USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1058 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 21 LYS NZ :NH3+ -142:sc= 1.11 (180deg=0.735) USER MOD Set 1.2: B 150 MET CE :methyl -172:sc= -1.06 (180deg=-1.5) USER MOD Set 2.1: A 17 HIS : no HE2:sc= -2.65! C(o=-2.7!,f=-5.3!) USER MOD Set 2.2: B 141 MET CE :methyl 159:sc= -0.0225 (180deg=-0.455) USER MOD Set 3.1: B 122 HIS : no HD1:sc= -0.0144 X(o=-0.0032,f=0.16) USER MOD Set 3.2: B 123 SER OG : rot 53:sc= 0.0112 USER MOD Set 4.1: B 102 SER OG : rot -67:sc= 0.351 USER MOD Set 4.2: B 105 HIS : no HD1:sc= 0.112 K(o=0.46,f=-0.19) USER MOD Set 5.1: A 46 TYR OH : rot 166:sc= 0.789 USER MOD Set 5.2: A 71 LYS NZ :NH3+ -136:sc= 0.884 (180deg=-0.512) USER MOD Single : A 1 GLY N :NH3+ -149:sc= 0.0228 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 166:sc= 1.31 (180deg=0.781) USER MOD Single : A 7 HIS : no HD1:sc= -0.406 X(o=-0.41,f=-0.0058) USER MOD Single : A 9 HIS : no HD1:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 11 THR OG1 : rot 170:sc= 1.26 USER MOD Single : A 12 GLN : amide:sc= -1.96! K(o=-2!,f=-0.77) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 GLN : amide:sc= -2.28! K(o=-2.3!,f=0) USER MOD Single : A 29 THR OG1 : rot -112:sc= -0.273 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 180:sc= -5.26! (180deg=-5.26!) USER MOD Single : A 42 ASN : amide:sc= -1.58! K(o=-1.6!,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -169:sc= -0.019 (180deg=-0.18) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 MET CE :methyl 158:sc= -1.92 (180deg=-3.21!) USER MOD Single : A 55 TYR OH : rot 120:sc= -0.169 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0.722 K(o=0.72,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0.675 USER MOD Single : A 64 TYR OH : rot 39:sc= 0.714 USER MOD Single : A 65 TYR OH : rot 165:sc= -0.149 USER MOD Single : A 66 HIS : no HD1:sc= -0.237 X(o=-0.24,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -128:sc= -0.593 (180deg=-2.5!) USER MOD Single : A 76 GLN : amide:sc= -0.66 K(o=-0.66,f=-1.6!) USER MOD Single : A 77 LYS NZ :NH3+ -154:sc= -0.812! (180deg=-2.41!) USER MOD Single : A 82 LYS NZ :NH3+ 170:sc= -1.65 (180deg=-1.92) USER MOD Single : A 85 SER OG : rot 180:sc= -0.169 USER MOD Single : B 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 104 SER OG : rot 180:sc= 0 USER MOD Single : B 106 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 ASN : amide:sc= -1.32 K(o=-1.3,f=-2!) USER MOD Single : B 109 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.7) USER MOD Single : B 110 THR OG1 : rot 180:sc= 0.00422 USER MOD Single : B 112 GLN : amide:sc= 0.608 K(o=0.61,f=-0.18) USER MOD Single : B 116 THR OG1 : rot 77:sc= 0.823 USER MOD Single : B 117 SER OG : rot 147:sc= -1.17! USER MOD Single : B 119 SER OG : rot -26:sc= 0.226 USER MOD Single : B 121 SER OG : rot -155:sc= 1.21 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 132 SER OG : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 26:sc= 1.18 USER MOD Single : B 139 CYS SG : rot -93:sc= 0.395 USER MOD Single : B 143 SER OG : rot -136:sc= 1.25 USER MOD Single : B 147 SER OG : rot -88:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.279 1.454 17.250 1.00 0.00 N ATOM 2 CA GLY A 1 -16.071 2.896 17.205 1.00 0.00 C ATOM 3 C GLY A 1 -17.059 3.546 16.294 1.00 0.00 C ATOM 4 O GLY A 1 -18.236 3.175 16.282 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.007 1.093 18.187 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.282 1.242 17.075 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.696 0.996 16.520 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.165 3.313 18.208 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.058 3.111 16.864 1.00 0.00 H new ATOM 10 N VAL A 2 -16.590 4.487 15.508 1.00 0.00 N ATOM 11 CA VAL A 2 -17.416 5.191 14.570 1.00 0.00 C ATOM 12 C VAL A 2 -17.782 4.252 13.439 1.00 0.00 C ATOM 13 O VAL A 2 -16.911 3.850 12.632 1.00 0.00 O ATOM 14 CB VAL A 2 -16.690 6.409 13.952 1.00 0.00 C ATOM 15 CG1 VAL A 2 -17.633 7.204 13.083 1.00 0.00 C ATOM 16 CG2 VAL A 2 -16.071 7.294 15.006 1.00 0.00 C ATOM 0 H VAL A 2 -15.614 4.784 15.506 1.00 0.00 H new ATOM 0 HA VAL A 2 -18.295 5.545 15.109 1.00 0.00 H new ATOM 0 HB VAL A 2 -15.880 6.023 13.334 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -17.104 8.057 12.657 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -18.008 6.571 12.279 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -18.470 7.560 13.684 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -15.572 8.136 14.527 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -16.849 7.665 15.673 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -15.344 6.721 15.581 1.00 0.00 H new ATOM 26 N ARG A 3 -19.024 3.896 13.387 1.00 0.00 N ATOM 27 CA ARG A 3 -19.510 3.041 12.349 1.00 0.00 C ATOM 28 C ARG A 3 -19.935 3.919 11.217 1.00 0.00 C ATOM 29 O ARG A 3 -20.827 4.757 11.350 1.00 0.00 O ATOM 30 CB ARG A 3 -20.631 2.040 12.793 1.00 0.00 C ATOM 31 CG ARG A 3 -22.021 2.604 13.160 1.00 0.00 C ATOM 32 CD ARG A 3 -22.027 3.442 14.425 1.00 0.00 C ATOM 33 NE ARG A 3 -21.536 2.696 15.595 1.00 0.00 N ATOM 34 CZ ARG A 3 -22.057 2.758 16.825 1.00 0.00 C ATOM 35 NH1 ARG A 3 -23.159 3.467 17.055 1.00 0.00 N ATOM 36 NH2 ARG A 3 -21.477 2.086 17.813 1.00 0.00 N ATOM 0 H ARG A 3 -19.731 4.188 14.061 1.00 0.00 H new ATOM 0 HA ARG A 3 -18.705 2.374 12.042 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -20.768 1.318 11.988 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -20.259 1.488 13.656 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -22.387 3.211 12.332 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -22.719 1.775 13.281 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -21.407 4.326 14.275 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -23.040 3.793 14.620 1.00 0.00 H new ATOM 0 HE ARG A 3 -20.733 2.082 15.456 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -23.612 3.968 16.291 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -23.551 3.510 17.996 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -20.642 1.529 17.630 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -21.866 2.127 18.755 1.00 0.00 H new ATOM 50 N LYS A 4 -19.238 3.796 10.158 1.00 0.00 N ATOM 51 CA LYS A 4 -19.429 4.642 9.029 1.00 0.00 C ATOM 52 C LYS A 4 -20.108 3.842 7.972 1.00 0.00 C ATOM 53 O LYS A 4 -19.551 2.864 7.496 1.00 0.00 O ATOM 54 CB LYS A 4 -18.074 5.130 8.550 1.00 0.00 C ATOM 55 CG LYS A 4 -17.184 5.566 9.681 1.00 0.00 C ATOM 56 CD LYS A 4 -15.796 5.894 9.215 1.00 0.00 C ATOM 57 CE LYS A 4 -14.914 6.220 10.382 1.00 0.00 C ATOM 58 NZ LYS A 4 -14.661 5.041 11.255 1.00 0.00 N ATOM 0 H LYS A 4 -18.505 3.097 10.039 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.041 5.509 9.278 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -17.582 4.334 7.991 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -18.215 5.963 7.861 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -17.618 6.440 10.167 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -17.137 4.775 10.430 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -15.382 5.050 8.663 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -15.827 6.739 8.528 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -13.963 6.608 10.017 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -15.376 7.012 10.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -13.872 5.249 11.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -15.515 4.830 11.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -14.419 4.219 10.666 1.00 0.00 H new ATOM 72 N GLY A 5 -21.296 4.263 7.604 1.00 0.00 N ATOM 73 CA GLY A 5 -22.138 3.528 6.678 1.00 0.00 C ATOM 74 C GLY A 5 -21.511 3.274 5.325 1.00 0.00 C ATOM 75 O GLY A 5 -21.910 2.353 4.607 1.00 0.00 O ATOM 0 H GLY A 5 -21.712 5.132 7.940 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -22.401 2.571 7.128 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -23.067 4.080 6.536 1.00 0.00 H new ATOM 79 N TRP A 6 -20.519 4.057 4.977 1.00 0.00 N ATOM 80 CA TRP A 6 -19.834 3.885 3.720 1.00 0.00 C ATOM 81 C TRP A 6 -18.991 2.604 3.680 1.00 0.00 C ATOM 82 O TRP A 6 -18.495 2.223 2.620 1.00 0.00 O ATOM 83 CB TRP A 6 -18.985 5.108 3.366 1.00 0.00 C ATOM 84 CG TRP A 6 -17.912 5.465 4.357 1.00 0.00 C ATOM 85 CD1 TRP A 6 -18.000 6.374 5.364 1.00 0.00 C ATOM 86 CD2 TRP A 6 -16.578 4.936 4.419 1.00 0.00 C ATOM 87 NE1 TRP A 6 -16.816 6.449 6.030 1.00 0.00 N ATOM 88 CE2 TRP A 6 -15.930 5.573 5.481 1.00 0.00 C ATOM 89 CE3 TRP A 6 -15.877 3.985 3.684 1.00 0.00 C ATOM 90 CZ2 TRP A 6 -14.617 5.297 5.823 1.00 0.00 C ATOM 91 CZ3 TRP A 6 -14.575 3.714 4.026 1.00 0.00 C ATOM 92 CH2 TRP A 6 -13.960 4.365 5.084 1.00 0.00 C ATOM 0 H TRP A 6 -20.167 4.824 5.550 1.00 0.00 H new ATOM 0 HA TRP A 6 -20.610 3.782 2.962 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -18.516 4.934 2.397 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -19.647 5.966 3.250 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -18.881 6.952 5.601 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -16.622 7.066 6.819 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -16.348 3.470 2.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -14.134 5.803 6.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -14.020 2.980 3.460 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -12.935 4.126 5.327 1.00 0.00 H new ATOM 103 N HIS A 7 -18.843 1.928 4.825 1.00 0.00 N ATOM 104 CA HIS A 7 -18.043 0.704 4.896 1.00 0.00 C ATOM 105 C HIS A 7 -18.646 -0.430 4.063 1.00 0.00 C ATOM 106 O HIS A 7 -17.949 -1.353 3.654 1.00 0.00 O ATOM 107 CB HIS A 7 -17.737 0.256 6.364 1.00 0.00 C ATOM 108 CG HIS A 7 -18.895 -0.199 7.230 1.00 0.00 C ATOM 109 ND1 HIS A 7 -18.718 -0.818 8.445 1.00 0.00 N ATOM 110 CD2 HIS A 7 -20.240 -0.093 7.062 1.00 0.00 C ATOM 111 CE1 HIS A 7 -19.919 -1.063 8.966 1.00 0.00 C ATOM 112 NE2 HIS A 7 -20.884 -0.643 8.166 1.00 0.00 N ATOM 0 H HIS A 7 -19.265 2.208 5.710 1.00 0.00 H new ATOM 0 HA HIS A 7 -17.080 0.951 4.449 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -17.014 -0.559 6.320 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -17.249 1.088 6.871 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -20.731 0.348 6.207 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -20.083 -1.543 9.919 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -21.889 -0.708 8.325 1.00 0.00 H new ATOM 120 N GLU A 8 -19.933 -0.316 3.769 1.00 0.00 N ATOM 121 CA GLU A 8 -20.633 -1.301 2.959 1.00 0.00 C ATOM 122 C GLU A 8 -20.368 -1.059 1.484 1.00 0.00 C ATOM 123 O GLU A 8 -20.740 -1.864 0.626 1.00 0.00 O ATOM 124 CB GLU A 8 -22.131 -1.224 3.197 1.00 0.00 C ATOM 125 CG GLU A 8 -22.552 -1.472 4.619 1.00 0.00 C ATOM 126 CD GLU A 8 -24.041 -1.531 4.751 1.00 0.00 C ATOM 127 OE1 GLU A 8 -24.630 -2.543 4.334 1.00 0.00 O ATOM 128 OE2 GLU A 8 -24.655 -0.574 5.263 1.00 0.00 O ATOM 0 H GLU A 8 -20.518 0.458 4.083 1.00 0.00 H new ATOM 0 HA GLU A 8 -20.266 -2.286 3.246 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -22.484 -0.238 2.894 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -22.626 -1.951 2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -22.118 -2.408 4.969 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -22.161 -0.680 5.258 1.00 0.00 H new ATOM 135 N HIS A 9 -19.734 0.048 1.193 1.00 0.00 N ATOM 136 CA HIS A 9 -19.478 0.451 -0.173 1.00 0.00 C ATOM 137 C HIS A 9 -18.043 0.200 -0.555 1.00 0.00 C ATOM 138 O HIS A 9 -17.585 0.589 -1.637 1.00 0.00 O ATOM 139 CB HIS A 9 -19.833 1.915 -0.368 1.00 0.00 C ATOM 140 CG HIS A 9 -21.294 2.199 -0.245 1.00 0.00 C ATOM 141 ND1 HIS A 9 -22.153 2.278 -1.310 1.00 0.00 N ATOM 142 CD2 HIS A 9 -22.048 2.401 0.858 1.00 0.00 C ATOM 143 CE1 HIS A 9 -23.376 2.519 -0.840 1.00 0.00 C ATOM 144 NE2 HIS A 9 -23.368 2.602 0.482 1.00 0.00 N ATOM 0 H HIS A 9 -19.379 0.698 1.894 1.00 0.00 H new ATOM 0 HA HIS A 9 -20.108 -0.152 -0.826 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -19.293 2.512 0.367 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -19.491 2.235 -1.352 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -21.680 2.405 1.874 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -24.257 2.632 -1.455 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -24.165 2.777 1.094 1.00 0.00 H new ATOM 152 N VAL A 10 -17.328 -0.414 0.339 1.00 0.00 N ATOM 153 CA VAL A 10 -15.976 -0.799 0.081 1.00 0.00 C ATOM 154 C VAL A 10 -15.946 -2.265 0.285 1.00 0.00 C ATOM 155 O VAL A 10 -16.314 -2.751 1.371 1.00 0.00 O ATOM 156 CB VAL A 10 -14.962 -0.191 1.065 1.00 0.00 C ATOM 157 CG1 VAL A 10 -13.605 0.066 0.479 1.00 0.00 C ATOM 158 CG2 VAL A 10 -15.505 0.910 1.901 1.00 0.00 C ATOM 0 H VAL A 10 -17.667 -0.662 1.268 1.00 0.00 H new ATOM 0 HA VAL A 10 -15.698 -0.460 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 10 -14.777 -0.988 1.785 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -12.955 0.494 1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -13.179 -0.872 0.124 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -13.695 0.763 -0.355 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -14.725 1.281 2.566 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -15.849 1.720 1.258 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.340 0.538 2.494 1.00 0.00 H new ATOM 168 N THR A 11 -15.590 -2.978 -0.718 1.00 0.00 N ATOM 169 CA THR A 11 -15.524 -4.379 -0.604 1.00 0.00 C ATOM 170 C THR A 11 -14.293 -4.728 0.199 1.00 0.00 C ATOM 171 O THR A 11 -13.289 -3.995 0.134 1.00 0.00 O ATOM 172 CB THR A 11 -15.355 -5.003 -1.974 1.00 0.00 C ATOM 173 OG1 THR A 11 -16.087 -4.247 -2.941 1.00 0.00 O ATOM 174 CG2 THR A 11 -15.876 -6.406 -1.936 1.00 0.00 C ATOM 0 H THR A 11 -15.338 -2.606 -1.634 1.00 0.00 H new ATOM 0 HA THR A 11 -16.436 -4.745 -0.133 1.00 0.00 H new ATOM 0 HB THR A 11 -14.300 -5.007 -2.249 1.00 0.00 H new ATOM 0 HG1 THR A 11 -15.850 -4.551 -3.842 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.759 -6.864 -2.918 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.317 -6.982 -1.198 1.00 0.00 H new ATOM 0 HG23 THR A 11 -16.932 -6.395 -1.664 1.00 0.00 H new ATOM 182 N GLN A 12 -14.347 -5.825 0.924 1.00 0.00 N ATOM 183 CA GLN A 12 -13.201 -6.330 1.628 1.00 0.00 C ATOM 184 C GLN A 12 -12.123 -6.653 0.608 1.00 0.00 C ATOM 185 O GLN A 12 -10.955 -6.374 0.809 1.00 0.00 O ATOM 186 CB GLN A 12 -13.604 -7.544 2.501 1.00 0.00 C ATOM 187 CG GLN A 12 -12.465 -8.285 3.217 1.00 0.00 C ATOM 188 CD GLN A 12 -11.652 -9.239 2.322 1.00 0.00 C ATOM 189 OE1 GLN A 12 -10.469 -9.472 2.569 1.00 0.00 O ATOM 190 NE2 GLN A 12 -12.264 -9.770 1.271 1.00 0.00 N ATOM 0 H GLN A 12 -15.190 -6.388 1.038 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.800 -5.587 2.317 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -14.314 -7.201 3.254 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -14.131 -8.259 1.868 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -11.787 -7.549 3.649 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.886 -8.856 4.045 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -13.246 -9.559 1.092 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.753 -10.390 0.642 1.00 0.00 H new ATOM 199 N ASP A 13 -12.552 -7.173 -0.514 1.00 0.00 N ATOM 200 CA ASP A 13 -11.661 -7.503 -1.603 1.00 0.00 C ATOM 201 C ASP A 13 -11.025 -6.239 -2.207 1.00 0.00 C ATOM 202 O ASP A 13 -9.865 -6.258 -2.588 1.00 0.00 O ATOM 203 CB ASP A 13 -12.414 -8.296 -2.663 1.00 0.00 C ATOM 204 CG ASP A 13 -11.529 -8.787 -3.781 1.00 0.00 C ATOM 205 OD1 ASP A 13 -10.809 -9.793 -3.584 1.00 0.00 O ATOM 206 OD2 ASP A 13 -11.569 -8.216 -4.884 1.00 0.00 O ATOM 0 H ASP A 13 -13.533 -7.381 -0.701 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.850 -8.118 -1.213 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -12.899 -9.150 -2.191 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -13.204 -7.672 -3.081 1.00 0.00 H new ATOM 211 N LEU A 14 -11.758 -5.106 -2.165 1.00 0.00 N ATOM 212 CA LEU A 14 -11.269 -3.851 -2.755 1.00 0.00 C ATOM 213 C LEU A 14 -10.228 -3.294 -1.834 