USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1245 hydrogens (5 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: B 46 TYR OH : rot -141:sc= 1.24 USER MOD Set 1.2: B 79 ASN : amide:sc= -4.22! C(o=-3!,f=-7.1!) USER MOD Set 2.1: B 48 ASN : amide:sc= -0.514 X(o=-0.69,f=-0.75) USER MOD Set 2.2: B 49 MET CE :methyl -157:sc= -0.173 (180deg=-0.772) USER MOD Set 3.1: B 7 ASN : amide:sc= -1.18 K(o=-1.8,f=-8.8!) USER MOD Set 3.2: B 14 TYR OH : rot 74:sc= 1.15 USER MOD Set 3.3: B 36 CYS SG : rot 76:sc= -1.79! USER MOD Set 4.1: A 68 HIS : no HD1:sc= 0.804 K(o=0.8,f=-5.8!) USER MOD Set 4.2: B 4 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 55 THR OG1 : rot -54:sc= 0.835 USER MOD Set 5.2: A 57 SER OG : rot -101:sc= 1.39 USER MOD Single : A 1 MET CE :methyl -160:sc= 0 (180deg=-0.343) USER MOD Single : A 1 MET N :NH3+ 154:sc= 1.28 (180deg=1.2) USER MOD Single : A 2 GLN : amide:sc= 1.04 K(o=1,f=-1.2) USER MOD Single : A 6 LYS NZ :NH3+ -123:sc= 1.24 (180deg=0.505) USER MOD Single : A 7 THR OG1 : rot -140:sc= -1.49! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.115 USER MOD Single : A 11 LYS NZ :NH3+ -179:sc= 1.19 (180deg=1.17) USER MOD Single : A 14 THR OG1 : rot -96:sc= 0.181 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0851 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0488 USER MOD Single : A 25 ASN : amide:sc= 0.892 K(o=0.89,f=-2!) USER MOD Single : A 27 LYS NZ :NH3+ -162:sc= 1.76 (180deg=0.48) USER MOD Single : A 29 LYS NZ :NH3+ -162:sc= 2.2 (180deg=1.57) USER MOD Single : A 31 GLN : amide:sc= -0.796 K(o=-0.8,f=-1.7!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.856 K(o=-0.86,f=-2.9!) USER MOD Single : A 41 GLN : amide:sc= 1.22 K(o=1.2,f=-3.3!) USER MOD Single : A 48 LYS NZ :NH3+ -157:sc= 0.00224 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 59 TYR OH : rot 30:sc= 0.83 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 98:sc= 1.1 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 151:sc= 0.236 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 23 MET CE :methyl -163:sc= -0.892 (180deg=-1.33) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0.204 USER MOD Single : B 33 GLN : amide:sc= -0.73 K(o=-0.73,f=-2.4!) USER MOD Single : B 40 LYS NZ :NH3+ 151:sc= -0.13 (180deg=-0.64) USER MOD Single : B 41 THR OG1 : rot 71:sc= 1.31 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -0.173 X(o=-0.17,f=-0.51) USER MOD Single : B 47 TYR OH : rot 180:sc= -0.113 USER MOD Single : B 54 SER OG : rot 180:sc= 0.0638 USER MOD Single : B 55 ASN : amide:sc= 1.29 K(o=1.3,f=-0.19) USER MOD Single : B 57 THR OG1 : rot -26:sc= 0.914 USER MOD Single : B 58 GLN : amide:sc= -0.0416 K(o=-0.042,f=-1.9!) USER MOD Single : B 59 SER OG : rot 100:sc= 1.28 USER MOD Single : B 61 LYS NZ :NH3+ 174:sc= 1.28 (180deg=1.22) USER MOD Single : B 66 LYS NZ :NH3+ -157:sc= 1.1 (180deg=0.801) USER MOD Single : B 67 THR OG1 : rot 180:sc= 0.183 USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot -98:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.481 9.155 -5.792 1.00 2.83 N ATOM 2 CA MET A 1 -20.100 9.609 -6.086 1.00 2.86 C ATOM 3 C MET A 1 -19.225 8.416 -6.449 1.00 2.62 C ATOM 4 O MET A 1 -19.556 7.277 -6.121 1.00 2.44 O ATOM 5 CB MET A 1 -19.505 10.358 -4.886 1.00 2.93 C ATOM 6 CG MET A 1 -19.229 9.480 -3.675 1.00 2.75 C ATOM 7 SD MET A 1 -18.636 10.426 -2.263 1.00 2.93 S ATOM 8 CE MET A 1 -18.114 9.112 -1.161 1.00 2.74 C ATOM 0 H1 MET A 1 -21.940 9.832 -5.149 1.00 2.83 H new ATOM 0 H2 MET A 1 -22.023 9.096 -6.678 1.00 2.83 H new ATOM 0 H3 MET A 1 -21.450 8.218 -5.343 1.00 2.83 H new ATOM 0 HA MET A 1 -20.135 10.295 -6.932 1.00 2.86 H new ATOM 0 HB2 MET A 1 -18.574 10.834 -5.195 1.00 2.93 H new ATOM 0 HB3 MET A 1 -20.189 11.155 -4.594 1.00 2.93 H new ATOM 0 HG2 MET A 1 -20.141 8.951 -3.398 1.00 2.75 H new ATOM 0 HG3 MET A 1 -18.490 8.724 -3.939 1.00 2.75 H new ATOM 0 HE1 MET A 1 -18.061 9.492 -0.141 1.00 2.74 H new ATOM 0 HE2 MET A 1 -18.832 8.293 -1.206 1.00 2.74 H new ATOM 0 HE3 MET A 1 -17.132 8.751 -1.465 1.00 2.74 H new ATOM 20 N GLN A 2 -18.118 8.672 -7.129 1.00 2.67 N ATOM 21 CA GLN A 2 -17.211 7.605 -7.532 1.00 2.50 C ATOM 22 C GLN A 2 -15.910 7.672 -6.740 1.00 2.38 C ATOM 23 O GLN A 2 -15.422 8.761 -6.431 1.00 2.54 O ATOM 24 CB GLN A 2 -16.898 7.702 -9.027 1.00 2.71 C ATOM 25 CG GLN A 2 -18.128 7.856 -9.906 1.00 2.89 C ATOM 26 CD GLN A 2 -19.040 6.647 -9.863 1.00 2.84 C ATOM 27 OE1 GLN A 2 -18.589 5.515 -9.693 1.00 2.74 O ATOM 28 NE2 GLN A 2 -20.331 6.884 -10.036 1.00 2.98 N ATOM 0 H GLN A 2 -17.825 9.607 -7.414 1.00 2.67 H new ATOM 0 HA GLN A 2 -17.704 6.655 -7.327 1.00 2.50 H new ATOM 0 HB2 GLN A 2 -16.235 8.551 -9.195 1.00 2.71 H new ATOM 0 HB3 GLN A 2 -16.355 6.808 -9.333 1.00 2.71 H new ATOM 0 HG2 GLN A 2 -18.686 8.737 -9.589 1.00 2.89 H new ATOM 0 HG3 GLN A 2 -17.813 8.031 -10.935 1.00 2.89 H new ATOM 0 HE21 GLN A 2 -20.660 7.840 -10.174 1.00 2.98 H new ATOM 0 HE22 GLN A 2 -20.996 6.111 -10.032 1.00 2.98 H new ATOM 37 N ILE A 3 -15.370 6.513 -6.393 1.00 2.13 N ATOM 38 CA ILE A 3 -14.110 6.439 -5.655 1.00 2.00 C ATOM 39 C ILE A 3 -13.124 5.548 -6.406 1.00 1.88 C ATOM 40 O ILE A 3 -13.522 4.756 -7.262 1.00 1.89 O ATOM 41 CB ILE A 3 -14.287 5.903 -4.215 1.00 1.84 C ATOM 42 CG1 ILE A 3 -14.999 4.548 -4.228 1.00 1.69 C ATOM 43 CG2 ILE A 3 -15.046 6.909 -3.352 1.00 2.08 C ATOM 44 CD1 ILE A 3 -14.893 3.794 -2.916 1.00 1.66 C ATOM 0 H ILE A 3 -15.784 5.606 -6.610 1.00 2.13 H new ATOM 0 HA ILE A 3 -13.728 7.457 -5.579 1.00 2.00 H new ATOM 0 HB ILE A 3 -13.298 5.763 -3.778 1.00 1.84 H new ATOM 0 HG12 ILE A 3 -16.052 4.702 -4.465 1.00 1.69 H new ATOM 0 HG13 ILE A 3 -14.580 3.934 -5.025 1.00 1.69 H new ATOM 0 HG21 ILE A 3 -15.159 6.511 -2.344 1.00 2.08 H new ATOM 0 HG22 ILE A 3 -14.491 7.846 -3.312 1.00 2.08 H new ATOM 0 HG23 ILE A 3 -16.031 7.089 -3.783 1.00 2.08 H new ATOM 0 HD11 ILE A 3 -15.420 2.844 -2.999 1.00 1.66 H new ATOM 0 HD12 ILE A 3 -13.844 3.608 -2.687 1.00 1.66 H new ATOM 0 HD13 ILE A 3 -15.339 4.388 -2.118 1.00 1.66 H new ATOM 56 N PHE A 4 -11.844 5.677 -6.085 1.00 1.82 N ATOM 57 CA PHE A 4 -10.813 4.892 -6.745 1.00 1.78 C ATOM 58 C PHE A 4 -10.106 3.979 -5.759 1.00 1.49 C ATOM 59 O PHE A 4 -9.528 4.437 -4.777 1.00 1.37 O ATOM 60 CB PHE A 4 -9.790 5.806 -7.422 1.00 2.05 C ATOM 61 CG PHE A 4 -10.351 6.594 -8.568 1.00 2.40 C ATOM 62 CD1 PHE A 4 -10.681 5.964 -9.758 1.00 2.58 C ATOM 63 CD2 PHE A 4 -10.547 7.960 -8.459 1.00 2.62 C ATOM 64 CE1 PHE A 4 -11.192 6.684 -10.820 1.00 2.92 C ATOM 65 CE2 PHE A 4 -11.058 8.685 -9.517 1.00 2.95 C ATOM 66 CZ PHE A 4 -11.381 8.046 -10.699 1.00 3.08 C ATOM 0 H PHE A 4 -11.496 6.318 -5.372 1.00 1.82 H new ATOM 0 HA PHE A 4 -11.300 4.278 -7.502 1.00 1.78 H new ATOM 0 HB2 PHE A 4 -9.386 6.496 -6.681 1.00 2.05 H new ATOM 0 HB3 PHE A 4 -8.957 5.201 -7.781 1.00 2.05 H new ATOM 0 HD1 PHE A 4 -10.537 4.898 -9.856 1.00 2.58 H new ATOM 0 HD2 PHE A 4 -10.298 8.464 -7.537 1.00 2.62 H new ATOM 0 HE1 PHE A 4 -11.443 6.183 -11.743 1.00 2.92 H new ATOM 0 HE2 PHE A 4 -11.205 9.751 -9.421 1.00 2.95 H new ATOM 0 HZ PHE A 4 -11.781 8.612 -11.527 1.00 3.08 H new ATOM 76 N VAL A 5 -10.167 2.688 -6.019 1.00 1.47 N ATOM 77 CA VAL A 5 -9.520 1.707 -5.171 1.00 1.28 C ATOM 78 C VAL A 5 -8.361 1.061 -5.915 1.00 1.34 C ATOM 79 O VAL A 5 -8.550 0.472 -6.980 1.00 1.55 O ATOM 80 CB VAL A 5 -10.508 0.615 -4.709 1.00 1.29 C ATOM 81 CG1 VAL A 5 -9.806 -0.424 -3.846 1.00 1.25 C ATOM 82 CG2 VAL A 5 -11.681 1.231 -3.961 1.00 1.31 C ATOM 0 H VAL A 5 -10.662 2.292 -6.818 1.00 1.47 H new ATOM 0 HA VAL A 5 -9.150 2.226 -4.287 1.00 1.28 H new ATOM 0 HB VAL A 5 -10.894 0.113 -5.596 1.00 1.29 H new ATOM 0 HG11 VAL A 5 -10.524 -1.182 -3.533 1.00 1.25 H new ATOM 0 HG12 VAL A 5 -9.008 -0.895 -4.420 1.00 1.25 