU A 98 -4.290 2.987 -3.763 1.00 32.03 H new ATOM 0 HB3 LEU A 98 -4.403 1.399 -3.030 1.00 32.03 H new ATOM 0 HG LEU A 98 -3.012 1.482 -5.000 1.00 30.35 H new ATOM 0 HD11 LEU A 98 -3.939 -0.514 -6.198 1.00 2.53 H new ATOM 0 HD12 LEU A 98 -4.018 -0.659 -4.426 1.00 2.53 H new ATOM 0 HD13 LEU A 98 -5.484 -0.259 -5.352 1.00 2.53 H new ATOM 0 HD21 LEU A 98 -3.941 1.576 -7.293 1.00 21.32 H new ATOM 0 HD22 LEU A 98 -5.503 2.082 -6.605 1.00 21.32 H new ATOM 0 HD23 LEU A 98 -4.067 3.114 -6.406 1.00 21.32 H new ATOM 1420 N LEU A 99 -6.750 0.806 -1.871 1.00 64.10 N ATOM 1421 CA LEU A 99 -7.212 -0.316 -1.056 1.00 53.44 C ATOM 1422 C LEU A 99 -8.702 -0.568 -1.253 1.00 40.23 C ATOM 1423 O LEU A 99 -9.127 -1.723 -1.322 1.00 54.34 O ATOM 1424 CB LEU A 99 -6.915 -0.007 0.418 1.00 62.31 C ATOM 1425 CG LEU A 99 -5.417 -0.137 0.745 1.00 71.01 C ATOM 1426 CD1 LEU A 99 -5.138 0.596 2.050 1.00 44.41 C ATOM 1427 CD2 LEU A 99 -4.958 -1.594 0.869 1.00 72.24 C ATOM 0 H LEU A 99 -6.325 1.549 -1.317 1.00 64.10 H new ATOM 0 HA LEU A 99 -6.686 -1.220 -1.363 1.00 53.44 H new ATOM 0 HB2 LEU A 99 -7.250 1.004 0.651 1.00 62.31 H new ATOM 0 HB3 LEU A 99 -7.485 -0.686 1.052 1.00 62.31 H new ATOM 0 HG LEU A 99 -4.858 0.301 -0.082 1.00 71.01 H new ATOM 0 HD11 LEU A 99 -4.079 0.513 2.295 1.00 44.41 H new ATOM 0 HD12 LEU A 99 -5.403 1.648 1.941 1.00 44.41 H new ATOM 0 HD13 LEU A 99 -5.731 0.153 2.850 1.00 44.41 H new ATOM 0 HD21 LEU A 99 -3.893 -1.622 1.100 1.00 72.24 H new ATOM 0 HD22 LEU A 99 -5.516 -2.084 1.667 1.00 72.24 H new ATOM 0 HD23 LEU A 99 -5.138 -2.114 -0.072 1.00 72.24 H new ATOM 1438 N ASP A 100 -9.487 0.500 -1.395 1.00 20.12 N ATOM 1439 CA ASP A 100 -10.921 0.381 -1.652 1.00 71.33 C ATOM 1440 C ASP A 100 -11.222 -0.095 -3.071 1.00 31.43 C ATOM 1441 O ASP A 100 -12.315 -0.583 -3.349 1.00 41.10 O ATOM 1442 CB ASP A 100 -11.622 1.723 -1.452 1.00 34.22 C ATOM 1443 CG ASP A 100 -13.113 1.485 -1.187 1.00 21.45 C ATOM 1444 OD1 ASP A 100 -13.445 0.762 -0.224 1.00 74.30 O ATOM 1445 OD2 ASP A 100 -13.964 2.010 -1.941 1.00 71.03 O ATOM 0 H ASP A 100 -9.151 1.461 -1.336 1.00 20.12 H new ATOM 0 HA ASP A 100 -11.291 -0.358 -0.942 1.00 71.33 H new ATOM 0 HB2 ASP A 100 -11.174 2.259 -0.615 1.00 34.22 H new ATOM 0 HB3 ASP A 100 -11.494 2.348 -2.336 1.00 34.22 H new ATOM 1449 N GLN A 101 -10.262 0.047 -3.987 1.00 60.10 N ATOM 1450 CA GLN A 101 -10.414 -0.407 -5.364 1.00 74.44 C ATOM 1451 C GLN A 101 -10.040 -1.884 -5.443 1.00 12.24 C ATOM 1452 O GLN A 101 -10.674 -2.642 -6.173 1.00 0.52 O ATOM 1453 CB GLN A 101 -9.619 0.469 -6.347 1.00 53.42 C ATOM 1454 CG GLN A 101 -9.915 1.963 -6.121 1.00 32.25 C ATOM 1455 CD GLN A 101 -9.889 2.837 -7.370 1.00 45.23 C ATOM 1456 OE1 GLN A 101 -9.390 2.468 -8.431 1.00 14.22 O ATOM 1457 NE2 GLN A 101 -10.458 4.025 -7.283 1.00 41.20 N ATOM 0 H GLN A 101 -9.359 0.480 -3.792 1.00 60.10 H new ATOM 0 HA GLN A 101 -11.455 -0.302 -5.669 1.00 74.44 H new ATOM 0 HB2 GLN A 101 -8.552 0.284 -6.223 1.00 53.42 H new ATOM 0 HB3 GLN A 101 -9.874 0.195 -7.371 1.00 53.42 H new ATOM 0 HG2 GLN A 101 -10.897 2.054 -5.656 1.00 32.25 H new ATOM 0 HG3 GLN A 101 -9.188 2.355 -5.410 1.00 32.25 H new ATOM 0 HE21 GLN A 101 -10.871 4.329 -6.402 1.00 41.20 H new ATOM 0 HE22 GLN A 101 -10.484 4.639 -8.097 1.00 41.20 H new ATOM 1464 N MET A 102 -9.098 -2.327 -4.604 1.00 61.31 N ATOM 1465 CA MET A 102 -8.739 -3.727 -4.414 1.00 55.21 C ATOM 1466 C MET A 102 -9.844 -4.537 -3.728 1.00 72.32 C ATOM 1467 O MET A 102 -9.591 -5.668 -3.341 1.00 21.44 O ATOM 1468 CB MET A 102 -7.437 -3.860 -3.609 1.00 22.12 C ATOM 1469 CG MET A 102 -6.263 -3.058 -4.175 1.00 71.24 C ATOM 1470 SD MET A 102 -4.788 -3.006 -3.103 1.00 5.11 S ATOM 1471 CE MET A 102 -4.634 -4.735 -2.568 1.00 3.24 C ATOM 0 H MET A 102 -8.549 -1.695 -4.021 1.00 61.31 H new ATOM 0 HA MET A 102 -8.596 -4.137 -5.414 1.00 55.21 H new ATOM 0 HB2 MET A 102 -7.622 -3.537 -2.585 1.00 22.12 H new ATOM 0 HB3 MET A 102 -7.156 -4.912 -3.566 1.00 22.12 H new ATOM 0 HG2 MET A 102 -5.981 -3.484 -5.138 1.00 71.24 H new ATOM 0 HG3 MET A 102 -6.595 -2.037 -4.363 1.00 71.24 H new ATOM 0 HE1 MET A 102 -3.608 -4.929 -2.254 1.00 3.24 H new ATOM 0 HE2 MET A 102 -5.310 -4.919 -1.733 1.00 3.24 H new ATOM 0 HE3 MET A 102 -4.891 -5.396 -3.396 1.00 3.24 H new ATOM 1479 N LYS A 103 -11.069 -4.032 -3.556 1.00 60.14 N ATOM 1480 CA LYS A 103 -12.151 -4.728 -2.851 1.00 44.12 C ATOM 1481 C LYS A 103 -12.574 -6.077 -3.470 1.00 41.42 C ATOM 1482 O LYS A 103 -13.538 -6.684 -3.009 1.00 44.22 O ATOM 1483 CB LYS A 103 -13.368 -3.773 -2.749 1.00 55.12 C ATOM 1484 CG LYS A 103 -13.390 -2.985 -1.435 1.00 62.32 C ATOM 1485 CD LYS A 103 -13.793 -3.911 -0.278 1.00 11.25 C ATOM 1486 CE LYS A 103 -13.510 -3.265 1.080 1.00 0.41 C ATOM 1487 NZ LYS A 103 -12.969 -4.250 2.036 1.00 60.03 N ATOM 0 H LYS A 103 -11.342 -3.114 -3.908 1.00 60.14 H new ATOM 0 HA LYS A 103 -11.763 -4.989 -1.866 1.00 44.12 H new ATOM 0 HB2 LYS A 103 -13.349 -3.075 -3.586 1.00 55.12 H new ATOM 0 HB3 LYS A 103 -14.288 -4.352 -2.837 1.00 55.12 H new ATOM 0 HG2 LYS A 103 -12.407 -2.554 -1.242 1.00 62.32 H new ATOM 0 HG3 LYS A 103 -14.093 -2.155 -1.510 1.00 62.32 H new ATOM 0 HD2 LYS A 103 -14.854 -4.151 -0.354 1.00 11.25 H new ATOM 0 HD3 LYS A 103 -13.247 -4.851 -0.356 1.00 11.25 H new ATOM 0 HE2 LYS A 103 -12.801 -2.447 0.956 1.00 0.41 H new ATOM 0 HE3 LYS A 103 -14.428 -2.833 1.479 1.00 0.41 H new ATOM 0 HZ1 LYS A 103 -12.786 -3.785 2.948 1.00 60.03 H new ATOM 0 HZ2 LYS A 103 -13.658 -5.018 2.171 1.00 60.03 H new ATOM 0 HZ3 LYS A 103 -12.081 -4.643 1.664 1.00 60.03 H new ATOM 1497 N ASN A 104 -11.916 -6.562 -4.525 1.00 75.22 N ATOM 1498 CA ASN A 104 -12.172 -7.843 -5.178 1.00 54.44 C ATOM 1499 C ASN A 104 -10.935 -8.745 -5.148 1.00 31.23 C ATOM 1500 O ASN A 104 -10.912 -9.746 -5.869 1.00 62.23 O ATOM 1501 CB ASN A 104 -12.615 -7.586 -6.630 1.00 73.31 C ATOM 1502 CG ASN A 104 -13.927 -6.833 -6.789 1.00 31.31 C ATOM 1503 OD1 ASN A 104 -14.232 -6.362 -7.884 1.00 44.21 O ATOM 1504 ND2 ASN A 104 -14.739 -6.717 -5.751 1.00 35.04 N ATOM 0 H ASN A 104 -11.155 -6.046 -4.966 1.00 75.22 H new ATOM 0 HA ASN A 104 -12.963 -8.361 -4.636 1.00 54.44 H new ATOM 0 HB2 ASN A 104 -11.830 -7.025 -7.137 1.00 73.31 H new ATOM 0 HB3 ASN A 104 -12.702 -8.545 -7.140 1.00 73.31 H new ATOM 0 HD21 ASN A 104 -15.631 -6.232 -5.853 1.00 35.04 H new ATOM 0 HD22 ASN A 104 -14.473 -7.112 -4.849 1.00 35.04 H new ATOM 1510 N TYR A 105 -9.903 -8.359 -4.386 1.00 31.13 N ATOM 1511 CA TYR A 105 -8.600 -9.006 -4.326 1.00 51.25 C ATOM 1512 C TYR A 105 -8.739 -10.501 -4.024 1.00 13.24 C ATOM 1513 O TYR A 105 -9.663 -10.937 -3.333 1.00 15.24 O ATOM 1514 CB TYR A 105 -7.710 -8.302 -3.284 1.00 21.14 C ATOM 1515 CG TYR A 105 -8.020 -8.659 -1.839 1.00 40.44 C ATOM 1516 CD1 TYR A 105 -9.146 -8.124 -1.182 1.00 74.11 C ATOM 1517 CD2 TYR A 105 -7.205 -9.590 -1.170 1.00 75.02 C ATOM 1518 CE1 TYR A 105 -9.453 -8.508 0.133 1.00 21.23 C ATOM 1519 CE2 TYR A 105 -7.522 -10.001 0.135 1.00 64.01 C ATOM 1520 CZ TYR A 105 -8.646 -9.459 0.790 1.00 15.22 C ATOM 1521 OH TYR A 105 -8.938 -9.827 2.064 1.00 52.42 O ATOM 0 H TYR A 105 -9.964 -7.549 -3.769 1.00 31.13 H new ATOM 0 HA TYR A 105 -8.122 -8.918 -5.302 1.00 51.25 H new ATOM 0 HB2 TYR A 105 -6.668 -8.549 -3.490 1.00 21.14 H new ATOM 0 HB3 TYR A 105 -7.812 -7.224 -3.408 1.00 21.14 H new ATOM 0 HD1 TYR A 105 -9.778 -7.413 -1.694 1.00 74.11 H new ATOM 0 HD2 TYR A 105 -6.331 -9.991 -1.662 1.00 75.02 H new ATOM 0 HE1 TYR A 105 -10.304 -8.077 0.639 1.00 21.23 H new ATOM 0 HE2 TYR A 105 -6.905 -10.732 0.636 1.00 64.01 H new ATOM 0 HH TYR A 105 -8.286 -10.491 2.370 1.00 52.42 H new ATOM 1530 N ARG A 106 -7.798 -11.279 -4.553 1.00 60.45 N ATOM 1531 CA ARG A 106 -7.732 -12.732 -4.486 1.00 41.24 C ATOM 1532 C ARG A 106 -6.268 -13.062 -4.221 1.00 0.34 C ATOM 1533 O ARG A 106 -5.581 -13.587 -5.101 1.00 25.04 O ATOM 1534 CB ARG A 106 -8.255 -13.332 -5.811 1.00 24.32 C ATOM 1535 CG ARG A 106 -9.766 -13.116 -6.032 1.00 32.13 C ATOM 1536 CD ARG A 106 -10.563 -14.415 -5.923 1.00 52.14 C ATOM 1537 NE ARG A 106 -10.551 -15.178 -7.179 1.00 23.24 N ATOM 1538 CZ ARG A 106 -10.755 -16.490 -7.332 1.00 63.43 C ATOM 1539 NH1 ARG A 106 -10.873 -17.310 -6.285 1.00 55.53 N ATOM 1540 NH2 ARG A 106 -10.842 -16.941 -8.577 1.00 12.33 N ATOM 0 H ARG A 106 -7.013 -10.884 -5.072 1.00 60.45 H new ATOM 0 HA ARG A 106 -8.355 -13.156 -3.699 1.00 41.24 H new ATOM 0 HB2 ARG A 106 -7.707 -12.888 -6.642 1.00 24.32 H new ATOM 0 HB3 ARG A 106 -8.043 -14.401 -5.825 1.00 24.32 H new ATOM 0 HG2 ARG A 106 -10.139 -12.402 -5.298 1.00 32.13 H new ATOM 0 HG3 ARG A 106 -9.927 -12.676 -7.016 1.00 32.13 H new ATOM 0 HD2 ARG A 106 -10.148 -15.028 -5.123 1.00 52.14 H new ATOM 0 HD3 ARG A 106 -11.593 -14.186 -5.648 1.00 52.14 H new ATOM 0 HE ARG A 106 -10.366 -14.646 -8.030 1.00 23.24 H new ATOM 0 HH11 ARG A 106 -10.808 -16.939 -5.337 1.00 55.53 H new ATOM 0 HH12 ARG A 106 -11.028 -18.307 -6.433 1.00 55.53 H new ATOM 0 HH21 ARG A 106 -10.754 -16.294 -9.361 1.00 12.33 H new ATOM 0 HH22 ARG A 106 -10.997 -17.934 -8.750 1.00 12.33 H new ATOM 1551 N GLY A 107 -5.761 -12.701 -3.045 1.00 55.24 N ATOM 1552 CA GLY A 107 -4.334 -12.714 -2.758 1.00 41.34 C ATOM 1553 C GLY A 107 -4.025 -12.051 -1.419 1.00 14.30 C ATOM 1554 O GLY A 107 -4.931 -11.873 -0.600 1.00 62.22 O ATOM 0 H GLY A 107 -6.335 -12.390 -2.261 1.00 55.24 H new ATOM 0 HA2 GLY A 107 -3.974 -13.743 -2.747 1.00 41.34 H new ATOM 0 HA3 GLY A 107 -3.797 -12.197 -3.553 1.00 41.34 H new ATOM 1558 N GLU A 108 -2.768 -11.658 -1.199 1.00 72.02 N ATOM 1559 CA GLU A 108 -2.288 -11.086 0.060 1.00 3.20 C ATOM 1560 C GLU A 108 -1.701 -9.688 -0.136 1.00 22.44 C ATOM 1561 O GLU A 108 -1.454 -9.274 -1.275 1.00 65.11 O ATOM 1562 CB GLU A 108 -1.255 -12.017 0.707 1.00 62.25 C ATOM 1563 CG GLU A 108 -1.860 -13.350 1.170 1.00 72.11 C ATOM 1564 CD GLU A 108 -1.824 -14.439 0.101 1.00 42.22 C ATOM 1565 OE1 GLU A 108 -0.705 -14.774 -0.349 1.00 25.23 O ATOM 1566 OE2 GLU A 108 -2.888 -15.032 -0.180 1.00 60.25 O ATOM 0 H GLU A 108 -2.039 -11.731 -1.909 1.00 72.02 H new ATOM 0 HA GLU A 108 -3.145 -10.988 0.726 1.00 3.20 H new ATOM 0 HB2 GLU A 108 -0.455 -12.215 -0.006 1.00 62.25 H new ATOM 0 HB3 GLU A 108 -0.803 -11.513 1.561 1.00 62.25 H new ATOM 0 HG2 GLU A 108 -1.320 -13.698 2.051 1.00 72.11 H new ATOM 0 HG3 GLU A 108 -2.894 -13.185 1.474 1.00 72.11 H new ATOM 1571 N VAL A 109 -1.487 -8.966 0.975 1.00 50.53 N ATOM 1572 CA VAL A 109 -1.007 -7.580 0.974 1.00 12.53 C ATOM 1573 C VAL A 109 0.105 -7.365 2.015 1.00 43.23 C ATOM 1574 O VAL A 109 0.043 -7.911 3.116 1.00 23.01 O ATOM 1575 CB VAL A 109 -2.198 -6.626 1.225 1.00 70.30 C ATOM 1576 CG1 VAL A 109 -1.796 -5.139 1.199 1.00 30.25 C ATOM 1577 CG2 VAL A 109 -3.322 -6.813 0.193 1.00 74.03 C ATOM 0 H VAL A 109 -1.646 -9.337 1.912 1.00 50.53 H new ATOM 0 HA VAL A 109 -0.572 -7.361 -0.001 1.00 12.53 H new ATOM 0 HB VAL A 109 -2.550 -6.892 2.222 1.00 70.30 H new ATOM 0 HG11 VAL A 109 -2.675 -4.521 1.381 1.00 30.25 H new ATOM 0 HG12 VAL A 109 -1.052 -4.950 1.973 1.00 30.25 H new ATOM 0 HG13 VAL A 109 -1.376 -4.893 0.224 1.00 30.25 H new ATOM 0 HG21 VAL A 109 -4.135 -6.121 0.412 1.00 74.03 H new ATOM 0 HG22 VAL A 109 -2.935 -6.614 -0.806 1.00 74.03 H new ATOM 0 HG23 VAL A 109 -3.694 -7.837 0.241 1.00 74.03 H new ATOM 1587 N ALA A 110 1.081 -6.500 1.719 1.00 10.22 N ATOM 1588 CA ALA A 110 2.028 -5.937 2.684 1.00 5.33 C ATOM 1589 C ALA A 110 2.494 -4.548 2.195 1.00 22.42 C ATOM 1590 O ALA A 110 2.226 -4.185 1.044 1.00 25.13 O ATOM 1591 CB ALA A 110 3.175 -6.933 2.919 1.00 12.33 C ATOM 0 H ALA A 110 1.238 -6.162 0.769 1.00 10.22 H new ATOM 0 HA ALA A 110 1.555 -5.780 3.653 1.00 5.33 H new ATOM 0 HB1 ALA A 110 3.880 -6.514 3.637 1.00 12.33 H new ATOM 0 HB2 ALA A 110 2.771 -7.867 3.310 1.00 12.33 H new