1.00 0.00 C ATOM 214 O LEU A 14 -9.097 -3.047 -2.242 1.00 0.00 O ATOM 215 CB LEU A 14 -12.458 -2.845 -2.960 1.00 0.00 C ATOM 216 CG LEU A 14 -12.177 -1.399 -3.510 1.00 0.00 C ATOM 217 CD1 LEU A 14 -11.601 -0.502 -2.452 1.00 0.00 C ATOM 218 CD2 LEU A 14 -11.252 -1.397 -4.708 1.00 0.00 C ATOM 0 H LEU A 14 -12.680 -5.039 -1.733 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.832 -4.027 -3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -13.169 -3.317 -3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -12.959 -2.735 -1.998 1.00 0.00 H new ATOM 0 HG LEU A 14 -13.149 -1.017 -3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.421 0.488 -2.872 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.303 -0.422 -1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.660 -0.920 -2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -11.094 -0.372 -5.044 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.295 -1.839 -4.430 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.699 -1.978 -5.514 1.00 0.00 H new ATOM 230 N ARG A 15 -10.600 -3.142 -0.570 1.00 0.00 N ATOM 231 CA ARG A 15 -9.672 -2.688 0.430 1.00 0.00 C ATOM 232 C ARG A 15 -8.426 -3.562 0.531 1.00 0.00 C ATOM 233 O ARG A 15 -7.317 -3.055 0.531 1.00 0.00 O ATOM 234 CB ARG A 15 -10.358 -2.525 1.761 1.00 0.00 C ATOM 235 CG ARG A 15 -11.097 -3.696 2.273 1.00 0.00 C ATOM 236 CD ARG A 15 -11.983 -3.265 3.383 1.00 0.00 C ATOM 237 NE ARG A 15 -11.187 -2.549 4.426 1.00 0.00 N ATOM 238 CZ ARG A 15 -11.453 -2.446 5.736 1.00 0.00 C ATOM 239 NH1 ARG A 15 -12.624 -2.841 6.237 1.00 0.00 N ATOM 240 NH2 ARG A 15 -10.549 -1.898 6.535 1.00 0.00 N ATOM 0 H ARG A 15 -11.541 -3.329 -0.223 1.00 0.00 H new ATOM 0 HA ARG A 15 -9.316 -1.709 0.111 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.606 -2.247 2.500 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.054 -1.690 1.685 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -11.687 -4.147 1.475 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.400 -4.457 2.623 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.767 -2.612 3.000 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -12.477 -4.132 3.822 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.340 -2.083 4.102 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.337 -3.230 5.620 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.806 -2.754 7.237 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.666 -1.562 6.151 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.736 -1.812 7.534 1.00 0.00 H new ATOM 254 N SER A 16 -8.607 -4.871 0.533 1.00 0.00 N ATOM 255 CA SER A 16 -7.496 -5.779 0.643 1.00 0.00 C ATOM 256 C SER A 16 -6.635 -5.751 -0.633 1.00 0.00 C ATOM 257 O SER A 16 -5.438 -6.021 -0.581 1.00 0.00 O ATOM 258 CB SER A 16 -7.987 -7.198 0.967 1.00 0.00 C ATOM 259 OG SER A 16 -6.908 -8.094 1.205 1.00 0.00 O ATOM 0 H SER A 16 -9.518 -5.323 0.459 1.00 0.00 H new ATOM 0 HA SER A 16 -6.863 -5.453 1.468 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.633 -7.167 1.845 1.00 0.00 H new ATOM 0 HB3 SER A 16 -8.592 -7.570 0.140 1.00 0.00 H new ATOM 0 HG SER A 16 -7.262 -8.985 1.409 1.00 0.00 H new ATOM 265 N HIS A 17 -7.235 -5.390 -1.767 1.00 0.00 N ATOM 266 CA HIS A 17 -6.488 -5.285 -3.015 1.00 0.00 C ATOM 267 C HIS A 17 -5.560 -4.076 -2.931 1.00 0.00 C ATOM 268 O HIS A 17 -4.421 -4.098 -3.426 1.00 0.00 O ATOM 269 CB HIS A 17 -7.438 -5.145 -4.210 1.00 0.00 C ATOM 270 CG HIS A 17 -6.792 -5.451 -5.530 1.00 0.00 C ATOM 271 ND1 HIS A 17 -6.577 -6.725 -6.004 1.00 0.00 N ATOM 272 CD2 HIS A 17 -6.296 -4.623 -6.463 1.00 0.00 C ATOM 273 CE1 HIS A 17 -5.963 -6.636 -7.179 1.00 0.00 C ATOM 274 NE2 HIS A 17 -5.765 -5.371 -7.514 1.00 0.00 N ATOM 0 H HIS A 17 -8.227 -5.168 -1.845 1.00 0.00 H new ATOM 0 HA HIS A 17 -5.902 -6.192 -3.162 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -8.288 -5.812 -4.068 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -7.831 -4.129 -4.234 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -6.843 -7.590 -5.534 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -6.306 -3.544 -6.408 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.665 -7.482 -7.780 1.00 0.00 H new ATOM 282 N LEU A 18 -6.058 -3.035 -2.298 1.00 0.00 N ATOM 283 CA LEU A 18 -5.297 -1.828 -2.022 1.00 0.00 C ATOM 284 C LEU A 18 -4.173 -2.148 -1.040 1.00 0.00 C ATOM 285 O LEU A 18 -3.045 -1.724 -1.231 1.00 0.00 O ATOM 286 CB LEU A 18 -6.241 -0.732 -1.483 1.00 0.00 C ATOM 287 CG LEU A 18 -7.075 0.092 -2.515 1.00 0.00 C ATOM 288 CD1 LEU A 18 -7.523 -0.729 -3.707 1.00 0.00 C ATOM 289 CD2 LEU A 18 -8.309 0.614 -1.848 1.00 0.00 C ATOM 0 H LEU A 18 -7.018 -3.000 -1.954 1.00 0.00 H new ATOM 0 HA LEU A 18 -4.842 -1.451 -2.938 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.939 -1.203 -0.791 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.641 -0.031 -0.903 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.425 0.892 -2.870 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.098 -0.100 -4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.649 -1.122 -4.227 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.145 -1.557 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.894 1.190 -2.565 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.905 -0.221 -1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.028 1.254 -1.012 1.00 0.00 H new ATOM 301 N VAL A 19 -4.499 -2.940 -0.022 1.00 0.00 N ATOM 302 CA VAL A 19 -3.524 -3.457 0.969 1.00 0.00 C ATOM 303 C VAL A 19 -2.393 -4.208 0.247 1.00 0.00 C ATOM 304 O VAL A 19 -1.205 -3.969 0.485 1.00 0.00 O ATOM 305 CB VAL A 19 -4.226 -4.456 1.948 1.00 0.00 C ATOM 306 CG1 VAL A 19 -3.260 -5.109 2.874 1.00 0.00 C ATOM 307 CG2 VAL A 19 -5.282 -3.781 2.752 1.00 0.00 C ATOM 0 H VAL A 19 -5.455 -3.252 0.151 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.121 -2.611 1.526 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.681 -5.221 1.319 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.794 -5.793 3.534 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.521 -5.664 2.296 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.757 -4.348 3.471 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -5.748 -4.504 3.421 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.835 -2.979 3.340 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.037 -3.365 2.085 1.00 0.00 H new ATOM 317 N HIS A 20 -2.797 -5.113 -0.610 1.00 0.00 N ATOM 318 CA HIS A 20 -1.914 -5.898 -1.449 1.00 0.00 C ATOM 319 C HIS A 20 -0.950 -4.984 -2.233 1.00 0.00 C ATOM 320 O HIS A 20 0.274 -5.206 -2.266 1.00 0.00 O ATOM 321 CB HIS A 20 -2.809 -6.733 -2.386 1.00 0.00 C ATOM 322 CG HIS A 20 -2.134 -7.375 -3.535 1.00 0.00 C ATOM 323 ND1 HIS A 20 -2.376 -7.014 -4.840 1.00 0.00 N ATOM 324 CD2 HIS A 20 -1.240 -8.376 -3.573 1.00 0.00 C ATOM 325 CE1 HIS A 20 -1.643 -7.782 -5.623 1.00 0.00 C ATOM 326 NE2 HIS A 20 -0.924 -8.642 -4.905 1.00 0.00 N ATOM 0 H HIS A 20 -3.783 -5.334 -0.750 1.00 0.00 H new ATOM 0 HA HIS A 20 -1.285 -6.558 -0.851 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -3.292 -7.511 -1.795 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -3.599 -6.087 -2.770 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.833 -8.890 -2.715 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -1.628 -7.721 -6.701 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -0.277 -9.348 -5.256 1.00 0.00 H new ATOM 334 N LYS A 21 -1.504 -3.954 -2.826 1.00 0.00 N ATOM 335 CA LYS A 21 -0.725 -2.995 -3.564 1.00 0.00 C ATOM 336 C LYS A 21 0.187 -2.203 -2.662 1.00 0.00 C ATOM 337 O LYS A 21 1.341 -1.952 -3.028 1.00 0.00 O ATOM 338 CB LYS A 21 -1.621 -2.117 -4.427 1.00 0.00 C ATOM 339 CG LYS A 21 -2.113 -2.862 -5.623 1.00 0.00 C ATOM 340 CD LYS A 21 -3.171 -2.116 -6.384 1.00 0.00 C ATOM 341 CE LYS A 21 -3.614 -2.916 -7.595 1.00 0.00 C ATOM 342 NZ LYS A 21 -2.479 -3.302 -8.477 1.00 0.00 N ATOM 0 H LYS A 21 -2.505 -3.759 -2.810 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.070 -3.539 -4.244 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.469 -1.768 -3.838 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.070 -1.233 -4.747 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.273 -3.068 -6.287 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.513 -3.825 -5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -4.026 -1.922 -5.736 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -2.785 -1.147 -6.701 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.131 -3.816 -7.261 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.332 -2.330 -8.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -2.775 -3.238 -9.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.677 -2.660 -8.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -2.190 -4.278 -8.264 1.00 0.00 H new ATOM 356 N LEU A 22 -0.319 -1.828 -1.485 1.00 0.00 N ATOM 357 CA LEU A 22 0.470 -1.139 -0.475 1.00 0.00 C ATOM 358 C LEU A 22 1.743 -1.896 -0.202 1.00 0.00 C ATOM 359 O LEU A 22 2.813 -1.316 -0.287 1.00 0.00 O ATOM 360 CB LEU A 22 -0.324 -0.932 0.823 1.00 0.00 C ATOM 361 CG LEU A 22 -1.404 0.148 0.802 1.00 0.00 C ATOM 362 CD1 LEU A 22 -2.236 0.090 2.070 1.00 0.00 C ATOM 363 CD2 LEU A 22 -0.750 1.489 0.739 1.00 0.00 C ATOM 0 H LEU A 22 -1.287 -1.996 -1.210 1.00 0.00 H new ATOM 0 HA LEU A 22 0.721 -0.152 -0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -0.795 -1.879 1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.381 -0.692 1.619 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.045 -0.016 -0.064 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.001 0.866 2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.713 -0.887 2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.592 0.249 2.935 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.514 2.266 0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.112 1.624 1.613 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.145 1.557 -0.165 1.00 0.00 H new ATOM 375 N VAL A 23 1.614 -3.207 0.069 1.00 0.00 N ATOM 376 CA VAL A 23 2.773 -4.086 0.284 1.00 0.00 C ATOM 377 C VAL A 23 3.721 -3.998 -0.889 1.00 0.00 C ATOM 378 O VAL A 23 4.860 -3.723 -0.708 1.00 0.00 O ATOM 379 CB VAL A 23 2.374 -5.582 0.433 1.00 0.00 C ATOM 380 CG1 VAL A 23 3.622 -6.464 0.464 1.00 0.00 C ATOM 381 CG2 VAL A 23 1.572 -5.802 1.679 1.00 0.00 C ATOM 0 H VAL A 23 0.714 -3.681 0.144 1.00 0.00 H new ATOM 0 HA VAL A 23 3.239 -3.744 1.208 1.00 0.00 H new ATOM 0 HB VAL A 23 1.762 -5.853 -0.428 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.327 -7.508 0.569 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.181 -6.336 -0.463 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.249 -6.178 1.308 1.00 0.00 H new ATOM 0 HG21 VAL A 23 1.306 -6.856 1.759 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.162 -5.510 2.548 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.664 -5.201 1.638 1.00 0.00 H new ATOM 391 N GLN A 24 3.207 -4.205 -2.089 1.00 0.00 N ATOM 392 CA GLN A 24 4.041 -4.220 -3.299 1.00 0.00 C ATOM 393 C GLN A 24 4.903 -2.950 -3.453 1.00 0.00 C ATOM 394 O GLN A 24 6.025 -3.018 -3.949 1.00 0.00 O ATOM 395 CB GLN A 24 3.180 -4.434 -4.543 1.00 0.00 C ATOM 396 CG GLN A 24 2.486 -5.789 -4.620 1.00 0.00 C ATOM 397 CD GLN A 24 3.354 -6.898 -5.216 1.00 0.00 C ATOM 398 OE1 GLN A 24 2.833 -7.833 -5.814 1.00 0.00 O ATOM 399 NE2 GLN A 24 4.658 -6.797 -5.105 1.00 0.00 N ATOM 0 H GLN A 24 2.215 -4.366 -2.261 1.00 0.00 H new ATOM 0 HA GLN A 24 4.731 -5.056 -3.190 1.00 0.00 H new ATOM 0 HB2 GLN A 24 2.422 -3.652 -4.581 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.807 -4.313 -5.426 1.00 0.00 H new ATOM 0 HG2 GLN A 24 2.175 -6.084 -3.618 1.00 0.00 H new ATOM 0 HG3 GLN A 24 1.581 -5.689 -5.219 1.00 0.00 H new ATOM 0 HE21 GLN A 24 5.068 -6.010 -4.602 1.00 0.00 H new ATOM 0 HE22 GLN A 24 5.262 -7.506 -5.521 1.00 0.00 H new ATOM 408 N ALA A 25 4.360 -1.813 -3.064 1.00 0.00 N ATOM 409 CA ALA A 25 5.093 -0.571 -3.107 1.00 0.00 C ATOM 410 C ALA A 25 6.017 -0.393 -1.884 1.00 0.00 C ATOM 411 O ALA A 25 7.170 -0.037 -2.019 1.00 0.00 O ATOM 412 CB ALA A 25 4.113 0.550 -3.159 1.00 0.00 C ATOM 0 H ALA A 25 3.406 -1.728 -2.713 1.00 0.00 H new ATOM 0 HA ALA A 25 5.730 -0.579 -3.992 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.648 1.499 -3.192 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.494 0.451 -4.051 1.00 0.00 H new ATOM 0 HB3 ALA A 25 3.480 0.521 -2.272 1.00 0.00 H new ATOM 418 N ILE A 26 5.505 -0.666 -0.698 1.00 0.00 N ATOM 419 CA ILE A 26 6.262 -0.420 0.539 1.00 0.00 C ATOM 420 C ILE A 26 7.326 -1.513 0.746 1.00 0.00 C ATOM 421 O ILE A 26 8.372 -1.294 1.360 1.00 0.00 O ATOM 422 CB ILE A 26 5.282 -0.297 1.772 1.00 0.00 C ATOM 423 CG1 ILE A 26 5.956 0.297 3.046 1.00 0.00 C ATOM 424 CG2 ILE A 26 4.634 -1.637 2.085 1.00 0.00 C ATOM 425 CD1 ILE A 26 6.633 -0.710 3.964 1.00 0.00 C ATOM 0 H ILE A 26 4.574 -1.056 -0.554 1.00 0.00 H new ATOM 0 HA ILE A 26 6.789 0.530 0.451 1.00 0.00 H new ATOM 0 HB ILE A 26 4.511 0.414 1.474 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.698 1.032 2.733 1.00 0.00 H new ATOM 0 HG13 ILE A 26 5.199 0.832 3.619 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.964 -1.527 2.938 1.00 0.00 H new ATOM 0 HG22 ILE A 26 4.067 -1.978 1.219 1.00 0.00 H new ATOM 0 HG23 ILE A 26 5.407 -2.368 2.323 1.00 0.00 H new ATOM 0 HD11 ILE A 26 7.068 -0.190 4.817 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.897 -1.433 4.317 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.419 -1.230 3.417 1.00 0.00 H new ATOM 437 N PHE A 27 7.062 -2.647 0.203 1.00 0.00 N ATOM 438 CA PHE A 27 7.910 -3.784 0.277 1.00 0.00 C ATOM 439 C PHE A 27 8.113 -4.370 -1.114 1.00 0.00 C ATOM 440 O PHE A 27 7.276 -5.146 -1.591 1.00 0.00 O ATOM 441 CB PHE A 27 7.295 -4.852 1.188 1.00 0.00 C ATOM 442 CG PHE A 27 7.368 -4.572 2.664 1.00 0.00 C ATOM 443 CD1 PHE A 27 8.586 -4.568 3.321 1.00 0.00 C ATOM 444 CD2 PHE A 27 6.220 -4.343 3.399 1.00 0.00 C ATOM 445 CE1 PHE A 27 8.655 -4.334 4.683 1.00 0.00 C ATOM 446 CE2 PHE A 27 6.282 -4.105 4.759 1.00 0.00 C ATOM 447 CZ PHE A 27 7.501 -4.101 5.401 1.00 0.00 C ATOM 0 H PHE A 27 6.209 -2.816 -0.330 1.00 0.00 H new ATOM 0 HA PHE A 27 8.870 -3.472 0.689 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.248 -4.979 0.912 1.00 0.00 H new ATOM 0 HB3 PHE A 27 7.794 -5.801 0.992 1.00 0.00 H new ATOM 0 HD1 PHE A 27 9.493 -4.750 2.764 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.261 -4.350 2.903 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.612 -4.334 5.183 1.00 0.00 H new ATOM 0 HE2 PHE A 27 5.376 -3.922 5.318 1.00 0.00 H new ATOM 0 HZ PHE A 27 7.553 -3.916 6.464 1.00 0.00 H new ATOM 457 N PRO A 28 9.182 -3.972 -1.817 1.00 0.00 N ATOM 458 CA PRO A 28 9.487 -4.529 -3.123 1.00 0.00 C ATOM 459 C PRO A 28 9.844 -6.010 -2.987 1.00 0.00 C ATOM 460 O PRO A 28 10.898 -6.375 -2.426 1.00 0.00 O ATOM 461 CB PRO A 28 10.682 -3.704 -3.612 1.00 0.00 C ATOM 462 CG PRO A 28 11.290 -3.157 -2.379 1.00 0.00 C ATOM 463 CD PRO A 28 10.162 -2.953 -1.409 1.00 0.00 C ATOM 0 HA PRO A 28 8.650 -4.481 -3.820 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.391 -4.322 -4.163 1.00 0.00 H new ATOM 0 HB3 PRO A 28 10.364 -2.907 -4.284 1.00 0.00 H new ATOM 0 HG2 PRO A 28 12.032 -3.844 -1.973 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.803 -2.217 -2.582 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.486 -3.096 -0.378 1.00 0.00 H new ATOM 0 HD3 PRO A 28 9.749 -1.947 -1.477 1.00 0.00 H new ATOM 471 N THR A 29 8.955 -6.847 -3.452 1.00 0.00 N ATOM 472 CA THR A 29 9.104 -8.261 -3.295 1.00 0.00 C ATOM 473 C THR A 29 10.147 -8.821 -4.272 1.00 0.00 C ATOM 474 O THR A 29 10.242 -8.365 -5.422 1.00 0.00 O ATOM 475 CB THR A 29 7.736 -9.001 -3.459 1.00 0.00 C ATOM 476 OG1 THR A 29 7.860 -10.366 -3.044 1.00 0.00 O ATOM 477 CG2 THR A 29 7.240 -8.970 -4.903 1.00 0.00 C ATOM 0 H THR A 29 8.110 -6.564 -3.949 1.00 0.00 H new ATOM 0 HA THR A 29 9.461 -8.440 -2.281 1.00 0.00 H new ATOM 0 HB THR A 29 7.013 -8.479 -2.833 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.764 -10.954 -3.822 1.00 0.00 H new ATOM 0 HG21 THR A 29 6.287 -9.495 -4.972 1.00 0.00 H new ATOM 0 HG22 THR A 29 7.108 -7.936 -5.220 1.00 0.00 H new ATOM 0 HG23 THR A 29 7.970 -9.457 -5.549 1.00 0.00 H new ATOM 485 N PRO A 30 10.978 -9.773 -3.813 1.00 0.00 N ATOM 486 CA PRO A 30 11.951 -10.436 -4.669 1.00 0.00 C ATOM 487 C PRO A 30 11.264 -11.400 -5.641 1.00 0.00 C ATOM 488 O PRO A 30 11.651 -11.520 -6.798 1.00 0.00 O ATOM 489 CB PRO A 30 12.831 -11.218 -3.677 1.00 0.00 C ATOM 490 CG PRO A 30 11.965 -11.429 -2.479 1.00 0.00 C ATOM 491 CD PRO A 30 11.060 -10.236 -2.406 1.00 0.00 C ATOM 0 HA PRO A 30 12.513 -9.734 -5.285 1.00 0.00 H new ATOM 0 HB2 PRO A 30 13.157 -12.168 -4.101 1.00 0.00 H new ATOM 0 HB3 PRO A 30 13.731 -10.658 -3.421 1.00 0.00 H new ATOM 0 HG2 PRO A 30 11.389 -12.350 -2.571 1.00 0.00 H new ATOM 0 HG3 PRO A 30 12.566 -11.518 -1.574 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.078 -10.501 -2.013 1.00 0.00 H new ATOM 0 HD3 PRO A 30 11.467 -9.464 -1.753 1.00 0.00 H new ATOM 499 N ASP A 31 10.219 -12.044 -5.175 1.00 0.00 N ATOM 500 CA ASP A 31 9.519 -13.047 -5.951 1.00 0.00 C ATOM 501 C ASP A 31 8.064 -12.991 -5.583 1.00 0.00 C ATOM 502 O ASP A 31 7.746 -12.674 -4.437 1.00 0.00 O ATOM 503 CB ASP A 31 10.038 -14.431 -5.580 1.00 0.00 C ATOM 504 CG ASP A 31 9.531 -15.529 -6.480 1.00 0.00 C ATOM 505 OD1 ASP A 31 10.158 -15.791 -7.523 1.00 0.00 O ATOM 506 OD2 ASP A 31 8.513 -16.163 -6.144 1.00 0.00 O ATOM 0 H ASP A 31 9.828 -11.888 -4.246 1.00 0.00 H new ATOM 0 HA ASP A 31 9.670 -12.862 -7.015 1.00 0.00 H new ATOM 0 HB2 ASP A 31 11.128 -14.421 -5.612 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.751 -14.654 -4.552 1.00 0.00 H new ATOM 511 N PRO A 32 7.153 -13.251 -6.516 1.00 0.00 N ATOM 512 CA PRO A 32 5.727 -13.308 -6.221 1.00 0.00 C ATOM 513 C PRO A 32 5.354 -14.300 -5.100 1.00 0.00 C ATOM 514 O PRO A 32 4.341 -14.127 -4.428 1.00 0.00 O ATOM 515 CB PRO A 32 5.084 -13.739 -7.528 1.00 0.00 C ATOM 516 CG PRO A 32 6.203 -14.170 -8.412 1.00 0.00 C ATOM 517 CD PRO A 32 7.408 -13.429 -7.954 1.00 0.00 C ATOM 0 HA PRO A 32 5.385 -12.340 -5.854 1.00 0.00 H new ATOM 0 HB2 PRO A 32 4.378 -14.554 -7.366 1.00 0.00 H new ATOM 0 HB3 PRO A 32 4.525 -12.918 -7.978 1.00 0.00 H new ATOM 0 HG2 PRO A 32 6.360 -15.247 -8.344 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.982 -13.946 -9.456 1.00 0.00 H new ATOM 0 HD2 PRO A 32 8.323 -13.993 -8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.515 -12.473 -8.467 1.00 0.00 H new ATOM 525 N ALA A 33 6.171 -15.309 -4.855 1.00 0.00 N ATOM 526 CA ALA A 33 5.832 -16.258 -3.811 1.00 0.00 C ATOM 527 C ALA A 33 6.119 -15.701 -2.424 1.00 0.00 C ATOM 528 O ALA A 33 5.666 -16.251 -1.417 1.00 0.00 O ATOM 529 CB ALA A 33 6.485 -17.609 -4.012 1.00 0.00 C ATOM 0 H ALA A 33 7.046 -15.490 -5.347 1.00 0.00 H new ATOM 0 HA ALA A 33 4.756 -16.419 -3.885 1.00 0.00 H new ATOM 0 HB1 ALA A 33 6.195 -18.277 -3.201 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.162 -18.031 -4.963 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.569 -17.492 -4.016 1.00 0.00 H new ATOM 535 N ALA A 34 6.828 -14.586 -2.366 1.00 0.00 N ATOM 536 CA ALA A 34 7.093 -13.927 -1.102 1.00 0.00 C ATOM 537 C ALA A 34 5.855 -13.151 -0.661 1.00 0.00 C ATOM 538 O ALA A 34 5.752 -12.693 0.472 1.00 0.00 O ATOM 539 CB ALA A 34 8.307 -13.017 -1.201 1.00 0.00 C ATOM 0 H ALA A 34 7.229 -14.120 -3.180 1.00 0.00 H new ATOM 0 HA ALA A 34 7.320 -14.684 -0.351 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.481 -12.537 -0.238 1.00 0.00 H new ATOM 0 HB2 ALA A 34 9.182 -13.606 -1.476 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.130 -12.255 -1.960 1.00 0.00 H new ATOM 545 N LEU A 35 4.892 -13.069 -1.566 1.00 0.00 N ATOM 546 CA LEU A 35 3.656 -12.352 -1.336 1.00 0.00 C ATOM 547 C LEU A 35 2.607 -13.281 -0.731 1.00 0.00 C ATOM 548 O LEU A 35 1.511 -12.865 -0.398 1.00 0.00 O ATOM 549 CB LEU A 35 3.139 -11.827 -2.649 1.00 0.00 C ATOM 550 CG LEU A 35 4.128 -11.013 -3.453 1.00 0.00 C ATOM 551 CD1 LEU A 35 3.658 -10.899 -4.870 1.00 0.00 C ATOM 552 CD2 LEU A 35 4.308 -9.648 -2.840 1.00 0.00 C ATOM 0 H LEU A 35 4.951 -13.503 -2.487 1.00 0.00 H new ATOM 0 HA LEU A 35 3.848 -11.530 -0.646 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.810 -12.671 -3.255 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.260 -11.212 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 35 5.094 -11.518 -3.444 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.374 -10.312 -5.445 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.572 -11.894 -5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.685 -10.408 -4.892 1.00 0.00 H new ATOM 0 HD21 LEU A 35 5.023 -9.075 -3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 35 3.351 -9.127 -2.824 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.681 -9.753 -1.821 1.00 0.00 H new ATOM 564 N LYS A 36 2.951 -14.539 -0.637 1.00 0.00 N ATOM 565 CA LYS A 36 2.088 -15.569 -0.067 1.00 0.00 C ATOM 566 C LYS A 36 2.939 -16.398 0.886 1.00 0.00 C ATOM 567 O LYS A 36 2.741 -17.603 1.080 1.00 0.00 O ATOM 568 CB LYS A 36 1.524 -16.421 -1.212 1.00 0.00 C ATOM 569 CG LYS A 36 2.600 -17.055 -2.082 1.00 0.00 C ATOM 570 CD LYS A 36 2.032 -17.751 -3.305 1.00 0.00 C ATOM 571 CE LYS A 36 1.359 -16.765 -4.257 1.00 0.00 C ATOM 572 NZ LYS A 36 0.892 -17.425 -5.486 1.00 0.00 N ATOM 0 H LYS A 36 3.852 -14.894 -0.957 1.00 0.00 H new ATOM 0 HA LYS A 36 1.247 -15.146 0.482 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.895 -17.207 -0.794 1.00 0.00 H new ATOM 0 HB3 LYS A 36 0.883 -15.799 -1.836 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.303 -16.286 -2.401 1.00 0.00 H new ATOM 0 HG3 LYS A 36 3.163 -17.775 -1.488 1.00 0.00 H new ATOM 0 HD2 LYS A 36 2.831 -18.275 -3.829 1.00 0.00 H new ATOM 0 HD3 LYS A 36 1.309 -18.505 -2.992 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.515 -16.293 -3.754 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.061 -15.972 -4.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.441 -16.723 -6.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.701 -17.854 -5.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.203 -18.165 -5.242 1.00 0.00 H new ATOM 586 N ASP A 37 3.869 -15.713 1.491 1.00 0.00 N ATOM 587 CA ASP A 37 4.888 -16.310 2.329 1.00 0.00 C ATOM 588 C ASP A 37 4.689 -15.908 3.787 1.00 0.00 C ATOM 589 O ASP A 37 3.804 -15.111 4.099 1.00 0.00 O ATOM 590 CB ASP A 37 6.218 -15.782 1.842 1.00 0.00 C ATOM 591 CG ASP A 37 7.396 -16.388 2.484 1.00 0.00 C ATOM 592 OD1 ASP A 37 7.684 -17.556 2.222 1.00 0.00 O ATOM 593 OD2 ASP A 37 8.007 -15.716 3.310 1.00 0.00 O ATOM 0 H ASP A 37 3.947 -14.699 1.417 1.00 0.00 H new ATOM 0 HA ASP A 37 4.839 -17.397 2.271 1.00 0.00 H new ATOM 0 HB2 ASP A 37 6.285 -15.943 0.766 1.00 0.00 H new ATOM 0 HB3 ASP A 37 6.247 -14.705 2.005 1.00 0.00 H new ATOM 598 N ARG A 38 5.512 -16.442 4.667 1.00 0.00 N ATOM 599 CA ARG A 38 5.479 -16.101 6.063 1.00 0.00 C ATOM 600 C ARG A 38 6.007 -14.683 6.284 1.00 0.00 C ATOM 601 O ARG A 38 5.651 -14.021 7.237 1.00 0.00 O ATOM 602 CB ARG A 38 6.242 -17.132 6.903 1.00 0.00 C ATOM 603 CG ARG A 38 7.782 -16.991 7.031 1.00 0.00 C ATOM 604 CD ARG A 38 8.519 -17.316 5.752 1.00 0.00 C ATOM 605 NE ARG A 38 9.980 -17.332 5.929 1.00 0.00 N ATOM 606 CZ ARG A 38 10.879 -16.937 5.011 1.00 0.00 C ATOM 607 NH1 ARG A 38 10.491 -16.354 3.886 1.00 0.00 N ATOM 608 NH2 ARG A 38 12.169 -17.106 5.242 1.00 0.00 N ATOM 0 H ARG A 38 6.226 -17.129 4.425 1.00 0.00 H new ATOM 0 HA ARG A 38 4.442 -16.122 6.397 1.00 0.00 H new ATOM 0 HB2 ARG A 38 5.823 -17.115 7.909 1.00 0.00 H new ATOM 0 HB3 ARG A 38 6.033 -18.118 6.487 1.00 0.00 H new ATOM 0 HG2 ARG A 38 8.023 -15.972 7.332 1.00 0.00 H new ATOM 0 HG3 ARG A 38 8.136 -17.650 7.824 1.00 0.00 H new ATOM 0 HD2 ARG A 38 8.191 -18.288 5.385 1.00 0.00 H new ATOM 0 HD3 ARG A 38 8.257 -16.582 4.990 1.00 0.00 H new ATOM 0 HE ARG A 38 10.340 -17.671 6.821 1.00 0.00 H new ATOM 0 HH11 ARG A 38 9.499 -16.200 3.707 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.185 -16.060 3.199 1.00 0.00 H new ATOM 0 HH21 ARG A 38 12.479 -17.535 6.114 1.00 0.00 H new ATOM 0 HH22 ARG A 38 12.855 -16.808 4.548 1.00 0.00 H new ATOM 622 N ARG A 39 6.854 -14.208 5.376 1.00 0.00 N ATOM 623 CA ARG A 39 7.344 -12.845 5.462 1.00 0.00 C ATOM 624 C ARG A 39 6.191 -11.892 5.115 1.00 0.00 C ATOM 625 O ARG A 39 6.076 -10.773 5.665 1.00 0.00 O ATOM 626 CB ARG A 39 8.525 -12.636 4.502 1.00 0.00 C ATOM 627 CG ARG A 39 9.218 -11.266 4.591 1.00 0.00 C ATOM 628 CD ARG A 39 10.099 -11.106 5.844 1.00 0.00 C ATOM 629 NE ARG A 39 9.360 -11.148 7.129 1.00 0.00 N ATOM 630 CZ ARG A 39 9.951 -11.114 8.349 1.00 0.00 C ATOM 631 NH1 ARG A 39 11.272 -11.032 8.452 1.00 0.00 N ATOM 632 NH2 ARG A 39 9.214 -11.175 9.459 1.00 0.00 N ATOM 0 H ARG A 39 7.209 -14.742 4.583 1.00 0.00 H new ATOM 0 HA ARG A 39 7.699 -12.642 6.472 1.00 0.00 H new ATOM 0 HB2 ARG A 39 9.267 -13.412 4.693 1.00 0.00 H new ATOM 0 HB3 ARG A 39 8.170 -12.778 3.481 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.833 -11.120 3.703 1.00 0.00 H new ATOM 0 HG3 ARG A 39 8.460 -10.483 4.587 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.851 -11.895 5.847 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.633 -10.158 5.778 1.00 0.00 H new ATOM 0 HE ARG A 39 8.342 -11.206 7.093 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.848 -10.994 7.611 1.00 0.00 H new ATOM 0 HH12 ARG A 39 11.711 -11.007 9.372 1.00 0.00 H new ATOM 0 HH21 ARG A 39 8.199 -11.248 9.394 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.666 -11.149 10.373 1.00 0.00 H new ATOM 646 N MET A 40 5.310 -12.385 4.249 1.00 0.00 N ATOM 647 CA MET A 40 4.135 -11.662 3.794 1.00 0.00 C ATOM 648 C MET A 40 3.233 -11.260 4.919 1.00 0.00 C ATOM 649 O MET A 40 2.774 -10.154 4.920 1.00 0.00 O ATOM 650 CB MET A 40 3.376 -12.441 2.704 1.00 0.00 C ATOM 651 CG MET A 40 1.880 -12.102 2.521 1.00 0.00 C ATOM 652 SD MET A 40 1.487 -10.351 2.233 1.00 0.00 S ATOM 653 CE MET A 40 2.506 -9.931 0.857 1.00 0.00 C ATOM 0 H MET A 40 5.398 -13.315 3.839 1.00 0.00 H new ATOM 0 HA MET A 40 4.496 -10.737 3.345 1.00 0.00 H new ATOM 0 HB2 MET A 40 3.881 -12.274 1.753 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.459 -13.505 2.926 1.00 0.00 H new ATOM 0 HG2 MET A 40 1.497 -12.682 1.682 1.00 0.00 H new ATOM 0 HG3 MET A 40 1.342 -12.433 3.409 1.00 0.00 H new ATOM 0 HE1 MET A 40 2.349 -8.885 0.594 1.00 0.00 H new ATOM 0 HE2 MET A 40 3.553 -10.086 1.119 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.247 -10.562 0.007 1.00 0.00 H new ATOM 663 N GLU A 41 3.038 -12.117 5.913 1.00 0.00 N ATOM 664 CA GLU A 41 2.122 -11.765 7.000 1.00 0.00 C ATOM 665 C GLU A 41 2.574 -10.479 7.702 1.00 0.00 C ATOM 666 O GLU A 41 1.759 -9.696 8.119 1.00 0.00 O ATOM 667 CB GLU A 41 1.918 -12.915 7.982 1.00 0.00 C ATOM 668 CG GLU A 41 3.117 -13.255 8.802 1.00 0.00 C ATOM 669 CD GLU A 41 2.962 -14.574 9.496 1.00 0.00 C ATOM 670 OE1 GLU A 41 3.198 -15.633 8.874 1.00 0.00 O ATOM 671 OE2 GLU A 41 2.604 -14.588 10.686 1.00 0.00 O ATOM 0 H GLU A 41 3.483 -13.031 5.994 1.00 0.00 H new ATOM 0 HA GLU A 41 1.146 -11.572 6.554 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.097 -12.661 8.652 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.613 -13.801 7.425 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.999 -13.283 8.162 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.285 -12.473 9.542 1.00 0.00 H new ATOM 678 N ASN A 42 3.888 -10.245 7.719 1.00 0.00 N ATOM 679 CA ASN A 42 4.472 -9.019 8.282 1.00 0.00 C ATOM 680 C ASN A 42 4.241 -7.852 7.333 1.00 0.00 C ATOM 681 O ASN A 42 3.806 -6.764 7.743 1.00 0.00 O ATOM 682 CB ASN A 42 5.990 -9.208 8.529 1.00 0.00 C ATOM 683 CG ASN A 42 6.738 -7.901 8.807 1.00 0.00 C ATOM 684 OD1 ASN A 42 6.834 -7.449 9.949 1.00 0.00 O ATOM 685 ND2 ASN A 42 7.311 -7.321 7.774 1.00 0.00 N ATOM 0 H ASN A 42 4.578 -10.896 7.345 1.00 0.00 H new ATOM 0 HA ASN A 42 3.988 -8.806 9.235 1.00 0.00 H new ATOM 0 HB2 ASN A 42 6.130 -9.883 9.374 1.00 0.00 H new ATOM 0 HB3 ASN A 42 6.433 -9.691 7.658 1.00 0.00 H new ATOM 0 HD21 ASN A 42 7.856 -6.469 7.905 1.00 0.00 H new ATOM 0 HD22 ASN A 42 7.210 -7.724 6.842 1.00 0.00 H new ATOM 692 N LEU A 43 4.510 -8.105 6.055 1.00 0.00 N ATOM 693 CA LEU A 43 4.371 -7.091 5.001 1.00 0.00 C ATOM 694 C LEU A 43 2.917 -6.606 4.938 1.00 0.00 C ATOM 695 O LEU A 43 2.618 -5.394 5.012 1.00 0.00 O ATOM 696 CB LEU A 43 4.762 -7.699 3.639 1.00 0.00 C ATOM 697 CG LEU A 43 6.063 -8.525 3.568 1.00 0.00 C ATOM 698 CD1 LEU A 43 6.335 -8.991 2.146 1.00 0.00 C ATOM 699 CD2 LEU A 43 7.249 -7.759 4.106 1.00 0.00 C ATOM 0 H LEU A 43 4.829 -9.013 5.717 1.00 0.00 H new ATOM 0 HA LEU A 43 5.027 -6.250 5.227 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.942 -8.337 3.309 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.842 -6.885 2.919 1.00 0.00 H new ATOM 0 HG LEU A 43 5.920 -9.400 4.202 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.258 -9.571 2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.508 -9.612 1.802 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.435 -8.125 1.492 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.144 -8.378 4.037 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.391 -6.850 3.521 1.00 0.00 H new ATOM 0 HD23 LEU A 43 7.070 -7.496 5.148 1.00 0.00 H new ATOM 711 N VAL A 44 2.019 -7.557 4.859 1.00 0.00 N ATOM 712 CA VAL A 44 0.624 -7.279 4.757 1.00 0.00 C ATOM 713 C VAL A 44 0.093 -6.760 6.074 1.00 0.00 C ATOM 714 O VAL A 44 -0.848 -6.015 6.078 1.00 0.00 O ATOM 715 CB VAL A 44 -0.194 -8.506 4.272 1.00 0.00 C ATOM 716 CG1 VAL A 44 -0.397 -9.558 5.348 1.00 0.00 C ATOM 717 CG2 VAL A 44 -1.493 -8.096 3.614 1.00 0.00 C ATOM 0 H VAL A 44 2.247 -8.551 4.864 1.00 0.00 H new ATOM 0 HA VAL A 44 0.504 -6.506 3.998 1.00 0.00 H new ATOM 0 HB VAL A 44 0.414 -8.988 3.506 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.976 -10.387 4.942 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.572 -9.924 5.687 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.933 -9.119 6.189 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.033 -8.985 3.290 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.103 -7.541 4.327 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.280 -7.466 2.750 1.00 0.00 H new ATOM 727 N ALA A 45 0.717 -7.150 7.192 1.00 0.00 N ATOM 728 CA ALA A 45 0.317 -6.636 8.506 1.00 0.00 C ATOM 729 C ALA A 45 0.441 -5.115 8.508 1.00 0.00 C ATOM 730 O ALA A 45 -0.484 -4.406 8.917 1.00 0.00 O ATOM 731 CB ALA A 45 1.156 -7.247 9.631 1.00 0.00 C ATOM 0 H ALA A 45 1.492 -7.812 7.213 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.719 -6.920 8.689 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.830 -6.842 10.589 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.029 -8.330 9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.207 -7.005 9.473 1.00 0.00 H new ATOM 737 N TYR A 46 1.581 -4.614 8.003 1.00 0.00 N ATOM 738 CA TYR A 46 1.775 -3.166 7.832 1.00 0.00 C ATOM 739 C TYR A 46 0.721 -2.598 6.904 1.00 0.00 C ATOM 740 O TYR A 46 0.125 -1.563 7.188 1.00 0.00 O ATOM 741 CB TYR A 46 3.200 -2.812 7.291 1.00 0.00 C ATOM 742 CG TYR A 46 3.274 -1.418 6.616 1.00 0.00 C ATOM 743 CD1 TYR A 46 3.573 -0.267 7.330 1.00 0.00 C ATOM 744 CD2 TYR A 46 2.973 -1.272 5.258 1.00 0.00 C ATOM 745 CE1 TYR A 46 3.564 0.976 6.706 1.00 0.00 C ATOM 746 CE2 TYR A 46 2.972 -0.042 4.648 1.00 0.00 C ATOM 747 CZ TYR A 46 3.264 1.075 5.370 1.00 0.00 C ATOM 748 OH TYR A 46 3.237 2.311 4.757 1.00 0.00 O ATOM 0 H TYR A 46 2.374 -5.184 7.709 1.00 0.00 H new ATOM 0 HA TYR A 46 1.678 -2.716 8.820 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.912 -2.847 8.115 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.507 -3.572 6.573 1.00 0.00 H new ATOM 0 HD1 TYR A 46 3.815 -0.337 8.380 1.00 0.00 H new ATOM 0 HD2 TYR A 46 2.735 -2.149 4.674 1.00 0.00 H new ATOM 0 HE1 TYR A 46 3.794 1.865 7.274 1.00 0.00 H new ATOM 0 HE2 TYR A 46 2.740 0.040 3.596 1.00 0.00 H new ATOM 0 HH TYR A 46 3.232 2.194 3.784 1.00 0.00 H new ATOM 758 N ALA A 47 0.512 -3.253 5.797 1.00 0.00 N ATOM 759 CA ALA A 47 -0.415 -2.753 4.822 1.00 0.00 C ATOM 760 C ALA A 47 -1.831 -2.670 5.393 1.00 0.00 C ATOM 761 O ALA A 47 -2.509 -1.686 5.200 1.00 0.00 O ATOM 762 CB ALA A 47 -0.352 -3.577 3.575 1.00 0.00 C ATOM 0 H ALA A 47 0.969 -4.130 5.548 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.128 -1.735 4.558 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.060 -3.186 2.845 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.656 -3.535 3.162 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.605 -4.611 3.809 1.00 0.00 H new ATOM 768 N LYS A 48 -2.223 -3.682 6.146 1.00 0.00 N ATOM 769 CA LYS A 48 -3.522 -3.732 6.801 1.00 0.00 C ATOM 770 C LYS A 48 -3.653 -2.643 7.854 1.00 0.00 C ATOM 771 O LYS A 48 -4.668 -1.948 7.908 1.00 0.00 O ATOM 772 CB LYS A 48 -3.717 -5.088 7.457 1.00 0.00 C ATOM 773 CG LYS A 48 -3.860 -6.240 6.475 1.00 0.00 C ATOM 774 CD LYS A 48 -3.801 -7.572 7.193 1.00 0.00 C ATOM 775 CE LYS A 48 -4.002 -8.753 6.247 1.00 0.00 C ATOM 776 NZ LYS A 48 -5.297 -8.706 5.527 1.00 0.00 N ATOM 0 H LYS A 48 -1.643 -4.502 6.323 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.286 -3.572 6.041 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.869 -5.287 8.113 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.606 -5.050 8.087 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.806 -6.152 5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.066 -6.189 5.730 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.837 -7.670 7.692 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.566 -7.597 7.969 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.189 -8.772 5.521 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.943 -9.681 6.