H new ATOM 0 HG13 VAL A 5 -9.383 0.060 -2.966 1.00 1.25 H new ATOM 0 HG21 VAL A 5 -12.365 0.443 -3.645 1.00 1.31 H new ATOM 0 HG22 VAL A 5 -11.314 1.766 -3.085 1.00 1.31 H new ATOM 0 HG23 VAL A 5 -12.206 1.926 -4.617 1.00 1.31 H new ATOM 92 N LYS A 6 -7.167 1.199 -5.363 1.00 1.24 N ATOM 93 CA LYS A 6 -5.972 0.631 -5.965 1.00 1.34 C ATOM 94 C LYS A 6 -5.512 -0.591 -5.177 1.00 1.31 C ATOM 95 O LYS A 6 -5.261 -0.507 -3.972 1.00 1.21 O ATOM 96 CB LYS A 6 -4.852 1.675 -6.027 1.00 1.38 C ATOM 97 CG LYS A 6 -5.164 2.855 -6.937 1.00 1.82 C ATOM 98 CD LYS A 6 -4.175 3.994 -6.741 1.00 2.07 C ATOM 99 CE LYS A 6 -2.816 3.666 -7.333 1.00 2.32 C ATOM 100 NZ LYS A 6 -2.722 4.075 -8.759 1.00 2.30 N ATOM 0 H LYS A 6 -6.999 1.703 -4.492 1.00 1.24 H new ATOM 0 HA LYS A 6 -6.212 0.322 -6.982 1.00 1.34 H new ATOM 0 HB2 LYS A 6 -4.657 2.045 -5.021 1.00 1.38 H new ATOM 0 HB3 LYS A 6 -3.937 1.193 -6.372 1.00 1.38 H new ATOM 0 HG2 LYS A 6 -5.142 2.529 -7.977 1.00 1.82 H new ATOM 0 HG3 LYS A 6 -6.174 3.212 -6.737 1.00 1.82 H new ATOM 0 HD2 LYS A 6 -4.566 4.899 -7.206 1.00 2.07 H new ATOM 0 HD3 LYS A 6 -4.067 4.203 -5.677 1.00 2.07 H new ATOM 0 HE2 LYS A 6 -2.038 4.169 -6.759 1.00 2.32 H new ATOM 0 HE3 LYS A 6 -2.632 2.595 -7.249 1.00 2.32 H new ATOM 0 HZ1 LYS A 6 -2.477 3.249 -9.342 1.00 2.30 H new ATOM 0 HZ2 LYS A 6 -3.636 4.460 -9.071 1.00 2.30 H new ATOM 0 HZ3 LYS A 6 -1.986 4.803 -8.864 1.00 2.30 H new ATOM 114 N THR A 7 -5.428 -1.723 -5.855 1.00 1.48 N ATOM 115 CA THR A 7 -4.995 -2.963 -5.228 1.00 1.57 C ATOM 116 C THR A 7 -3.476 -3.118 -5.289 1.00 1.69 C ATOM 117 O THR A 7 -2.804 -2.426 -6.057 1.00 1.71 O ATOM 118 CB THR A 7 -5.658 -4.171 -5.908 1.00 1.78 C ATOM 119 OG1 THR A 7 -6.097 -3.806 -7.221 1.00 2.04 O ATOM 120 CG2 THR A 7 -6.837 -4.674 -5.093 1.00 1.54 C ATOM 0 H THR A 7 -5.655 -1.810 -6.846 1.00 1.48 H new ATOM 0 HA THR A 7 -5.299 -2.922 -4.182 1.00 1.57 H new ATOM 0 HB THR A 7 -4.923 -4.973 -5.978 1.00 1.78 H new ATOM 0 HG1 THR A 7 -6.969 -4.216 -7.400 1.00 2.04 H new ATOM 0 HG21 THR A 7 -7.289 -5.529 -5.596 1.00 1.54 H new ATOM 0 HG22 THR A 7 -6.493 -4.975 -4.103 1.00 1.54 H new ATOM 0 HG23 THR A 7 -7.576 -3.879 -4.994 1.00 1.54 H new ATOM 128 N LEU A 8 -2.949 -4.048 -4.491 1.00 1.83 N ATOM 129 CA LEU A 8 -1.509 -4.305 -4.436 1.00 1.98 C ATOM 130 C LEU A 8 -0.988 -4.831 -5.770 1.00 2.23 C ATOM 131 O LEU A 8 0.209 -4.779 -6.047 1.00 2.45 O ATOM 132 CB LEU A 8 -1.196 -5.318 -3.329 1.00 2.17 C ATOM 133 CG LEU A 8 -1.736 -4.960 -1.946 1.00 2.08 C ATOM 134 CD1 LEU A 8 -1.651 -6.160 -1.023 1.00 2.40 C ATOM 135 CD2 LEU A 8 -0.971 -3.786 -1.359 1.00 1.93 C ATOM 0 H LEU A 8 -3.502 -4.639 -3.870 1.00 1.83 H new ATOM 0 HA LEU A 8 -1.010 -3.360 -4.220 1.00 1.98 H new ATOM 0 HB2 LEU A 8 -1.602 -6.287 -3.620 1.00 2.17 H new ATOM 0 HB3 LEU A 8 -0.114 -5.434 -3.260 1.00 2.17 H new ATOM 0 HG LEU A 8 -2.782 -4.670 -2.049 1.00 2.08 H new ATOM 0 HD11 LEU A 8 -2.039 -5.891 -0.040 1.00 2.40 H new ATOM 0 HD12 LEU A 8 -2.241 -6.978 -1.435 1.00 2.40 H new ATOM 0 HD13 LEU A 8 -0.611 -6.474 -0.929 1.00 2.40 H new ATOM 0 HD21 LEU A 8 -1.371 -3.547 -0.374 1.00 1.93 H new ATOM 0 HD22 LEU A 8 0.083 -4.047 -1.269 1.00 1.93 H new ATOM 0 HD23 LEU A 8 -1.075 -2.920 -2.013 1.00 1.93 H new ATOM 147 N THR A 9 -1.894 -5.335 -6.593 1.00 2.27 N ATOM 148 CA THR A 9 -1.529 -5.870 -7.891 1.00 2.56 C ATOM 149 C THR A 9 -1.371 -4.755 -8.925 1.00 2.55 C ATOM 150 O THR A 9 -0.926 -4.996 -10.047 1.00 2.82 O ATOM 151 CB THR A 9 -2.592 -6.873 -8.367 1.00 2.78 C ATOM 152 OG1 THR A 9 -3.599 -7.015 -7.351 1.00 2.48 O ATOM 153 CG2 THR A 9 -1.968 -8.228 -8.660 1.00 3.37 C ATOM 0 H THR A 9 -2.891 -5.384 -6.382 1.00 2.27 H new ATOM 0 HA THR A 9 -0.571 -6.379 -7.787 1.00 2.56 H new ATOM 0 HB THR A 9 -3.040 -6.496 -9.286 1.00 2.78 H new ATOM 0 HG1 THR A 9 -4.280 -7.653 -7.652 1.00 2.48 H new ATOM 0 HG21 THR A 9 -2.741 -8.920 -8.995 1.00 3.37 H new ATOM 0 HG22 THR A 9 -1.214 -8.120 -9.440 1.00 3.37 H new ATOM 0 HG23 THR A 9 -1.501 -8.617 -7.755 1.00 3.37 H new ATOM 161 N GLY A 10 -1.722 -3.535 -8.532 1.00 2.29 N ATOM 162 CA GLY A 10 -1.611 -2.402 -9.432 1.00 2.34 C ATOM 163 C GLY A 10 -2.833 -2.245 -10.318 1.00 2.44 C ATOM 164 O GLY A 10 -2.711 -2.052 -11.528 1.00 2.64 O ATOM 0 H GLY A 10 -2.082 -3.310 -7.604 1.00 2.29 H new ATOM 0 HA2 GLY A 10 -1.468 -1.492 -8.850 1.00 2.34 H new ATOM 0 HA3 GLY A 10 -0.726 -2.523 -10.057 1.00 2.34 H new ATOM 168 N LYS A 11 -4.012 -2.336 -9.720 1.00 2.38 N ATOM 169 CA LYS A 11 -5.258 -2.206 -10.461 1.00 2.49 C ATOM 170 C LYS A 11 -6.081 -1.051 -9.910 1.00 2.30 C ATOM 171 O LYS A 11 -6.270 -0.945 -8.697 1.00 2.03 O ATOM 172 CB LYS A 11 -6.084 -3.496 -10.363 1.00 2.57 C ATOM 173 CG LYS A 11 -5.348 -4.755 -10.801 1.00 2.80 C ATOM 174 CD LYS A 11 -6.097 -6.018 -10.391 1.00 2.84 C ATOM 175 CE LYS A 11 -7.484 -6.080 -11.022 1.00 3.07 C ATOM 176 NZ LYS A 11 -8.200 -7.341 -10.687 1.00 3.12 N ATOM 0 H LYS A 11 -4.132 -2.500 -8.720 1.00 2.38 H new ATOM 0 HA LYS A 11 -5.009 -2.016 -11.505 1.00 2.49 H new ATOM 0 HB2 LYS A 11 -6.413 -3.624 -9.332 1.00 2.57 H new ATOM 0 HB3 LYS A 11 -6.981 -3.385 -10.972 1.00 2.57 H new ATOM 0 HG2 LYS A 11 -5.220 -4.743 -11.883 1.00 2.80 H new ATOM 0 HG3 LYS A 11 -4.350 -4.765 -10.362 1.00 2.80 H new ATOM 0 HD2 LYS A 11 -5.522 -6.895 -10.689 1.00 2.84 H new ATOM 0 HD3 LYS A 11 -6.189 -6.050 -9.305 1.00 2.84 H new ATOM 0 HE2 LYS A 11 -8.074 -5.229 -10.682 1.00 3.07 H new ATOM 0 HE3 LYS A 11 -7.393 -5.993 -12.105 1.00 3.07 H new ATOM 0 HZ1 LYS A 11 -9.131 -7.346 -11.151 1.00 3.12 H new ATOM 0 HZ2 LYS A 11 -7.644 -8.155 -11.018 1.00 3.12 H new ATOM 0 HZ3 LYS A 11 -8.327 -7.405 -9.657 1.00 3.12 H new HETATM 190 CAC 3X9 A 12 -3.278 1.316 -16.396 1.00 2.42 C HETATM 191 CAS 3X9 A 12 -2.529 0.971 -15.107 1.00 2.03 C HETATM 192 CAD 3X9 A 12 -2.876 -0.437 -14.621 1.00 2.59 C HETATM 193 NAQ 3X9 A 12 -1.080 1.106 -15.303 1.00 2.38 N HETATM 194 OAH 3X9 A 12 -0.540 -0.138 -15.852 1.00 2.56 O HETATM 195 CAR 3X9 A 12 -0.543 1.338 -13.953 1.00 3.05 C HETATM 196 CAA 3X9 A 12 0.682 2.240 -13.775 1.00 3.92 C HETATM 197 CAB 3X9 A 12 -0.854 0.238 -12.932 1.00 3.69 C HETATM 198 CAI 3X9 A 12 -1.597 2.358 -13.505 1.00 3.00 C HETATM 199 CAO 3X9 A 12 -2.775 2.012 -14.017 1.00 2.30 C HETATM 200 CAJ 3X9 A 12 -4.162 2.560 -13.679 1.00 2.46 C HETATM 201 SAL 3X9 A 12 -5.369 1.204 -13.439 1.00 2.40 S HETATM 202 N 3X9 A 12 -6.555 -0.179 -10.788 1.00 2.50 N HETATM 203 CA 3X9 A 12 -7.381 0.943 -10.364 1.00 2.39 C HETATM 204 CB 3X9 A 12 -6.979 2.245 -11.071 1.00 2.59 C HETATM 205 SG 3X9 A 12 -7.074 2.178 -12.890 1.00 2.82 S HETATM 206 C 3X9 A 12 -8.850 0.625 -10.627 1.00 2.44 C HETATM 207 O 3X9 A 12 -9.298 0.576 -11.774 1.00 2.75 O ATOM 213 N ILE A 13 -9.596 0.374 -9.567 1.00 2.19 N ATOM 214 CA ILE A 13 -11.005 0.053 -9.699 1.00 2.26 C ATOM 215 C ILE A 13 -11.868 1.210 -9.211 1.00 2.10 C ATOM 216 O ILE A 13 -11.618 1.780 -8.151 1.00 1.85 O ATOM 217 CB ILE A 13 -11.364 -1.220 -8.903 1.00 2.24 C ATOM 218 CG1 ILE A 13 -10.344 -2.330 -9.179 1.00 2.28 C ATOM 219 CG2 ILE A 13 -12.772 -1.692 -9.251 1.00 2.75 C ATOM 220 CD1 ILE A 13 -10.419 -3.476 -8.195 1.00 2.57 C ATOM 0 H ILE A 13 -9.251 0.386 -8.607 1.00 2.19 H new ATOM 0 HA ILE A 13 -11.201 -0.125 -10.756 1.00 2.26 H new ATOM 0 HB ILE A 13 -11.335 -0.979 -7.840 1.00 2.24 H new ATOM 0 HG12 ILE A 13 -10.502 -2.715 -10.186 1.00 2.28 H new ATOM 0 HG13 ILE A 13 -9.341 -1.905 -9.154 1.00 2.28 H new ATOM 0 HG21 ILE A 13 -13.006 -2.590 -8.680 1.00 2.75 H new ATOM 0 HG22 ILE A 13 -13.489 -0.909 -9.006 1.00 2.75 H new ATOM 0 HG23 ILE A 13 -12.828 -1.915 -10.317 1.00 2.75 H new ATOM 0 HD11 ILE A 13 -9.669 -4.225 -8.451 1.00 2.57 H new ATOM 0 HD12 ILE A 13 -10.231 -3.104 -7.188 1.00 2.57 H new ATOM 0 HD13 ILE A 13 -11.411 -3.927 -8.236 1.00 2.57 H