ATOM 0 HB3 ALA A 110 3.688 -7.125 1.977 1.00 12.33 H new ATOM 1597 N SER A 111 3.123 -3.737 3.063 1.00 64.04 N ATOM 1598 CA SER A 111 3.386 -2.317 2.795 1.00 53.12 C ATOM 1599 C SER A 111 4.786 -1.907 3.266 1.00 4.51 C ATOM 1600 O SER A 111 5.021 -1.697 4.459 1.00 64.30 O ATOM 1601 CB SER A 111 2.277 -1.466 3.424 1.00 65.12 C ATOM 1602 OG SER A 111 2.261 -0.142 2.918 1.00 62.13 O ATOM 0 H SER A 111 3.463 -4.051 3.972 1.00 64.04 H new ATOM 0 HA SER A 111 3.373 -2.145 1.719 1.00 53.12 H new ATOM 0 HB2 SER A 111 1.311 -1.936 3.237 1.00 65.12 H new ATOM 0 HB3 SER A 111 2.413 -1.438 4.505 1.00 65.12 H new ATOM 0 HG SER A 111 2.657 0.465 3.577 1.00 62.13 H new ATOM 1607 N PHE A 112 5.712 -1.774 2.314 1.00 53.50 N ATOM 1608 CA PHE A 112 7.146 -1.668 2.497 1.00 5.14 C ATOM 1609 C PHE A 112 7.612 -0.227 2.232 1.00 72.43 C ATOM 1610 O PHE A 112 7.520 0.309 1.128 1.00 51.40 O ATOM 1611 CB PHE A 112 7.841 -2.747 1.640 1.00 63.03 C ATOM 1612 CG PHE A 112 7.958 -2.494 0.157 1.00 12.52 C ATOM 1613 CD1 PHE A 112 6.875 -2.742 -0.709 1.00 53.22 C ATOM 1614 CD2 PHE A 112 9.197 -2.089 -0.365 1.00 22.13 C ATOM 1615 CE1 PHE A 112 7.021 -2.559 -2.092 1.00 72.34 C ATOM 1616 CE2 PHE A 112 9.344 -1.929 -1.747 1.00 22.33 C ATOM 1617 CZ PHE A 112 8.259 -2.151 -2.613 1.00 73.30 C ATOM 0 H PHE A 112 5.452 -1.736 1.328 1.00 53.50 H new ATOM 0 HA PHE A 112 7.431 -1.868 3.530 1.00 5.14 H new ATOM 0 HB2 PHE A 112 8.846 -2.894 2.036 1.00 63.03 H new ATOM 0 HB3 PHE A 112 7.303 -3.685 1.779 1.00 63.03 H new ATOM 0 HD1 PHE A 112 5.929 -3.074 -0.307 1.00 53.22 H new ATOM 0 HD2 PHE A 112 10.031 -1.902 0.296 1.00 22.13 H new ATOM 0 HE1 PHE A 112 6.185 -2.731 -2.753 1.00 72.34 H new ATOM 0 HE2 PHE A 112 10.300 -1.632 -2.152 1.00 22.33 H new ATOM 0 HZ PHE A 112 8.378 -2.008 -3.677 1.00 73.30 H new ATOM 1626 N PHE A 113 8.078 0.442 3.284 1.00 12.34 N ATOM 1627 CA PHE A 113 8.511 1.834 3.321 1.00 70.24 C ATOM 1628 C PHE A 113 10.027 1.897 3.524 1.00 13.54 C ATOM 1629 O PHE A 113 10.614 0.990 4.119 1.00 53.22 O ATOM 1630 CB PHE A 113 7.788 2.520 4.488 1.00 73.21 C ATOM 1631 CG PHE A 113 7.942 1.774 5.805 1.00 65.44 C ATOM 1632 CD1 PHE A 113 7.113 0.672 6.090 1.00 54.33 C ATOM 1633 CD2 PHE A 113 8.988 2.093 6.689 1.00 32.44 C ATOM 1634 CE1 PHE A 113 7.353 -0.124 7.219 1.00 42.10 C ATOM 1635 CE2 PHE A 113 9.210 1.317 7.840 1.00 45.51 C ATOM 1636 CZ PHE A 113 8.401 0.196 8.096 1.00 62.34 C ATOM 0 H PHE A 113 8.169 -0.007 4.195 1.00 12.34 H new ATOM 0 HA PHE A 113 8.271 2.337 2.384 1.00 70.24 H new ATOM 0 HB2 PHE A 113 8.175 3.532 4.603 1.00 73.21 H new ATOM 0 HB3 PHE A 113 6.728 2.609 4.249 1.00 73.21 H new ATOM 0 HD1 PHE A 113 6.287 0.438 5.435 1.00 54.33 H new ATOM 0 HD2 PHE A 113 9.625 2.940 6.482 1.00 32.44 H new ATOM 0 HE1 PHE A 113 6.730 -0.985 7.414 1.00 42.10 H new ATOM 0 HE2 PHE A 113 10.001 1.582 8.526 1.00 45.51 H new ATOM 0 HZ PHE A 113 8.586 -0.417 8.965 1.00 62.34 H new ATOM 1645 N THR A 114 10.661 2.991 3.102 1.00 52.12 N ATOM 1646 CA THR A 114 12.118 3.157 3.111 1.00 12.24 C ATOM 1647 C THR A 114 12.565 4.308 4.033 1.00 14.45 C ATOM 1648 O THR A 114 13.754 4.625 4.092 1.00 25.35 O ATOM 1649 CB THR A 114 12.621 3.332 1.662 1.00 30.45 C ATOM 1650 OG1 THR A 114 11.982 4.420 1.019 1.00 13.13 O ATOM 1651 CG2 THR A 114 12.442 2.078 0.805 1.00 42.23 C ATOM 0 H THR A 114 10.167 3.805 2.736 1.00 52.12 H new ATOM 0 HA THR A 114 12.572 2.258 3.528 1.00 12.24 H new ATOM 0 HB THR A 114 13.689 3.529 1.753 1.00 30.45 H new ATOM 0 HG1 THR A 114 12.323 4.506 0.104 1.00 13.13 H new ATOM 0 HG21 THR A 114 12.815 2.269 -0.201 1.00 42.23 H new ATOM 0 HG22 THR A 114 12.998 1.252 1.248 1.00 42.23 H new ATOM 0 HG23 THR A 114 11.384 1.818 0.756 1.00 42.23 H new ATOM 1659 N SER A 115 11.637 4.960 4.741 1.00 52.12 N ATOM 1660 CA SER A 115 11.910 6.062 5.661 1.00 24.13 C ATOM 1661 C SER A 115 11.531 5.608 7.067 1.00 71.41 C ATOM 1662 O SER A 115 10.443 5.063 7.236 1.00 30.21 O ATOM 1663 CB SER A 115 11.077 7.289 5.276 1.00 33.01 C ATOM 1664 OG SER A 115 11.212 7.647 3.914 1.00 13.21 O ATOM 0 H SER A 115 10.646 4.726 4.686 1.00 52.12 H new ATOM 0 HA SER A 115 12.965 6.332 5.617 1.00 24.13 H new ATOM 0 HB2 SER A 115 10.027 7.090 5.491 1.00 33.01 H new ATOM 0 HB3 SER A 115 11.375 8.133 5.898 1.00 33.01 H new ATOM 0 HG SER A 115 10.658 8.433 3.726 1.00 13.21 H new ATOM 1669 N ALA A 116 12.405 5.774 8.069 1.00 43.44 N ATOM 1670 CA ALA A 116 12.087 5.372 9.443 1.00 21.33 C ATOM 1671 C ALA A 116 12.943 6.063 10.519 1.00 10.31 C ATOM 1672 O ALA A 116 12.902 5.627 11.676 1.00 52.41 O ATOM 1673 CB ALA A 116 12.216 3.842 9.583 1.00 33.15 C ATOM 0 H ALA A 116 13.333 6.182 7.953 1.00 43.44 H new ATOM 0 HA ALA A 116 11.061 5.694 9.619 1.00 21.33 H new ATOM 0 HB1 ALA A 116 11.979 3.549 10.606 1.00 33.15 H new ATOM 0 HB2 ALA A 116 11.525 3.354 8.896 1.00 33.15 H new ATOM 0 HB3 ALA A 116 13.236 3.540 9.346 1.00 33.15 H new ATOM 1679 N GLY A 117 13.741 7.083 10.175 1.00 34.22 N ATOM 1680 CA GLY A 117 14.751 7.665 11.059 1.00 30.21 C ATOM 1681 C GLY A 117 14.196 8.323 12.327 1.00 50.13 C ATOM 1682 O GLY A 117 14.977 8.622 13.235 1.00 73.11 O ATOM 0 H GLY A 117 13.700 7.531 9.260 1.00 34.22 H new ATOM 0 HA2 GLY A 117 15.452 6.883 11.350 1.00 30.21 H new ATOM 0 HA3 GLY A 117 15.318 8.409 10.499 1.00 30.21 H new ATOM 1686 N THR A 118 12.879 8.516 12.427 1.00 52.50 N ATOM 1687 CA THR A 118 12.216 8.975 13.650 1.00 13.13 C ATOM 1688 C THR A 118 10.858 8.290 13.872 1.00 14.13 C ATOM 1689 O THR A 118 10.233 8.490 14.912 1.00 70.20 O ATOM 1690 CB THR A 118 12.083 10.522 13.644 1.00 43.50 C ATOM 1691 OG1 THR A 118 12.521 11.117 12.427 1.00 32.12 O ATOM 1692 CG2 THR A 118 12.897 11.124 14.788 1.00 23.44 C ATOM 0 H THR A 118 12.235 8.356 11.652 1.00 52.50 H new ATOM 0 HA THR A 118 12.843 8.687 14.493 1.00 13.13 H new ATOM 0 HB THR A 118 11.020 10.734 13.761 1.00 43.50 H new ATOM 0 HG1 THR A 118 12.412 