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.461 -9.614 5.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.065 -8.529 6.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.275 -7.941 4.822 1.00 0.00 H new ATOM 790 N LYS A 49 -2.625 -2.485 8.675 1.00 0.00 N ATOM 791 CA LYS A 49 -2.647 -1.497 9.750 1.00 0.00 C ATOM 792 C LYS A 49 -2.740 -0.074 9.167 1.00 0.00 C ATOM 793 O LYS A 49 -3.465 0.797 9.680 1.00 0.00 O ATOM 794 CB LYS A 49 -1.414 -1.671 10.695 1.00 0.00 C ATOM 795 CG LYS A 49 -0.080 -1.358 10.120 1.00 0.00 C ATOM 796 CD LYS A 49 1.030 -1.642 11.125 1.00 0.00 C ATOM 797 CE LYS A 49 2.357 -1.046 10.689 1.00 0.00 C ATOM 798 NZ LYS A 49 3.408 -1.227 11.699 1.00 0.00 N ATOM 0 H LYS A 49 -1.763 -3.028 8.619 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.536 -1.659 10.360 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.564 -1.038 11.569 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.399 -2.702 11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.080 -1.951 9.220 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.046 -0.310 9.822 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.752 -1.235 12.097 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.140 -2.719 11.250 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.671 -1.510 9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.227 0.018 10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.295 -0.804 11.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 3.122 -0.763 12.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 3.553 -2.242 11.872 1.00 0.00 H new ATOM 812 N VAL A 50 -2.053 0.130 8.073 1.00 0.00 N ATOM 813 CA VAL A 50 -2.052 1.393 7.385 1.00 0.00 C ATOM 814 C VAL A 50 -3.366 1.618 6.648 1.00 0.00 C ATOM 815 O VAL A 50 -3.939 2.703 6.723 1.00 0.00 O ATOM 816 CB VAL A 50 -0.817 1.495 6.456 1.00 0.00 C ATOM 817 CG1 VAL A 50 -0.922 2.636 5.469 1.00 0.00 C ATOM 818 CG2 VAL A 50 0.401 1.697 7.317 1.00 0.00 C ATOM 0 H VAL A 50 -1.473 -0.583 7.631 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.972 2.197 8.117 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.753 0.575 5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.029 2.660 4.844 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.801 2.494 4.841 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.011 3.578 6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.285 1.772 6.684 1.00 0.00 H new ATOM 0 HG22 VAL A 50 0.290 2.614 7.895 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.511 0.851 7.996 1.00 0.00 H new ATOM 828 N GLU A 51 -3.859 0.579 5.991 1.00 0.00 N ATOM 829 CA GLU A 51 -5.134 0.625 5.287 1.00 0.00 C ATOM 830 C GLU A 51 -6.230 0.983 6.275 1.00 0.00 C ATOM 831 O GLU A 51 -7.033 1.862 6.011 1.00 0.00 O ATOM 832 CB GLU A 51 -5.380 -0.734 4.604 1.00 0.00 C ATOM 833 CG GLU A 51 -6.617 -0.859 3.711 1.00 0.00 C ATOM 834 CD GLU A 51 -7.921 -1.155 4.463 1.00 0.00 C ATOM 835 OE1 GLU A 51 -7.891 -1.881 5.477 1.00 0.00 O ATOM 836 OE2 GLU A 51 -8.992 -0.754 4.010 1.00 0.00 O ATOM 0 H GLU A 51 -3.386 -0.323 5.930 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.127 1.389 4.509 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.504 -0.972 4.001 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.448 -1.495 5.382 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.739 0.068 3.150 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.445 -1.652 2.983 1.00 0.00 H new ATOM 843 N GLY A 52 -6.190 0.347 7.446 1.00 0.00 N ATOM 844 CA GLY A 52 -7.140 0.623 8.502 1.00 0.00 C ATOM 845 C GLY A 52 -7.093 2.059 8.938 1.00 0.00 C ATOM 846 O GLY A 52 -8.128 2.699 9.101 1.00 0.00 O ATOM 0 H GLY A 52 -5.500 -0.367 7.680 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.146 0.381 8.158 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.931 -0.022 9.355 1.00 0.00 H new ATOM 850 N ASP A 53 -5.889 2.573 9.086 1.00 0.00 N ATOM 851 CA ASP A 53 -5.658 3.970 9.459 1.00 0.00 C ATOM 852 C ASP A 53 -6.350 4.931 8.501 1.00 0.00 C ATOM 853 O ASP A 53 -7.145 5.768 8.923 1.00 0.00 O ATOM 854 CB ASP A 53 -4.174 4.251 9.463 1.00 0.00 C ATOM 855 CG ASP A 53 -3.831 5.699 9.776 1.00 0.00 C ATOM 856 OD1 ASP A 53 -3.876 6.100 10.965 1.00 0.00 O ATOM 857 OD2 ASP A 53 -3.507 6.451 8.845 1.00 0.00 O ATOM 0 H ASP A 53 -5.032 2.037 8.952 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.076 4.125 10.454 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -3.692 3.605 10.197 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.760 3.990 8.489 1.00 0.00 H new ATOM 862 N MET A 54 -6.070 4.782 7.222 1.00 0.00 N ATOM 863 CA MET A 54 -6.662 5.644 6.184 1.00 0.00 C ATOM 864 C MET A 54 -8.124 5.395 5.959 1.00 0.00 C ATOM 865 O MET A 54 -8.853 6.308 5.611 1.00 0.00 O ATOM 866 CB MET A 54 -5.877 5.628 4.870 1.00 0.00 C ATOM 867 CG MET A 54 -5.368 4.296 4.439 1.00 0.00 C ATOM 868 SD MET A 54 -3.672 4.425 3.819 1.00 0.00 S ATOM 869 CE MET A 54 -2.879 5.357 5.140 1.00 0.00 C ATOM 0 H MET A 54 -5.434 4.071 6.861 1.00 0.00 H new ATOM 0 HA MET A 54 -6.582 6.654 6.587 1.00 0.00 H new ATOM 0 HB2 MET A 54 -6.516 6.025 4.081 1.00 0.00 H new ATOM 0 HB3 MET A 54 -5.030 6.307 4.966 1.00 0.00 H new ATOM 0 HG2 MET A 54 -5.401 3.600 5.277 1.00 0.00 H new ATOM 0 HG3 MET A 54 -6.014 3.889 3.661 1.00 0.00 H new ATOM 0 HE1 MET A 54 -1.803 5.186 5.111 1.00 0.00 H new ATOM 0 HE2 MET A 54 -3.081 6.420 5.007 1.00 0.00 H new ATOM 0 HE3 MET A 54 -3.272 5.030 6.103 1.00 0.00 H new ATOM 879 N TYR A 55 -8.550 4.183 6.181 1.00 0.00 N ATOM 880 CA TYR A 55 -9.927 3.815 6.061 1.00 0.00 C ATOM 881 C TYR A 55 -10.703 4.583 7.132 1.00 0.00 C ATOM 882 O TYR A 55 -11.647 5.289 6.847 1.00 0.00 O ATOM 883 CB TYR A 55 -10.010 2.311 6.290 1.00 0.00 C ATOM 884 CG TYR A 55 -11.317 1.674 5.996 1.00 0.00 C ATOM 885 CD1 TYR A 55 -11.620 1.250 4.717 1.00 0.00 C ATOM 886 CD2 TYR A 55 -12.228 1.464 6.995 1.00 0.00 C ATOM 887 CE1 TYR A 55 -12.805 0.629 4.444 1.00 0.00 C ATOM 888 CE2 TYR A 55 -13.429 0.847 6.735 1.00 0.00 C ATOM 889 CZ TYR A 55 -13.707 0.429 5.452 1.00 0.00 C ATOM 890 OH TYR A 55 -14.890 -0.192 5.183 1.00 0.00 O ATOM 0 H TYR A 55 -7.939 3.414 6.454 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.346 4.053 5.083 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -9.248 1.829 5.677 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -9.757 2.109 7.331 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -10.909 1.412 3.921 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -12.001 1.787 8.000 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -13.028 0.299 3.440 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -14.146 0.692 7.527 1.00 0.00 H new ATOM 0 HH TYR A 55 -14.961 -1.008 5.721 1.00 0.00 H new ATOM 900 N GLU A 56 -10.206 4.511 8.347 1.00 0.00 N ATOM 901 CA GLU A 56 -10.816 5.181 9.485 1.00 0.00 C ATOM 902 C GLU A 56 -10.533 6.685 9.491 1.00 0.00 C ATOM 903 O GLU A 56 -11.148 7.442 10.256 1.00 0.00 O ATOM 904 CB GLU A 56 -10.334 4.536 10.769 1.00 0.00 C ATOM 905 CG GLU A 56 -10.834 3.116 10.937 1.00 0.00 C ATOM 906 CD GLU A 56 -12.307 3.068 11.221 1.00 0.00 C ATOM 907 OE1 GLU A 56 -13.130 3.028 10.290 1.00 0.00 O ATOM 908 OE2 GLU A 56 -12.683 3.089 12.402 1.00 0.00 O ATOM 0 H GLU A 56 -9.364 3.985 8.579 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.897 5.068 9.404 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.244 4.537 10.783 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -10.664 5.135 11.617 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.621 2.547 10.032 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.292 2.635 11.751 1.00 0.00 H new ATOM 915 N SER A 57 -9.582 7.108 8.687 1.00 0.00 N ATOM 916 CA SER A 57 -9.275 8.513 8.551 1.00 0.00 C ATOM 917 C SER A 57 -10.178 9.151 7.478 1.00 0.00 C ATOM 918 O SER A 57 -10.342 10.382 7.433 1.00 0.00 O ATOM 919 CB SER A 57 -7.783 8.696 8.194 1.00 0.00 C ATOM 920 OG SER A 57 -7.378 10.057 8.224 1.00 0.00 O ATOM 0 H SER A 57 -9.005 6.493 8.114 1.00 0.00 H new ATOM 0 HA SER A 57 -9.465 9.014 9.500 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.173 8.124 8.893 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.598 8.287 7.201 1.00 0.00 H new ATOM 0 HG SER A 57 -6.428 10.121 7.993 1.00 0.00 H new ATOM 926 N ALA A 58 -10.773 8.330 6.645 1.00 0.00 N ATOM 927 CA ALA A 58 -11.594 8.815 5.572 1.00 0.00 C ATOM 928 C ALA A 58 -13.064 8.797 5.929 1.00 0.00 C ATOM 929 O ALA A 58 -13.463 8.283 6.985 1.00 0.00 O ATOM 930 CB ALA A 58 -11.378 7.994 4.347 1.00 0.00 C ATOM 0 H ALA A 58 -10.700 7.314 6.695 1.00 0.00 H new ATOM 0 HA ALA A 58 -11.302 9.849 5.387 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.006 8.372 3.540 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.331 8.053 4.049 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.639 6.956 4.554 1.00 0.00 H new ATOM 936 N ASN A 59 -13.856 9.382 5.061 1.00 0.00 N ATOM 937 CA ASN A 59 -15.308 9.445 5.224 1.00 0.00 C ATOM 938 C ASN A 59 -15.985 8.849 4.008 1.00 0.00 C ATOM 939 O ASN A 59 -17.189 9.038 3.791 1.00 0.00 O ATOM 940 CB ASN A 59 -15.762 10.894 5.374 1.00 0.00 C ATOM 941 CG ASN A 59 -15.088 11.631 6.506 1.00 0.00 C ATOM 942 OD1 ASN A 59 -15.575 11.655 7.639 1.00 0.00 O ATOM 943 ND2 ASN A 59 -13.944 12.201 6.228 1.00 0.00 N ATOM 0 H ASN A 59 -13.518 9.834 4.212 1.00 0.00 H new ATOM 0 HA ASN A 59 -15.580 8.883 6.118 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -15.568 11.424 4.442 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -16.840 10.912 5.532 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -13.424 12.685 6.960 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.572 12.161 5.279 1.00 0.00 H new ATOM 950 N SER A 60 -15.221 8.147 3.219 1.00 0.00 N ATOM 951 CA SER A 60 -15.715 7.442 2.069 1.00 0.00 C ATOM 952 C SER A 60 -14.633 6.536 1.604 1.00 0.00 C ATOM 953 O SER A 60 -13.454 6.772 1.915 1.00 0.00 O ATOM 954 CB SER A 60 -16.100 8.406 0.938 1.00 0.00 C ATOM 955 OG SER A 60 -14.996 9.159 0.510 1.00 0.00 O ATOM 0 H SER A 60 -14.216 8.047 3.360 1.00 0.00 H new ATOM 0 HA SER A 60 -16.612 6.886 2.341 1.00 0.00 H new ATOM 0 HB2 SER A 60 -16.505 7.841 0.098 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.888 9.076 1.281 1.00 0.00 H new ATOM 0 HG SER A 60 -15.271 9.762 -0.212 1.00 0.00 H new ATOM 961 N ARG A 61 -14.989 5.480 0.893 1.00 0.00 N ATOM 962 CA ARG A 61 -13.957 4.641 0.335 1.00 0.00 C ATOM 963 C ARG A 61 -13.206 5.402 -0.731 1.00 0.00 C ATOM 964 O ARG A 61 -12.046 5.204 -0.898 1.00 0.00 O ATOM 965 CB ARG A 61 -14.397 3.243 -0.198 1.00 0.00 C ATOM 966 CG ARG A 61 -15.393 3.200 -1.347 1.00 0.00 C ATOM 967 CD ARG A 61 -16.664 3.906 -1.052 1.00 0.00 C ATOM 968 NE ARG A 61 -17.653 3.620 -2.105 1.00 0.00 N ATOM 969 CZ ARG A 61 -18.717 4.373 -2.461 1.00 0.00 C ATOM 970 NH1 ARG A 61 -19.053 5.462 -1.779 1.00 0.00 N ATOM 971 NH2 ARG A 61 -19.462 3.990 -3.481 1.00 0.00 N ATOM 0 H ARG A 61 -15.948 5.195 0.696 1.00 0.00 H new ATOM 0 HA ARG A 61 -13.316 4.398 1.182 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -13.501 2.708 -0.512 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -14.825 2.687 0.636 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -14.936 3.645 -2.231 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -15.612 2.160 -1.590 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -17.050 3.589 -0.083 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -16.487 4.980 -0.989 1.00 0.00 H new ATOM 0 HE ARG A 61 -17.519 2.753 -2.626 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -18.504 5.745 -0.968 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -19.860 6.015 -2.067 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -19.231 3.136 -3.989 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -20.268 4.548 -3.761 1.00 0.00 H new ATOM 985 N ASP A 62 -13.909 6.308 -1.414 1.00 0.00 N ATOM 986 CA ASP A 62 -13.314 7.155 -2.449 1.00 0.00 C ATOM 987 C ASP A 62 -12.178 7.981 -1.872 1.00 0.00 C ATOM 988 O ASP A 62 -11.083 7.967 -2.398 1.00 0.00 O ATOM 989 CB ASP A 62 -14.393 8.062 -3.060 1.00 0.00 C ATOM 990 CG ASP A 62 -13.838 9.216 -3.888 1.00 0.00 C ATOM 991 OD1 ASP A 62 -13.452 9.016 -5.071 1.00 0.00 O ATOM 992 OD2 ASP A 62 -13.832 10.362 -3.376 1.00 0.00 O ATOM 0 H ASP A 62 -14.904 6.475 -1.265 1.00 0.00 H new ATOM 0 HA ASP A 62 -12.903 6.521 -3.235 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -15.047 7.458 -3.690 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -15.009 8.468 -2.257 1.00 0.00 H new ATOM 997 N GLU A 63 -12.429 8.615 -0.733 1.00 0.00 N ATOM 998 CA GLU A 63 -11.423 9.411 -0.055 1.00 0.00 C ATOM 999 C GLU A 63 -10.278 8.549 0.455 1.00 0.00 C ATOM 1000 O GLU A 63 -9.106 8.878 0.245 1.00 0.00 O ATOM 1001 CB GLU A 63 -12.058 10.229 1.087 1.00 0.00 C ATOM 1002 CG GLU A 63 -11.066 10.851 2.050 1.00 0.00 C ATOM 1003 CD GLU A 63 -11.690 11.842 2.990 1.00 0.00 C ATOM 1004 OE1 GLU A 63 -12.492 11.444 3.858 1.00 0.00 O ATOM 1005 OE2 GLU A 63 -11.354 13.044 2.902 1.00 0.00 O ATOM 0 H GLU A 63 -13.332 8.590 -0.258 1.00 0.00 H new ATOM 0 HA GLU A 63 -11.003 10.108 -0.780 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.667 11.022 0.652 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.731 9.581 1.649 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.590 10.061 2.630 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.280 11.347 1.481 1.00 0.00 H new ATOM 1012 N TYR A 64 -10.617 7.428 1.070 1.00 0.00 N ATOM 1013 CA TYR A 64 -9.625 6.564 1.664 1.00 0.00 C ATOM 1014 C TYR A 64 -8.727 5.951 0.593 1.00 0.00 C ATOM 1015 O TYR A 64 -7.502 5.985 0.710 1.00 0.00 O ATOM 1016 CB TYR A 64 -10.318 5.522 2.585 1.00 0.00 C ATOM 1017 CG TYR A 64 -10.019 4.094 2.319 1.00 0.00 C ATOM 1018 CD1 TYR A 64 -8.935 3.487 2.895 1.00 0.00 C ATOM 1019 CD2 TYR A 64 -10.820 3.357 1.474 1.00 0.00 C ATOM 1020 CE1 TYR A 64 -8.650 2.189 2.644 1.00 0.00 C ATOM 1021 CE2 TYR A 64 -10.540 2.056 1.207 1.00 0.00 C ATOM 1022 CZ TYR A 64 -9.449 1.474 1.797 1.00 0.00 C ATOM 1023 OH TYR A 64 -9.156 0.188 1.546 1.00 0.00 O ATOM 0 H TYR A 64 -11.577 7.099 1.168 1.00 0.00 H new ATOM 0 HA TYR A 64 -8.958 7.144 2.301 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -10.040 5.741 3.616 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -11.396 5.664 2.508 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -8.299 4.053 3.559 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -11.682 3.821 1.018 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.796 1.720 