new ATOM 232 N THR A 14 -12.864 1.573 -10.002 1.00 2.34 N ATOM 233 CA THR A 14 -13.770 2.647 -9.644 1.00 2.30 C ATOM 234 C THR A 14 -15.068 2.063 -9.108 1.00 2.19 C ATOM 235 O THR A 14 -15.664 1.187 -9.734 1.00 2.35 O ATOM 236 CB THR A 14 -14.061 3.544 -10.860 1.00 2.67 C ATOM 237 OG1 THR A 14 -12.859 3.706 -11.626 1.00 3.08 O ATOM 238 CG2 THR A 14 -14.583 4.906 -10.424 1.00 2.73 C ATOM 0 H THR A 14 -13.065 1.135 -10.901 1.00 2.34 H new ATOM 0 HA THR A 14 -13.300 3.257 -8.873 1.00 2.30 H new ATOM 0 HB THR A 14 -14.829 3.067 -11.469 1.00 2.67 H new ATOM 0 HG1 THR A 14 -12.414 4.539 -11.364 1.00 3.08 H new ATOM 0 HG21 THR A 14 -14.780 5.519 -11.304 1.00 2.73 H new ATOM 0 HG22 THR A 14 -15.505 4.778 -9.857 1.00 2.73 H new ATOM 0 HG23 THR A 14 -13.838 5.398 -9.799 1.00 2.73 H new ATOM 246 N LEU A 15 -15.481 2.515 -7.939 1.00 1.98 N ATOM 247 CA LEU A 15 -16.704 2.018 -7.333 1.00 1.93 C ATOM 248 C LEU A 15 -17.687 3.154 -7.100 1.00 1.97 C ATOM 249 O LEU A 15 -17.291 4.261 -6.727 1.00 1.98 O ATOM 250 CB LEU A 15 -16.401 1.317 -6.002 1.00 1.77 C ATOM 251 CG LEU A 15 -15.410 0.156 -6.083 1.00 1.84 C ATOM 252 CD1 LEU A 15 -15.068 -0.345 -4.692 1.00 1.79 C ATOM 253 CD2 LEU A 15 -15.975 -0.973 -6.932 1.00 2.10 C ATOM 0 H LEU A 15 -14.991 3.222 -7.391 1.00 1.98 H new ATOM 0 HA LEU A 15 -17.151 1.299 -8.019 1.00 1.93 H new ATOM 0 HB2 LEU A 15 -16.012 2.056 -5.302 1.00 1.77 H new ATOM 0 HB3 LEU A 15 -17.337 0.945 -5.585 1.00 1.77 H new ATOM 0 HG LEU A 15 -14.496 0.516 -6.556 1.00 1.84 H new ATOM 0 HD11 LEU A 15 -14.361 -1.172 -4.767 1.00 1.79 H new ATOM 0 HD12 LEU A 15 -14.621 0.464 -4.114 1.00 1.79 H new ATOM 0 HD13 LEU A 15 -15.976 -0.687 -4.195 1.00 1.79 H new ATOM 0 HD21 LEU A 15 -15.255 -1.790 -6.977 1.00 2.10 H new ATOM 0 HD22 LEU A 15 -16.904 -1.332 -6.488 1.00 2.10 H new ATOM 0 HD23 LEU A 15 -16.172 -0.607 -7.940 1.00 2.10 H new ATOM 265 N GLU A 16 -18.966 2.881 -7.329 1.00 2.07 N ATOM 266 CA GLU A 16 -20.001 3.877 -7.122 1.00 2.18 C ATOM 267 C GLU A 16 -20.528 3.761 -5.703 1.00 2.13 C ATOM 268 O GLU A 16 -21.133 2.752 -5.323 1.00 2.17 O ATOM 269 CB GLU A 16 -21.142 3.720 -8.133 1.00 2.35 C ATOM 270 CG GLU A 16 -22.202 4.807 -8.014 1.00 2.59 C ATOM 271 CD GLU A 16 -23.111 4.876 -9.221 1.00 2.79 C ATOM 272 OE1 GLU A 16 -22.683 5.413 -10.263 1.00 2.59 O ATOM 273 OE2 GLU A 16 -24.263 4.406 -9.131 1.00 3.44 O ATOM 0 H GLU A 16 -19.307 1.978 -7.658 1.00 2.07 H new ATOM 0 HA GLU A 16 -19.568 4.866 -7.273 1.00 2.18 H new ATOM 0 HB2 GLU A 16 -20.729 3.733 -9.142 1.00 2.35 H new ATOM 0 HB3 GLU A 16 -21.612 2.746 -7.993 1.00 2.35 H new ATOM 0 HG2 GLU A 16 -22.803 4.626 -7.123 1.00 2.59 H new ATOM 0 HG3 GLU A 16 -21.713 5.771 -7.878 1.00 2.59 H new ATOM 280 N VAL A 17 -20.287 4.793 -4.919 1.00 2.15 N ATOM 281 CA VAL A 17 -20.710 4.813 -3.535 1.00 2.21 C ATOM 282 C VAL A 17 -21.353 6.143 -3.186 1.00 2.41 C ATOM 283 O VAL A 17 -21.314 7.090 -3.973 1.00 2.48 O ATOM 284 CB VAL A 17 -19.520 4.564 -2.585 1.00 2.14 C ATOM 285 CG1 VAL A 17 -19.052 3.120 -2.667 1.00 2.03 C ATOM 286 CG2 VAL A 17 -18.377 5.513 -2.908 1.00 2.12 C ATOM 0 H VAL A 17 -19.796 5.635 -5.221 1.00 2.15 H new ATOM 0 HA VAL A 17 -21.440 4.013 -3.409 1.00 2.21 H new ATOM 0 HB VAL A 17 -19.854 4.754 -1.565 1.00 2.14 H new ATOM 0 HG11 VAL A 17 -18.213 2.970 -1.988 1.00 2.03 H new ATOM 0 HG12 VAL A 17 -19.869 2.456 -2.385 1.00 2.03 H new ATOM 0 HG13 VAL A 17 -18.738 2.897 -3.687 1.00 2.03 H new ATOM 0 HG21 VAL A 17 -17.545 5.325 -2.229 1.00 2.12 H new ATOM 0 HG22 VAL A 17 -18.050 5.353 -3.935 1.00 2.12 H new ATOM 0 HG23 VAL A 17 -18.715 6.543 -2.791 1.00 2.12 H new ATOM 296 N GLU A 18 -21.939 6.209 -2.009 1.00 2.56 N ATOM 297 CA GLU A 18 -22.584 7.419 -1.539 1.00 2.79 C ATOM 298 C GLU A 18 -21.960 7.841 -0.218 1.00 2.89 C ATOM 299 O GLU A 18 -21.389 7.010 0.482 1.00 2.82 O ATOM 300 CB GLU A 18 -24.087 7.177 -1.380 1.00 2.97 C ATOM 301 CG GLU A 18 -24.802 6.971 -2.705 1.00 2.97 C ATOM 302 CD GLU A 18 -24.915 8.252 -3.504 1.00 3.10 C ATOM 303 OE1 GLU A 18 -23.965 8.590 -4.241 1.00 3.05 O ATOM 304 OE2 GLU A 18 -25.963 8.926 -3.396 1.00 3.35 O ATOM 0 H GLU A 18 -21.982 5.429 -1.353 1.00 2.56 H new ATOM 0 HA GLU A 18 -22.442 8.220 -2.265 1.00 2.79 H new ATOM 0 HB2 GLU A 18 -24.243 6.301 -0.750 1.00 2.97 H new ATOM 0 HB3 GLU A 18 -24.533 8.026 -0.862 1.00 2.97 H new ATOM 0 HG2 GLU A 18 -24.266 6.226 -3.292 1.00 2.97 H new ATOM 0 HG3 GLU A 18 -25.799 6.573 -2.519 1.00 2.97 H new ATOM 311 N PRO A 19 -22.048 9.130 0.149 1.00 3.09 N ATOM 312 CA PRO A 19 -21.480 9.623 1.407 1.00 3.24 C ATOM 313 C PRO A 19 -22.020 8.877 2.627 1.00 3.36 C ATOM 314 O PRO A 19 -21.355 8.796 3.659 1.00 3.45 O ATOM 315 CB PRO A 19 -21.907 11.094 1.444 1.00 3.49 C ATOM 316 CG PRO A 19 -22.191 11.459 0.029 1.00 3.43 C ATOM 317 CD PRO A 19 -22.684 10.206 -0.634 1.00 3.23 C ATOM 0 HA PRO A 19 -20.400 9.479 1.445 1.00 3.24 H new ATOM 0 HB2 PRO A 19 -22.789 11.231 2.070 1.00 3.49 H new ATOM 0 HB3 PRO A 19 -21.119 11.721 1.861 1.00 3.49 H new ATOM 0 HG2 PRO A 19 -22.939 12.250 -0.027 1.00 3.43 H new ATOM 0 HG3 PRO A 19 -21.294 11.834 -0.464 1.00 3.43 H new ATOM 0 HD2 PRO A 19 -23.771 10.136 -0.603 1.00 3.23 H new ATOM 0 HD3 PRO A 19 -22.392 10.165 -1.683 1.00 3.23 H new ATOM 325 N SER A 20 -23.217 8.313 2.497 1.00 3.39 N ATOM 326 CA SER A 20 -23.851 7.581 3.585 1.00 3.54 C ATOM 327 C SER A 20 -23.585 6.075 3.491 1.00 3.40 C ATOM 328 O SER A 20 -24.102 5.298 4.298 1.00 3.55 O ATOM 329 CB SER A 20 -25.355 7.845 3.558 1.00 3.70 C ATOM 330 OG SER A 20 -25.788 8.134 2.239 1.00 3.60 O ATOM 0 H SER A 20 -23.770 8.351 1.641 1.00 3.39 H new ATOM 0 HA SER A 20 -23.423 7.931 4.525 1.00 3.54 H new ATOM 0 HB2 SER A 20 -25.889 6.975 3.939 1.00 3.70 H new ATOM 0 HB3 SER A 20 -25.595 8.680 4.216 1.00 3.70 H new ATOM 0 HG SER A 20 -26.754 8.299 2.241 1.00 3.60 H new ATOM 336 N ASP A 21 -22.775 5.670 2.517 1.00 3.13 N ATOM 337 CA ASP A 21 -22.459 4.257 2.320 1.00 3.01 C ATOM 338 C ASP A 21 -21.548 3.755 3.431 1.00 3.06 C ATOM 339 O ASP A 21 -20.708 4.504 3.943 1.00 3.08 O ATOM 340 CB ASP A 21 -21.787 4.036 0.963 1.00 2.73 C ATOM 341 CG ASP A 21 -22.307 2.809 0.240 1.00 2.73 C ATOM 342 OD1 ASP A 21 -22.709 1.844 0.915 1.00 2.80 O ATOM 343 OD2 ASP A 21 -22.317 2.810 -1.015 1.00 2.77 O ATOM 0 H ASP A 21 -22.325 6.299 1.852 1.00 3.13 H new ATOM 0 HA ASP A 21 -23.393 3.696 2.345 1.00 3.01 H new ATOM 0 HB2 ASP A 21 -21.945 4.914 0.337 1.00 2.73 H new ATOM 0 HB3 ASP A 21 -20.711 3.938 1.108 1.00 2.73 H new ATOM 348 N THR A 22 -21.718 2.498 3.801 1.00 3.14 N ATOM 349 CA THR A 22 -20.918 1.896 4.852 1.00 3.25 C ATOM 350 C THR A 22 -19.693 1.205 4.268 1.00 3.02 C ATOM 351 O THR A 22 -19.724 0.722 3.134 1.00 2.82 O ATOM 352 CB THR A 22 -21.736 0.872 5.662 1.00 3.52 C ATOM 353 OG1 THR A 22 -23.043 0.721 5.087 1.00 3.64 O ATOM 354 CG2 THR A 22 -21.867 1.306 7.114 1.00 3.69 C ATOM 0 H THR A 22 -22.407 1.871 3.386 1.00 3.14 H new ATOM 0 HA THR A 22 -20.601 2.700 5.517 1.00 3.25 H new ATOM 0 HB THR A 22 -21.210 -0.082 5.630 1.00 3.52 H new ATOM 0 HG1 THR A 22 -23.556 0.067 5.607 1.00 3.64 H new ATOM 0 HG21 THR A 22 -22.449 0.566 7.664 1.00 3.69 H new ATOM 0 HG22 THR A 22 -20.876 1.392 7.559 1.00 3.69 H new ATOM 0 HG23 THR A 22 -22.371 2.271 7.161 1.00 3.69 H new ATOM 362 N ILE A 23 -18.619 1.156 5.049 1.00 3.09 N ATOM 363 CA ILE A 23 -17.383 0.516 4.618 1.00 2.90 C ATOM 364 C ILE A 23 -17.639 -0.940 4.233 1.00 2.93 C ATOM 365 O ILE A 23 -17.160 -1.414 3.204 1.00 2.72 O ATOM 366 CB ILE A 23 -16.305 0.577 5.722 1.00 3.04 C ATOM 367 CG1 ILE A 23 -15.985 2.033 6.079 1.00 3.09 C ATOM 368 CG2 ILE A 23 -15.042 -0.158 5.291 1.00 2.88 C ATOM 369 CD1 ILE A 23 -15.576 2.876 4.893 1.00 2.83 C ATOM 0 H ILE A 23 -18.581 1.554 5.987 1.00 3.09 H new ATOM 0 HA ILE A 23 -17.018 1.061 