12.089 12.481 1.00 32.12 H new ATOM 0 HG21 THR A 118 12.797 12.209 14.774 1.00 23.44 H new ATOM 0 HG22 THR A 118 12.530 10.738 15.739 1.00 23.44 H new ATOM 0 HG23 THR A 118 13.947 10.855 14.668 1.00 23.44 H new ATOM 1700 N ASN A 119 10.367 7.503 12.906 1.00 50.10 N ATOM 1701 CA ASN A 119 8.969 7.094 12.840 1.00 63.30 C ATOM 1702 C ASN A 119 8.871 5.687 12.241 1.00 73.10 C ATOM 1703 O ASN A 119 8.704 5.538 11.029 1.00 65.33 O ATOM 1704 CB ASN A 119 8.202 8.165 12.027 1.00 24.01 C ATOM 1705 CG ASN A 119 7.164 8.876 12.858 1.00 34.12 C ATOM 1706 OD1 ASN A 119 6.065 8.205 13.101 1.00 41.22 O flip ATOM 1707 ND2 ASN A 119 7.312 10.033 13.235 1.00 22.15 N flip ATOM 0 H ASN A 119 10.937 7.133 12.146 1.00 50.10 H new ATOM 0 HA ASN A 119 8.515 7.032 13.829 1.00 63.30 H new ATOM 0 HB2 ASN A 119 8.909 8.894 11.631 1.00 24.01 H new ATOM 0 HB3 ASN A 119 7.719 7.692 11.172 1.00 24.01 H new ATOM 0 HD21 ASN A 119 8.179 10.529 13.030 1.00 22.15 H new ATOM 0 HD22 ASN A 119 6.568 10.500 13.753 1.00 22.15 H new ATOM 1713 N HIS A 120 8.939 4.647 13.078 1.00 12.22 N ATOM 1714 CA HIS A 120 8.825 3.246 12.676 1.00 43.54 C ATOM 1715 C HIS A 120 7.558 2.632 13.270 1.00 23.11 C ATOM 1716 O HIS A 120 6.607 2.391 12.528 1.00 4.23 O ATOM 1717 CB HIS A 120 10.098 2.460 13.042 1.00 64.14 C ATOM 1718 CG HIS A 120 10.121 1.036 12.543 1.00 65.11 C ATOM 1719 ND1 HIS A 120 10.596 -0.073 13.215 1.00 21.31 N ATOM 1720 CD2 HIS A 120 9.727 0.624 11.301 1.00 65.31 C ATOM 1721 CE1 HIS A 120 10.474 -1.130 12.392 1.00 22.34 C ATOM 1722 NE2 HIS A 120 9.988 -0.744 11.201 1.00 21.01 N ATOM 0 H HIS A 120 9.079 4.762 14.082 1.00 12.22 H new ATOM 0 HA HIS A 120 8.734 3.190 11.591 1.00 43.54 H new ATOM 0 HB2 HIS A 120 10.963 2.987 12.639 1.00 64.14 H new ATOM 0 HB3 HIS A 120 10.206 2.453 14.127 1.00 64.14 H new ATOM 0 HD2 HIS A 120 9.291 1.246 10.533 1.00 65.31 H new ATOM 0 HE1 HIS A 120 10.731 -2.146 12.652 1.00 22.34 H new ATOM 0 HE2 HIS A 120 9.839 -1.335 10.383 1.00 21.01 H new ATOM 1729 N LYS A 121 7.502 2.414 14.595 1.00 10.15 N ATOM 1730 CA LYS A 121 6.382 1.709 15.243 1.00 2.35 C ATOM 1731 C LYS A 121 5.026 2.346 14.921 1.00 31.32 C ATOM 1732 O LYS A 121 4.039 1.618 14.813 1.00 43.41 O ATOM 1733 CB LYS A 121 6.559 1.656 16.772 1.00 2.51 C ATOM 1734 CG LYS A 121 7.448 0.508 17.278 1.00 4.31 C ATOM 1735 CD LYS A 121 7.593 0.598 18.807 1.00 20.44 C ATOM 1736 CE LYS A 121 8.339 -0.605 19.412 1.00 32.42 C ATOM 1737 NZ LYS A 121 7.451 -1.511 20.178 1.00 52.21 N ATOM 0 H LYS A 121 8.227 2.719 15.244 1.00 10.15 H new ATOM 0 HA LYS A 121 6.394 0.697 14.839 1.00 2.35 H new ATOM 0 HB2 LYS A 121 6.985 2.602 17.108 1.00 2.51 H new ATOM 0 HB3 LYS A 121 5.576 1.567 17.235 1.00 2.51 H new ATOM 0 HG2 LYS A 121 7.012 -0.452 17.001 1.00 4.31 H new ATOM 0 HG3 LYS A 121 8.429 0.560 16.806 1.00 4.31 H new ATOM 0 HD2 LYS A 121 8.125 1.514 19.063 1.00 20.44 H new ATOM 0 HD3 LYS A 121 6.603 0.668 19.257 1.00 20.44 H new ATOM 0 HE2 LYS A 121 8.820 -1.167 18.612 1.00 32.42 H new ATOM 0 HE3 LYS A 121 9.131 -0.242 20.067 1.00 32.42 H new ATOM 0 HZ1 LYS A 121 8.008 -2.301 20.561 1.00 52.21 H new ATOM 0 HZ2 LYS A 121 7.011 -0.986 20.961 1.00 52.21 H new ATOM 0 HZ3 LYS A 121 6.709 -1.882 19.551 1.00 52.21 H new ATOM 1747 N ALA A 122 4.981 3.672 14.757 1.00 72.11 N ATOM 1748 CA ALA A 122 3.755 4.390 14.440 1.00 52.42 C ATOM 1749 C ALA A 122 3.151 3.922 13.108 1.00 61.23 C ATOM 1750 O ALA A 122 1.949 3.667 13.038 1.00 4.24 O ATOM 1751 CB ALA A 122 4.072 5.887 14.431 1.00 70.22 C ATOM 0 H ALA A 122 5.800 4.274 14.842 1.00 72.11 H new ATOM 0 HA ALA A 122 2.998 4.182 15.196 1.00 52.42 H new ATOM 0 HB1 ALA A 122 3.168 6.449 14.196 1.00 70.22 H new ATOM 0 HB2 ALA A 122 4.440 6.187 15.412 1.00 70.22 H new ATOM 0 HB3 ALA A 122 4.834 6.093 13.679 1.00 70.22 H new ATOM 1757 N TYR A 123 3.982 3.739 12.072 1.00 73.30 N ATOM 1758 CA TYR A 123 3.539 3.353 10.731 1.00 10.45 C ATOM 1759 C TYR A 123 2.765 2.039 10.756 1.00 42.34 C ATOM 1760 O TYR A 123 1.825 1.857 9.985 1.00 12.12 O ATOM 1761 CB TYR A 123 4.733 3.208 9.780 1.00 32.25 C ATOM 1762 CG TYR A 123 4.337 2.904 8.349 1.00 2.12 C ATOM 1763 CD1 TYR A 123 4.000 3.948 7.466 1.00 54.12 C ATOM 1764 CD2 TYR A 123 4.300 1.569 7.903 1.00 33.23 C ATOM 1765 CE1 TYR A 123 3.650 3.662 6.134 1.00 4.32 C ATOM 1766 CE2 TYR A 123 3.944 1.275 6.577 1.00 70.03 C ATOM 1767 CZ TYR A 123 3.630 2.319 5.684 1.00 14.22 C ATOM 1768 OH TYR A 123 3.327 2.018 4.393 1.00 71.12 O ATOM 0 H TYR A 123 4.992 3.857 12.146 1.00 73.30 H new ATOM 0 HA TYR A 123 2.882 4.146 10.374 1.00 10.45 H new ATOM 0 HB2 TYR A 123 5.315 4.129 9.799 1.00 32.25 H new ATOM 0 HB3 TYR A 123 5.383 2.413 10.145 1.00 32.25 H new ATOM 0 HD1 TYR A 123 4.010 4.971 7.812 1.00 54.12 H new ATOM 0 HD2 TYR A 123 4.547 0.768 8.584 1.00 33.23 H new ATOM 0 HE1 TYR A 123 3.397 4.464 5.456 1.00 4.32 H new ATOM 0 HE2 TYR A 123 3.911 0.249 6.241 1.00 70.03 H new ATOM 0 HH TYR A 123 3.606 2.755 3.811 1.00 71.12 H new ATOM 1777 N VAL A 124 3.159 1.126 11.642 1.00 40.23 N ATOM 1778 CA VAL A 124 2.518 -0.165 11.783 1.00 54.51 C ATOM 1779 C VAL A 124 1.063 0.027 12.235 1.00 4.31 C ATOM 1780 O VAL A 124 0.185 -0.653 11.705 1.00 13.41 O ATOM 1781 CB VAL A 124 3.361 -1.036 12.734 1.00 42.11 C ATOM 1782 CG1 VAL A 124 2.731 -2.415 12.927 1.00 64.32 C ATOM 1783 CG2 VAL A 124 4.809 -1.207 12.229 1.00 14.45 C ATOM 0 H VAL A 124 3.939 1.270 12.284 1.00 40.23 H new ATOM 0 HA VAL A 124 2.469 -0.693 10.831 1.00 54.51 H new ATOM 0 HB VAL A 124 3.385 -0.513 13.690 1.00 42.11 H new ATOM 0 HG11 VAL A 124 3.349 -3.006 13.603 1.00 64.32 H new ATOM 0 HG12 VAL A 124 1.733 -2.303 13.352 1.00 64.32 H new ATOM 0 HG13 VAL A 124 2.661 -2.921 11.964 1.00 64.32 H new ATOM 0 HG21 VAL A 124 5.368 -1.828 12.929 1.00 14.45 H new ATOM 0 HG22 VAL A 124 4.799 -1.685 11.249 1.00 14.45 H new ATOM 0 HG23 VAL A 124 5.285 -0.230 12.151 1.00 14.45 H new ATOM 1793 N SER