3.110 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -11.169 1.487 0.538 1.00 0.00 H new ATOM 0 HH TYR A 64 -8.845 -0.243 2.369 1.00 0.00 H new ATOM 1033 N TYR A 65 -9.356 5.453 -0.458 1.00 0.00 N ATOM 1034 CA TYR A 65 -8.687 4.886 -1.596 1.00 0.00 C ATOM 1035 C TYR A 65 -7.809 5.943 -2.239 1.00 0.00 C ATOM 1036 O TYR A 65 -6.665 5.685 -2.511 1.00 0.00 O ATOM 1037 CB TYR A 65 -9.754 4.341 -2.564 1.00 0.00 C ATOM 1038 CG TYR A 65 -9.311 3.919 -3.935 1.00 0.00 C ATOM 1039 CD1 TYR A 65 -8.073 3.340 -4.177 1.00 0.00 C ATOM 1040 CD2 TYR A 65 -10.163 4.104 -4.998 1.00 0.00 C ATOM 1041 CE1 TYR A 65 -7.711 2.967 -5.447 1.00 0.00 C ATOM 1042 CE2 TYR A 65 -9.816 3.736 -6.258 1.00 0.00 C ATOM 1043 CZ TYR A 65 -8.593 3.168 -6.485 1.00 0.00 C ATOM 1044 OH TYR A 65 -8.251 2.804 -7.750 1.00 0.00 O ATOM 0 H TYR A 65 -10.373 5.436 -0.537 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.038 4.060 -1.305 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -10.230 3.484 -2.088 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.521 5.107 -2.682 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -7.388 3.181 -3.357 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -11.131 4.552 -4.827 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -6.745 2.521 -5.630 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -10.503 3.891 -7.077 1.00 0.00 H new ATOM 0 HH TYR A 65 -9.052 2.790 -8.314 1.00 0.00 H new ATOM 1054 N HIS A 66 -8.347 7.152 -2.389 1.00 0.00 N ATOM 1055 CA HIS A 66 -7.635 8.278 -2.996 1.00 0.00 C ATOM 1056 C HIS A 66 -6.354 8.594 -2.224 1.00 0.00 C ATOM 1057 O HIS A 66 -5.275 8.542 -2.777 1.00 0.00 O ATOM 1058 CB HIS A 66 -8.562 9.527 -3.038 1.00 0.00 C ATOM 1059 CG HIS A 66 -8.001 10.779 -3.687 1.00 0.00 C ATOM 1060 ND1 HIS A 66 -8.546 11.369 -4.806 1.00 0.00 N ATOM 1061 CD2 HIS A 66 -6.975 11.587 -3.308 1.00 0.00 C ATOM 1062 CE1 HIS A 66 -7.857 12.480 -5.069 1.00 0.00 C ATOM 1063 NE2 HIS A 66 -6.889 12.661 -4.184 1.00 0.00 N ATOM 0 H HIS A 66 -9.295 7.381 -2.091 1.00 0.00 H new ATOM 0 HA HIS A 66 -7.357 8.004 -4.014 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -9.476 9.253 -3.564 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -8.845 9.773 -2.015 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -6.329 11.420 -2.459 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -8.062 13.145 -5.895 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -6.219 13.430 -4.152 1.00 0.00 H new ATOM 1071 N LEU A 67 -6.482 8.873 -0.943 1.00 0.00 N ATOM 1072 CA LEU A 67 -5.343 9.313 -0.154 1.00 0.00 C ATOM 1073 C LEU A 67 -4.288 8.195 0.037 1.00 0.00 C ATOM 1074 O LEU A 67 -3.059 8.464 0.054 1.00 0.00 O ATOM 1075 CB LEU A 67 -5.815 9.973 1.179 1.00 0.00 C ATOM 1076 CG LEU A 67 -6.506 9.085 2.229 1.00 0.00 C ATOM 1077 CD1 LEU A 67 -5.504 8.418 3.123 1.00 0.00 C ATOM 1078 CD2 LEU A 67 -7.507 9.862 3.060 1.00 0.00 C ATOM 0 H LEU A 67 -7.358 8.804 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.821 10.088 -0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -4.944 10.429 1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.500 10.782 0.925 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.050 8.317 1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.024 7.798 3.853 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.841 7.794 2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.918 9.176 3.642 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.971 9.196 3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.996 10.671 3.582 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.275 10.279 2.409 1.00 0.00 H new ATOM 1090 N LEU A 68 -4.744 6.950 0.121 1.00 0.00 N ATOM 1091 CA LEU A 68 -3.825 5.841 0.291 1.00 0.00 C ATOM 1092 C LEU A 68 -3.085 5.623 -1.017 1.00 0.00 C ATOM 1093 O LEU A 68 -1.878 5.336 -1.031 1.00 0.00 O ATOM 1094 CB LEU A 68 -4.575 4.569 0.778 1.00 0.00 C ATOM 1095 CG LEU A 68 -5.204 3.613 -0.229 1.00 0.00 C ATOM 1096 CD1 LEU A 68 -4.167 2.634 -0.746 1.00 0.00 C ATOM 1097 CD2 LEU A 68 -6.308 2.858 0.427 1.00 0.00 C ATOM 0 H LEU A 68 -5.729 6.690 0.075 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.093 6.070 1.066 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.872 3.990 1.377 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.369 4.899 1.448 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.595 4.191 -1.066 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.631 1.958 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.360 3.182 -1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.764 2.058 0.087 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.759 2.174 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.911 2.290 1.268 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -7.064 3.557 0.786 1.00 0.00 H new ATOM 1109 N ALA A 69 -3.825 5.797 -2.108 1.00 0.00 N ATOM 1110 CA ALA A 69 -3.312 5.715 -3.448 1.00 0.00 C ATOM 1111 C ALA A 69 -2.239 6.759 -3.643 1.00 0.00 C ATOM 1112 O ALA A 69 -1.212 6.491 -4.225 1.00 0.00 O ATOM 1113 CB ALA A 69 -4.440 5.938 -4.420 1.00 0.00 C ATOM 0 H ALA A 69 -4.823 6.004 -2.070 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.878 4.730 -3.621 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -4.059 5.877 -5.439 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.204 5.175 -4.272 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.875 6.924 -4.253 1.00 0.00 H new ATOM 1119 N GLU A 70 -2.472 7.927 -3.098 1.00 0.00 N ATOM 1120 CA GLU A 70 -1.521 9.021 -3.171 1.00 0.00 C ATOM 1121 C GLU A 70 -0.210 8.646 -2.511 1.00 0.00 C ATOM 1122 O GLU A 70 0.881 8.872 -3.082 1.00 0.00 O ATOM 1123 CB GLU A 70 -2.095 10.252 -2.502 1.00 0.00 C ATOM 1124 CG GLU A 70 -3.270 10.830 -3.235 1.00 0.00 C ATOM 1125 CD GLU A 70 -2.876 11.466 -4.528 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -2.105 12.463 -4.504 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -3.337 11.032 -5.586 1.00 0.00 O ATOM 0 H GLU A 70 -3.327 8.152 -2.589 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.330 9.234 -4.223 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.398 9.998 -1.486 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -1.316 11.010 -2.422 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.998 10.042 -3.427 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.761 11.570 -2.603 1.00 0.00 H new ATOM 1134 N LYS A 71 -0.292 8.055 -1.318 1.00 0.00 N ATOM 1135 CA LYS A 71 0.927 7.698 -0.635 1.00 0.00 C ATOM 1136 C LYS A 71 1.648 6.550 -1.350 1.00 0.00 C ATOM 1137 O LYS A 71 2.848 6.604 -1.533 1.00 0.00 O ATOM 1138 CB LYS A 71 0.738 7.473 0.911 1.00 0.00 C ATOM 1139 CG LYS A 71 0.278 6.088 1.432 1.00 0.00 C ATOM 1140 CD LYS A 71 1.415 5.049 1.387 1.00 0.00 C ATOM 1141 CE LYS A 71 1.290 3.975 2.455 1.00 0.00 C ATOM 1142 NZ LYS A 71 1.616 4.502 3.802 1.00 0.00 N ATOM 0 H LYS A 71 -1.158 7.825 -0.830 1.00 0.00 H new ATOM 0 HA LYS A 71 1.590 8.561 -0.692 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.688 7.704 1.393 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.016 8.210 1.262 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.083 6.187 2.456 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -0.560 5.735 0.832 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.427 4.576 0.405 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.370 5.560 1.506 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.275 3.578 2.455 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.956 3.146 2.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.222 3.822 4.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.117 5.408 3.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.738 4.646 4.340 1.00 0.00 H new ATOM 1156 N ILE A 72 0.905 5.539 -1.795 1.00 0.00 N ATOM 1157 CA ILE A 72 1.529 4.402 -2.471 1.00 0.00 C ATOM 1158 C ILE A 72 2.211 4.851 -3.778 1.00 0.00 C ATOM 1159 O ILE A 72 3.330 4.465 -4.065 1.00 0.00 O ATOM 1160 CB ILE A 72 0.531 3.215 -2.744 1.00 0.00 C ATOM 1161 CG1 ILE A 72 1.253 2.036 -3.318 1.00 0.00 C ATOM 1162 CG2 ILE A 72 -0.576 3.591 -3.633 1.00 0.00 C ATOM 1163 CD1 ILE A 72 0.356 0.914 -3.762 1.00 0.00 C ATOM 0 H ILE A 72 -0.109 5.482 -1.703 1.00 0.00 H new ATOM 0 HA ILE A 72 2.285 4.017 -1.787 1.00 0.00 H new ATOM 0 HB ILE A 72 0.101 2.952 -1.777 1.00 0.00 H new ATOM 0 HG12 ILE A 72 1.847 2.368 -4.169 1.00 0.00 H new ATOM 0 HG13 ILE A 72 1.950 1.654 -2.572 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.230 2.732 -3.784 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.144 4.405 -3.182 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.177 3.916 -4.594 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.961 0.102 -4.164 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.220 0.550 -2.911 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.325 1.276 -4.533 1.00 0.00 H new ATOM 1175 N TYR A 73 1.533 5.706 -4.504 1.00 0.00 N ATOM 1176 CA TYR A 73 1.979 6.265 -5.768 1.00 0.00 C ATOM 1177 C TYR A 73 3.340 6.983 -5.590 1.00 0.00 C ATOM 1178 O TYR A 73 4.348 6.676 -6.306 1.00 0.00 O ATOM 1179 CB TYR A 73 0.875 7.244 -6.214 1.00 0.00 C ATOM 1180 CG TYR A 73 1.037 7.976 -7.516 1.00 0.00 C ATOM 1181 CD1 TYR A 73 1.823 9.098 -7.590 1.00 0.00 C ATOM 1182 CD2 TYR A 73 0.353 7.574 -8.649 1.00 0.00 C ATOM 1183 CE1 TYR A 73 1.941 9.810 -8.765 1.00 0.00 C ATOM 1184 CE2 TYR A 73 0.462 8.269 -9.830 1.00 0.00 C ATOM 1185 CZ TYR A 73 1.257 9.389 -9.886 1.00 0.00 C ATOM 1186 OH TYR A 73 1.378 10.086 -11.067 1.00 0.00 O ATOM 0 H TYR A 73 0.615 6.050 -4.222 1.00 0.00 H new ATOM 0 HA TYR A 73 2.136 5.493 -6.521 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.060 6.686 -6.264 1.00 0.00 H new ATOM 0 HB3 TYR A 73 0.759 7.991 -5.428 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.359 9.429 -6.713 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.278 6.699 -8.605 1.00 0.00 H new ATOM 0 HE1 TYR A 73 2.564 10.691 -8.807 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.073 7.937 -10.708 1.00 0.00 H new ATOM 0 HH TYR A 73 0.832 9.656 -11.758 1.00 0.00 H new ATOM 1196 N LYS A 74 3.391 7.901 -4.617 1.00 0.00 N ATOM 1197 CA LYS A 74 4.608 8.660 -4.369 1.00 0.00 C ATOM 1198 C LYS A 74 5.721 7.742 -3.879 1.00 0.00 C ATOM 1199 O LYS A 74 6.885 7.965 -4.180 1.00 0.00 O ATOM 1200 CB LYS A 74 4.382 9.820 -3.386 1.00 0.00 C ATOM 1201 CG LYS A 74 4.116 9.410 -1.958 1.00 0.00 C ATOM 1202 CD LYS A 74 3.905 10.596 -0.996 1.00 0.00 C ATOM 1203 CE LYS A 74 2.688 11.480 -1.331 1.00 0.00 C ATOM 1204 NZ LYS A 74 2.922 12.439 -2.447 1.00 0.00 N ATOM 0 H LYS A 74 2.612 8.129 -4.000 1.00 0.00 H new ATOM 0 HA LYS A 74 4.911 9.103 -5.318 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.259 10.467 -3.404 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.540 10.415 -3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 74 3.232 8.772 -1.932 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.953 8.810 -1.601 1.00 0.00 H new ATOM 0 HD2 LYS A 74 3.790 10.210 0.017 1.00 0.00 H new ATOM 0 HD3 LYS A 74 4.801 11.216 -1.001 1.00 0.00 H new ATOM 0 HE2 LYS A 74 1.846 10.838 -1.589 1.00 0.00 H new ATOM 0 HE3 LYS A 74 2.402 12.039 -0.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.657 13.397 -2.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 3.928 12.425 -2.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 2.344 12.165 -3.267 1.00 0.00 H new ATOM 1218 N ILE A 75 5.340 6.701 -3.158 1.00 0.00 N ATOM 1219 CA ILE A 75 6.263 5.717 -2.651 1.00 0.00 C ATOM 1220 C ILE A 75 6.869 4.894 -3.787 1.00 0.00 C ATOM 1221 O ILE A 75 8.052 4.565 -3.751 1.00 0.00 O ATOM 1222 CB ILE A 75 5.589 4.806 -1.557 1.00 0.00 C ATOM 1223 CG1 ILE A 75 5.913 5.285 -0.138 1.00 0.00 C ATOM 1224 CG2 ILE A 75 5.943 3.343 -1.706 1.00 0.00 C ATOM 1225 CD1 ILE A 75 5.461 6.690 0.194 1.00 0.00 C ATOM 0 H ILE A 75 4.368 6.519 -2.909 1.00 0.00 H new ATOM 0 HA ILE A 75 7.081 6.246 -2.163 1.00 0.00 H new ATOM 0 HB ILE A 75 4.515 4.900 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.455 4.597 0.572 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.991 5.224 0.010 1.00 0.00 H new ATOM 0 HG21 ILE A 75 5.448 2.767 -0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.614 2.987 -2.682 1.00 0.00 H new ATOM 0 HG23 ILE A 75 7.023 3.219 -1.620 1.00 0.00 H new ATOM 0 HD11 ILE A 75 5.739 6.929 1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 75 5.939 7.396 -0.485 1.00 0.00 H new ATOM 0 HD13 ILE A 75 4.379 6.759 0.086 1.00 0.00 H new ATOM 1237 N GLN A 76 6.075 4.594 -4.800 1.00 0.00 N ATOM 1238 CA GLN A 76 6.568 3.827 -5.921 1.00 0.00 C ATOM 1239 C GLN A 76 7.621 4.601 -6.677 1.00 0.00 C ATOM 1240 O GLN A 76 8.698 4.080 -6.989 1.00 0.00 O ATOM 1241 CB GLN A 76 5.456 3.352 -6.836 1.00 0.00 C ATOM 1242 CG GLN A 76 4.428 2.502 -6.111 1.00 0.00 C ATOM 1243 CD GLN A 76 3.681 1.553 -7.013 1.00 0.00 C ATOM 1244 OE1 GLN A 76 4.188 1.110 -8.040 1.00 0.00 O ATOM 1245 NE2 GLN A 76 2.502 1.180 -6.608 1.00 0.00 N ATOM 0 H GLN A 76 5.095 4.869 -4.866 1.00 0.00 H new ATOM 0 HA GLN A 76 7.032 2.928 -5.517 1.00 0.00 H new ATOM 0 HB2 GLN A 76 4.961 4.216 -7.279 1.00 0.00 H new ATOM 0 HB3 GLN A 76 5.886 2.776 -7.656 1.00 0.00 H new ATOM 0 HG2 GLN A 76 4.929 1.929 -5.331 1.00 0.00 H new ATOM 0 HG3 GLN A 76 3.712 3.158 -5.615 1.00 0.00 H new ATOM 0 HE21 GLN A 76 2.111 1.569 -5.750 1.00 0.00 H new ATOM 0 HE22 GLN A 76 1.969 0.499 -7.149 1.00 0.00 H new ATOM 1254 N LYS A 77 7.359 5.853 -6.937 1.00 0.00 N ATOM 1255 CA LYS A 77 8.382 6.654 -7.574 1.00 0.00 C ATOM 1256 C LYS A 77 9.562 6.955 -6.656 1.00 0.00 C ATOM 1257 O LYS A 77 10.710 7.103 -7.129 1.00 0.00 O ATOM 1258 CB LYS A 77 7.804 7.856 -8.277 1.00 0.00 C ATOM 1259 CG LYS A 77 6.736 8.592 -7.517 1.00 0.00 C ATOM 1260 CD LYS A 77 5.789 9.318 -8.457 1.00 0.00 C ATOM 1261 CE LYS A 77 5.124 8.378 -9.508 1.00 0.00 C ATOM 1262 NZ LYS A 77 5.923 8.208 -10.779 1.00 0.00 N ATOM 0 H LYS A 77 6.483 6.332 -6.730 1.00 0.00 H new ATOM 0 HA LYS A 77 8.818 6.047 -8.367 1.00 0.00 H new ATOM 0 HB2 LYS A 77 8.614 8.551 -8.499 1.00 0.00 H new ATOM 0 HB3 LYS A 77 7.390 7.534 -9.233 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.174 7.889 -6.903 1.00 0.00 H new ATOM 0 HG3 LYS A 77 7.198 9.309 -6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.010 9.806 -7.871 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.336 10.104 -8.977 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.968 7.398 -9.056 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.140 8.772 -9.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.282 7.968 -11.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.420 9.095 -10.