3.747 1.00 2.90 H new ATOM 0 HB ILE A 23 -16.699 0.081 6.609 1.00 3.04 H new ATOM 0 HG12 ILE A 23 -16.860 2.483 6.548 1.00 3.09 H new ATOM 0 HG13 ILE A 23 -15.184 2.049 6.818 1.00 3.09 H new ATOM 0 HG21 ILE A 23 -14.298 -0.100 6.086 1.00 2.88 H new ATOM 0 HG22 ILE A 23 -15.279 -1.203 5.091 1.00 2.88 H new ATOM 0 HG23 ILE A 23 -14.643 0.303 4.387 1.00 2.88 H new ATOM 0 HD11 ILE A 23 -15.366 3.893 5.225 1.00 2.83 H new ATOM 0 HD12 ILE A 23 -14.682 2.451 4.436 1.00 2.83 H new ATOM 0 HD13 ILE A 23 -16.385 2.893 4.162 1.00 2.83 H new ATOM 381 N GLU A 24 -18.420 -1.630 5.058 1.00 3.22 N ATOM 382 CA GLU A 24 -18.763 -3.025 4.809 1.00 3.34 C ATOM 383 C GLU A 24 -19.494 -3.170 3.473 1.00 3.15 C ATOM 384 O GLU A 24 -19.291 -4.144 2.743 1.00 3.13 O ATOM 385 CB GLU A 24 -19.632 -3.574 5.941 1.00 3.72 C ATOM 386 CG GLU A 24 -20.208 -4.950 5.642 1.00 3.88 C ATOM 387 CD GLU A 24 -21.048 -5.493 6.773 1.00 4.24 C ATOM 388 OE1 GLU A 24 -22.091 -4.878 7.097 1.00 4.44 O ATOM 389 OE2 GLU A 24 -20.680 -6.547 7.330 1.00 4.46 O ATOM 0 H GLU A 24 -18.829 -1.243 5.909 1.00 3.22 H new ATOM 0 HA GLU A 24 -17.837 -3.599 4.766 1.00 3.34 H new ATOM 0 HB2 GLU A 24 -19.038 -3.626 6.853 1.00 3.72 H new ATOM 0 HB3 GLU A 24 -20.450 -2.879 6.132 1.00 3.72 H new ATOM 0 HG2 GLU A 24 -20.815 -4.896 4.739 1.00 3.88 H new ATOM 0 HG3 GLU A 24 -19.392 -5.643 5.437 1.00 3.88 H new ATOM 396 N ASN A 25 -20.331 -2.190 3.147 1.00 3.06 N ATOM 397 CA ASN A 25 -21.076 -2.218 1.895 1.00 2.92 C ATOM 398 C ASN A 25 -20.115 -2.072 0.724 1.00 2.62 C ATOM 399 O ASN A 25 -20.280 -2.710 -0.312 1.00 2.56 O ATOM 400 CB ASN A 25 -22.132 -1.113 1.855 1.00 2.93 C ATOM 401 CG ASN A 25 -23.280 -1.449 0.920 1.00 3.05 C ATOM 402 OD1 ASN A 25 -23.626 -2.618 0.738 1.00 3.31 O ATOM 403 ND2 ASN A 25 -23.881 -0.432 0.324 1.00 3.00 N ATOM 0 H ASN A 25 -20.509 -1.372 3.729 1.00 3.06 H new ATOM 0 HA ASN A 25 -21.592 -3.175 1.822 1.00 2.92 H new ATOM 0 HB2 ASN A 25 -22.521 -0.948 2.860 1.00 2.93 H new ATOM 0 HB3 ASN A 25 -21.667 -0.180 1.536 1.00 2.93 H new ATOM 0 HD21 ASN A 25 -24.660 -0.602 -0.312 1.00 3.00 H new ATOM 0 HD22 ASN A 25 -23.565 0.522 0.501 1.00 3.00 H new ATOM 410 N VAL A 26 -19.101 -1.231 0.903 1.00 2.47 N ATOM 411 CA VAL A 26 -18.087 -1.027 -0.124 1.00 2.21 C ATOM 412 C VAL A 26 -17.324 -2.326 -0.357 1.00 2.23 C ATOM 413 O VAL A 26 -17.042 -2.700 -1.497 1.00 2.12 O ATOM 414 CB VAL A 26 -17.092 0.091 0.263 1.00 2.10 C ATOM 415 CG1 VAL A 26 -16.083 0.333 -0.850 1.00 1.86 C ATOM 416 CG2 VAL A 26 -17.832 1.377 0.601 1.00 2.17 C ATOM 0 H VAL A 26 -18.960 -0.680 1.750 1.00 2.47 H new ATOM 0 HA VAL A 26 -18.598 -0.721 -1.037 1.00 2.21 H new ATOM 0 HB VAL A 26 -16.548 -0.237 1.149 1.00 2.10 H new ATOM 0 HG11 VAL A 26 -15.395 1.124 -0.552 1.00 1.86 H new ATOM 0 HG12 VAL A 26 -15.523 -0.583 -1.039 1.00 1.86 H new ATOM 0 HG13 VAL A 26 -16.607 0.631 -1.758 1.00 1.86 H new ATOM 0 HG21 VAL A 26 -17.113 2.151 0.871 1.00 2.17 H new ATOM 0 HG22 VAL A 26 -18.409 1.703 -0.265 1.00 2.17 H new ATOM 0 HG23 VAL A 26 -18.505 1.200 1.440 1.00 2.17 H new ATOM 426 N LYS A 27 -17.022 -3.022 0.738 1.00 2.43 N ATOM 427 CA LYS A 27 -16.312 -4.297 0.673 1.00 2.54 C ATOM 428 C LYS A 27 -17.133 -5.322 -0.107 1.00 2.70 C ATOM 429 O LYS A 27 -16.584 -6.163 -0.825 1.00 2.74 O ATOM 430 CB LYS A 27 -16.019 -4.821 2.084 1.00 2.81 C ATOM 431 CG LYS A 27 -15.222 -3.847 2.945 1.00 2.73 C ATOM 432 CD LYS A 27 -13.979 -4.490 3.542 1.00 2.94 C ATOM 433 CE LYS A 27 -14.335 -5.565 4.550 1.00 3.45 C ATOM 434 NZ LYS A 27 -13.385 -5.595 5.694 1.00 3.49 N ATOM 0 H LYS A 27 -17.259 -2.722 1.684 1.00 2.43 H new ATOM 0 HA LYS A 27 -15.365 -4.138 0.157 1.00 2.54 H new ATOM 0 HB2 LYS A 27 -16.962 -5.045 2.582 1.00 2.81 H new ATOM 0 HB3 LYS A 27 -15.469 -5.759 2.007 1.00 2.81 H new ATOM 0 HG2 LYS A 27 -14.930 -2.987 2.342 1.00 2.73 H new ATOM 0 HG3 LYS A 27 -15.856 -3.472 3.748 1.00 2.73 H new ATOM 0 HD2 LYS A 27 -13.375 -4.924 2.745 1.00 2.94 H new ATOM 0 HD3 LYS A 27 -13.370 -3.726 4.024 1.00 2.94 H new ATOM 0 HE2 LYS A 27 -15.345 -5.392 4.922 1.00 3.45 H new ATOM 0 HE3 LYS A 27 -14.339 -6.537 4.057 1.00 3.45 H new ATOM 0 HZ1 LYS A 27 -13.467 -6.506 6.190 1.00 3.49 H new ATOM 0 HZ2 LYS A 27 -12.413 -5.479 5.342 1.00 3.49 H new ATOM 0 HZ3 LYS A 27 -13.609 -4.821 6.352 1.00 3.49 H new ATOM 448 N ALA A 28 -18.452 -5.238 0.032 1.00 2.84 N ATOM 449 CA ALA A 28 -19.353 -6.139 -0.668 1.00 3.02 C ATOM 450 C ALA A 28 -19.259 -5.911 -2.169 1.00 2.83 C ATOM 451 O ALA A 28 -19.279 -6.856 -2.955 1.00 2.98 O ATOM 452 CB ALA A 28 -20.782 -5.938 -0.188 1.00 3.19 C ATOM 0 H ALA A 28 -18.919 -4.552 0.625 1.00 2.84 H new ATOM 0 HA ALA A 28 -19.059 -7.166 -0.452 1.00 3.02 H new ATOM 0 HB1 ALA A 28 -21.444 -6.620 -0.722 1.00 3.19 H new ATOM 0 HB2 ALA A 28 -20.838 -6.140 0.882 1.00 3.19 H new ATOM 0 HB3 ALA A 28 -21.089 -4.910 -0.380 1.00 3.19 H new ATOM 458 N LYS A 29 -19.140 -4.644 -2.556 1.00 2.54 N ATOM 459 CA LYS A 29 -19.026 -4.279 -3.963 1.00 2.40 C ATOM 460 C LYS A 29 -17.710 -4.798 -4.531 1.00 2.37 C ATOM 461 O LYS A 29 -17.652 -5.249 -5.677 1.00 2.47 O ATOM 462 CB LYS A 29 -19.129 -2.761 -4.137 1.00 2.16 C ATOM 463 CG LYS A 29 -20.265 -2.148 -3.336 1.00 2.25 C ATOM 464 CD LYS A 29 -20.544 -0.709 -3.738 1.00 2.16 C ATOM 465 CE LYS A 29 -21.319 0.016 -2.648 1.00 2.32 C ATOM 466 NZ LYS A 29 -22.134 1.140 -3.183 1.00 2.25 N ATOM 0 H LYS A 29 -19.120 -3.852 -1.913 1.00 2.54 H new ATOM 0 HA LYS A 29 -19.849 -4.738 -4.512 1.00 2.40 H new ATOM 0 HB2 LYS A 29 -18.188 -2.301 -3.834 1.00 2.16 H new ATOM 0 HB3 LYS A 29 -19.270 -2.531 -5.193 1.00 2.16 H new ATOM 0 HG2 LYS A 29 -21.167 -2.743 -3.476 1.00 2.25 H new ATOM 0 HG3 LYS A 29 -20.020 -2.185 -2.275 1.00 2.25 H new ATOM 0 HD2 LYS A 29 -19.604 -0.191 -3.928 1.00 2.16 H new ATOM 0 HD3 LYS A 29 -21.112 -0.690 -4.668 1.00 2.16 H new ATOM 0 HE2 LYS A 29 -21.972 -0.692 -2.138 1.00 2.32 H new ATOM 0 HE3 LYS A 29 -20.621 0.399 -1.903 1.00 2.32 H new ATOM 0 HZ1 LYS A 29 -22.394 1.781 -2.406 1.00 2.25 H new ATOM 0 HZ2 LYS A 29 -21.582 1.662 -3.893 1.00 2.25 H new ATOM 0 HZ3 LYS A 29 -22.997 0.764 -3.624 1.00 2.25 H new ATOM 480 N ILE A 30 -16.657 -4.740 -3.719 1.00 2.29 N ATOM 481 CA ILE A 30 -15.351 -5.235 -4.132 1.00 2.30 C ATOM 482 C ILE A 30 -15.415 -6.749 -4.285 1.00 2.63 C ATOM 483 O ILE A 30 -14.909 -7.309 -5.257 1.00 2.75 O ATOM 484 CB ILE A 30 -14.245 -4.878 -3.114 1.00 2.17 C ATOM 485 CG1 ILE A 30 -14.174 -3.362 -2.921 1.00 1.87 C ATOM 486 CG2 ILE A 30 -12.896 -5.422 -3.571 1.00 2.22 C ATOM 487 CD1 ILE A 30 -13.243 -2.928 -1.809 1.00 1.74 C ATOM 0 H ILE A 30 -16.685 -4.356 -2.774 1.00 2.29 H new ATOM 0 HA ILE A 30 -15.100 -4.759 -5.080 1.00 2.30 H new ATOM 0 HB ILE A 30 -14.492 -5.341 -2.158 1.00 2.17 H new ATOM 0 HG12 ILE A 30 -13.849 -2.902 -3.854 1.00 1.87 H new ATOM 0 HG13 ILE A 30 -15.175 -2.985 -2.711 1.00 1.87 H new ATOM 0 HG21 ILE A 30 -12.131 -5.159 -2.840 1.00 2.22 H new ATOM 0 HG22 ILE A 30 -12.953 -6.507 -3.663 1.00 2.22 H new ATOM 0 HG23 ILE A 30 -12.638 -4.989 -4.538 1.00 2.22 H new ATOM 0 HD11 ILE A 30 -13.247 -1.841 -1.735 1.00 1.74 H new ATOM 0 HD12 ILE A 30 -13.579 -3.358 -0.865 1.00 1.74 H new ATOM 0 HD13 ILE A 30 -12.232 -3.273 -2.026 1.00 1.74 H new ATOM 499 N GLN A 31 -16.070 -7.395 -3.327 1.00 2.82 N ATOM 500 CA GLN A 31 -16.228 -8.846 -3.331 1.00 3.16 C ATOM 501 C GLN A 31 -17.030 -9.304 -4.546 1.00 3.29 C ATOM 502 O GLN A 31 -16.724 -10.323 -5.158 1.00 3.56 O ATOM 503 CB GLN A 31 -16.931 -9.304 -2.051 1.00 3.37 C ATOM 504 CG GLN A 31 -17.152 -10.807 -1.973 1.00 3.73 C ATOM 505 CD GLN A 31 -18.287 -11.183 -1.042 1.00 3.95 C ATOM 506 OE1 GLN A 31 -19.259 -10.443 -0.893 1.00 3.91 O ATOM 507 NE2 GLN A 31 -18.173 -12.341 -0.417 1.00 4.28 N ATOM 0 H GLN A 31 -16.505 -6.931 -2.529 1.00 2.82 H new