A 125 0.784 0.930 13.181 1.00 62.44 N ATOM 1794 CA SER A 125 -0.585 1.169 13.627 1.00 61.00 C ATOM 1795 C SER A 125 -1.375 1.850 12.515 1.00 64.30 C ATOM 1796 O SER A 125 -2.430 1.345 12.144 1.00 60.42 O ATOM 1797 CB SER A 125 -0.604 1.970 14.925 1.00 74.03 C ATOM 1798 OG SER A 125 -1.872 1.865 15.566 1.00 3.44 O ATOM 0 H SER A 125 1.487 1.503 13.648 1.00 62.44 H new ATOM 0 HA SER A 125 -1.066 0.215 13.844 1.00 61.00 H new ATOM 0 HB2 SER A 125 0.177 1.607 15.593 1.00 74.03 H new ATOM 0 HB3 SER A 125 -0.383 3.017 14.715 1.00 74.03 H new ATOM 0 HG SER A 125 -2.444 2.609 15.284 1.00 3.44 H new ATOM 1803 N HIS A 126 -0.819 2.910 11.921 1.00 71.13 N ATOM 1804 CA HIS A 126 -1.324 3.616 10.780 1.00 12.25 C ATOM 1805 C HIS A 126 -1.802 2.639 9.711 1.00 22.01 C ATOM 1806 O HIS A 126 -2.982 2.662 9.369 1.00 40.52 O ATOM 1807 CB HIS A 126 -0.169 4.536 10.327 1.00 13.31 C ATOM 1808 CG HIS A 126 -0.202 4.890 8.874 1.00 61.03 C ATOM 1809 ND1 HIS A 126 0.773 4.635 7.935 1.00 43.44 N ATOM 1810 CD2 HIS A 126 -1.334 5.257 8.226 1.00 62.44 C ATOM 1811 CE1 HIS A 126 0.235 4.887 6.731 1.00 43.23 C ATOM 1812 NE2 HIS A 126 -1.054 5.258 6.852 1.00 74.00 N ATOM 0 H HIS A 126 0.055 3.311 12.262 1.00 71.13 H new ATOM 0 HA HIS A 126 -2.205 4.218 11.002 1.00 12.25 H new ATOM 0 HB2 HIS A 126 -0.199 5.454 10.914 1.00 13.31 H new ATOM 0 HB3 HIS A 126 0.779 4.046 10.549 1.00 13.31 H new ATOM 0 HD1 HIS A 126 1.724 4.315 8.119 1.00 43.44 H new ATOM 0 HD2 HIS A 126 -2.280 5.504 8.685 1.00 62.44 H new ATOM 0 HE1 HIS A 126 0.764 4.804 5.793 1.00 43.23 H new ATOM 1819 N PHE A 127 -0.928 1.790 9.171 1.00 40.13 N ATOM 1820 CA PHE A 127 -1.343 0.984 8.041 1.00 64.42 C ATOM 1821 C PHE A 127 -2.331 -0.118 8.449 1.00 13.22 C ATOM 1822 O PHE A 127 -3.155 -0.496 7.628 1.00 71.11 O ATOM 1823 CB PHE A 127 -0.129 0.479 7.255 1.00 1.23 C ATOM 1824 CG PHE A 127 -0.531 -0.131 5.929 1.00 65.03 C ATOM 1825 CD1 PHE A 127 -1.145 0.681 4.958 1.00 45.14 C ATOM 1826 CD2 PHE A 127 -0.377 -1.508 5.692 1.00 3.23 C ATOM 1827 CE1 PHE A 127 -1.568 0.127 3.740 1.00 41.54 C ATOM 1828 CE2 PHE A 127 -0.847 -2.071 4.491 1.00 63.30 C ATOM 1829 CZ PHE A 127 -1.429 -1.253 3.507 1.00 34.42 C ATOM 0 H PHE A 127 0.032 1.650 9.486 1.00 40.13 H new ATOM 0 HA PHE A 127 -1.904 1.617 7.354 1.00 64.42 H new ATOM 0 HB2 PHE A 127 0.560 1.305 7.081 1.00 1.23 H new ATOM 0 HB3 PHE A 127 0.406 -0.262 7.849 1.00 1.23 H new ATOM 0 HD1 PHE A 127 -1.291 1.734 5.150 1.00 45.14 H new ATOM 0 HD2 PHE A 127 0.102 -2.133 6.431 1.00 3.23 H new ATOM 0 HE1 PHE A 127 -2.001 0.761 2.981 1.00 41.54 H new ATOM 0 HE2 PHE A 127 -0.760 -3.135 4.325 1.00 63.30 H new ATOM 0 HZ PHE A 127 -1.768 -1.683 2.576 1.00 34.42 H new ATOM 1838 N ASN A 128 -2.321 -0.602 9.696 1.00 0.51 N ATOM 1839 CA ASN A 128 -3.325 -1.548 10.204 1.00 31.23 C ATOM 1840 C ASN A 128 -4.678 -0.860 10.166 1.00 74.00 C ATOM 1841 O ASN A 128 -5.628 -1.378 9.592 1.00 33.12 O ATOM 1842 CB ASN A 128 -3.028 -2.036 11.636 1.00 23.42 C ATOM 1843 CG ASN A 128 -2.114 -3.251 11.697 1.00 42.41 C ATOM 1844 OD1 ASN A 128 -2.475 -4.346 11.281 1.00 53.42 O ATOM 1845 ND2 ASN A 128 -0.916 -3.128 12.238 1.00 42.23 N ATOM 0 H ASN A 128 -1.614 -0.348 10.386 1.00 0.51 H new ATOM 0 HA ASN A 128 -3.307 -2.434 9.570 1.00 31.23 H new ATOM 0 HB2 ASN A 128 -2.572 -1.222 12.199 1.00 23.42 H new ATOM 0 HB3 ASN A 128 -3.969 -2.277 12.130 1.00 23.42 H new ATOM 0 HD21 ASN A 128 -0.302 -3.939 12.306 1.00 42.23 H new ATOM 0 HD22 ASN A 128 -0.605 -2.222 12.588 1.00 42.23 H new ATOM 1851 N GLU A 129 -4.749 0.329 10.755 1.00 74.11 N ATOM 1852 CA GLU A 129 -5.956 1.127 10.864 1.00 63.24 C ATOM 1853 C GLU A 129 -6.484 1.617 9.516 1.00 0.12 C ATOM 1854 O GLU A 129 -7.603 2.129 9.445 1.00 0.34 O ATOM 1855 CB GLU A 129 -5.623 2.354 11.716 1.00 20.12 C ATOM 1856 CG GLU A 129 -5.406 2.068 13.206 1.00 42.24 C ATOM 1857 CD GLU A 129 -4.935 3.329 13.929 1.00 75.33 C ATOM 1858 OE1 GLU A 129 -5.691 4.326 13.940 1.00 54.10 O ATOM 1859 OE2 GLU A 129 -3.804 3.350 14.478 1.00 32.15 O ATOM 0 H GLU A 129 -3.938 0.775 11.183 1.00 74.11 H new ATOM 0 HA GLU A 129 -6.730 0.498 11.304 1.00 63.24 H new ATOM 0 HB2 GLU A 129 -4.723 2.822 11.316 1.00 20.12 H new ATOM 0 HB3 GLU A 129 -6.431 3.078 11.614 1.00 20.12 H new ATOM 0 HG2 GLU A 129 -6.334 1.710 13.653 1.00 42.24 H new ATOM 0 HG3 GLU A 129 -4.668 1.275 13.327 1.00 42.24 H new ATOM 1864 N TRP A 130 -5.661 1.590 8.469 1.00 63.20 N ATOM 1865 CA TRP A 130 -6.002 2.125 7.160 1.00 33.24 C ATOM 1866 C TRP A 130 -6.153 0.994 6.140 1.00 4.42 C ATOM 1867 O TRP A 130 -6.424 1.280 4.974 1.00 32.14 O ATOM 1868 CB TRP A 130 -4.969 3.189 6.753 1.00 63.03 C ATOM 1869 CG TRP A 130 -4.985 4.479 7.536 1.00 13.43 C ATOM 1870 CD1 TRP A 130 -5.332 4.650 8.831 1.00 23.05 C ATOM 1871 CD2 TRP A 130 -4.680 5.819 7.068 1.00 52.41 C ATOM 1872 NE1 TRP A 130 -5.222 5.966 9.208 1.00 60.32 N ATOM 1873 CE2 TRP A 130 -4.824 6.742 8.148 1.00 31.22 C ATOM 1874 CE3 TRP A 130 -4.324 6.345 5.816 1.00 55.31 C ATOM 1875 CZ2 TRP A 130 -4.634 8.118 7.990 1.00 55.51 C ATOM 1876 CZ3 TRP A 130 -4.173 7.726 5.632 1.00 4.24 C ATOM 1877 CH2 TRP A 130 -4.334 8.609 6.713 1.00 12.52 C ATOM 0 H TRP A 130 -4.724 1.188 8.511 1.00 63.20 H new ATOM 0 HA TRP A 130 -6.971 2.623 7.197 1.00 33.24 H new ATOM 0 HB2 TRP A 130 -3.975 2.750 6.840 1.00 63.03 H new ATOM 0 HB3 TRP A 130 -5.122 3.427 5.700 1.00 63.03 H new ATOM 0 HD1 TRP A 130 -5.654 3.854 9.486 1.00 23.05 H new ATOM 0 HE1 TRP A 130 -5.410 6.318 10.147 1.00 60.32 H new ATOM 0 HE3 TRP A 130 -4.164 5.676 4.983 1.00 55.31 H new ATOM 0 HZ2 TRP A 130 -4.717 8.787 8.834 1.00 55.51 H new ATOM 0 HZ3 TRP A 130 -3.931 8.114 4.653 1.00 4.24 H new ATOM 0 HH2 TRP A 130 -4.226 9.672 6.558 1.00 12.52 H new ATOM 1887 N ALA A 131 -5.997 -0.270 6.554 1.00 20.15 N ATOM 1888 CA ALA A 131 -6.031 -1.449 5.688 1.00 44.22 C ATOM 1889 C ALA A 131 -6.711 -2.641 6.381 1.00 35.32 C ATOM 