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.617 7.444 -10.653 1.00 0.00 H new ATOM 1276 N GLU A 78 9.293 6.988 -5.359 1.00 0.00 N ATOM 1277 CA GLU A 78 10.316 7.173 -4.346 1.00 0.00 C ATOM 1278 C GLU A 78 11.276 5.984 -4.404 1.00 0.00 C ATOM 1279 O GLU A 78 12.497 6.152 -4.460 1.00 0.00 O ATOM 1280 CB GLU A 78 9.673 7.207 -2.959 1.00 0.00 C ATOM 1281 CG GLU A 78 10.584 7.682 -1.845 1.00 0.00 C ATOM 1282 CD GLU A 78 10.833 9.171 -1.888 1.00 0.00 C ATOM 1283 OE1 GLU A 78 11.613 9.644 -2.733 1.00 0.00 O ATOM 1284 OE2 GLU A 78 10.226 9.907 -1.068 1.00 0.00 O ATOM 0 H GLU A 78 8.352 6.886 -4.980 1.00 0.00 H new ATOM 0 HA GLU A 78 10.844 8.109 -4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.799 7.857 -2.996 1.00 0.00 H new ATOM 0 HB3 GLU A 78 9.316 6.206 -2.715 1.00 0.00 H new ATOM 0 HG2 GLU A 78 10.142 7.420 -0.884 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.537 7.157 -1.912 1.00 0.00 H new ATOM 1291 N LEU A 79 10.704 4.768 -4.428 1.00 0.00 N ATOM 1292 CA LEU A 79 11.493 3.554 -4.457 1.00 0.00 C ATOM 1293 C LEU A 79 12.329 3.453 -5.704 1.00 0.00 C ATOM 1294 O LEU A 79 13.496 3.066 -5.622 1.00 0.00 O ATOM 1295 CB LEU A 79 10.656 2.262 -4.188 1.00 0.00 C ATOM 1296 CG LEU A 79 9.511 1.900 -5.146 1.00 0.00 C ATOM 1297 CD1 LEU A 79 9.996 1.178 -6.391 1.00 0.00 C ATOM 1298 CD2 LEU A 79 8.459 1.091 -4.452 1.00 0.00 C ATOM 0 H LEU A 79 9.696 4.614 -4.428 1.00 0.00 H new ATOM 0 HA LEU A 79 12.185 3.627 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.348 1.420 -4.170 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.232 2.347 -3.187 1.00 0.00 H new ATOM 0 HG LEU A 79 9.073 2.844 -5.469 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.145 0.947 -7.032 1.00 0.00 H new ATOM 0 HD12 LEU A 79 10.695 1.815 -6.932 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.496 0.253 -6.104 1.00 0.00 H new ATOM 0 HD21 LEU A 79 7.662 0.850 -5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 79 8.900 0.169 -4.074 1.00 0.00 H new ATOM 0 HD23 LEU A 79 8.048 1.664 -3.621 1.00 0.00 H new ATOM 1310 N GLU A 80 11.755 3.839 -6.834 1.00 0.00 N ATOM 1311 CA GLU A 80 12.425 3.788 -8.076 1.00 0.00 C ATOM 1312 C GLU A 80 13.672 4.663 -8.045 1.00 0.00 C ATOM 1313 O GLU A 80 14.767 4.172 -8.261 1.00 0.00 O ATOM 1314 CB GLU A 80 11.468 4.262 -9.130 1.00 0.00 C ATOM 1315 CG GLU A 80 11.505 3.483 -10.409 1.00 0.00 C ATOM 1316 CD GLU A 80 12.807 3.595 -11.189 1.00 0.00 C ATOM 1317 OE1 GLU A 80 13.039 4.644 -11.832 1.00 0.00 O ATOM 1318 OE2 GLU A 80 13.603 2.622 -11.201 1.00 0.00 O ATOM 0 H GLU A 80 10.801 4.196 -6.890 1.00 0.00 H new ATOM 0 HA GLU A 80 12.748 2.770 -8.293 1.00 0.00 H new ATOM 0 HB2 GLU A 80 10.456 4.223 -8.726 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.682 5.308 -9.352 1.00 0.00 H new ATOM 0 HG2 GLU A 80 11.323 2.432 -10.183 1.00 0.00 H new ATOM 0 HG3 GLU A 80 10.687 3.819 -11.046 1.00 0.00 H new ATOM 1325 N GLU A 81 13.531 5.927 -7.673 1.00 0.00 N ATOM 1326 CA GLU A 81 14.680 6.808 -7.730 1.00 0.00 C ATOM 1327 C GLU A 81 15.704 6.506 -6.638 1.00 0.00 C ATOM 1328 O GLU A 81 16.902 6.645 -6.870 1.00 0.00 O ATOM 1329 CB GLU A 81 14.316 8.287 -7.738 1.00 0.00 C ATOM 1330 CG GLU A 81 13.671 8.798 -6.475 1.00 0.00 C ATOM 1331 CD GLU A 81 13.571 10.284 -6.498 1.00 0.00 C ATOM 1332 OE1 GLU A 81 14.619 10.956 -6.318 1.00 0.00 O ATOM 1333 OE2 GLU A 81 12.477 10.817 -6.693 1.00 0.00 O ATOM 0 H GLU A 81 12.665 6.351 -7.341 1.00 0.00 H new ATOM 0 HA GLU A 81 15.145 6.596 -8.693 1.00 0.00 H new ATOM 0 HB2 GLU A 81 15.221 8.866 -7.924 1.00 0.00 H new ATOM 0 HB3 GLU A 81 13.640 8.474 -8.573 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.677 8.363 -6.367 1.00 0.00 H new ATOM 0 HG3 GLU A 81 14.253 8.481 -5.610 1.00 0.00 H new ATOM 1340 N LYS A 82 15.249 6.066 -5.462 1.00 0.00 N ATOM 1341 CA LYS A 82 16.180 5.759 -4.380 1.00 0.00 C ATOM 1342 C LYS A 82 17.036 4.545 -4.742 1.00 0.00 C ATOM 1343 O LYS A 82 18.199 4.464 -4.374 1.00 0.00 O ATOM 1344 CB LYS A 82 15.452 5.614 -2.996 1.00 0.00 C ATOM 1345 CG LYS A 82 14.520 4.408 -2.838 1.00 0.00 C ATOM 1346 CD LYS A 82 15.276 3.148 -2.445 1.00 0.00 C ATOM 1347 CE LYS A 82 14.470 1.897 -2.719 1.00 0.00 C ATOM 1348 NZ LYS A 82 13.229 1.772 -1.907 1.00 0.00 N ATOM 0 H LYS A 82 14.265 5.918 -5.240 1.00 0.00 H new ATOM 0 HA LYS A 82 16.857 6.605 -4.259 1.00 0.00 H new ATOM 0 HB2 LYS A 82 16.211 5.564 -2.215 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.872 6.519 -2.819 1.00 0.00 H new ATOM 0 HG2 LYS A 82 13.767 4.629 -2.082 1.00 0.00 H new ATOM 0 HG3 LYS A 82 13.990 4.235 -3.775 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.216 3.102 -2.995 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.529 3.192 -1.386 1.00 0.00 H new ATOM 0 HE2 LYS A 82 14.201 1.877 -3.775 1.00 0.00 H new ATOM 0 HE3 LYS A 82 15.099 1.027 -2.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 12.654 0.985 -2.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 13.480 1.588 -0.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.684 2.656 -1.968 1.00 0.00 H new ATOM 1362 N ARG A 83 16.438 3.613 -5.468 1.00 0.00 N ATOM 1363 CA ARG A 83 17.118 2.407 -5.915 1.00 0.00 C ATOM 1364 C ARG A 83 18.016 2.706 -7.115 1.00 0.00 C ATOM 1365 O ARG A 83 19.137 2.215 -7.210 1.00 0.00 O ATOM 1366 CB ARG A 83 16.070 1.347 -6.301 1.00 0.00 C ATOM 1367 CG ARG A 83 16.607 -0.020 -6.752 1.00 0.00 C ATOM 1368 CD ARG A 83 17.311 -0.783 -5.632 1.00 0.00 C ATOM 1369 NE ARG A 83 18.622 -0.209 -5.271 1.00 0.00 N ATOM 1370 CZ ARG A 83 19.135 -0.177 -4.032 1.00 0.00 C ATOM 1371 NH1 ARG A 83 18.442 -0.622 -3.006 1.00 0.00 N ATOM 1372 NH2 ARG A 83 20.355 0.309 -3.825 1.00 0.00 N ATOM 0 H ARG A 83 15.464 3.672 -5.765 1.00 0.00 H new ATOM 0 HA ARG A 83 17.742 2.033 -5.104 1.00 0.00 H new ATOM 0 HB2 ARG A 83 15.414 1.190 -5.445 1.00 0.00 H new ATOM 0 HB3 ARG A 83 15.455 1.753 -7.104 1.00 0.00 H new ATOM 0 HG2 ARG A 83 15.781 -0.622 -7.131 1.00 0.00 H new ATOM 0 HG3 ARG A 83 17.302 0.124 -7.579 1.00 0.00 H new ATOM 0 HD2 ARG A 83 16.671 -0.793 -4.750 1.00 0.00 H new ATOM 0 HD3 ARG A 83 17.448 -1.820 -5.938 1.00 0.00 H new ATOM 0 HE ARG A 83 19.181 0.195 -6.022 1.00 0.00 H new ATOM 0 HH11 ARG A 83 17.504 -0.997 -3.148 1.00 0.00 H new ATOM 0 HH12 ARG A 83 18.843 -0.592 -2.069 1.00 0.00 H new ATOM 0 HH21 ARG A 83 20.904 0.659 -4.610 1.00 0.00 H new ATOM 0 HH22 ARG A 83 20.742 0.332 -2.881 1.00 0.00 H new ATOM 1386 N ARG A 84 17.511 3.523 -7.998 1.00 0.00 N ATOM 1387 CA ARG A 84 18.126 3.783 -9.281 1.00 0.00 C ATOM 1388 C ARG A 84 19.157 4.900 -9.269 1.00 0.00 C ATOM 1389 O ARG A 84 20.309 4.681 -9.642 1.00 0.00 O ATOM 1390 CB ARG A 84 17.022 4.124 -10.247 1.00 0.00 C ATOM 1391 CG ARG A 84 17.419 4.334 -11.673 1.00 0.00 C ATOM 1392 CD ARG A 84 16.198 4.757 -12.424 1.00 0.00 C ATOM 1393 NE ARG A 84 16.399 4.857 -13.853 1.00 0.00 N ATOM 1394 CZ ARG A 84 15.416 4.987 -14.738 1.00 0.00 C ATOM 1395 NH1 ARG A 84 14.142 4.989 -14.335 1.00 0.00 N ATOM 1396 NH2 ARG A 84 15.708 5.084 -16.025 1.00 0.00 N ATOM 0 H ARG A 84 16.644 4.039 -7.848 1.00 0.00 H new ATOM 0 HA ARG A 84 18.676 2.888 -9.571 1.00 0.00 H new ATOM 0 HB2 ARG A 84 16.282 3.324 -10.214 1.00 0.00 H new ATOM 0 HB3 ARG A 84 16.529 5.030 -9.894 1.00 0.00 H new ATOM 0 HG2 ARG A 84 18.196 5.095 -11.746 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.830 3.417 -12.095 1.00 0.00 H new ATOM 0 HD2 ARG A 84 15.397 4.045 -12.228 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.865 5.723 -12.044 1.00 0.00 H new ATOM 0 HE ARG A 84 17.356 4.826 -14.204 1.00 0.00 H new ATOM 0 HH11 ARG A 84 13.920 4.890 -13.344 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.391 5.089 -15.018 1.00 0.00 H new ATOM 0 HH21 ARG A 84 16.681 5.059 -16.331 1.00 0.00 H new ATOM 0 HH22 ARG A 84 14.960 5.184 -16.711 1.00 0.00 H new ATOM 1410 N SER A 85 18.774 6.091 -8.868 1.00 0.00 N ATOM 1411 CA SER A 85 19.656 7.222 -9.013 1.00 0.00 C ATOM 1412 C SER A 85 19.373 8.356 -8.016 1.00 0.00 C ATOM 1413 O SER A 85 18.415 9.126 -8.187 1.00 0.00 O ATOM 1414 CB SER A 85 19.592 7.750 -10.456 1.00 0.00 C ATOM 1415 OG SER A 85 20.065 6.777 -11.399 1.00 0.00 O ATOM 0 H SER A 85 17.870 6.299 -8.445 1.00 0.00 H new ATOM 0 HA SER A 85 20.661 6.866 -8.787 1.00 0.00 H new ATOM 0 HB2 SER A 85 18.565 8.022 -10.699 1.00 0.00 H new ATOM 0 HB3 SER A 85 20.190 8.657 -10.538 1.00 0.00 H new ATOM 0 HG SER A 85 20.009 7.145 -12.305 1.00 0.00 H new ATOM 1421 N ARG A 86 20.173 8.372 -6.950 1.00 0.00 N ATOM 1422 CA ARG A 86 20.268 9.418 -5.960 1.00 0.00 C ATOM 1423 C ARG A 86 21.238 8.987 -4.861 1.00 0.00 C ATOM 1424 O ARG A 86 21.910 9.803 -4.275 1.00 0.00 O ATOM 1425 CB ARG A 86 18.940 9.787 -5.344 1.00 0.00 C ATOM 1426 CG ARG A 86 18.269 8.688 -4.561 1.00 0.00 C ATOM 1427 CD ARG A 86 17.401 9.263 -3.478 1.00 0.00 C ATOM 1428 NE ARG A 86 16.386 10.202 -3.983 1.00 0.00 N ATOM 1429 CZ ARG A 86 15.911 11.278 -3.319 1.00 0.00 C ATOM 1430 NH1 ARG A 86 16.382 11.608 -2.111 1.00 0.00 N ATOM 1431 NH2 ARG A 86 14.988 12.026 -3.890 1.00 0.00 N ATOM 0 H ARG A 86 20.809 7.599 -6.752 1.00 0.00 H new ATOM 0 HA ARG A 86 20.630 10.308 -6.475 1.00 0.00 H new ATOM 0 HB2 ARG A 86 19.088 10.642 -4.685 1.00 0.00 H new ATOM 0 HB3 ARG A 86 18.266 10.109 -6.138 1.00 0.00 H new ATOM 0 HG2 ARG A 86 17.666 8.074 -5.230 1.00 0.00 H new ATOM 0 HG3 ARG A 86 19.023 8.035 -4.122 1.00 0.00 H new ATOM 0 HD2 ARG A 86 16.903 8.449 -2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 86 18.031 9.776 -2.751 1.00 0.00 H new ATOM 0 HE ARG A 86 16.009 10.025 -4.914 1.00 0.00 H new ATOM 0 HH11 ARG A 86 17.112 11.043 -1.677 1.00 0.00 H new ATOM 0 HH12 ARG A 86 16.011 12.424 -1.625 1.00 0.00 H new ATOM 0 HH21 ARG A 86 14.643 11.789 -4.820 1.00 0.00 H new ATOM 0 HH22 ARG A 86 14.619 12.842 -3.402 1.00 0.00 H new ATOM 1445 N LEU A 87 21.297 7.688 -4.598 1.00 0.00 N ATOM 1446 CA LEU A 87 22.144 7.147 -3.542 1.00 0.00 C ATOM 1447 C LEU A 87 23.208 6.239 -4.129 1.00 0.00 C ATOM 1448 O LEU A 87 22.895 5.374 -4.965 1.00 0.00 O ATOM 1449 CB LEU A 87 21.265 6.368 -2.563 1.00 0.00 C ATOM 1450 CG LEU A 87 20.262 7.200 -1.763 1.00 0.00 C ATOM 1451 CD1 LEU A 87 19.161 6.324 -1.210 1.00 0.00 C ATOM 1452 CD2 LEU A 87 20.966 7.931 -0.633 1.00 0.00 C ATOM 0 H LEU A 87 20.763 6.983 -5.107 1.00 0.00 H new ATOM 0 HA LEU A 87 22.647 7.962 -3.021 1.00 0.00 H new ATOM 0 HB2 LEU A 87 20.716 5.610 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 87 21.913 5.841 -1.862 1.00 0.00 H new ATOM 0 HG LEU A 87 19.815 7.934 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 87 18.459 6.936 -0.644 1.00 0.00 H new ATOM 0 HD12 LEU A 87 18.637 5.836 -2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 87 19.593 5.567 -0.555 1.00 0.00 H new ATOM 0 HD21 LEU A 87 20.240 8.519 -0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 87 21.437 7.206 0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 87 21.727 8.593 -1.046 1.00 0.00 H new TER 1464 LEU A 87 ATOM 1465 N GLY B 101 15.660 21.263 5.187 1.00 0.00 N ATOM 1466 CA GLY B 101 16.383 21.321 6.443 1.00 0.00 C ATOM 1467 C GLY B 101 16.146 20.080 7.272 1.00 0.00 C ATOM 1468 O GLY B 101 17.012 19.629 8.041 1.00 0.00 O ATOM 0 HA2 GLY B 101 17.449 21.431 6.246 1.00 0.00 H new ATOM 0 HA3 GLY B 101 16.070 22.201 7.005 1.00 0.00 H new ATOM 1472 N SER B 102 14.979 19.529 7.126 1.00 0.00 N ATOM 1473 CA SER B 102 14.598 18.355 7.843 1.00 0.00 C ATOM 1474 C SER B 102 13.973 17.341 6.899 1.00 0.00 C ATOM 1475 O SER B 102 12.784 17.400 6.602 1.00 0.00 O ATOM 1476 CB SER B 102 13.641 18.723 8.959 1.00 0.00 C ATOM 1477 OG SER B 102 14.220 19.730 9.784 1.00 0.00 O ATOM 0 H SER B 102 14.259 19.887 6.499 1.00 0.00 H new ATOM 0 HA SER B 102 15.484 17.900 8.285 1.00 0.00 H new ATOM 0 HB2 SER B 102 12.701 19.081 8.540 1.00 0.00 H new ATOM 0 HB3 SER B 102 13.409 17.841 9.556 1.00 0.00 H new ATOM 0 HG SER B 102 14.996 19.361 10.255 1.00 0.00 H new ATOM 1483 N MET B 103 14.804 16.489 6.360 1.00 0.00 N ATOM 1484 CA MET B 103 14.350 15.435 5.475 1.00 0.00 C ATOM 1485 C MET B 103 14.736 14.084 6.042 1.00 0.00 C ATOM 1486 O MET B 103 14.028 13.086 5.858 1.00 0.00 O ATOM 1487 CB MET B 103 14.935 15.608 4.075 1.00 0.00 C ATOM 1488 CG MET B 103 14.465 16.862 3.353 1.00 0.00 C ATOM 1489 SD MET B 103 12.677 16.893 3.103 1.00 0.00 S ATOM 1490 CE MET B 103 12.502 18.416 2.183 1.00 0.00 C ATOM 0 H MET B 103 15.812 16.501 6.517 1.00 0.00 H new ATOM 0 HA MET B 103 13.264 15.493 5.397 1.00 0.00 H new ATOM 0 HB2 MET B 103 16.022 15.630 4.148 1.00 0.00 H new ATOM 0 HB3 MET B 103 14.674 14.737 3.474 1.00 0.00 H new ATOM 0 HG2 MET B 103 14.763 17.740 3.927 1.00 0.00 H new ATOM 0 HG3 MET B 103 14.964 16.928 2.386 1.00 0.00 H new ATOM 0 HE1 MET B 103 11.450 18.581 1.949 1.00 0.00 H new ATOM 0 HE2 MET B 103 12.876 19.247 2.781 1.00 0.00 H new ATOM 0 HE3 MET B 103 13.073 18.349 1.257 1.00 0.00 H new ATOM 1500 N SER B 104 15.837 14.056 6.762 1.00 0.00 N ATOM 1501 CA SER B 104 16.289 12.847 7.388 1.00 0.00 C ATOM 1502 C SER B 104 15.595 12.674 8.743 1.00 0.00 C ATOM 1503 O SER B 104 15.109 11.578 9.071 1.00 0.00 O ATOM 1504 CB SER B 104 17.804 12.883 7.510 1.00 0.00 C ATOM 1505 OG SER B 104 18.381 13.135 6.226 1.00 0.00 O ATOM 0 H SER B 104 16.434 14.866 6.925 1.00 0.00 H new ATOM 0 HA SER B 104 16.026 11.981 6.781 1.00 0.00 H new ATOM 0 HB2 SER B 104 18.104 13.659 8.214 1.00 0.00 H new ATOM 0 HB3 SER B 104 18.170 11.935 7.905 1.00 0.00 H new ATOM 0 HG SER B 104 19.357 13.160 6.305 1.00 0.00 H new ATOM 1511 N HIS B 105 15.508 13.759 9.512 1.00 0.00 N ATOM 1512 CA HIS B 105 14.776 13.733 10.762 1.00 0.00 C ATOM 1513 C HIS B 105 13.379 14.306 10.512 1.00 0.00 C ATOM 1514 O HIS B 105 13.142 15.530 10.558 1.00 0.00 O ATOM 1515 CB HIS B 105 15.538 14.422 11.947 1.00 0.00 C ATOM 1516 CG HIS B 105 15.756 15.912 11.855 1.00 0.00 C ATOM 1517 ND1 HIS B 105 15.227 16.803 12.755 1.00 0.00 N ATOM 1518 CD2 HIS B 105 16.474 16.652 10.975 1.00 0.00 C ATOM 1519 CE1 HIS B 105 15.617 18.021 12.413 1.00 0.00 C ATOM 1520 NE2 HIS B 105 16.383 17.995 11.333 1.00 0.00 N ATOM 0 H HIS B 105 15.935 14.658 9.287 1.00 0.00 H new ATOM 0 HA HIS B 105 14.679 12.701 11.098 1.00 0.00 H new ATOM 0 HB2 HIS B 105 14.989 14.217 12.866 1.00 0.00 H new ATOM 0 HB3 HIS B 105 16.513 13.944 12.045 1.00 0.00 H new ATOM 0 HD2 HIS B 105 17.027 16.263 10.133 1.00 0.00 H new ATOM 0 HE1 HIS B 105 15.345 18.920 12.946 1.00 0.00 H new ATOM 0 HE2 HIS B 105 16.815 18.790 10.863 1.00 0.00 H new ATOM 1528 N TYR B 106 12.494 13.398 10.150 1.00 0.00 N ATOM 1529 CA TYR B 106 11.143 13.690 9.698 1.00 0.00 C ATOM 1530 C TYR B 106 11.147 14.293 8.297 1.00 0.00 C ATOM 1531 O TYR B 106 12.196 14.640 7.774 1.00 0.00 O ATOM 1532 CB TYR B 106 10.296 14.458 10.714 1.00 0.00 C ATOM 1533 CG TYR B 106 9.919 13.607 11.904 1.00 0.00 C ATOM 1534 CD1 TYR B 106 8.793 12.798 11.861 1.00 0.00 C ATOM 1535 CD2 TYR B 106 10.688 13.595 13.059 1.00 0.00 C ATOM 1536 CE1 TYR B 106 8.438 12.006 12.929 1.00 0.00 C ATOM 1537 CE2 TYR B 106 10.340 12.804 14.136 1.00 0.00 C ATOM 1538 CZ TYR B 106 9.212 12.011 14.062 1.00 0.00 C ATOM 1539 OH TYR B 106 8.851 11.224 15.136 1.00 0.00 O ATOM 0 H TYR B 106 12.701 12.399 10.162 1.00 0.00 H new ATOM 0 HA TYR B 106 10.625 12.734 9.620 1.00 0.00 H new ATOM 0 HB2 TYR B 106 10.848 15.334 11.056 1.00 0.00 H new ATOM 0 HB3 TYR B 106 9.390 14.822 10.228 1.00 0.00 H new ATOM 0 HD1 TYR B 106 8.182 12.789 10.971 1.00 0.00 H new ATOM 0 HD2 TYR B 106 11.572 14.213 13.116 1.00 0.00 H new ATOM 0 HE1 TYR B 106 7.556 11.385 12.876 1.00 0.00 H new ATOM 0 HE2 TYR B 106 10.946 12.806 15.030 1.00 0.00 H new ATOM 0 HH TYR B 106 9.502 11.339 15.859 1.00 0.00 H new ATOM 1549 N GLY B 107 10.008 14.340 7.664 1.00 0.00 N ATOM 1550 CA GLY B 107 9.949 14.820 6.305 1.00 0.00 C ATOM 1551 C GLY B 107 10.003 13.664 5.327 1.00 0.00 C ATOM 1552 O GLY B 107 8.961 13.163 4.888 1.00 0.00 O ATOM 0 H GLY B 107 9.112 14.055 8.060 1.00 0.00 H new ATOM 0 HA2 GLY B 107 9.031 15.388 6.154 1.00 0.00 H new ATOM 0 HA3 GLY B 107 10.780 15.501 6.118 1.00 0.00 H new ATOM 1556 N ASN B 108 11.200 13.200 5.015 1.00 0.00 N ATOM 1557 CA ASN B 108 11.367 12.052 4.116 1.00 0.00 C ATOM 1558 C ASN B 108 11.530 10.798 4.932 1.00 0.00 C ATOM 1559 O ASN B 108 12.584 10.175 4.937 1.00 0.00 O ATOM 1560 CB ASN B 108 12.573 12.188 3.145 1.00 0.00 C ATOM 1561 CG ASN B 108 12.481 13.302 2.113 1.00 0.00 C ATOM 1562 OD1 ASN B 108 13.500 13.865 1.721 1.00 0.00 O ATOM 1563 ND2 ASN B 108 11.302 13.596 1.628 1.00 0.00 N ATOM 0 H ASN B 108 12.074 13.593 5.365 1.00 0.00 H new ATOM 0 HA ASN B 108 10.470 12.010 3.499 1.00 0.00 H new ATOM 0 HB2 ASN B 108 13.474 12.343 3.738 1.00 0.00 H new ATOM 0 HB3 ASN B 108 12.697 11.242 2.618 1.00 0.00 H new ATOM 0 HD21 ASN B 108 11.212 14.310 0.905 1.00 0.00 H new ATOM 0 HD22 ASN B 108 10.473 13.112 1.973 1.00 0.00 H new ATOM 1570 N GLN B 109 10.512 10.462 5.683 1.00 0.00 N ATOM 1571 CA GLN B 109 10.564 9.296 6.534 1.00 0.00 C ATOM 1572 C GLN B 109 10.255 8.061 5.777 1.00 0.00 C ATOM 1573 O GLN B 109 10.871 7.020 6.011 1.00 0.00 O ATOM 1574 CB GLN B 109 9.686 9.450 7.762 1.00 0.00 C ATOM 1575 CG GLN B 109 10.134 10.598 8.627 1.00 0.00 C ATOM 1576 CD GLN B 109 11.611 10.490 9.013 1.00 0.00 C ATOM 1577 OE1 GLN B 109 11.958 9.922 10.033 1.00 0.00 O ATOM 1578 NE2 GLN B 109 12.481 11.042 8.187 1.00 0.00 N ATOM 0 H GLN B 109 9.634 10.980 5.724 1.00 0.00 H new ATOM 0 HA GLN B 109 11.588 9.203 6.896 1.00 0.00 H new ATOM 0 HB2 GLN B 109 8.653 9.609 7.453 1.00 0.00 H new ATOM 0 HB3 GLN B 109 9.707 8.527 8.342 1.00 0.00 H new ATOM 0 HG2 GLN B 109 9.966 11.536 8.098 1.00 0.00 H new ATOM 0 HG3 GLN B 109 9.525 10.629 9.531 1.00 0.00 H new ATOM 0 HE21 