ATOM 0 HA GLN A 31 -15.235 -9.293 -3.380 1.00 3.16 H new ATOM 0 HB2 GLN A 31 -16.340 -8.988 -1.191 1.00 3.37 H new ATOM 0 HB3 GLN A 31 -17.895 -8.801 -1.978 1.00 3.37 H new ATOM 0 HG2 GLN A 31 -17.363 -11.191 -2.971 1.00 3.73 H new ATOM 0 HG3 GLN A 31 -16.235 -11.288 -1.634 1.00 3.73 H new ATOM 0 HE21 GLN A 31 -17.350 -12.924 -0.569 1.00 4.28 H new ATOM 0 HE22 GLN A 31 -18.908 -12.652 0.218 1.00 4.28 H new ATOM 516 N ASP A 32 -18.044 -8.531 -4.898 1.00 3.12 N ATOM 517 CA ASP A 32 -18.905 -8.851 -6.031 1.00 3.24 C ATOM 518 C ASP A 32 -18.160 -8.747 -7.365 1.00 3.24 C ATOM 519 O ASP A 32 -18.500 -9.436 -8.328 1.00 3.48 O ATOM 520 CB ASP A 32 -20.112 -7.907 -6.040 1.00 3.12 C ATOM 521 CG ASP A 32 -21.134 -8.251 -7.108 1.00 3.45 C ATOM 522 OD1 ASP A 32 -21.750 -9.332 -7.023 1.00 3.31 O ATOM 523 OD2 ASP A 32 -21.348 -7.427 -8.023 1.00 4.07 O ATOM 0 H ASP A 32 -18.295 -7.670 -4.412 1.00 3.12 H new ATOM 0 HA ASP A 32 -19.235 -9.883 -5.917 1.00 3.24 H new ATOM 0 HB2 ASP A 32 -20.594 -7.935 -5.063 1.00 3.12 H new ATOM 0 HB3 ASP A 32 -19.765 -6.885 -6.195 1.00 3.12 H new ATOM 528 N LYS A 33 -17.134 -7.905 -7.420 1.00 3.00 N ATOM 529 CA LYS A 33 -16.385 -7.706 -8.659 1.00 3.03 C ATOM 530 C LYS A 33 -15.087 -8.515 -8.708 1.00 3.15 C ATOM 531 O LYS A 33 -14.798 -9.180 -9.707 1.00 3.38 O ATOM 532 CB LYS A 33 -16.082 -6.218 -8.840 1.00 2.78 C ATOM 533 CG LYS A 33 -17.322 -5.368 -9.084 1.00 2.68 C ATOM 534 CD LYS A 33 -17.075 -3.905 -8.756 1.00 2.47 C ATOM 535 CE LYS A 33 -18.367 -3.100 -8.773 1.00 2.38 C ATOM 536 NZ LYS A 33 -18.893 -2.909 -10.153 1.00 2.46 N ATOM 0 H LYS A 33 -16.803 -7.353 -6.629 1.00 3.00 H new ATOM 0 HA LYS A 33 -17.010 -8.067 -9.476 1.00 3.03 H new ATOM 0 HB2 LYS A 33 -15.568 -5.850 -7.952 1.00 2.78 H new ATOM 0 HB3 LYS A 33 -15.397 -6.095 -9.679 1.00 2.78 H new ATOM 0 HG2 LYS A 33 -17.627 -5.461 -10.126 1.00 2.68 H new ATOM 0 HG3 LYS A 33 -18.145 -5.743 -8.476 1.00 2.68 H new ATOM 0 HD2 LYS A 33 -16.609 -3.826 -7.774 1.00 2.47 H new ATOM 0 HD3 LYS A 33 -16.374 -3.484 -9.476 1.00 2.47 H new ATOM 0 HE2 LYS A 33 -19.117 -3.608 -8.167 1.00 2.38 H new ATOM 0 HE3 LYS A 33 -18.193 -2.127 -8.315 1.00 2.38 H new ATOM 0 HZ1 LYS A 33 -19.773 -2.356 -10.116 1.00 2.46 H new ATOM 0 HZ2 LYS A 33 -18.189 -2.401 -10.726 1.00 2.46 H new ATOM 0 HZ3 LYS A 33 -19.085 -3.836 -10.583 1.00 2.46 H new ATOM 550 N GLU A 34 -14.302 -8.451 -7.639 1.00 3.04 N ATOM 551 CA GLU A 34 -13.032 -9.169 -7.581 1.00 3.16 C ATOM 552 C GLU A 34 -13.219 -10.608 -7.112 1.00 3.47 C ATOM 553 O GLU A 34 -12.520 -11.508 -7.572 1.00 3.71 O ATOM 554 CB GLU A 34 -12.050 -8.443 -6.660 1.00 2.90 C ATOM 555 CG GLU A 34 -11.487 -7.166 -7.265 1.00 2.71 C ATOM 556 CD GLU A 34 -10.605 -7.424 -8.476 1.00 2.87 C ATOM 557 OE1 GLU A 34 -11.144 -7.560 -9.594 1.00 2.98 O ATOM 558 OE2 GLU A 34 -9.369 -7.486 -8.321 1.00 2.94 O ATOM 0 H GLU A 34 -14.521 -7.911 -6.802 1.00 3.04 H new ATOM 0 HA GLU A 34 -12.625 -9.195 -8.592 1.00 3.16 H new ATOM 0 HB2 GLU A 34 -12.552 -8.202 -5.723 1.00 2.90 H new ATOM 0 HB3 GLU A 34 -11.227 -9.115 -6.417 1.00 2.90 H new ATOM 0 HG2 GLU A 34 -12.311 -6.513 -7.554 1.00 2.71 H new ATOM 0 HG3 GLU A 34 -10.910 -6.635 -6.508 1.00 2.71 H new ATOM 565 N GLY A 35 -14.165 -10.825 -6.207 1.00 3.52 N ATOM 566 CA GLY A 35 -14.410 -12.166 -5.701 1.00 3.85 C ATOM 567 C GLY A 35 -13.675 -12.443 -4.403 1.00 3.91 C ATOM 568 O GLY A 35 -13.821 -13.511 -3.811 1.00 4.28 O ATOM 0 H GLY A 35 -14.766 -10.101 -5.814 1.00 3.52 H new ATOM 0 HA2 GLY A 35 -15.480 -12.301 -5.544 1.00 3.85 H new ATOM 0 HA3 GLY A 35 -14.103 -12.895 -6.451 1.00 3.85 H new ATOM 572 N ILE A 36 -12.897 -11.471 -3.954 1.00 3.58 N ATOM 573 CA ILE A 36 -12.128 -11.607 -2.728 1.00 3.63 C ATOM 574 C ILE A 36 -13.028 -11.431 -1.506 1.00 3.66 C ATOM 575 O ILE A 36 -13.717 -10.416 -1.387 1.00 3.46 O ATOM 576 CB ILE A 36 -10.987 -10.570 -2.675 1.00 3.37 C ATOM 577 CG1 ILE A 36 -10.155 -10.618 -3.960 1.00 3.36 C ATOM 578 CG2 ILE A 36 -10.103 -10.820 -1.465 1.00 3.48 C ATOM 579 CD1 ILE A 36 -9.308 -9.381 -4.192 1.00 3.12 C ATOM 0 H ILE A 36 -12.781 -10.573 -4.424 1.00 3.58 H new ATOM 0 HA ILE A 36 -11.698 -12.608 -2.717 1.00 3.63 H new ATOM 0 HB ILE A 36 -11.428 -9.577 -2.587 1.00 3.37 H new ATOM 0 HG12 ILE A 36 -9.503 -11.491 -3.927 1.00 3.36 H new ATOM 0 HG13 ILE A 36 -10.825 -10.752 -4.810 1.00 3.36 H new ATOM 0 HG21 ILE A 36 -9.302 -10.081 -1.440 1.00 3.48 H new ATOM 0 HG22 ILE A 36 -10.699 -10.739 -0.556 1.00 3.48 H new ATOM 0 HG23 ILE A 36 -9.672 -11.819 -1.529 1.00 3.48 H new ATOM 0 HD11 ILE A 36 -8.749 -9.492 -5.121 1.00 3.12 H new ATOM 0 HD12 ILE A 36 -9.954 -8.505 -4.259 1.00 3.12 H new ATOM 0 HD13 ILE A 36 -8.612 -9.256 -3.363 1.00 3.12 H new ATOM 591 N PRO A 37 -13.047 -12.426 -0.604 1.00 3.95 N ATOM 592 CA PRO A 37 -13.856 -12.384 0.623 1.00 4.07 C ATOM 593 C PRO A 37 -13.615 -11.122 1.462 1.00 3.85 C ATOM 594 O PRO A 37 -12.471 -10.694 1.637 1.00 3.74 O ATOM 595 CB PRO A 37 -13.391 -13.625 1.388 1.00 4.42 C ATOM 596 CG PRO A 37 -12.883 -14.556 0.350 1.00 4.53 C ATOM 597 CD PRO A 37 -12.288 -13.687 -0.718 1.00 4.23 C ATOM 0 HA PRO A 37 -14.923 -12.366 0.399 1.00 4.07 H new ATOM 0 HB2 PRO A 37 -12.611 -13.375 2.108 1.00 4.42 H new ATOM 0 HB3 PRO A 37 -14.212 -14.072 1.950 1.00 4.42 H new ATOM 0 HG2 PRO A 37 -12.137 -15.234 0.764 1.00 4.53 H new ATOM 0 HG3 PRO A 37 -13.688 -15.173 -0.050 1.00 4.53 H new ATOM 0 HD2 PRO A 37 -11.222 -13.529 -0.558 1.00 4.23 H new ATOM 0 HD3 PRO A 37 -12.399 -14.134 -1.706 1.00 4.23 H new ATOM 605 N PRO A 38 -14.697 -10.528 2.009 1.00 3.81 N ATOM 606 CA PRO A 38 -14.624 -9.304 2.824 1.00 3.65 C ATOM 607 C PRO A 38 -13.693 -9.429 4.032 1.00 3.83 C ATOM 608 O PRO A 38 -13.105 -8.441 4.474 1.00 3.72 O ATOM 609 CB PRO A 38 -16.066 -9.098 3.296 1.00 3.74 C ATOM 610 CG PRO A 38 -16.916 -9.853 2.337 1.00 3.80 C ATOM 611 CD PRO A 38 -16.086 -11.007 1.859 1.00 3.95 C ATOM 0 HA PRO A 38 -14.216 -8.475 2.245 1.00 3.65 H new ATOM 0 HB2 PRO A 38 -16.201 -9.466 4.313 1.00 3.74 H new ATOM 0 HB3 PRO A 38 -16.328 -8.040 3.303 1.00 3.74 H new ATOM 0 HG2 PRO A 38 -17.829 -10.203 2.819 1.00 3.80 H new ATOM 0 HG3 PRO A 38 -17.219 -9.220 1.503 1.00 3.80 H new ATOM 0 HD2 PRO A 38 -16.267 -11.903 2.453 1.00 3.95 H new ATOM 0 HD3 PRO A 38 -16.312 -11.260 0.823 1.00 3.95 H new ATOM 619 N ASP A 39 -13.558 -10.640 4.559 1.00 4.13 N ATOM 620 CA ASP A 39 -12.700 -10.878 5.720 1.00 4.35 C ATOM 621 C ASP A 39 -11.231 -10.650 5.392 1.00 4.24 C ATOM 622 O ASP A 39 -10.450 -10.248 6.249 1.00 4.34 O ATOM 623 CB ASP A 39 -12.881 -12.299 6.251 1.00 4.71 C ATOM 624 CG ASP A 39 -14.084 -12.435 7.160 1.00 4.84 C ATOM 625 OD1 ASP A 39 -13.936 -12.240 8.382 1.00 5.06 O ATOM 626 OD2 ASP A 39 -15.182 -12.751 6.654 1.00 5.01 O ATOM 0 H ASP A 39 -14.029 -11.472 4.204 1.00 4.13 H new ATOM 0 HA ASP A 39 -13.001 -10.163 6.486 1.00 4.35 H new ATOM 0 HB2 ASP A 39 -12.986 -12.986 5.411 1.00 4.71 H new ATOM 0 HB3 ASP A 39 -11.984 -12.596 6.795 1.00 4.71 H new ATOM 631 N GLN A 40 -10.863 -10.894 4.143 1.00 4.08 N ATOM 632 CA GLN A 40 -9.479 -10.734 3.713 1.00 3.98 C ATOM 633 C GLN A 40 -9.244 -9.336 3.147 1.00 3.57 C ATOM 634 O GLN A 40 -8.132 -8.997 2.745 1.00 3.41 O ATOM 635 CB GLN A 40 -9.129 -11.791 2.663 1.00 4.11 C ATOM 636 CG GLN A 40 -9.700 -13.167 2.971 1.00 4.52 C ATOM 637 CD GLN A 40 -9.483 -14.150 1.845 1.00 4.65 C ATOM 638 OE1 GLN A 40 -9.348 -13.766 0.684 1.00 4.51 O ATOM 639 NE2 GLN A 40 -9.453 -15.429 2.175 1.00 5.01 N ATOM 0 H GLN A 40 -11.501 -11.203 3.410 1.00 4.08 H new ATOM 0 HA GLN A 40 -8.833 -10.866 4.581 1.00 3.98 H new ATOM 0 HB2 GLN A 40 -9.498 -11.463 1.692 1.00 4.11 H new ATOM 0 HB3 GLN A 40 -8.045 -11.866 2.583 1.00 4.11 H new ATOM 0 HG2 GLN A 40 -9.238 -13.553 3.880 1.00 4.52 H new ATOM 0 HG3 GLN A 40 -10.768 -13.077 3.170 1.00 4.52 H new ATOM 0 HE21 GLN A 40 -9.569 -15.707 3.149 1.00 5.01 H new ATOM 0 HE22 GLN A 40 -9.314 -16.138 1.455 1.00 5.01 H new ATOM 648 N GLN A 41 -10.293 -8.523 3.150 1.00 3.41 N ATOM 649 CA GLN A 41 -10.222 -7.169 2.615 1.00 3.03 C ATOM 650 C GLN A 41 -9.908 -6.137 3.691 1.00 2.97 C ATOM 651 O GLN A 41 -10.699 -5.926 4.613 1.00 3.16 O ATOM 652 CB GLN A 41 -11.548 -6.784 1.969 1.00 2.91 C ATOM 653 CG GLN A 41 -11.876 -7.523 0.688 1.00 2.92 C ATOM 654 CD GLN A 41 -13.128 -6.963 0.044 1.00 2.81 C ATOM 655 OE1 GLN A 41 -13.411 -5.770 0.157 1.00 2.68 O ATOM 656 NE2 GLN A 41 -13.894 -7.807 -0.623 1.00 2.92 N ATOM 0 H GLN A 41 -11.208 -8.780 3.519 1.00 3.41 H new ATOM 0 HA GLN A 41 -9.416 -7.170 1.881 1.00 3.03 H new ATOM 0 HB2 GLN A 41 -12.349 -6.960 2.687 1.00 2.91 H new ATOM 0 HB3 GLN A 41 -11.536 -5.714 1.760 1.00 2.91 H new ATOM 0 HG2 GLN A 41 -11.039 -7.444 -0.006 1.00 2.92 H new ATOM 0 HG3 GLN A 41 -12.015 -8.583 0.901 1.00 2.92 H new ATOM 0 HE21 GLN A 41 -13.628 -8.789 -0.696 1.00 2.92 H new ATOM 0 HE22 GLN A 41 -14.752 -7.477 -1.065 1.00 2.92 H new ATOM 665 N ARG A 42 -8.759 -5.494 3.568 1.00 2.77 N ATOM 666 CA ARG A 42 -8.368 -4.450 4.502 1.00 2.74 C ATOM 667 C ARG A 42 -8.265 -3.130 3.737 1.00 2.38 C ATOM 668 O ARG A 42 -7.367 -2.949 2.918 1.00 2.17 O ATOM 669 CB ARG A 42 -7.039 -4.791 5.189 1.00 2.88 C ATOM 670 CG ARG A 42 -6.978 -6.215 5.723 1.00 3.16 C ATOM 671 CD ARG A 42 -5.875 -6.380 6.758 1.00 3.34 C ATOM 672 NE ARG A 42 -6.268 -5.862 8.070 1.00 3.46 N ATOM 673 CZ ARG A 42 -5.422 -5.290 8.930 1.00 3.72 C ATOM 674 NH1 ARG A 42 -4.125 -5.221 8.653 1.00 3.91 N ATOM 675 NH2 ARG A 42 -5.868 -4.821 10.092 1.00 3.87 N ATOM 0 H ARG A 42 -8.079 -5.676 2.830 1.00 2.77 H new ATOM 0 HA ARG A 42 -9.119 -4.363 5.287 1.00 2.74 H new ATOM 0 HB2 ARG A 42 -6.224 -4.642 4.480 1.00 2.88 H new ATOM 0 HB3 ARG A 42 -6.876 -4.096 6.012 1.00 2.88 H new ATOM 0 HG2 ARG A 42 -7.937 -6.478 6.168 1.00 3.16 H new ATOM 0 HG3 ARG A 42 -6.809 -6.907 4.898 1.00 3.16 H new ATOM 0 HD2 ARG A 42 -5.618 -7.435 6.848 1.00 3.34 H new ATOM 0 HD3 ARG A 42 -4.979 -5.861 6.418 1.00 3.34 H new ATOM 0 HE ARG A 42 -7.247 -5.943 8.343 1.00 3.46 H new ATOM 0 HH11 ARG A 42 -3.769 -5.607 7.778 1.00 3.91 H new ATOM 0 HH12 ARG A 42 -3.485 -4.782 9.315 1.00 3.91 H new ATOM 0 HH21 ARG A 42 -6.858 -4.898 10.327 1.00 3.87 H new ATOM 0 HH22 ARG A 42 -5.220 -4.384 10.748 1.00 3.87 H new ATOM 689 N LEU A 43 -9.207 -2.227 3.986 1.00 2.36 N ATOM 690 CA LEU A 43 -9.240 -0.940 3.293 1.00 2.08 C ATOM 691 C LEU A 43 -8.574 0.157 4.105 1.00 2.15 C ATOM 692 O LEU A 43 -8.844 0.319 5.297 1.00 2.45 O ATOM 693 CB LEU A 43 -10.686 -0.541 2.988 1.00 2.07 C ATOM 694 CG LEU A 43 -11.314 -1.242 1.783 1.00 1.94 C ATOM 695 CD1 LEU A 43 -12.830 -1.133 1.835 1.00 2.06 C ATOM 696 CD2 LEU A 43 -10.787 -0.640 0.491 1.00 1.58 C ATOM 0 H LEU A 43 -9.959 -2.360 4.662 1.00 2.36 H new ATOM 0 HA LEU A 43 -8.684 -1.058 2.363 1.00 2.08 H new ATOM 0 HB2 LEU A 43 -11.296 -0.748 3.867 1.00 2.07 H new ATOM 0 HB3 LEU A 43 -10.722 0.536 2.821 1.00 2.07 H new ATOM 0 HG LEU A 43 -11.041 -2.297 1.815 1.00 1.94 H new ATOM 0 HD11 LEU A 43 -13.261 -1.637 0.970 1.00 2.06 H new ATOM 0 HD12 LEU A 43 -13.197 -1.601 2.748 1.00 2.06 H new ATOM 0 HD13 LEU A 43 -13.120 -0.082 1.824 1.00 2.06 H new ATOM 0 HD21 LEU A 43 -11.242 -1.148 -0.359 1.00 1.58 H new ATOM 0 HD22 LEU A 43 -11.036 0.421 0.456 1.00 1.58 H new ATOM 0 HD23 LEU A 43 -9.704 -0.760 0.449 1.00 1.58 H new ATOM 708 N ILE A 44 -7.701 0.907 3.445 1.00 1.91 N ATOM 709 CA ILE A 44 -6.989 2.003 4.082 1.00 2.00 C ATOM 710 C ILE A 44 -7.084 3.271 3.233 1.00 1.90 C ATOM 711 O ILE A 44 -6.822 3.246 2.025 1.00 1.71 O ATOM 712 CB ILE A 44 -5.502 1.645 4.318 1.00 2.01 C ATOM 713 CG1 ILE A 44 -5.377 0.494 5.317 1.00 2.27 C ATOM 714 CG2 ILE A 44 -4.723 2.852 4.816 1.00 2.14 C ATOM 715 CD1 ILE A 44 -5.185 -0.855 4.661 1.00 2.43 C ATOM 0 H ILE A 44 -7.469 0.773 2.461 1.00 1.91 H new ATOM 0 HA ILE A 44 -7.459 2.182 5.049 1.00 2.00 H new ATOM 0 HB ILE A 44 -5.079 1.331 3.364 1.00 2.01 H new ATOM 0 HG12 ILE A 44 -4.535 0.689 5.981 1.00 2.27 H new ATOM 0 HG13 ILE A 44 -6.272 0.463 5.938 1.00 2.27 H new ATOM 0 HG21 ILE A 44 -3.681 2.573 4.974 1.00 2.14 H new ATOM 0 HG22 ILE A 44 -4.777 3.650 4.076 1.00 2.14 H new ATOM 0 HG23 ILE A 44 -5.152 3.199 5.756 1.00 2.14 H new ATOM 0 HD11 ILE A 44 -5.104 -1.625 5.429 1.00 2.43 H new ATOM 0 HD12 ILE A 44 -6.038 -1.072 4.018 1.00 2.43 H new ATOM 0 HD13 ILE A 44 -4.274 -0.842 4.062 1.00 2.43 H new ATOM 727 N PHE A 45 -7.465 4.370 3.870 1.00 2.10 N ATOM 728 CA PHE A 45 -7.596 5.653 3.191 1.00 2.11 C ATOM 729 C PHE A 45 -6.710 6.702 3.852 1.00 2.32 C ATOM 730 O PHE A 45 -6.870 7.003 5.037 1.00 2.63 O ATOM 731 CB PHE A 45 -9.057 6.113 3.212 1.00 2.22 C ATOM 732 CG PHE A 45 -9.276 7.483 2.634 1.00 2.31 C ATOM 733 CD1 PHE A 45 -9.075 7.720 1.284 1.00 2.13 C ATOM 734 CD2 PHE A 45 -9.688 8.534 3.439 1.00 2.66 C ATOM 735 CE1 PHE A 45 -9.278 8.980 0.749 1.00 2.33 C ATOM 736 CE2 PHE A 45 -9.892 9.794 2.908 1.00 2.81 C ATOM 737 CZ PHE A 45 -9.687 10.016 1.561 1.00 2.67 C ATOM 0 H PHE A 45 -7.691 4.398 4.864 1.00 2.10 H new ATOM 0 HA PHE A 45 -7.276 5.530 2.156 1.00 2.11 H new ATOM 0 HB2 PHE A 45 -9.661 5.395 2.657 1.00 2.22 H new ATOM 0 HB3 PHE A 45 -9.415 6.103 4.241 1.00 2.22 H new ATOM 0 HD1 PHE A 45 -8.756 6.912 0.642 1.00 2.13 H new ATOM 0 HD2 PHE A 45 -9.851 8.366 4.493 1.00 2.66 H new ATOM 0 HE1 PHE A 45 -9.116 9.152 -0.305 1.00 2.33 H new ATOM 0 HE2 PHE A 45 -10.212 10.604 3.547 1.00 2.81 H new ATOM 0 HZ PHE A 45 -9.847 10.999 1.144 1.00 2.67 H new ATOM 747 N ALA A 46 -5.763 7.235 3.080 1.00 2.21 N ATOM 748 CA ALA A 46 -4.834 8.262 3.558 1.00 2.44 C ATOM 749 C ALA A 46 -4.028 7.783 4.768 1.00 2.57 C ATOM 750 O ALA A 46 -3.631 8.584 5.615 1.00 2.92 O ATOM 751 CB ALA A 46 -5.587 9.550 3.886 1.00 2.74 C ATOM 0 H ALA A 46 -5.617 6.968 2.106 1.00 2.21 H new ATOM 0 HA ALA A 46 -4.124 8.464 2.756 1.00 2.44 H new ATOM 0 HB1 ALA A 46 -4.883 10.303 4.240 1.00 2.74 H new ATOM 0 HB2 ALA A 46 -6.090 9.916 2.991 1.00 2.74 H new ATOM 0 HB3 ALA A 46 -6.326 9.352 4.662 1.00 2.74 H new ATOM 757 N GLY A 47 -3.793 6.476 4.841 1.00 2.46 N ATOM 758 CA GLY A 47 -3.036 5.916 5.947 1.00 2.63 C ATOM 759 C GLY A 47 -3.921 5.516 7.111 1.00 2.81 C ATOM 760 O GLY A 47 -3.465 4.875 8.056 1.00 2.98 O ATOM 0 H GLY A 47 -4.114 5.794 4.153 1.00 2.46 H new ATOM 0 HA2 GLY A 47 -2.482 5.044 5.599 1.00 2.63 H new ATOM 0 HA3 GLY A 47 -2.301 6.646 6.287 1.00 2.63 H new ATOM 764 N LYS A 48 -5.190 5.894 7.041 1.00 2.82 N ATOM 765 CA LYS A 48 -6.145 5.573 8.091 1.00 3.02 C ATOM 766 C LYS A 48 -6.930 4.320 7.718 1.00 2.88 C ATOM 767 O LYS A 48 -7.445 4.211 6.604 1.00 2.64 O ATOM 768 CB LYS A 48 -7.107 6.748 8.316 1.00 3.20 C ATOM 769 CG LYS A 48 -6.419 8.109 8.372 1.00 3.41 C ATOM 770 CD LYS A 48 -7.393 9.236 8.696 1.00 3.75 C ATOM 771 CE LYS A 48 -8.347 9.512 7.542 1.00 3.74 C ATOM 772 NZ LYS A 48 -9.194 10.708 7.801 1.00 4.25 N ATOM 0 H LYS A 48 -5.583 6.426 6.264 1.00 2.82 H new ATOM 0 HA LYS A 48 -5.598 5.388 9.015 1.00 3.02 H new ATOM 0 HB2 LYS A 48 -7.846 6.758 7.515 1.00 3.20 H new ATOM 0 HB3 LYS A 48 -7.649 6.587 9.248 1.00 3.20 H new ATOM 0 HG2 LYS A 48 -5.631 8.085 9.125 1.00 3.41 H new ATOM 0 HG3 LYS A 48 -5.939 8.311 7.415 1.00 3.41 H new ATOM 0 HD2 LYS A 48 -7.966 8.976 9.586 1.00 3.75 H new ATOM 0 HD3 LYS A 48 -6.834 10.142 8.930 1.00 3.75 H new ATOM 0 HE2 LYS A 48 -7.776 9.662 6.626 1.00 3.74 H new ATOM 0 HE3 LYS A 48 -8.985 8.643 7.381 1.00 3.74 H new ATOM 0 HZ1 LYS A 48 -10.060 10.651 7.228 1.00 4.25 H new ATOM 0 HZ2 LYS A 48 -9.448 10.742 8.809 1.00 4.25 H new ATOM 0 HZ3 LYS A 48 -8.667 11.568 7.548 1.00 4.25 H new ATOM 786 N GLN A 49 -7.026 3.384 8.650 1.00 