1890 O ALA A 131 -6.415 -3.797 6.067 1.00 13.25 O ATOM 1891 CB ALA A 131 -4.602 -1.798 5.249 1.00 40.32 C ATOM 0 H ALA A 131 -5.839 -0.505 7.534 1.00 20.15 H new ATOM 0 HA ALA A 131 -6.628 -1.219 4.805 1.00 44.22 H new ATOM 0 HB1 ALA A 131 -4.624 -2.676 4.604 1.00 40.32 H new ATOM 0 HB2 ALA A 131 -4.173 -0.957 4.703 1.00 40.32 H new ATOM 0 HB3 ALA A 131 -3.993 -2.009 6.128 1.00 40.32 H new ATOM 1897 N ASP A 132 -7.589 -2.374 7.349 1.00 3.13 N ATOM 1898 CA ASP A 132 -8.289 -3.356 8.181 1.00 11.14 C ATOM 1899 C ASP A 132 -9.397 -4.062 7.391 1.00 55.31 C ATOM 1900 O ASP A 132 -10.587 -3.954 7.691 1.00 62.20 O ATOM 1901 CB ASP A 132 -8.889 -2.654 9.398 1.00 1.15 C ATOM 1902 CG ASP A 132 -9.569 -3.609 10.387 1.00 55.52 C ATOM 1903 OD1 ASP A 132 -9.094 -4.757 10.567 1.00 75.00 O ATOM 1904 OD2 ASP A 132 -10.578 -3.212 11.020 1.00 22.35 O ATOM 0 H ASP A 132 -7.845 -1.416 7.587 1.00 3.13 H new ATOM 0 HA ASP A 132 -7.571 -4.110 8.504 1.00 11.14 H new ATOM 0 HB2 ASP A 132 -8.101 -2.108 9.917 1.00 1.15 H new ATOM 0 HB3 ASP A 132 -9.617 -1.917 9.059 1.00 1.15 H new ATOM 1908 N GLY A 133 -9.026 -4.787 6.346 1.00 72.22 N ATOM 1909 CA GLY A 133 -9.933 -5.726 5.707 1.00 62.12 C ATOM 1910 C GLY A 133 -9.344 -6.527 4.562 1.00 35.34 C ATOM 1911 O GLY A 133 -9.954 -7.518 4.162 1.00 60.40 O ATOM 0 H GLY A 133 -8.099 -4.742 5.922 1.00 72.22 H new ATOM 0 HA2 GLY A 133 -10.300 -6.421 6.462 1.00 62.12 H new ATOM 0 HA3 GLY A 133 -10.796 -5.174 5.335 1.00 62.12 H new ATOM 1915 N LEU A 134 -8.200 -6.113 4.017 1.00 14.23 N ATOM 1916 CA LEU A 134 -7.439 -6.915 3.083 1.00 35.03 C ATOM 1917 C LEU A 134 -6.667 -7.964 3.888 1.00 33.45 C ATOM 1918 O LEU A 134 -6.533 -7.841 5.109 1.00 72.21 O ATOM 1919 CB LEU A 134 -6.460 -6.019 2.317 1.00 60.42 C ATOM 1920 CG LEU A 134 -7.051 -4.868 1.482 1.00 73.13 C ATOM 1921 CD1 LEU A 134 -7.900 -5.333 0.286 1.00 54.44 C ATOM 1922 CD2 LEU A 134 -7.791 -3.788 2.271 1.00 41.51 C ATOM 0 H LEU A 134 -7.780 -5.205 4.218 1.00 14.23 H new ATOM 0 HA LEU A 134 -8.100 -7.401 2.365 1.00 35.03 H new ATOM 0 HB2 LEU A 134 -5.764 -5.589 3.037 1.00 60.42 H new ATOM 0 HB3 LEU A 134 -5.876 -6.653 1.650 1.00 60.42 H new ATOM 0 HG LEU A 134 -6.150 -4.394 1.093 1.00 73.13 H new ATOM 0 HD11 LEU A 134 -8.280 -4.464 -0.251 1.00 54.44 H new ATOM 0 HD12 LEU A 134 -7.286 -5.934 -0.385 1.00 54.44 H new ATOM 0 HD13 LEU A 134 -8.737 -5.932 0.645 1.00 54.44 H new ATOM 0 HD21 LEU A 134 -8.165 -3.028 1.585 1.00 41.51 H new ATOM 0 HD22 LEU A 134 -8.628 -4.237 2.806 1.00 41.51 H new ATOM 0 HD23 LEU A 134 -7.109 -3.327 2.985 1.00 41.51 H new ATOM 1933 N ASN A 135 -6.081 -8.954 3.218 1.00 61.22 N ATOM 1934 CA ASN A 135 -5.257 -9.972 3.872 1.00 34.32 C ATOM 1935 C ASN A 135 -3.842 -9.429 4.099 1.00 21.23 C ATOM 1936 O ASN A 135 -2.898 -9.841 3.415 1.00 52.34 O ATOM 1937 CB ASN A 135 -5.251 -11.268 3.052 1.00 24.31 C ATOM 1938 CG ASN A 135 -4.774 -12.450 3.888 1.00 35.20 C ATOM 1939 OD1 ASN A 135 -5.574 -13.209 4.420 1.00 52.51 O ATOM 1940 ND2 ASN A 135 -3.477 -12.622 4.058 1.00 55.53 N ATOM 0 H ASN A 135 -6.163 -9.074 2.208 1.00 61.22 H new ATOM 0 HA ASN A 135 -5.683 -10.211 4.846 1.00 34.32 H new ATOM 0 HB2 ASN A 135 -6.254 -11.467 2.676 1.00 24.31 H new ATOM 0 HB3 ASN A 135 -4.603 -11.149 2.184 1.00 24.31 H new ATOM 0 HD21 ASN A 135 -3.136 -13.391 4.635 1.00 55.53 H new ATOM 0 HD22 ASN A 135 -2.815 -11.986 3.612 1.00 55.53 H new ATOM 1946 N VAL A 136 -3.690 -8.456 4.999 1.00 32.43 N ATOM 1947 CA VAL A 136 -2.391 -7.855 5.278 1.00 51.33 C ATOM 1948 C VAL A 136 -1.634 -8.751 6.255 1.00 33.32 C ATOM 1949 O VAL A 136 -2.183 -9.129 7.292 1.00 74.43 O ATOM 1950 CB VAL A 136 -2.485 -6.409 5.803 1.00 52.42 C ATOM 1951 CG1 VAL A 136 -1.084 -5.773 5.732 1.00 44.50 C ATOM 1952 CG2 VAL A 136 -3.455 -5.535 4.993 1.00 2.42 C ATOM 0 H VAL A 136 -4.457 -8.068 5.548 1.00 32.43 H new ATOM 0 HA VAL A 136 -1.847 -7.782 4.336 1.00 51.33 H new ATOM 0 HB VAL A 136 -2.864 -6.458 6.824 1.00 52.42 H new ATOM 0 HG11 VAL A 136 -1.131 -4.748 6.100 1.00 44.50 H new ATOM 0 HG12 VAL A 136 -0.392 -6.348 6.347 1.00 44.50 H new ATOM 0 HG13 VAL A 136 -0.737 -5.772 4.699 1.00 44.50 H new ATOM 0 HG21 VAL A 136 -3.476 -4.529 5.413 1.00 2.42 H new ATOM 0 HG22 VAL A 136 -3.123 -5.488 3.956 1.00 2.42 H new ATOM 0 HG23 VAL A 136 -4.455 -5.967 5.035 1.00 2.42 H new ATOM 1962 N ILE A 137 -0.375 -9.076 5.947 1.00 43.24 N ATOM 1963 CA ILE A 137 0.484 -9.924 6.783 1.00 40.12 C ATOM 1964 C ILE A 137 1.923 -9.389 6.917 1.00 64.42 C ATOM 1965 O ILE A 137 2.768 -10.068 7.509 1.00 73.33 O ATOM 1966 CB ILE A 137 0.454 -11.395 6.291 1.00 51.23 C ATOM 1967 CG1 ILE A 137 1.239 -11.671 4.990 1.00 44.45 C ATOM 1968 CG2 ILE A 137 -0.982 -11.939 6.180 1.00 0.13 C ATOM 1969 CD1 ILE A 137 0.927 -10.772 3.800 1.00 61.25 C ATOM 0 H ILE A 137 0.085 -8.753 5.096 1.00 43.24 H new ATOM 0 HA ILE A 137 0.069 -9.894 7.790 1.00 40.12 H new ATOM 0 HB ILE A 137 0.984 -11.939 7.073 1.00 51.23 H new ATOM 0 HG12 ILE A 137 2.303 -11.587 5.210 1.00 44.45 H new ATOM 0 HG13 ILE A 137 1.055 -12.704 4.694 1.00 44.45 H new ATOM 0 HG21 ILE A 137 -0.954 -12.972 5.832 1.00 0.13 H new ATOM 0 HG22 ILE A 137 -1.463 -11.898 7.157 1.00 0.13 H new ATOM 0 HG23 ILE A 137 -1.547 -11.333 5.472 1.00 0.13 H new ATOM 0 HD11 ILE A 137 1.542 -11.067 2.950 1.00 61.25 H new ATOM 0 HD12 ILE A 137 -0.126 -10.869 3.537 1.00 61.25 H new ATOM 0 HD13 ILE A 137 1.141 -9.736 4.061 1.00 61.25 H new ATOM 1980 N GLY A 138 2.237 -8.204 6.377 1.00 51.32 N ATOM 1981 CA GLY A 138 3.608 -7.714 6.278 1.00 51.11 C ATOM 1982 C GLY A 138 3.726 -6.208 6.436 1.00 30.02 C ATOM 1983 O GLY A 138 3.061 -5.458 5.715 1.00 61.12 O ATOM 0 H GLY A 138 1.542 -7.561 5.997 1.00 51.32 H new ATOM 0 HA2 GLY A 138 4.215 -8.200 7.042 1.00 51.11 H new ATOM 0 HA3 GLY A 138 4.020 -8.003 5.311 1.00 51.11 H new ATOM 1987 N VAL A 139 4.587 -5.773 7.360 1.00 12.55 N ATOM 1988 CA VAL A 139 4.976 -4.381 7.537 1.00 25.41 C ATOM 1989 C VAL A 139 6.424 -4.384 8.036 1.00 53.14 C ATOM 1990 O VAL A 139 6.671 -4.733 9.195 1.00 1.25 O ATOM 1991 CB VAL A 139 4.037 -3.662 8.536 1.00 65.22 C ATOM 1992 CG1 VAL A 139 4.210 -2.142 8.421 1.00 63.03 C ATOM 1993 CG2 VAL A 139 2.546 -3.968 8.372 1.00 21.04 C ATOM 0 H VAL A 139 5.043 -6.401 8.022 1.00 12.55 H new ATOM 0 HA VAL A 139 4.897 -3.835 6.597 1.00 25.41 H new ATOM 0 HB VAL A 139 4.337 -4.047 9.511 1.00 65.22 H new ATOM 0 HG11 VAL A 139 3.545 -1.646 9.128 1.00 63.03 H new ATOM 0 HG12 VAL A 139 5.243 -1.875 8.646 1.00 63.03 H new ATOM 0 HG13 VAL A 139 3.965 -1.824 7.408 1.00 63.03 H new ATOM 0 HG21 VAL A 139 1.977 -3.415 9.119 1.00 21.04 H new ATOM 0 HG22 VAL A 139 2.221 -3.671 7.375 1.00 21.04 H new ATOM 0 HG23 VAL A 139 2.377 -5.037 8.505 1.00 21.04 H new ATOM 2003 N ALA A 140 7.400 -4.062 7.185 1.00 53.21 N ATOM 2004 CA ALA A 140 8.808 -3.976 7.570 1.00 23.22 C ATOM 2005 C ALA A 140 9.561 -2.984 6.674 1.00 5.31 C ATOM 2006 O ALA A 140 9.135 -2.725 5.541 1.00 74.40 O ATOM 2007 CB ALA A 140 9.437 -5.375 7.483 1.00 63.32 C ATOM 0 H ALA A 140 7.233 -3.852 6.201 1.00 53.21 H new ATOM 0 HA ALA A 140 8.879 -3.610 8.594 1.00 23.22 H new ATOM 0 HB1 ALA A 140 10.487 -5.320 7.769 1.00 63.32 H new ATOM 0 HB2 ALA A 140 8.913 -6.052 8.157 1.00 63.32 H new ATOM 0 HB3 ALA A 140 9.358 -5.747 6.461 1.00 63.32 H new ATOM 2013 N ARG A 141 10.684 -2.430 7.157 1.00 3.13 N ATOM 2014 CA ARG A 141 11.553 -1.597 6.346 1.00 10.52 C ATOM 2015 C ARG A 141 12.477 -2.471 5.505 1.00 41.41 C ATOM 2016 O ARG A 141 13.054 -3.438 6.012 1.00 3.24 O ATOM 2017 CB ARG A 141 12.367 -0.659 7.237 1.00 73.14 C ATOM 2018 CG ARG A 141 13.337 0.165 6.382 1.00 44.53 C ATOM 2019 CD ARG A 141 13.930 1.309 7.173 1.00 65.33 C ATOM 2020 NE ARG A 141 15.005 1.945 6.391 1.00 64.22 N ATOM 2021 CZ ARG A 141 15.450 3.199 6.496 1.00 65.32 C ATOM 2022 NH1 ARG A 141 14.945 4.004 7.419 1.00 72.34 N ATOM 2023 NH2 ARG A 141 16.403 3.635 5.683 1.00 4.13 N ATOM 0 H ARG A 141 11.005 -2.553 8.118 1.00 3.13 H new ATOM 0 HA ARG A 141 10.941 -0.992 5.677 1.00 10.52 H new ATOM 0 HB2 ARG A 141 11.699 0.005 7.786 1.00 73.14 H new ATOM 0 HB3 ARG A 141 12.922 -1.237 7.977 1.00 73.14 H new ATOM 0 HG2 ARG A 141 14.136 -0.478 6.013 1.00 44.53 H new ATOM 0 HG3 ARG A 141 12.814 0.556 5.509 1.00 44.53 H new ATOM 0 HD2 ARG A 141 13.157 2.040 7.410 1.00 65.33 H new ATOM 0 HD3 ARG A 141 14.324 0.943 8.121 1.00 65.33 H new ATOM 0 HE ARG A 141 15.461 1.361 5.690 1.00 64.22 H new ATOM 0 HH11 ARG A 141 14.217 3.665 8.048 1.00 72.34 H new ATOM 0 HH12 ARG A 141 15.284 4.963 7.500 1.00 72.34 H new ATOM 0 HH21 ARG A 141 16.796 3.012 4.977 1.00 4.13 H new ATOM 0 HH22 ARG A 141 16.743 4.593 5.763 1.00 4.13 H new ATOM 2034 N ASP A 142 12.728 -2.011 4.289 1.00 33.12 N ATOM 2035 CA ASP A 142 13.436 -2.658 3.200 1.00 5.45 C ATOM 2036 C ASP A 142 12.846 -4.052 2.940 1.00 2.14 C ATOM 2037 O ASP A 142 11.904 -4.522 3.580 1.00 14.24 O ATOM 2038 CB ASP A 142 14.970 -2.631 3.406 1.00 25.15 C ATOM 2039 CG ASP A 142 15.606 -1.230 3.373 1.00 70.43 C ATOM 2040 OD1 ASP A 142 14.900 -0.200 3.305 1.00 64.03 O ATOM 2041 OD2 ASP A 142 16.849 -1.129 3.540 1.00 22.45 O ATOM 0 H ASP A 142 12.408 -1.082 4.015 1.00 33.12 H new ATOM 0 HA ASP A 142 13.283 -2.088 2.284 1.00 5.45 H new ATOM 0 HB2 ASP A 142 15.201 -3.096 4.364 1.00 25.15 H new ATOM 0 HB3 ASP A 142 15.436 -3.243 2.634 1.00 25.15 H new ATOM 2045 N ASP A 143 13.402 -4.726 1.947 1.00 65.34 N ATOM 2046 CA ASP A 143 13.030 -6.036 1.418 1.00 63.01 C ATOM 2047 C ASP A 143 13.430 -7.186 2.344 1.00 43.45 C ATOM 2048 O ASP A 143 13.292 -8.347 1.970 1.00 14.34 O ATOM 2049 CB ASP A 143 13.658 -6.225 0.031 1.00 64.01 C ATOM 2050 CG ASP A 143 15.117 -5.797 0.012 1.00 50.14 C ATOM 2051 OD1 ASP A 143 15.343 -4.574 -0.171 1.00 63.11 O ATOM 2052 OD2 ASP A 143 16.037 -6.608 0.227 1.00 71.32 O ATOM 0 H ASP A 143 14.199 -4.338 1.442 1.00 65.34 H new ATOM 0 HA ASP A 143 11.943 -6.062 1.344 1.00 63.01 H new ATOM 0 HB2 ASP A 143 13.582 -7.272 -0.264 1.00 64.01 H new ATOM 0 HB3 ASP A 143 13.099 -5.646 -0.704 1.00 64.01 H new ATOM 2056 N SER A 144 13.855 -6.880 3.570 1.00 5.43 N ATOM 2057 CA SER A 144 14.371 -7.805 4.568 1.00 33.13 C ATOM 2058 C SER A 144 13.381 -8.920 4.933 1.00 4.43 C ATOM 2059 O SER A 144 13.745 -9.845 5.658 1.00 61.11 O ATOM 2060 CB SER A 144 14.737 -6.973 5.809 1.00 5.32 C ATOM 2061 OG SER A 144 15.934 -7.417 6.411 1.00 72.32 O ATOM 0 H SER A 144 13.846 -5.918 3.910 1.00 5.43 H new ATOM 0 HA SER A 144 15.241 -8.319 4.158 1.00 33.13 H new ATOM 0 HB2 SER A 144 14.841 -5.926 5.525 1.00 5.32 H new ATOM 0 HB3 SER A 144 13.925 -7.028 6.534 1.00 5.32 H new ATOM 0 HG SER A 144 16.132 -6.862 7.194 1.00 72.32 H new ATOM 2066 N GLU A 145 12.123 -8.839 4.484 1.00 12.20 N ATOM 2067 CA GLU A 145 11.098 -9.838 4.729 1.00 54.11 C ATOM 2068 C GLU A 145 10.301 -10.167 3.451 1.00 30.34 C ATOM 2069 O GLU A 145 9.254 -10.796 3.543 1.00 12.30 O ATOM 2070 CB GLU A 145 10.196 -9.425 5.913 1.00 52.41 C ATOM 2071 CG GLU A 145 10.951 -8.823 7.113 1.00 74.34 C ATOM 2072 CD GLU A 145 10.217 -8.825 8.453 1.00 70.33 C ATOM 2073 OE1 GLU A 145 9.347 -9.695 8.684 1.00 13.21 O ATOM 2074 OE2 GLU A 145 10.586 -8.030 9.348 1.00 13.10 O ATOM 0 H GLU A 145 11.790 -8.053 3.926 1.00 12.20 H new ATOM 0 HA GLU A 145 11.592 -10.766 5.018 1.00 54.11 H new ATOM 0 HB2 GLU A 145 9.464 -8.699 5.559 1.00 52.41 H new ATOM 0 HB3 GLU A 145 9.640 -10.299 6.252 1.00 52.41 H new ATOM 0 HG2 GLU A 145 11.886 -9.369 7.236 1.00 74.34 H new ATOM 0 HG3 GLU A 145 11.213 -7.793 6.869 1.00 74.34 H new ATOM 2079 N VAL A 146 10.752 -9.804 2.242 1.00 72.45 N ATOM 2080 CA VAL A 146 10.023 -10.182 1.020 1.00 41.31 C ATOM 2081 C VAL A 146 9.938 -11.710 0.874 1.00 53.33 C ATOM 2082 O VAL A 146 8.939 -12.229 0.378 1.00 4.40 O ATOM 2083 CB VAL A 146 10.632 -9.473 -0.208 1.00 73.33 C ATOM 2084 CG1 VAL