GLN B 109 12.155 11.510 7.341 1.00 0.00 H new ATOM 0 HE22 GLN B 109 13.479 11.000 8.395 1.00 0.00 H new ATOM 1587 N THR B 110 9.350 8.182 4.832 1.00 0.00 N ATOM 1588 CA THR B 110 8.981 7.083 3.994 1.00 0.00 C ATOM 1589 C THR B 110 10.189 6.593 3.203 1.00 0.00 C ATOM 1590 O THR B 110 10.368 5.418 3.039 1.00 0.00 O ATOM 1591 CB THR B 110 7.823 7.477 3.069 1.00 0.00 C ATOM 1592 OG1 THR B 110 8.123 8.736 2.455 1.00 0.00 O ATOM 1593 CG2 THR B 110 6.532 7.596 3.857 1.00 0.00 C ATOM 0 H THR B 110 8.853 9.050 4.629 1.00 0.00 H new ATOM 0 HA THR B 110 8.636 6.260 4.621 1.00 0.00 H new ATOM 0 HB THR B 110 7.698 6.708 2.307 1.00 0.00 H new ATOM 0 HG1 THR B 110 7.388 8.994 1.861 1.00 0.00 H new ATOM 0 HG21 THR B 110 5.720 7.876 3.186 1.00 0.00 H new ATOM 0 HG22 THR B 110 6.302 6.639 4.325 1.00 0.00 H new ATOM 0 HG23 THR B 110 6.645 8.359 4.628 1.00 0.00 H new ATOM 1601 N LEU B 111 11.047 7.527 2.785 1.00 0.00 N ATOM 1602 CA LEU B 111 12.286 7.209 2.078 1.00 0.00 C ATOM 1603 C LEU B 111 13.180 6.298 2.931 1.00 0.00 C ATOM 1604 O LEU B 111 13.712 5.303 2.437 1.00 0.00 O ATOM 1605 CB LEU B 111 13.045 8.503 1.738 1.00 0.00 C ATOM 1606 CG LEU B 111 14.378 8.349 0.999 1.00 0.00 C ATOM 1607 CD1 LEU B 111 14.173 7.748 -0.381 1.00 0.00 C ATOM 1608 CD2 LEU B 111 15.089 9.688 0.898 1.00 0.00 C ATOM 0 H LEU B 111 10.900 8.526 2.928 1.00 0.00 H new ATOM 0 HA LEU B 111 12.029 6.685 1.157 1.00 0.00 H new ATOM 0 HB2 LEU B 111 12.391 9.131 1.132 1.00 0.00 H new ATOM 0 HB3 LEU B 111 13.232 9.041 2.667 1.00 0.00 H new ATOM 0 HG LEU B 111 15.004 7.666 1.573 1.00 0.00 H new ATOM 0 HD11 LEU B 111 15.136 7.650 -0.882 1.00 0.00 H new ATOM 0 HD12 LEU B 111 13.713 6.765 -0.285 1.00 0.00 H new ATOM 0 HD13 LEU B 111 13.523 8.397 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU B 111 16.034 9.559 0.370 1.00 0.00 H new ATOM 0 HD22 LEU B 111 14.462 10.393 0.352 1.00 0.00 H new ATOM 0 HD23 LEU B 111 15.282 10.074 1.899 1.00 0.00 H new ATOM 1620 N GLN B 112 13.290 6.624 4.216 1.00 0.00 N ATOM 1621 CA GLN B 112 14.153 5.888 5.148 1.00 0.00 C ATOM 1622 C GLN B 112 13.605 4.472 5.336 1.00 0.00 C ATOM 1623 O GLN B 112 14.335 3.465 5.191 1.00 0.00 O ATOM 1624 CB GLN B 112 14.187 6.582 6.518 1.00 0.00 C ATOM 1625 CG GLN B 112 14.314 8.101 6.481 1.00 0.00 C ATOM 1626 CD GLN B 112 15.553 8.619 5.781 1.00 0.00 C ATOM 1627 OE1 GLN B 112 16.609 7.983 5.782 1.00 0.00 O ATOM 1628 NE2 GLN B 112 15.430 9.767 5.174 1.00 0.00 N ATOM 0 H GLN B 112 12.787 7.402 4.644 1.00 0.00 H new ATOM 0 HA GLN B 112 15.161 5.858 4.734 1.00 0.00 H new ATOM 0 HB2 GLN B 112 13.277 6.324 7.059 1.00 0.00 H new ATOM 0 HB3 GLN B 112 15.023 6.179 7.090 1.00 0.00 H new ATOM 0 HG2 GLN B 112 13.435 8.513 5.985 1.00 0.00 H new ATOM 0 HG3 GLN B 112 14.308 8.477 7.504 1.00 0.00 H new ATOM 0 HE21 GLN B 112 14.539 10.263 5.196 1.00 0.00 H new ATOM 0 HE22 GLN B 112 16.225 10.169 4.677 1.00 0.00 H new ATOM 1637 N ASP B 113 12.309 4.402 5.639 1.00 0.00 N ATOM 1638 CA ASP B 113 11.618 3.128 5.839 1.00 0.00 C ATOM 1639 C ASP B 113 11.672 2.292 4.591 1.00 0.00 C ATOM 1640 O ASP B 113 12.066 1.146 4.631 1.00 0.00 O ATOM 1641 CB ASP B 113 10.145 3.316 6.257 1.00 0.00 C ATOM 1642 CG ASP B 113 9.955 3.746 7.695 1.00 0.00 C ATOM 1643 OD1 ASP B 113 9.836 2.869 8.586 1.00 0.00 O ATOM 1644 OD2 ASP B 113 9.878 4.957 7.967 1.00 0.00 O ATOM 0 H ASP B 113 11.712 5.221 5.752 1.00 0.00 H new ATOM 0 HA ASP B 113 12.139 2.619 6.650 1.00 0.00 H new ATOM 0 HB2 ASP B 113 9.687 4.059 5.604 1.00 0.00 H new ATOM 0 HB3 ASP B 113 9.612 2.379 6.097 1.00 0.00 H new ATOM 1649 N LEU B 114 11.349 2.904 3.473 1.00 0.00 N ATOM 1650 CA LEU B 114 11.286 2.227 2.190 1.00 0.00 C ATOM 1651 C LEU B 114 12.668 1.825 1.691 1.00 0.00 C ATOM 1652 O LEU B 114 12.797 0.980 0.822 1.00 0.00 O ATOM 1653 CB LEU B 114 10.572 3.113 1.183 1.00 0.00 C ATOM 1654 CG LEU B 114 10.297 2.555 -0.206 1.00 0.00 C ATOM 1655 CD1 LEU B 114 9.504 1.249 -0.132 1.00 0.00 C ATOM 1656 CD2 LEU B 114 9.541 3.599 -0.992 1.00 0.00 C ATOM 0 H LEU B 114 11.120 3.897 3.425 1.00 0.00 H new ATOM 0 HA LEU B 114 10.721 1.303 2.315 1.00 0.00 H new ATOM 0 HB2 LEU B 114 9.617 3.406 1.618 1.00 0.00 H new ATOM 0 HB3 LEU B 114 11.161 4.022 1.065 1.00 0.00 H new ATOM 0 HG LEU B 114 11.240 2.325 -0.701 1.00 0.00 H new ATOM 0 HD11 LEU B 114 9.323 0.875 -1.140 1.00 0.00 H new ATOM 0 HD12 LEU B 114 10.072 0.510 0.433 1.00 0.00 H new ATOM 0 HD13 LEU B 114 8.550 1.430 0.364 1.00 0.00 H new ATOM 0 HD21 LEU B 114 9.332 3.221 -1.993 1.00 0.00 H new ATOM 0 HD22 LEU B 114 8.602 3.826 -0.487 1.00 0.00 H new ATOM 0 HD23 LEU B 114 10.142 4.505 -1.065 1.00 0.00 H new ATOM 1668 N LEU B 115 13.695 2.455 2.196 1.00 0.00 N ATOM 1669 CA LEU B 115 15.053 2.044 1.882 1.00 0.00 C ATOM 1670 C LEU B 115 15.354 0.767 2.658 1.00 0.00 C ATOM 1671 O LEU B 115 15.861 -0.227 2.106 1.00 0.00 O ATOM 1672 CB LEU B 115 16.051 3.144 2.265 1.00 0.00 C ATOM 1673 CG LEU B 115 17.529 2.859 1.984 1.00 0.00 C ATOM 1674 CD1 LEU B 115 17.784 2.698 0.490 1.00 0.00 C ATOM 1675 CD2 LEU B 115 18.398 3.960 2.563 1.00 0.00 C ATOM 0 H LEU B 115 13.626 3.254 2.826 1.00 0.00 H new ATOM 0 HA LEU B 115 15.148 1.866 0.811 1.00 0.00 H new ATOM 0 HB2 LEU B 115 15.773 4.055 1.735 1.00 0.00 H new ATOM 0 HB3 LEU B 115 15.940 3.348 3.330 1.00 0.00 H new ATOM 0 HG LEU B 115 17.792 1.919 2.468 1.00 0.00 H new ATOM 0 HD11 LEU B 115 18.842 2.497 0.321 1.00 0.00 H new ATOM 0 HD12 LEU B 115 17.191 1.868 0.107 1.00 0.00 H new ATOM 0 HD13 LEU B 115 17.502 3.615 -0.028 1.00 0.00 H new ATOM 0 HD21 LEU B 115 19.446 3.744 2.355 1.00 0.00 H new ATOM 0 HD22 LEU B 115 18.128 4.913 2.109 1.00 0.00 H new ATOM 0 HD23 LEU B 115 18.246 4.015 3.641 1.00 0.00 H new ATOM 1687 N THR B 116 14.964 0.786 3.906 1.00 0.00 N ATOM 1688 CA THR B 116 15.164 -0.310 4.813 1.00 0.00 C ATOM 1689 C THR B 116 14.280 -1.530 4.420 1.00 0.00 C ATOM 1690 O THR B 116 14.717 -2.677 4.516 1.00 0.00 O ATOM 1691 CB THR B 116 14.874 0.158 6.260 1.00 0.00 C ATOM 1692 OG1 THR B 116 15.689 1.327 6.548 1.00 0.00 O ATOM 1693 CG2 THR B 116 15.205 -0.930 7.269 1.00 0.00 C ATOM 0 H THR B 116 14.488 1.583 4.328 1.00 0.00 H new ATOM 0 HA THR B 116 16.202 -0.637 4.754 1.00 0.00 H new ATOM 0 HB THR B 116 13.813 0.393 6.340 1.00 0.00 H new ATOM 0 HG1 THR B 116 15.296 2.114 6.116 1.00 0.00 H new ATOM 0 HG21 THR B 116 14.990 -0.570 8.275 1.00 0.00 H new ATOM 0 HG22 THR B 116 14.601 -1.813 7.063 1.00 0.00 H new ATOM 0 HG23 THR B 116 16.261 -1.187 7.193 1.00 0.00 H new ATOM 1701 N SER B 117 13.073 -1.275 3.946 1.00 0.00 N ATOM 1702 CA SER B 117 12.186 -2.329 3.516 1.00 0.00 C ATOM 1703 C SER B 117 12.628 -2.865 2.155 1.00 0.00 C ATOM 1704 O SER B 117 12.533 -4.054 1.885 1.00 0.00 O ATOM 1705 CB SER B 117 10.757 -1.812 3.473 1.00 0.00 C ATOM 1706 OG SER B 117 10.652 -0.693 2.621 1.00 0.00 O ATOM 0 H SER B 117 12.687 -0.336 3.851 1.00 0.00 H new ATOM 0 HA SER B 117 12.227 -3.154 4.228 1.00 0.00 H new ATOM 0 HB2 SER B 117 10.091 -2.602 3.126 1.00 0.00 H new ATOM 0 HB3 SER B 117 10.434 -1.541 4.478 1.00 0.00 H new ATOM 0 HG SER B 117 9.770 -0.688 2.195 1.00 0.00 H new ATOM 1712 N ASP B 118 13.146 -1.965 1.311 1.00 0.00 N ATOM 1713 CA ASP B 118 13.704 -2.322 -0.011 1.00 0.00 C ATOM 1714 C ASP B 118 14.830 -3.302 0.170 1.00 0.00 C ATOM 1715 O ASP B 118 14.982 -4.252 -0.588 1.00 0.00 O ATOM 1716 CB ASP B 118 14.240 -1.072 -0.671 1.00 0.00 C ATOM 1717 CG ASP B 118 14.725 -1.242 -2.082 1.00 0.00 C ATOM 1718 OD1 ASP B 118 13.895 -1.132 -2.997 1.00 0.00 O ATOM 1719 OD2 ASP B 118 15.935 -1.311 -2.289 1.00 0.00 O ATOM 0 H ASP B 118 13.193 -0.968 1.519 1.00 0.00 H new ATOM 0 HA ASP B 118 12.926 -2.768 -0.630 1.00 0.00 H new ATOM 0 HB2 ASP B 118 13.457 -0.314 -0.664 1.00 0.00 H new ATOM 0 HB3 ASP B 118 15.062 -0.687 -0.067 1.00 0.00 H new ATOM 1724 N SER B 119 15.569 -3.081 1.247 1.00 0.00 N ATOM 1725 CA SER B 119 16.690 -3.892 1.669 1.00 0.00 C ATOM 1726 C SER B 119 16.297 -5.385 1.898 1.00 0.00 C ATOM 1727 O SER B 119 17.175 -6.230 2.068 1.00 0.00 O ATOM 1728 CB SER B 119 17.307 -3.256 2.929 1.00 0.00 C ATOM 1729 OG SER B 119 18.446 -3.944 3.410 1.00 0.00 O ATOM 0 H SER B 119 15.392 -2.296 1.874 1.00 0.00 H new ATOM 0 HA SER B 119 17.432 -3.912 0.871 1.00 0.00 H new ATOM 0 HB2 SER B 119 17.582 -2.225 2.708 1.00 0.00 H new ATOM 0 HB3 SER B 119 16.553 -3.223 3.716 1.00 0.00 H new ATOM 0 HG SER B 119 18.400 -4.884 3.137 1.00 0.00 H new ATOM 1735 N LEU B 120 14.986 -5.694 1.910 1.00 0.00 N ATOM 1736 CA LEU B 120 14.514 -7.062 2.001 1.00 0.00 C ATOM 1737 C LEU B 120 14.990 -7.830 0.767 1.00 0.00 C ATOM 1738 O LEU B 120 15.770 -8.782 0.881 1.00 0.00 O ATOM 1739 CB LEU B 120 12.980 -7.088 2.094 1.00 0.00 C ATOM 1740 CG LEU B 120 12.313 -8.464 2.127 1.00 0.00 C ATOM 1741 CD1 LEU B 120 12.720 -9.249 3.364 1.00 0.00 C ATOM 1742 CD2 LEU B 120 10.801 -8.328 2.041 1.00 0.00 C ATOM 0 H LEU B 120 14.241 -4.999 1.857 1.00 0.00 H new ATOM 0 HA LEU B 120 14.915 -7.533 2.899 1.00 0.00 H new ATOM 0 HB2 LEU B 120 12.685 -6.546 2.993 1.00 0.00 H new ATOM 0 HB3 LEU B 120 12.579 -6.537 1.244 1.00 0.00 H new ATOM 0 HG LEU B 120 12.657 -9.023 1.257 1.00 0.00 H new ATOM 0 HD11 LEU B 120 12.228 -10.222 3.356 1.00 0.00 H new ATOM 0 HD12 LEU B 120 13.801 -9.389 3.367 1.00 0.00 H new ATOM 0 HD13 LEU B 120 12.423 -8.700 4.257 1.00 0.00 H new ATOM 0 HD21 LEU B 120 10.345 -9.318 2.066 1.00 0.00 H new ATOM 0 HD22 LEU B 120 10.440 -7.741 2.885 1.00 0.00 H new ATOM 0 HD23 LEU B 120 10.533 -7.828 1.110 1.00 0.00 H new ATOM 1754 N SER B 121 14.543 -7.406 -0.402 1.00 0.00 N ATOM 1755 CA SER B 121 14.991 -8.011 -1.644 1.00 0.00 C ATOM 1756 C SER B 121 16.390 -7.490 -1.972 1.00 0.00 C ATOM 1757 O SER B 121 17.198 -8.182 -2.603 1.00 0.00 O ATOM 1758 CB SER B 121 14.011 -7.693 -2.786 1.00 0.00 C ATOM 1759 OG SER B 121 14.380 -8.340 -4.005 1.00 0.00 O ATOM 0 H SER B 121 13.872 -6.647 -0.517 1.00 0.00 H new ATOM 0 HA SER B 121 15.025 -9.094 -1.529 1.00 0.00 H new ATOM 0 HB2 SER B 121 13.007 -8.006 -2.499 1.00 0.00 H new ATOM 0 HB3 SER B 121 13.976 -6.615 -2.944 1.00 0.00 H new ATOM 0 HG SER B 121 14.017 -7.838 -4.765 1.00 0.00 H new ATOM 1765 N HIS B 122 16.653 -6.271 -1.495 1.00 0.00 N ATOM 1766 CA HIS B 122 17.878 -5.505 -1.692 1.00 0.00 C ATOM 1767 C HIS B 122 17.803 -4.750 -3.008 1.00 0.00 C ATOM 1768 O HIS B 122 17.893 -3.529 -3.013 1.00 0.00 O ATOM 1769 CB HIS B 122 19.180 -6.347 -1.520 1.00 0.00 C ATOM 1770 CG HIS B 122 20.470 -5.566 -1.568 1.00 0.00 C ATOM 1771 ND1 HIS B 122 21.147 -5.129 -0.445 1.00 0.00 N ATOM 1772 CD2 HIS B 122 21.227 -5.187 -2.627 1.00 0.00 C ATOM 1773 CE1 HIS B 122 22.265 -4.518 -0.847 1.00 0.00 C ATOM 1774 NE2 HIS B 122 22.362 -4.524 -2.166 1.00 0.00 N ATOM 0 H HIS B 122 15.973 -5.765 -0.927 1.00 0.00 H new ATOM 0 HA HIS B 122 17.949 -4.771 -0.889 1.00 0.00 H new ATOM 0 HB2 HIS B 122 19.129 -6.872 -0.566 1.00 0.00 H new ATOM 0 HB3 HIS B 122 19.206 -7.107 -2.301 1.00 0.00 H new ATOM 0 HD2 HIS B 122 20.988 -5.370 -3.664 1.00 0.00 H new ATOM 0 HE1 HIS B 122 22.993 -4.077 -0.183 1.00 0.00 H new ATOM 0 HE2 HIS B 122 23.113 -4.125 -2.729 1.00 0.00 H new ATOM 1782 N SER B 123 17.609 -5.474 -4.113 1.00 0.00 N ATOM 1783 CA SER B 123 17.439 -4.844 -5.413 1.00 0.00 C ATOM 1784 C SER B 123 16.980 -5.823 -6.524 1.00 0.00 C ATOM 1785 O SER B 123 17.797 -6.268 -7.345 1.00 0.00 O ATOM 1786 CB SER B 123 18.716 -4.080 -5.826 1.00 0.00 C ATOM 1787 OG SER B 123 19.858 -4.900 -5.683 1.00 0.00 O ATOM 0 H SER B 123 17.567 -6.493 -4.128 1.00 0.00 H new ATOM 0 HA SER B 123 16.625 -4.128 -5.299 1.00 0.00 H new ATOM 0 HB2 SER B 123 18.628 -3.748 -6.860 1.00 0.00 H new ATOM 0 HB3 SER B 123 18.825 -3.186 -5.212 1.00 0.00 H new ATOM 0 HG SER B 123 19.718 -5.743 -6.164 1.00 0.00 H new ATOM 1793 N ASP B 124 15.700 -6.196 -6.513 1.00 0.00 N ATOM 1794 CA ASP B 124 15.099 -7.027 -7.582 1.00 0.00 C ATOM 1795 C ASP B 124 13.620 -7.210 -7.328 1.00 0.00 C ATOM 1796 O ASP B 124 13.194 -7.298 -6.174 1.00 0.00 O ATOM 1797 CB ASP B 124 15.761 -8.413 -7.736 1.00 0.00 C ATOM 1798 CG ASP B 124 15.272 -9.124 -8.986 1.00 0.00 C ATOM 1799 OD1 ASP B 124 15.583 -8.648 -10.106 1.00 0.00 O ATOM 1800 OD2 ASP B 124 14.536 -10.137 -8.887 1.00 0.00 O ATOM 0 H ASP B 124 15.047 -5.938 -5.773 1.00 0.00 H new ATOM 0 HA ASP B 124 15.269 -6.487 -8.513 1.00 0.00 H new ATOM 0 HB2 ASP B 124 16.844 -8.298 -7.781 1.00 0.00 H new ATOM 0 HB3 ASP B 124 15.541 -9.022 -6.859 1.00 0.00 H new ATOM 1805 N GLY B 125 12.847 -7.262 -8.386 1.00 0.00 N ATOM 1806 CA GLY B 125 11.432 -7.414 -8.259 1.00 0.00 C ATOM 1807 C GLY B 125 10.787 -6.074 -8.137 1.00 0.00 C ATOM 1808 O GLY B 125 10.998 -5.197 -8.996 1.00 0.00 O ATOM 0 H GLY B 125 13.184 -7.200 -9.347 1.00 0.00 H new ATOM 0 HA2 GLY B 125 11.035 -7.941 -9.126 1.00 0.00 H new ATOM 0 HA3 GLY B 125 11.200 -8.020 -7.384 1.00 0.00 H new ATOM 1812 N GLY B 126 10.054 -5.883 -7.084 1.00 0.00 N ATOM 1813 CA GLY B 126 9.412 -4.627 -6.869 1.00 0.00 C ATOM 1814 C GLY B 126 7.943 -4.789 -6.645 1.00 0.00 C ATOM 1815 O GLY B 126 7.523 -5.572 -5.774 1.00 0.00 O ATOM 0 H GLY B 126 9.886 -6.582 -6.361 1.00 0.00 H new ATOM 0 HA2 GLY B 126 9.859 -4.132 -6.007 1.00 0.00 H new ATOM 0 HA3 GLY B 126 9.580 -3.980 -7.730 1.00 0.00 H new ATOM 1819 N GLY B 127 7.164 -4.086 -7.425 1.00 0.00 N ATOM 1820 CA GLY B 127 5.745 -4.148 -7.286 1.00 0.00 C ATOM 1821 C GLY B 127 5.110 -5.027 -8.333 1.00 0.00 C ATOM 1822 O GLY B 127 5.758 -5.938 -8.869 1.00 0.00 O ATOM 0 H GLY B 127 7.496 -3.465 -8.163 1.00 0.00 H new ATOM 0 HA2 GLY B 127 5.495 -4.527 -6.295 1.00 0.00 H new ATOM 0 HA3 GLY B 127 5.330 -3.143 -7.357 1.00 0.00 H new ATOM 1826 N SER B 128 3.867 -4.758 -8.634 1.00 0.00 N ATOM 1827 CA SER B 128 3.132 -5.515 -9.597 1.00 0.00 C ATOM 1828 C SER B 128 2.006 -4.651 -10.142 1.00 0.00 C ATOM 1829 O SER B 128 1.336 -3.927 -9.376 1.00 0.00 O ATOM 1830 CB SER B 128 2.573 -6.796 -8.955 1.00 0.00 C ATOM 1831 OG SER B 128 1.913 -7.611 -9.908 1.00 0.00 O ATOM 0 H SER B 128 3.336 -3.998 -8.210 1.00 0.00 H new ATOM 0 HA SER B 128 3.789 -5.811 -10.414 1.00 0.00 H new ATOM 0 HB2 SER B 128 3.386 -7.358 -8.495 1.00 0.00 H new ATOM 0 HB3 SER B 128 1.878 -6.531 -8.158 1.00 0.00 H new ATOM 0 HG SER B 128 1.571 -8.417 -9.468 1.00 0.00 H new ATOM 1837 N GLY B 129 1.807 -4.718 -11.436 1.00 0.00 N ATOM 1838 CA GLY B 129 0.792 -3.940 -12.081 1.00 0.00 C ATOM 1839 C GLY B 129 -0.524 -4.663 -12.155 1.00 0.00 C ATOM 1840 O GLY B 129 -0.716 -5.702 -11.500 1.00 0.00 O ATOM 0 H GLY B 129 2.346 -5.313 -12.065 1.00 0.00 H new ATOM 0 HA2 GLY B 129 0.659 -3.003 -11.541 1.00 0.00 H new ATOM 0 HA3 GLY B 129 1.120 -3.684 -13.088 1.00 0.00 H new ATOM 1844 N GLY B 130 -1.436 -4.106 -12.916 1.00 0.00 N ATOM 1845 CA GLY B 130 -2.724 -4.725 -13.114 1.00 0.00 C ATOM 1846 C GLY B 130 -3.673 -4.510 -11.958 1.00 0.00 C ATOM 1847 O GLY B 130 -3.323 -3.872 -10.957 1.00 0.00 O ATOM 0 H GLY B 130 -1.309 -3.222 -13.409 1.00 0.00 H new ATOM 0 HA2 GLY B 130 -3.174 -4.328 -14.024 1.00 0.00 H new ATOM 0 HA3 GLY B 130 -2.586 -5.795 -13.268 1.00 0.00 H new ATOM 1851 N GLY B 131 -4.860 -5.032 -12.099 1.00 0.00 N ATOM 1852 CA GLY B 131 -5.883 -4.943 -11.093 1.00 0.00 C ATOM 1853 C GLY B 131 -6.837 -6.087 -11.277 1.00 0.00 C ATOM 1854 O GLY B 131 -6.950 -6.602 -12.388 1.00 0.00 O ATOM 0 H GLY B 131 -5.150 -5.542 -12.934 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -5.439 -4.977 -10.098 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -6.411 -3.993 -11.174 1.00 0.00 H new ATOM 1858 N SER B 132 -7.488 -6.513 -10.234 1.00 0.00 N ATOM 1859 CA SER B 132 -8.392 -7.639 -10.324 1.00 0.00 C ATOM 1860 C SER B 132 -9.625 -7.403 -9.466 1.00 0.00 C ATOM 1861 O SER B 132 -9.515 -6.887 -8.346 1.00 0.00 O ATOM 1862 CB SER B 132 -7.676 -8.928 -9.882 1.00 0.00 C ATOM 1863 OG SER B 132 -6.506 -9.176 -10.677 1.00 0.00 O ATOM 0 H SER B 132 -7.414 -6.100 -9.304 1.00 0.00 H new ATOM 0 HA SER B 132 -8.709 -7.748 -11.361 1.00 0.00 H new ATOM 0 HB2 SER B 132 -7.394 -8.848 -8.832 1.00 0.00 H new ATOM 0 HB3 SER B 132 -8.360 -9.773 -9.965 1.00 0.00 H new ATOM 0 HG SER B 132 -6.072 -10.000 -10.372 1.00 0.00 H new ATOM 1869 N GLY B 133 -10.779 -7.753 -9.995 1.00 0.00 N ATOM 1870 CA GLY B 133 -11.996 -7.626 -9.254 