3.08 N ATOM 787 CA GLN A 49 -7.740 2.138 8.411 1.00 3.05 C ATOM 788 C GLN A 49 -9.243 2.353 8.556 1.00 3.16 C ATOM 789 O GLN A 49 -9.689 3.123 9.407 1.00 3.39 O ATOM 790 CB GLN A 49 -7.253 1.062 9.382 1.00 3.29 C ATOM 791 CG GLN A 49 -7.734 -0.336 9.037 1.00 3.57 C ATOM 792 CD GLN A 49 -6.865 -1.414 9.654 1.00 4.03 C ATOM 793 OE1 GLN A 49 -5.890 -1.860 9.050 1.00 4.36 O ATOM 794 NE2 GLN A 49 -7.211 -1.842 10.857 1.00 4.45 N ATOM 0 H GLN A 49 -6.617 3.464 9.581 1.00 3.08 H new ATOM 0 HA GLN A 49 -7.539 1.804 7.393 1.00 3.05 H new ATOM 0 HB2 GLN A 49 -6.163 1.067 9.399 1.00 3.29 H new ATOM 0 HB3 GLN A 49 -7.589 1.314 10.388 1.00 3.29 H new ATOM 0 HG2 GLN A 49 -8.761 -0.459 9.381 1.00 3.57 H new ATOM 0 HG3 GLN A 49 -7.744 -0.457 7.954 1.00 3.57 H new ATOM 0 HE21 GLN A 49 -8.027 -1.446 11.324 1.00 4.45 H new ATOM 0 HE22 GLN A 49 -6.662 -2.568 11.317 1.00 4.45 H new ATOM 803 N LEU A 50 -10.019 1.678 7.721 1.00 3.02 N ATOM 804 CA LEU A 50 -11.469 1.814 7.753 1.00 3.12 C ATOM 805 C LEU A 50 -12.122 0.589 8.377 1.00 3.38 C ATOM 806 O LEU A 50 -11.821 -0.546 8.002 1.00 3.37 O ATOM 807 CB LEU A 50 -12.011 2.014 6.337 1.00 2.80 C ATOM 808 CG LEU A 50 -11.139 2.878 5.421 1.00 2.64 C ATOM 809 CD1 LEU A 50 -11.721 2.924 4.018 1.00 2.69 C ATOM 810 CD2 LEU A 50 -10.999 4.288 5.980 1.00 2.66 C ATOM 0 H LEU A 50 -9.670 1.031 7.014 1.00 3.02 H new ATOM 0 HA LEU A 50 -11.709 2.685 8.363 1.00 3.12 H new ATOM 0 HB2 LEU A 50 -12.140 1.036 5.873 1.00 2.80 H new ATOM 0 HB3 LEU A 50 -13.000 2.468 6.404 1.00 2.80 H new ATOM 0 HG LEU A 50 -10.148 2.427 5.373 1.00 2.64 H new ATOM 0 HD11 LEU A 50 -11.088 3.542 3.382 1.00 2.69 H new ATOM 0 HD12 LEU A 50 -11.769 1.914 3.611 1.00 2.69 H new ATOM 0 HD13 LEU A 50 -12.724 3.349 4.054 1.00 2.69 H new ATOM 0 HD21 LEU A 50 -10.376 4.884 5.313 1.00 2.66 H new ATOM 0 HD22 LEU A 50 -11.984 4.747 6.062 1.00 2.66 H new ATOM 0 HD23 LEU A 50 -10.537 4.244 6.966 1.00 2.66 H new ATOM 822 N GLU A 51 -13.007 0.822 9.338 1.00 3.67 N ATOM 823 CA GLU A 51 -13.719 -0.260 10.001 1.00 3.95 C ATOM 824 C GLU A 51 -14.995 -0.597 9.244 1.00 3.85 C ATOM 825 O GLU A 51 -15.670 0.295 8.732 1.00 3.69 O ATOM 826 CB GLU A 51 -14.078 0.118 11.438 1.00 4.34 C ATOM 827 CG GLU A 51 -12.902 0.097 12.397 1.00 4.50 C ATOM 828 CD GLU A 51 -13.342 0.076 13.847 1.00 4.91 C ATOM 829 OE1 GLU A 51 -14.234 -0.731 14.195 1.00 5.09 O ATOM 830 OE2 GLU A 51 -12.797 0.863 14.646 1.00 5.20 O ATOM 0 H GLU A 51 -13.248 1.754 9.676 1.00 3.67 H new ATOM 0 HA GLU A 51 -13.060 -1.128 10.016 1.00 3.95 H new ATOM 0 HB2 GLU A 51 -14.517 1.115 11.441 1.00 4.34 H new ATOM 0 HB3 GLU A 51 -14.842 -0.568 11.803 1.00 4.34 H new ATOM 0 HG2 GLU A 51 -12.286 -0.779 12.194 1.00 4.50 H new ATOM 0 HG3 GLU A 51 -12.278 0.973 12.222 1.00 4.50 H new ATOM 837 N ASP A 52 -15.322 -1.883 9.186 1.00 4.01 N ATOM 838 CA ASP A 52 -16.531 -2.346 8.502 1.00 3.96 C ATOM 839 C ASP A 52 -17.766 -1.632 9.048 1.00 4.11 C ATOM 840 O ASP A 52 -18.662 -1.251 8.294 1.00 3.94 O ATOM 841 CB ASP A 52 -16.698 -3.859 8.666 1.00 4.19 C ATOM 842 CG ASP A 52 -15.860 -4.658 7.683 1.00 4.03 C ATOM 843 OD1 ASP A 52 -14.613 -4.646 7.805 1.00 3.91 O ATOM 844 OD2 ASP A 52 -16.439 -5.314 6.791 1.00 4.23 O ATOM 0 H ASP A 52 -14.766 -2.629 9.605 1.00 4.01 H new ATOM 0 HA ASP A 52 -16.426 -2.113 7.442 1.00 3.96 H new ATOM 0 HB2 ASP A 52 -16.424 -4.141 9.682 1.00 4.19 H new ATOM 0 HB3 ASP A 52 -17.748 -4.119 8.535 1.00 4.19 H new ATOM 849 N GLY A 53 -17.784 -1.433 10.363 1.00 4.44 N ATOM 850 CA GLY A 53 -18.903 -0.768 11.010 1.00 4.63 C ATOM 851 C GLY A 53 -18.786 0.752 11.016 1.00 4.57 C ATOM 852 O GLY A 53 -19.041 1.399 12.034 1.00 4.86 O ATOM 0 H GLY A 53 -17.038 -1.722 10.996 1.00 4.44 H new ATOM 0 HA2 GLY A 53 -19.826 -1.051 10.504 1.00 4.63 H new ATOM 0 HA3 GLY A 53 -18.981 -1.123 12.038 1.00 4.63 H new ATOM 856 N ARG A 54 -18.385 1.319 9.890 1.00 4.22 N ATOM 857 CA ARG A 54 -18.251 2.766 9.756 1.00 4.17 C ATOM 858 C ARG A 54 -18.716 3.191 8.372 1.00 3.87 C ATOM 859 O ARG A 54 -18.884 2.350 7.490 1.00 3.66 O ATOM 860 CB ARG A 54 -16.803 3.218 9.972 1.00 4.12 C ATOM 861 CG ARG A 54 -16.365 3.262 11.429 1.00 4.43 C ATOM 862 CD ARG A 54 -17.237 4.195 12.254 1.00 4.74 C ATOM 863 NE ARG A 54 -16.726 4.353 13.612 1.00 5.09 N ATOM 864 CZ ARG A 54 -17.034 3.542 14.625 1.00 5.38 C ATOM 865 NH1 ARG A 54 -17.860 2.519 14.438 1.00 5.44 N ATOM 866 NH2 ARG A 54 -16.515 3.756 15.824 1.00 5.69 N ATOM 0 H ARG A 54 -18.144 0.797 9.047 1.00 4.22 H new ATOM 0 HA ARG A 54 -18.869 3.237 10.521 1.00 4.17 H new ATOM 0 HB2 ARG A 54 -16.141 2.545 9.427 1.00 4.12 H new ATOM 0 HB3 ARG A 54 -16.677 4.210 9.538 1.00 4.12 H new ATOM 0 HG2 ARG A 54 -16.406 2.258 11.851 1.00 4.43 H new ATOM 0 HG3 ARG A 54 -15.327 3.589 11.487 1.00 4.43 H new ATOM 0 HD2 ARG A 54 -17.287 5.170 11.769 1.00 4.74 H new ATOM 0 HD3 ARG A 54 -18.254 3.804 12.291 1.00 4.74 H new ATOM 0 HE ARG A 54 -16.094 5.132 13.798 1.00 5.09 H new ATOM 0 HH11 ARG A 54 -18.262 2.350 13.516 1.00 5.44 H new ATOM 0 HH12 ARG A 54 -18.092 1.902 15.216 1.00 5.44 H new ATOM 0 HH21 ARG A 54 -15.880 4.541 15.972 1.00 5.69 H new ATOM 0 HH22 ARG A 54 -16.750 3.136 16.599 1.00 5.69 H new ATOM 880 N THR A 55 -18.924 4.484 8.184 1.00 3.88 N ATOM 881 CA THR A 55 -19.373 4.997 6.901 1.00 3.65 C ATOM 882 C THR A 55 -18.271 5.799 6.220 1.00 3.46 C ATOM 883 O THR A 55 -17.236 6.084 6.824 1.00 3.54 O ATOM 884 CB THR A 55 -20.631 5.876 7.053 1.00 3.84 C ATOM 885 OG1 THR A 55 -20.452 6.823 8.114 1.00 4.30 O ATOM 886 CG2 THR A 55 -21.859 5.030 7.334 1.00 3.80 C ATOM 0 H THR A 55 -18.789 5.196 8.902 1.00 3.88 H new ATOM 0 HA THR A 55 -19.624 4.136 6.282 1.00 3.65 H new ATOM 0 HB THR A 55 -20.780 6.407 6.113 1.00 3.84 H new ATOM 0 HG1 THR A 55 -20.196 6.351 8.934 1.00 4.30 H new ATOM 0 HG21 THR A 55 -22.731 5.677 7.436 1.00 3.80 H new ATOM 0 HG22 THR A 55 -22.018 4.334 6.510 1.00 3.80 H new ATOM 0 HG23 THR A 55 -21.712 4.470 8.258 1.00 3.80 H new ATOM 894 N LEU A 56 -18.493 6.158 4.960 1.00 3.24 N ATOM 895 CA LEU A 56 -17.515 6.927 4.200 1.00 3.08 C ATOM 896 C LEU A 56 -17.357 8.334 4.767 1.00 3.34 C ATOM 897 O LEU A 56 -16.243 8.857 4.847 1.00 3.35 O ATOM 898 CB LEU A 56 -17.921 6.998 2.725 1.00 2.86 C ATOM 899 CG LEU A 56 -17.956 5.655 1.988 1.00 2.59 C ATOM 900 CD1 LEU A 56 -18.438 5.839 0.564 1.00 2.48 C ATOM 901 CD2 LEU A 56 -16.585 5.002 1.991 1.00 2.42 C ATOM 0 H LEU A 56 -19.342 5.928 4.444 1.00 3.24 H new ATOM 0 HA LEU A 56 -16.555 6.418 4.281 1.00 3.08 H new ATOM 0 HB2 LEU A 56 -18.908 7.455 2.659 1.00 2.86 H new ATOM 0 HB3 LEU A 56 -17.228 7.660 2.206 1.00 2.86 H new ATOM 0 HG LEU A 56 -18.654 5.003 2.513 1.00 2.59 H new ATOM 0 HD11 LEU A 56 -18.455 4.874 0.058 1.00 2.48 H new ATOM 0 HD12 LEU A 56 -19.442 6.263 0.572 1.00 2.48 H new ATOM 0 HD13 LEU A 56 -17.764 6.513 0.036 1.00 2.48 H new ATOM 0 HD21 LEU A 56 -16.634 4.050 1.462 1.00 2.42 H new ATOM 0 HD22 LEU A 56 -15.869 5.657 1.494 1.00 2.42 H new ATOM 0 HD23 LEU A 56 -16.266 4.830 3.019 1.00 2.42 H new ATOM 913 N SER A 57 -18.465 8.931 5.189 1.00 3.59 N ATOM 914 CA SER A 57 -18.446 10.278 5.745 1.00 3.87 C ATOM 915 C SER A 57 -17.691 10.310 7.073 1.00 4.06 C ATOM 916 O SER A 57 -17.220 11.362 7.509 1.00 4.25 O ATOM 917 CB SER A 57 -19.878 10.780 5.939 1.00 4.10 C ATOM 918 OG SER A 57 -20.783 9.692 6.052 1.00 4.20 O ATOM 0 H SER A 57 -19.390 8.502 5.157 1.00 3.59 H new ATOM 0 HA SER A 57 -17.928 10.933 5.045 1.00 3.87 H new ATOM 0 HB2 SER A 57 -19.933 11.399 6.835 1.00 4.10 H new ATOM 0 HB3 SER A 57 -20.164 11.411 5.097 1.00 4.10 H new ATOM 0 HG SER A 57 -21.244 9.560 5.197 1.00 4.20 H new ATOM 924 N ASP A 58 -17.562 9.144 7.697 1.00 4.03 N ATOM 925 CA ASP A 58 -16.865 9.019 8.975 1.00 4.23 C ATOM 926 C ASP A 58 -15.379 9.308 8.816 1.00 4.13 C ATOM 927 O ASP