A 146 10.096 -10.020 -1.539 1.00 5.43 C ATOM 2085 CG2 VAL A 146 10.291 -7.975 -0.153 1.00 50.33 C ATOM 0 H VAL A 146 11.600 -9.260 2.083 1.00 72.45 H new ATOM 0 HA VAL A 146 8.991 -9.839 1.095 1.00 41.31 H new ATOM 0 HB VAL A 146 11.707 -9.650 -0.169 1.00 73.33 H new ATOM 0 HG11 VAL A 146 10.560 -9.483 -2.366 1.00 5.43 H new ATOM 0 HG12 VAL A 146 10.332 -11.081 -1.617 1.00 5.43 H new ATOM 0 HG13 VAL A 146 9.015 -9.884 -1.579 1.00 5.43 H new ATOM 0 HG21 VAL A 146 10.720 -7.472 -1.020 1.00 50.33 H new ATOM 0 HG22 VAL A 146 9.208 -7.848 -0.159 1.00 50.33 H new ATOM 0 HG23 VAL A 146 10.702 -7.541 0.759 1.00 50.33 H new ATOM 2095 N ASP A 147 10.897 -12.445 1.437 1.00 21.41 N ATOM 2096 CA ASP A 147 10.926 -13.908 1.466 1.00 70.13 C ATOM 2097 C ASP A 147 9.703 -14.499 2.214 1.00 31.44 C ATOM 2098 O ASP A 147 9.389 -15.675 2.049 1.00 50.35 O ATOM 2099 CB ASP A 147 12.267 -14.362 2.082 1.00 24.31 C ATOM 2100 CG ASP A 147 12.889 -15.590 1.396 1.00 62.03 C ATOM 2101 OD1 ASP A 147 12.248 -16.667 1.365 1.00 1.12 O ATOM 2102 OD2 ASP A 147 14.071 -15.517 0.986 1.00 61.23 O ATOM 0 H ASP A 147 11.702 -12.025 1.901 1.00 21.41 H new ATOM 0 HA ASP A 147 10.855 -14.291 0.448 1.00 70.13 H new ATOM 0 HB2 ASP A 147 12.975 -13.535 2.034 1.00 24.31 H new ATOM 0 HB3 ASP A 147 12.112 -14.588 3.137 1.00 24.31 H new ATOM 2106 N LYS A 148 8.953 -13.711 3.004 1.00 4.10 N ATOM 2107 CA LYS A 148 7.699 -14.127 3.659 1.00 22.00 C ATOM 2108 C LYS A 148 6.454 -13.492 3.039 1.00 23.04 C ATOM 2109 O LYS A 148 5.350 -13.755 3.503 1.00 50.44 O ATOM 2110 CB LYS A 148 7.729 -13.885 5.181 1.00 63.15 C ATOM 2111 CG LYS A 148 7.905 -12.410 5.539 1.00 42.34 C ATOM 2112 CD LYS A 148 7.295 -11.909 6.850 1.00 12.20 C ATOM 2113 CE LYS A 148 7.912 -12.436 8.144 1.00 54.35 C ATOM 2114 NZ LYS A 148 9.380 -12.376 8.187 1.00 51.23 N ATOM 0 H LYS A 148 9.207 -12.745 3.210 1.00 4.10 H new ATOM 0 HA LYS A 148 7.629 -15.201 3.486 1.00 22.00 H new ATOM 0 HB2 LYS A 148 6.803 -14.254 5.622 1.00 63.15 H new ATOM 0 HB3 LYS A 148 8.543 -14.461 5.621 1.00 63.15 H new ATOM 0 HG2 LYS A 148 8.974 -12.199 5.566 1.00 42.34 H new ATOM 0 HG3 LYS A 148 7.484 -11.817 4.727 1.00 42.34 H new ATOM 0 HD2 LYS A 148 7.361 -10.821 6.861 1.00 12.20 H new ATOM 0 HD3 LYS A 148 6.235 -12.164 6.851 1.00 12.20 H new ATOM 0 HE2 LYS A 148 7.513 -11.864 8.982 1.00 54.35 H new ATOM 0 HE3 LYS A 148 7.599 -13.470 8.286 1.00 54.35 H new ATOM 0 HZ1 LYS A 148 9.721 -12.829 9.059 1.00 51.23 H new ATOM 0 HZ2 LYS A 148 9.772 -12.874 7.363 1.00 51.23 H new ATOM 0 HZ3 LYS A 148 9.688 -11.383 8.170 1.00 51.23 H new ATOM 2124 N TRP A 149 6.602 -12.660 2.017 1.00 3.10 N ATOM 2125 CA TRP A 149 5.510 -12.157 1.189 1.00 54.22 C ATOM 2126 C TRP A 149 5.640 -12.726 -0.229 1.00 10.44 C ATOM 2127 O TRP A 149 5.429 -12.023 -1.217 1.00 63.44 O ATOM 2128 CB TRP A 149 5.501 -10.628 1.204 1.00 12.33 C ATOM 2129 CG TRP A 149 5.749 -9.979 2.532 1.00 43.23 C ATOM 2130 CD1 TRP A 149 5.253 -10.390 3.719 1.00 13.40 C ATOM 2131 CD2 TRP A 149 6.605 -8.843 2.830 1.00 64.35 C ATOM 2132 NE1 TRP A 149 5.760 -9.599 4.729 1.00 24.30 N ATOM 2133 CE2 TRP A 149 6.581 -8.608 4.234 1.00 54.34 C ATOM 2134 CE3 TRP A 149 7.403 -7.992 2.046 1.00 32.04 C ATOM 2135 CZ2 TRP A 149 7.297 -7.555 4.823 1.00 51.34 C ATOM 2136 CZ3 TRP A 149 8.176 -6.972 2.629 1.00 53.24 C ATOM 2137 CH2 TRP A 149 8.115 -6.748 4.013 1.00 21.30 C ATOM 0 H TRP A 149 7.514 -12.304 1.731 1.00 3.10 H new ATOM 0 HA TRP A 149 4.552 -12.486 1.592 1.00 54.22 H new ATOM 0 HB2 TRP A 149 6.257 -10.274 0.503 1.00 12.33 H new ATOM 0 HB3 TRP A 149 4.535 -10.287 0.831 1.00 12.33 H new ATOM 0 HD1 TRP A 149 4.565 -11.211 3.856 1.00 13.40 H new ATOM 0 HE1 TRP A 149 5.553 -9.731 5.719 1.00 24.30 H new ATOM 0 HE3 TRP A 149 7.423 -8.124 0.974 1.00 32.04 H new ATOM 0 HZ2 TRP A 149 7.221 -7.367 5.884 1.00 51.34 H new ATOM 0 HZ3 TRP A 149 8.817 -6.361 2.011 1.00 53.24 H new ATOM 0 HH2 TRP A 149 8.698 -5.954 4.457 1.00 21.30 H new ATOM 2147 N SER A 150 6.071 -13.984 -0.339 1.00 32.33 N ATOM 2148 CA SER A 150 6.327 -14.647 -1.612 1.00 41.43 C ATOM 2149 C SER A 150 6.145 -16.172 -1.503 1.00 24.40 C ATOM 2150 O SER A 150 5.668 -16.793 -2.456 1.00 50.13 O ATOM 2151 CB SER A 150 7.741 -14.232 -2.071 1.00 43.15 C ATOM 2152 OG SER A 150 8.030 -14.592 -3.410 1.00 61.24 O ATOM 0 H SER A 150 6.254 -14.578 0.470 1.00 32.33 H new ATOM 0 HA SER A 150 5.602 -14.336 -2.365 1.00 41.43 H new ATOM 0 HB2 SER A 150 7.847 -13.153 -1.963 1.00 43.15 H new ATOM 0 HB3 SER A 150 8.478 -14.692 -1.413 1.00 43.15 H new ATOM 0 HG SER A 150 8.937 -14.300 -3.639 1.00 61.24 H new ATOM 2157 N LYS A 151 6.504 -16.779 -0.359 1.00 14.53 N ATOM 2158 CA LYS A 151 6.425 -18.228 -0.158 1.00 11.21 C ATOM 2159 C LYS A 151 4.996 -18.734 -0.091 1.00 34.22 C ATOM 2160 O LYS A 151 4.273 -18.358 0.853 1.00 10.23 O ATOM 2161 CB LYS A 151 7.102 -18.625 1.156 1.00 22.12 C ATOM 2162 CG LYS A 151 8.624 -18.592 1.132 1.00 21.40 C ATOM 2163 CD LYS A 151 9.244 -19.804 0.431 1.00 30.40 C ATOM 2164 CE LYS A 151 10.766 -19.752 0.586 1.00 33.14 C ATOM 2165 NZ LYS A 151 11.221 -19.990 1.971 1.00 12.33 N ATOM 0 H LYS A 151 6.858 -16.273 0.453 1.00 14.53 H new ATOM 0 HA LYS A 151 6.925 -18.673 -1.018 1.00 11.21 H new ATOM 0 HB2 LYS A 151 6.752 -17.958 1.944 1.00 22.12 H new ATOM 0 HB3 LYS A 151 6.780 -19.631 1.424 1.00 22.12 H new ATOM 0 HG2 LYS A 151 8.953 -17.682 0.629 1.00 21.40 H new ATOM 0 HG3 LYS A 151 8.996 -18.543 2.155 1.00 21.40 H new ATOM 0 HD2 LYS A 151 8.854 -20.727 0.861 1.00 30.40 H new ATOM 0 HD3 LYS A 151 8.974 -19.806 -0.625 1.00 30.40 H new ATOM 0 HE2 LYS A 151 11.217 -20.497 -0.070 1.00 33.14 H new ATOM 0 HE3 LYS A 151 11.125 -18.777 0.256 1.00 33.14 H new ATOM 0 HZ1 LYS A 151 12.237 -20.211 1.969 1.00 12.33 H new ATOM 0 HZ2 LYS A 151 11.053 -19.138 2.543 1.00 12.33 H new ATOM 0 HZ3 LYS A 151 10.694 -20.789 2.377 1.00 12.33 H new TER 2175 LYS A 151