1.00 0.00 C ATOM 1871 C GLY B 133 -13.168 -7.193 -10.109 1.00 0.00 C ATOM 1872 O GLY B 133 -13.016 -6.909 -11.308 1.00 0.00 O ATOM 0 H GLY B 133 -10.890 -8.127 -10.937 1.00 0.00 H new ATOM 0 HA2 GLY B 133 -12.230 -8.581 -8.784 1.00 0.00 H new ATOM 0 HA3 GLY B 133 -11.852 -6.903 -8.451 1.00 0.00 H new ATOM 1876 N GLY B 134 -14.328 -7.172 -9.502 1.00 0.00 N ATOM 1877 CA GLY B 134 -15.539 -6.725 -10.136 1.00 0.00 C ATOM 1878 C GLY B 134 -16.486 -6.184 -9.098 1.00 0.00 C ATOM 1879 O GLY B 134 -16.626 -6.778 -8.017 1.00 0.00 O ATOM 0 H GLY B 134 -14.458 -7.471 -8.535 1.00 0.00 H new ATOM 0 HA2 GLY B 134 -15.312 -5.954 -10.872 1.00 0.00 H new ATOM 0 HA3 GLY B 134 -16.006 -7.551 -10.673 1.00 0.00 H new ATOM 1883 N GLY B 135 -17.099 -5.059 -9.372 1.00 0.00 N ATOM 1884 CA GLY B 135 -17.991 -4.471 -8.414 1.00 0.00 C ATOM 1885 C GLY B 135 -17.905 -2.967 -8.393 1.00 0.00 C ATOM 1886 O GLY B 135 -17.934 -2.336 -9.438 1.00 0.00 O ATOM 0 H GLY B 135 -16.996 -4.539 -10.243 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -19.014 -4.770 -8.643 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -17.760 -4.859 -7.422 1.00 0.00 H new ATOM 1890 N SER B 136 -17.735 -2.418 -7.212 1.00 0.00 N ATOM 1891 CA SER B 136 -17.747 -0.984 -6.970 1.00 0.00 C ATOM 1892 C SER B 136 -16.629 -0.175 -7.689 1.00 0.00 C ATOM 1893 O SER B 136 -16.901 0.594 -8.617 1.00 0.00 O ATOM 1894 CB SER B 136 -17.756 -0.752 -5.455 1.00 0.00 C ATOM 1895 OG SER B 136 -16.915 -1.712 -4.775 1.00 0.00 O ATOM 0 H SER B 136 -17.580 -2.967 -6.367 1.00 0.00 H new ATOM 0 HA SER B 136 -18.655 -0.587 -7.424 1.00 0.00 H new ATOM 0 HB2 SER B 136 -17.409 0.258 -5.237 1.00 0.00 H new ATOM 0 HB3 SER B 136 -18.776 -0.827 -5.079 1.00 0.00 H new ATOM 0 HG SER B 136 -16.213 -2.022 -5.385 1.00 0.00 H new ATOM 1901 N LEU B 137 -15.409 -0.333 -7.247 1.00 0.00 N ATOM 1902 CA LEU B 137 -14.279 0.406 -7.797 1.00 0.00 C ATOM 1903 C LEU B 137 -13.446 -0.526 -8.648 1.00 0.00 C ATOM 1904 O LEU B 137 -12.795 -0.126 -9.602 1.00 0.00 O ATOM 1905 CB LEU B 137 -13.420 0.958 -6.653 1.00 0.00 C ATOM 1906 CG LEU B 137 -14.133 1.848 -5.631 1.00 0.00 C ATOM 1907 CD1 LEU B 137 -13.197 2.173 -4.485 1.00 0.00 C ATOM 1908 CD2 LEU B 137 -14.633 3.131 -6.284 1.00 0.00 C ATOM 0 H LEU B 137 -15.160 -0.976 -6.495 1.00 0.00 H new ATOM 0 HA LEU B 137 -14.643 1.234 -8.405 1.00 0.00 H new ATOM 0 HB2 LEU B 137 -12.977 0.115 -6.122 1.00 0.00 H new ATOM 0 HB3 LEU B 137 -12.599 1.528 -7.087 1.00 0.00 H new ATOM 0 HG LEU B 137 -14.995 1.305 -5.244 1.00 0.00 H new ATOM 0 HD11 LEU B 137 -13.712 2.806 -3.763 1.00 0.00 H new ATOM 0 HD12 LEU B 137 -12.883 1.249 -3.999 1.00 0.00 H new ATOM 0 HD13 LEU B 137 -12.321 2.697 -4.868 1.00 0.00 H new ATOM 0 HD21 LEU B 137 -15.136 3.747 -5.538 1.00 0.00 H new ATOM 0 HD22 LEU B 137 -13.788 3.681 -6.699 1.00 0.00 H new ATOM 0 HD23 LEU B 137 -15.333 2.884 -7.082 1.00 0.00 H new ATOM 1920 N GLU B 138 -13.512 -1.779 -8.289 1.00 0.00 N ATOM 1921 CA GLU B 138 -12.740 -2.828 -8.881 1.00 0.00 C ATOM 1922 C GLU B 138 -13.209 -3.233 -10.300 1.00 0.00 C ATOM 1923 O GLU B 138 -12.513 -3.976 -10.980 1.00 0.00 O ATOM 1924 CB GLU B 138 -12.645 -4.047 -7.938 1.00 0.00 C ATOM 1925 CG GLU B 138 -13.983 -4.598 -7.431 1.00 0.00 C ATOM 1926 CD GLU B 138 -14.538 -3.931 -6.176 1.00 0.00 C ATOM 1927 OE1 GLU B 138 -14.934 -2.749 -6.228 1.00 0.00 O ATOM 1928 OE2 GLU B 138 -14.656 -4.618 -5.135 1.00 0.00 O ATOM 0 H GLU B 138 -14.130 -2.106 -7.547 1.00 0.00 H new ATOM 0 HA GLU B 138 -11.739 -2.420 -9.020 1.00 0.00 H new ATOM 0 HB2 GLU B 138 -12.117 -4.846 -8.458 1.00 0.00 H new ATOM 0 HB3 GLU B 138 -12.036 -3.771 -7.077 1.00 0.00 H new ATOM 0 HG2 GLU B 138 -14.720 -4.502 -8.228 1.00 0.00 H new ATOM 0 HG3 GLU B 138 -13.865 -5.663 -7.233 1.00 0.00 H new ATOM 1935 N CYS B 139 -14.396 -2.764 -10.719 1.00 0.00 N ATOM 1936 CA CYS B 139 -14.971 -3.110 -12.043 1.00 0.00 C ATOM 1937 C CYS B 139 -14.009 -2.770 -13.205 1.00 0.00 C ATOM 1938 O CYS B 139 -13.573 -3.655 -13.952 1.00 0.00 O ATOM 1939 CB CYS B 139 -16.303 -2.378 -12.213 1.00 0.00 C ATOM 1940 SG CYS B 139 -16.221 -0.608 -11.825 1.00 0.00 S ATOM 0 H CYS B 139 -14.983 -2.142 -10.163 1.00 0.00 H new ATOM 0 HA CYS B 139 -15.131 -4.188 -12.077 1.00 0.00 H new ATOM 0 HB2 CYS B 139 -16.645 -2.500 -13.241 1.00 0.00 H new ATOM 0 HB3 CYS B 139 -17.049 -2.847 -11.571 1.00 0.00 H new ATOM 0 HG CYS B 139 -16.538 -0.422 -10.578 1.00 0.00 H new ATOM 1946 N ASP B 140 -13.669 -1.519 -13.328 1.00 0.00 N ATOM 1947 CA ASP B 140 -12.666 -1.071 -14.273 1.00 0.00 C ATOM 1948 C ASP B 140 -11.641 -0.416 -13.435 1.00 0.00 C ATOM 1949 O ASP B 140 -11.691 0.777 -13.167 1.00 0.00 O ATOM 1950 CB ASP B 140 -13.230 -0.110 -15.335 1.00 0.00 C ATOM 1951 CG ASP B 140 -12.173 0.339 -16.338 1.00 0.00 C ATOM 1952 OD1 ASP B 140 -11.500 -0.519 -16.935 1.00 0.00 O ATOM 1953 OD2 ASP B 140 -11.986 1.564 -16.543 1.00 0.00 O ATOM 0 H ASP B 140 -14.080 -0.768 -12.773 1.00 0.00 H new ATOM 0 HA ASP B 140 -12.266 -1.902 -14.853 1.00 0.00 H new ATOM 0 HB2 ASP B 140 -14.046 -0.600 -15.867 1.00 0.00 H new ATOM 0 HB3 ASP B 140 -13.652 0.765 -14.841 1.00 0.00 H new ATOM 1958 N MET B 141 -10.767 -1.224 -12.942 1.00 0.00 N ATOM 1959 CA MET B 141 -9.921 -0.819 -11.879 1.00 0.00 C ATOM 1960 C MET B 141 -8.610 -0.279 -12.359 1.00 0.00 C ATOM 1961 O MET B 141 -8.117 0.700 -11.806 1.00 0.00 O ATOM 1962 CB MET B 141 -9.695 -1.990 -10.943 1.00 0.00 C ATOM 1963 CG MET B 141 -9.134 -1.593 -9.606 1.00 0.00 C ATOM 1964 SD MET B 141 -8.889 -2.994 -8.518 1.00 0.00 S ATOM 1965 CE MET B 141 -8.523 -2.136 -6.996 1.00 0.00 C ATOM 0 H MET B 141 -10.621 -2.180 -13.265 1.00 0.00 H new ATOM 0 HA MET B 141 -10.420 -0.006 -11.351 1.00 0.00 H new ATOM 0 HB2 MET B 141 -10.641 -2.510 -10.791 1.00 0.00 H new ATOM 0 HB3 MET B 141 -9.015 -2.697 -11.417 1.00 0.00 H new ATOM 0 HG2 MET B 141 -8.183 -1.081 -9.753 1.00 0.00 H new ATOM 0 HG3 MET B 141 -9.809 -0.882 -9.130 1.00 0.00 H new ATOM 0 HE1 MET B 141 -8.708 -2.799 -6.151 1.00 0.00 H new ATOM 0 HE2 MET B 141 -7.477 -1.828 -6.994 1.00 0.00 H new ATOM 0 HE3 MET B 141 -9.160 -1.256 -6.912 1.00 0.00 H new ATOM 1975 N GLU B 142 -8.050 -0.892 -13.400 1.00 0.00 N ATOM 1976 CA GLU B 142 -6.726 -0.522 -13.878 1.00 0.00 C ATOM 1977 C GLU B 142 -6.581 0.941 -14.225 1.00 0.00 C ATOM 1978 O GLU B 142 -5.603 1.552 -13.848 1.00 0.00 O ATOM 1979 CB GLU B 142 -6.216 -1.422 -14.990 1.00 0.00 C ATOM 1980 CG GLU B 142 -5.885 -2.821 -14.516 1.00 0.00 C ATOM 1981 CD GLU B 142 -5.174 -3.624 -15.558 1.00 0.00 C ATOM 1982 OE1 GLU B 142 -4.017 -3.302 -15.868 1.00 0.00 O ATOM 1983 OE2 GLU B 142 -5.737 -4.609 -16.062 1.00 0.00 O ATOM 0 H GLU B 142 -8.494 -1.645 -13.925 1.00 0.00 H new ATOM 0 HA GLU B 142 -6.077 -0.687 -13.018 1.00 0.00 H new ATOM 0 HB2 GLU B 142 -6.968 -1.480 -15.777 1.00 0.00 H new ATOM 0 HB3 GLU B 142 -5.326 -0.974 -15.432 1.00 0.00 H new ATOM 0 HG2 GLU B 142 -5.265 -2.761 -13.622 1.00 0.00 H new ATOM 0 HG3 GLU B 142 -6.805 -3.332 -14.232 1.00 0.00 H new ATOM 1990 N SER B 143 -7.562 1.500 -14.872 1.00 0.00 N ATOM 1991 CA SER B 143 -7.542 2.895 -15.252 1.00 0.00 C ATOM 1992 C SER B 143 -7.408 3.800 -14.005 1.00 0.00 C ATOM 1993 O SER B 143 -6.474 4.629 -13.898 1.00 0.00 O ATOM 1994 CB SER B 143 -8.832 3.184 -16.019 1.00 0.00 C ATOM 1995 OG SER B 143 -9.952 2.662 -15.295 1.00 0.00 O ATOM 0 H SER B 143 -8.407 1.003 -15.156 1.00 0.00 H new ATOM 0 HA SER B 143 -6.681 3.108 -15.885 1.00 0.00 H new ATOM 0 HB2 SER B 143 -8.948 4.258 -16.162 1.00 0.00 H new ATOM 0 HB3 SER B 143 -8.786 2.733 -17.010 1.00 0.00 H new ATOM 0 HG SER B 143 -10.562 2.211 -15.916 1.00 0.00 H new ATOM 2001 N ILE B 144 -8.281 3.558 -13.046 1.00 0.00 N ATOM 2002 CA ILE B 144 -8.351 4.330 -11.828 1.00 0.00 C ATOM 2003 C ILE B 144 -7.095 4.107 -10.971 1.00 0.00 C ATOM 2004 O ILE B 144 -6.471 5.067 -10.516 1.00 0.00 O ATOM 2005 CB ILE B 144 -9.615 3.963 -11.000 1.00 0.00 C ATOM 2006 CG1 ILE B 144 -10.871 4.015 -11.889 1.00 0.00 C ATOM 2007 CG2 ILE B 144 -9.773 4.940 -9.833 1.00 0.00 C ATOM 2008 CD1 ILE B 144 -12.148 3.581 -11.190 1.00 0.00 C ATOM 0 H ILE B 144 -8.970 2.808 -13.095 1.00 0.00 H new ATOM 0 HA ILE B 144 -8.412 5.381 -12.111 1.00 0.00 H new ATOM 0 HB ILE B 144 -9.497 2.951 -10.613 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -11.000 5.033 -12.257 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -10.713 3.379 -12.760 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -10.660 4.678 -9.257 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -8.894 4.885 -9.191 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -9.878 5.954 -10.219 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -12.984 3.647 -11.886 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -12.043 2.552 -10.846 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -12.334 4.232 -10.336 1.00 0.00 H new ATOM 2020 N ILE B 145 -6.701 2.844 -10.782 1.00 0.00 N ATOM 2021 CA ILE B 145 -5.531 2.536 -9.956 1.00 0.00 C ATOM 2022 C ILE B 145 -4.255 3.037 -10.561 1.00 0.00 C ATOM 2023 O ILE B 145 -3.348 3.334 -9.853 1.00 0.00 O ATOM 2024 CB ILE B 145 -5.334 1.047 -9.561 1.00 0.00 C ATOM 2025 CG1 ILE B 145 -5.218 0.151 -10.778 1.00 0.00 C ATOM 2026 CG2 ILE B 145 -6.413 0.569 -8.621 1.00 0.00 C ATOM 2027 CD1 ILE B 145 -4.911 -1.277 -10.439 1.00 0.00 C ATOM 0 H ILE B 145 -7.167 2.030 -11.183 1.00 0.00 H new ATOM 0 HA ILE B 145 -5.763 3.071 -9.035 1.00 0.00 H new ATOM 0 HB ILE B 145 -4.387 0.984 -9.024 1.00 0.00 H new ATOM 0 HG12 ILE B 145 -6.151 0.191 -11.340 1.00 0.00 H new ATOM 0 HG13 ILE B 145 -4.436 0.538 -11.432 1.00 0.00 H new ATOM 0 HG21 ILE B 145 -6.239 -0.477 -8.369 1.00 0.00 H new ATOM 0 HG22 ILE B 145 -6.395 1.169 -7.711 1.00 0.00 H new ATOM 0 HG23 ILE B 145 -7.386 0.669 -9.103 1.00 0.00 H new ATOM 0 HD11 ILE B 145 -4.842 -1.862 -11.356 1.00 0.00 H new ATOM 0 HD12 ILE B 145 -3.963 -1.328 -9.904 1.00 0.00 H new ATOM 0 HD13 ILE B 145 -5.705 -1.680 -9.810 1.00 0.00 H new ATOM 2039 N ARG B 146 -4.156 3.090 -11.863 1.00 0.00 N ATOM 2040 CA ARG B 146 -2.951 3.634 -12.438 1.00 0.00 C ATOM 2041 C ARG B 146 -2.900 5.125 -12.153 1.00 0.00 C ATOM 2042 O ARG B 146 -1.967 5.602 -11.514 1.00 0.00 O ATOM 2043 CB ARG B 146 -2.821 3.331 -13.941 1.00 0.00 C ATOM 2044 CG ARG B 146 -2.719 1.839 -14.258 1.00 0.00 C ATOM 2045 CD ARG B 146 -2.648 1.580 -15.753 1.00 0.00 C ATOM 2046 NE ARG B 146 -2.774 0.141 -16.077 1.00 0.00 N ATOM 2047 CZ ARG B 146 -2.441 -0.418 -17.254 1.00 0.00 C ATOM 2048 NH1 ARG B 146 -1.845 0.305 -18.192 1.00 0.00 N ATOM 2049 NH2 ARG B 146 -2.703 -1.694 -17.481 1.00 0.00 N ATOM 0 H ARG B 146 -4.865 2.777 -12.526 1.00 0.00 H new ATOM 0 HA ARG B 146 -2.094 3.148 -11.972 1.00 0.00 H new ATOM 0 HB2 ARG B 146 -3.683 3.747 -14.463 1.00 0.00 H new ATOM 0 HB3 ARG B 146 -1.938 3.838 -14.330 1.00 0.00 H new ATOM 0 HG2 ARG B 146 -1.833 1.425 -13.776 1.00 0.00 H new ATOM 0 HG3 ARG B 146 -3.581 1.320 -13.840 1.00 0.00 H new ATOM 0 HD2 ARG B 146 -3.441 2.135 -16.254 1.00 0.00 H new ATOM 0 HD3 ARG B 146 -1.702 1.957 -16.141 1.00 0.00 H new ATOM 0 HE ARG B 146 -3.142 -0.474 -15.351 1.00 0.00 H new ATOM 0 HH11 ARG B 146 -1.637 1.289 -18.022 1.00 0.00 H new ATOM 0 HH12 ARG B 146 -1.594 -0.123 -19.083 1.00 0.00 H new ATOM 0 HH21 ARG B 146 -3.159 -2.257 -16.763 1.00 0.00 H new ATOM 0 HH22 ARG B 146 -2.449 -2.116 -18.375 1.00 0.00 H new ATOM 2063 N SER B 147 -3.970 5.817 -12.512 1.00 0.00 N ATOM 2064 CA SER B 147 -4.044 7.259 -12.358 1.00 0.00 C ATOM 2065 C SER B 147 -3.906 7.702 -10.883 1.00 0.00 C ATOM 2066 O SER B 147 -3.056 8.535 -10.550 1.00 0.00 O ATOM 2067 CB SER B 147 -5.383 7.757 -12.943 1.00 0.00 C ATOM 2068 OG SER B 147 -5.533 9.168 -12.811 1.00 0.00 O ATOM 0 H SER B 147 -4.807 5.396 -12.916 1.00 0.00 H new ATOM 0 HA SER B 147 -3.207 7.701 -12.898 1.00 0.00 H new ATOM 0 HB2 SER B 147 -5.442 7.483 -13.996 1.00 0.00 H new ATOM 0 HB3 SER B 147 -6.208 7.256 -12.437 1.00 0.00 H new ATOM 0 HG SER B 147 -5.943 9.374 -11.945 1.00 0.00 H new ATOM 2074 N GLU B 148 -4.740 7.170 -10.027 1.00 0.00 N ATOM 2075 CA GLU B 148 -4.731 7.533 -8.627 1.00 0.00 C ATOM 2076 C GLU B 148 -3.689 6.800 -7.813 1.00 0.00 C ATOM 2077 O GLU B 148 -3.012 7.394 -6.989 1.00 0.00 O ATOM 2078 CB GLU B 148 -6.121 7.379 -7.985 1.00 0.00 C ATOM 2079 CG GLU B 148 -7.101 8.524 -8.259 1.00 0.00 C ATOM 2080 CD GLU B 148 -7.404 8.767 -9.721 1.00 0.00 C ATOM 2081 OE1 GLU B 148 -8.325 8.138 -10.251 1.00 0.00 O ATOM 2082 OE2 GLU B 148 -6.736 9.642 -10.353 1.00 0.00 O ATOM 0 H GLU B 148 -5.444 6.475 -10.276 1.00 0.00 H new ATOM 0 HA GLU B 148 -4.453 8.587 -8.611 1.00 0.00 H new ATOM 0 HB2 GLU B 148 -6.566 6.450 -8.340 1.00 0.00 H new ATOM 0 HB3 GLU B 148 -5.996 7.281 -6.907 1.00 0.00 H new ATOM 0 HG2 GLU B 148 -8.036 8.315 -7.739 1.00 0.00 H new ATOM 0 HG3 GLU B 148 -6.696 9.440 -7.830 1.00 0.00 H new ATOM 2089 N LEU B 149 -3.538 5.534 -8.066 1.00 0.00 N ATOM 2090 CA LEU B 149 -2.790 4.693 -7.170 1.00 0.00 C ATOM 2091 C LEU B 149 -1.344 4.448 -7.571 1.00 0.00 C ATOM 2092 O LEU B 149 -0.496 4.377 -6.690 1.00 0.00 O ATOM 2093 CB LEU B 149 -3.628 3.404 -6.846 1.00 0.00 C ATOM 2094 CG LEU B 149 -3.076 2.367 -5.851 1.00 0.00 C ATOM 2095 CD1 LEU B 149 -4.217 1.555 -5.261 1.00 0.00 C ATOM 2096 CD2 LEU B 149 -2.119 1.416 -6.538 1.00 0.00 C ATOM 0 H LEU B 149 -3.921 5.058 -8.883 1.00 0.00 H new ATOM 0 HA LEU B 149 -2.650 5.238 -6.236 1.00 0.00 H new ATOM 0 HB2 LEU B 149 -4.598 3.731 -6.471 1.00 0.00 H new ATOM 0 HB3 LEU B 149 -3.809 2.887 -7.789 1.00 0.00 H new ATOM 0 HG LEU B 149 -2.549 2.907 -5.065 1.00 0.00 H new ATOM 0 HD11 LEU B 149 -3.818 0.824 -4.558 1.00 0.00 H new ATOM 0 HD12 LEU B 149 -4.906 2.220 -4.740 1.00 0.00 H new ATOM 0 HD13 LEU B 149 -4.747 1.038 -6.061 1.00 0.00 H new ATOM 0 HD21 LEU B 149 -1.742 0.693 -5.814 1.00 0.00 H new ATOM 0 HD22 LEU B 149 -2.640 0.891 -7.338 1.00 0.00 H new ATOM 0 HD23 LEU B 149 -1.285 1.979 -6.956 1.00 0.00 H new ATOM 2108 N MET B 150 -1.014 4.360 -8.865 1.00 0.00 N ATOM 2109 CA MET B 150 0.364 4.041 -9.198 1.00 0.00 C ATOM 2110 C MET B 150 0.704 4.211 -10.665 1.00 0.00 C ATOM 2111 O MET B 150 0.082 3.644 -11.578 1.00 0.00 O ATOM 2112 CB MET B 150 0.762 2.654 -8.703 1.00 0.00 C ATOM 2113 CG MET B 150 0.041 1.527 -9.393 1.00 0.00 C ATOM 2114 SD MET B 150 0.455 -0.097 -8.757 1.00 0.00 S ATOM 2115 CE MET B 150 -0.247 -1.052 -10.072 1.00 0.00 C ATOM 0 H MET B 150 -1.647 4.497 -9.653 1.00 0.00 H new ATOM 0 HA MET B 150 0.959 4.783 -8.666 1.00 0.00 H new ATOM 0 HB2 MET B 150 1.835 2.524 -8.842 1.00 0.00 H new ATOM 0 HB3 MET B 150 0.570 2.593 -7.632 1.00 0.00 H new ATOM 0 HG2 MET B 150 -1.033 1.682 -9.295 1.00 0.00 H new ATOM 0 HG3 MET B 150 0.272 1.559 -10.458 1.00 0.00 H new ATOM 0 HE1 MET B 150 -0.225 -2.109 -9.806 1.00 0.00 H new ATOM 0 HE2 MET B 150 -1.279 -0.741 -10.237 1.00 0.00 H new ATOM 0 HE3 MET B 150 0.329 -0.895 -10.984 1.00 0.00 H new ATOM 2125 N ASP B 151 1.731 4.937 -10.846 1.00 0.00 N ATOM 2126 CA ASP B 151 2.258 5.309 -12.134 1.00 0.00 C ATOM 2127 C ASP B 151 3.535 4.546 -12.361 1.00 0.00 C ATOM 2128 O ASP B 151 3.645 3.743 -13.290 1.00 0.00 O ATOM 2129 CB ASP B 151 2.540 6.818 -12.103 1.00 0.00 C ATOM 2130 CG ASP B 151 3.336 7.334 -13.266 1.00 0.00 C ATOM 2131 OD1 ASP B 151 2.769 7.520 -14.357 1.00 0.00 O ATOM 2132 OD2 ASP B 151 4.548 7.605 -13.086 1.00 0.00 O ATOM 0 H ASP B 151 2.272 5.320 -10.070 1.00 0.00 H new ATOM 0 HA ASP B 151 1.557 5.080 -12.937 1.00 0.00 H new ATOM 0 HB2 ASP B 151 1.589 7.350 -12.067 1.00 0.00 H new ATOM 0 HB3 ASP B 151 3.073 7.055 -11.182 1.00 0.00 H new ATOM 2137 N ALA B 152 4.447 4.791 -11.455 1.00 0.00 N ATOM 2138 CA ALA B 152 5.765 4.257 -11.352 1.00 0.00 C ATOM 2139 C ALA B 152 6.381 5.185 -10.367 1.00 0.00 C ATOM 2140 O ALA B 152 5.775 5.353 -9.315 1.00 0.00 O ATOM 2141 CB ALA B 152 6.534 4.314 -12.675 1.00 0.00 C ATOM 2142 OXT ALA B 152 7.369 5.874 -10.686 1.00 0.00 O ATOM 0 H ALA B 152 4.254 5.441 -10.693 1.00 0.00 H new ATOM 0 HA ALA B 152 5.773 3.203 -11.074 1.00 0.00 H new ATOM 0 HB1 ALA B 152 7.530 3.894 -12.535 1.00 0.00 H new ATOM 0 HB2 ALA B 152 6.000 3.738 -13.431 1.00 0.00 H new ATOM 0 HB3 ALA B 152 6.620 5.350 -13.002 1.00 0.00 H new TER 2148 ALA B 152