A 58 -14.742 9.879 9.703 1.00 4.35 O ATOM 928 CB ASP A 58 -17.037 7.610 9.547 1.00 4.24 C ATOM 929 CG ASP A 58 -18.328 7.431 10.314 1.00 4.46 C ATOM 930 OD1 ASP A 58 -18.739 8.371 11.025 1.00 4.72 O ATOM 931 OD2 ASP A 58 -18.929 6.342 10.213 1.00 4.40 O ATOM 0 H ASP A 58 -17.934 8.265 7.336 1.00 4.03 H new ATOM 0 HA ASP A 58 -17.302 9.747 9.658 1.00 4.23 H new ATOM 0 HB2 ASP A 58 -17.003 6.887 8.732 1.00 4.24 H new ATOM 0 HB3 ASP A 58 -16.197 7.387 10.205 1.00 4.24 H new ATOM 936 N TYR A 59 -14.837 8.919 7.675 1.00 3.82 N ATOM 937 CA TYR A 59 -13.421 9.108 7.397 1.00 3.71 C ATOM 938 C TYR A 59 -13.200 10.280 6.452 1.00 3.69 C ATOM 939 O TYR A 59 -12.081 10.503 5.981 1.00 3.59 O ATOM 940 CB TYR A 59 -12.834 7.831 6.809 1.00 3.39 C ATOM 941 CG TYR A 59 -12.890 6.664 7.767 1.00 3.47 C ATOM 942 CD1 TYR A 59 -11.955 6.531 8.786 1.00 3.62 C ATOM 943 CD2 TYR A 59 -13.876 5.697 7.648 1.00 3.44 C ATOM 944 CE1 TYR A 59 -12.006 5.466 9.662 1.00 3.75 C ATOM 945 CE2 TYR A 59 -13.932 4.630 8.520 1.00 3.57 C ATOM 946 CZ TYR A 59 -12.992 4.517 9.522 1.00 3.74 C ATOM 947 OH TYR A 59 -13.044 3.454 10.393 1.00 3.92 O ATOM 0 H TYR A 59 -15.357 8.468 6.922 1.00 3.82 H new ATOM 0 HA TYR A 59 -12.913 9.335 8.334 1.00 3.71 H new ATOM 0 HB2 TYR A 59 -13.375 7.574 5.899 1.00 3.39 H new ATOM 0 HB3 TYR A 59 -11.798 8.011 6.524 1.00 3.39 H new ATOM 0 HD1 TYR A 59 -11.177 7.272 8.894 1.00 3.62 H new ATOM 0 HD2 TYR A 59 -14.611 5.780 6.861 1.00 3.44 H new ATOM 0 HE1 TYR A 59 -11.276 5.378 10.453 1.00 3.75 H new ATOM 0 HE2 TYR A 59 -14.709 3.886 8.418 1.00 3.57 H new ATOM 0 HH TYR A 59 -12.687 3.727 11.264 1.00 3.92 H new ATOM 957 N ASN A 60 -14.277 11.020 6.193 1.00 3.82 N ATOM 958 CA ASN A 60 -14.243 12.191 5.316 1.00 3.89 C ATOM 959 C ASN A 60 -13.946 11.795 3.879 1.00 3.58 C ATOM 960 O ASN A 60 -13.373 12.571 3.116 1.00 3.60 O ATOM 961 CB ASN A 60 -13.213 13.222 5.796 1.00 4.13 C ATOM 962 CG ASN A 60 -13.475 13.712 7.208 1.00 4.55 C ATOM 963 OD1 ASN A 60 -14.620 13.775 7.659 1.00 4.83 O ATOM 964 ND2 ASN A 60 -12.412 14.051 7.923 1.00 4.67 N ATOM 0 H ASN A 60 -15.198 10.825 6.585 1.00 3.82 H new ATOM 0 HA ASN A 60 -15.232 12.647 5.355 1.00 3.89 H new ATOM 0 HB2 ASN A 60 -12.217 12.781 5.750 1.00 4.13 H new ATOM 0 HB3 ASN A 60 -13.216 14.074 5.116 1.00 4.13 H new ATOM 0 HD21 ASN A 60 -12.526 14.378 8.882 1.00 4.67 H new ATOM 0 HD22 ASN A 60 -11.480 13.985 7.514 1.00 4.67 H new ATOM 971 N ILE A 61 -14.353 10.592 3.510 1.00 3.32 N ATOM 972 CA ILE A 61 -14.131 10.105 2.161 1.00 3.03 C ATOM 973 C ILE A 61 -15.072 10.809 1.193 1.00 3.10 C ATOM 974 O ILE A 61 -16.296 10.678 1.287 1.00 3.17 O ATOM 975 CB ILE A 61 -14.316 8.573 2.066 1.00 2.74 C ATOM 976 CG1 ILE A 61 -13.280 7.880 2.950 1.00 2.69 C ATOM 977 CG2 ILE A 61 -14.193 8.095 0.621 1.00 2.48 C ATOM 978 CD1 ILE A 61 -13.405 6.371 2.983 1.00 2.47 C ATOM 0 H ILE A 61 -14.837 9.937 4.124 1.00 3.32 H new ATOM 0 HA ILE A 61 -13.099 10.329 1.892 1.00 3.03 H new ATOM 0 HB ILE A 61 -15.316 8.317 2.415 1.00 2.74 H new ATOM 0 HG12 ILE A 61 -12.283 8.144 2.597 1.00 2.69 H new ATOM 0 HG13 ILE A 61 -13.370 8.264 3.966 1.00 2.69 H new ATOM 0 HG21 ILE A 61 -14.327 7.014 0.583 1.00 2.48 H new ATOM 0 HG22 ILE A 61 -14.957 8.577 0.012 1.00 2.48 H new ATOM 0 HG23 ILE A 61 -13.206 8.352 0.235 1.00 2.48 H new ATOM 0 HD11 ILE A 61 -12.634 5.956 3.632 1.00 2.47 H new ATOM 0 HD12 ILE A 61 -14.388 6.096 3.365 1.00 2.47 H new ATOM 0 HD13 ILE A 61 -13.283 5.974 1.975 1.00 2.47 H new ATOM 990 N GLN A 62 -14.492 11.580 0.285 1.00 3.14 N ATOM 991 CA GLN A 62 -15.267 12.318 -0.699 1.00 3.27 C ATOM 992 C GLN A 62 -15.148 11.666 -2.075 1.00 3.04 C ATOM 993 O GLN A 62 -14.677 10.532 -2.201 1.00 2.76 O ATOM 994 CB GLN A 62 -14.794 13.773 -0.760 1.00 3.59 C ATOM 995 CG GLN A 62 -14.648 14.422 0.609 1.00 3.87 C ATOM 996 CD GLN A 62 -14.457 15.926 0.537 1.00 4.05 C ATOM 997 OE1 GLN A 62 -15.416 16.690 0.623 1.00 4.49 O ATOM 998 NE2 GLN A 62 -13.218 16.366 0.380 1.00 3.76 N ATOM 0 H GLN A 62 -13.483 11.710 0.210 1.00 3.14 H new ATOM 0 HA GLN A 62 -16.315 12.300 -0.398 1.00 3.27 H new ATOM 0 HB2 GLN A 62 -13.835 13.814 -1.277 1.00 3.59 H new ATOM 0 HB3 GLN A 62 -15.501 14.352 -1.354 1.00 3.59 H new ATOM 0 HG2 GLN A 62 -15.534 14.202 1.205 1.00 3.87 H new ATOM 0 HG3 GLN A 62 -13.797 13.978 1.126 1.00 3.87 H new ATOM 0 HE21 GLN A 62 -12.446 15.703 0.312 1.00 3.76 H new ATOM 0 HE22 GLN A 62 -13.036 17.368 0.327 1.00 3.76 H new ATOM 1007 N LYS A 63 -15.582 12.378 -3.102 1.00 3.20 N ATOM 1008 CA LYS A 63 -15.518 11.869 -4.461 1.00 3.08 C ATOM 1009 C LYS A 63 -14.077 11.832 -4.964 1.00 3.06 C ATOM 1010 O LYS A 63 -13.262 12.690 -4.611 1.00 3.22 O ATOM 1011 CB LYS A 63 -16.383 12.722 -5.388 1.00 3.32 C ATOM 1012 CG LYS A 63 -16.148 14.216 -5.259 1.00 3.74 C ATOM 1013 CD LYS A 63 -17.070 14.993 -6.177 1.00 3.93 C ATOM 1014 CE LYS A 63 -16.894 16.489 -6.008 1.00 4.37 C ATOM 1015 NZ LYS A 63 -18.009 17.247 -6.630 1.00 4.58 N ATOM 0 H LYS A 63 -15.983 13.312 -3.019 1.00 3.20 H new ATOM 0 HA LYS A 63 -15.903 10.849 -4.460 1.00 3.08 H new ATOM 0 HB2 LYS A 63 -16.194 12.424 -6.419 1.00 3.32 H new ATOM 0 HB3 LYS A 63 -17.433 12.512 -5.183 1.00 3.32 H new ATOM 0 HG2 LYS A 63 -16.312 14.526 -4.227 1.00 3.74 H new ATOM 0 HG3 LYS A 63 -15.110 14.447 -5.500 1.00 3.74 H new ATOM 0 HD2 LYS A 63 -16.870 14.717 -7.212 1.00 3.93 H new ATOM 0 HD3 LYS A 63 -18.105 14.722 -5.969 1.00 3.93 H new ATOM 0 HE2 LYS A 63 -16.837 16.731 -4.947 1.00 4.37 H new ATOM 0 HE3 LYS A 63 -15.950 16.797 -6.457 1.00 4.37 H new ATOM 0 HZ1 LYS A 63 -17.854 18.266 -6.494 1.00 4.58 H new ATOM 0 HZ2 LYS A 63 -18.048 17.035 -7.647 1.00 4.58 H new ATOM 0 HZ3 LYS A 63 -18.907 16.971 -6.185 1.00 4.58 H new ATOM 1029 N GLU A 64 -13.777 10.817 -5.771 1.00 2.89 N ATOM 1030 CA GLU A 64 -12.447 10.625 -6.350 1.00 2.89 C ATOM 1031 C GLU A 64 -11.399 10.348 -5.272 1.00 2.75 C ATOM 1032 O GLU A 64 -10.227 10.692 -5.427 1.00 2.87 O ATOM 1033 CB GLU A 64 -12.034 11.832 -7.199 1.00 3.19 C ATOM 1034 CG GLU A 64 -12.915 12.047 -8.418 1.00 3.34 C ATOM 1035 CD GLU A 64 -12.365 13.107 -9.347 1.00 3.64 C ATOM 1036 OE1 GLU A 64 -12.111 14.235 -8.880 1.00 4.05 O ATOM 1037 OE2 GLU A 64 -12.190 12.820 -10.552 1.00 3.64 O ATOM 0 H GLU A 64 -14.451 10.101 -6.043 1.00 2.89 H new ATOM 0 HA GLU A 64 -12.502 9.750 -6.998 1.00 2.89 H new ATOM 0 HB2 GLU A 64 -12.061 12.728 -6.579 1.00 3.19 H new ATOM 0 HB3 GLU A 64 -11.002 11.701 -7.525 1.00 3.19 H new ATOM 0 HG2 GLU A 64 -13.014 11.107 -8.961 1.00 3.34 H new ATOM 0 HG3 GLU A 64 -13.915 12.335 -8.094 1.00 3.34 H new ATOM 1044 N SER A 65 -11.825 9.727 -4.182 1.00 2.56 N ATOM 1045 CA SER A 65 -10.915 9.384 -3.100 1.00 2.45 C ATOM 1046 C SER A 65 -10.125 8.132 -3.460 1.00 2.13 C ATOM 1047 O SER A 65 -10.688 7.173 -3.988 1.00 1.97 O ATOM 1048 CB SER A 65 -11.693 9.162 -1.804 1.00 2.46 C ATOM 1049 OG SER A 65 -12.229 10.380 -1.319 1.00 2.80 O ATOM 0 H SER A 65 -12.794 9.451 -4.024 1.00 2.56 H new ATOM 0 HA SER A 65 -10.219 10.210 -2.951 1.00 2.45 H new ATOM 0 HB2 SER A 65 -12.499 8.449 -1.977 1.00 2.46 H new ATOM 0 HB3 SER A 65 -11.037 8.724 -1.052 1.00 2.46 H new ATOM 0 HG SER A 65 -13.168 10.456 -1.591 1.00 2.80 H new ATOM 1055 N THR A 66 -8.829 8.150 -3.190 1.00 2.08 N ATOM 1056 CA THR A 66 -7.978 7.013 -3.493 1.00 1.82 C ATOM 1057 C THR A 66 -7.811 6.110 -2.270 1.00 1.61 C ATOM 1058 O THR A 66 -7.200 6.496 -1.268 1.00 1.77 O ATOM 1059 CB THR A 66 -6.599 7.479 -4.002 1.00 2.02 C ATOM 1060 OG1 THR A 66 -6.764 8.301 -5.168 1.00 2.27 O ATOM 1061 CG2 THR A 66 -5.713 6.292 -4.347 1.00 1.90 C ATOM 0 H THR A 66 -8.345 8.939 -2.762 1.00 2.08 H new ATOM 0 HA THR A 66 -8.463 6.438 -4.282 1.00 1.82 H new ATOM 0 HB THR A 66 -6.121 8.051 -3.207 1.00 2.02 H new ATOM 0 HG1 THR A 66 -5.886 8.596 -5.487 1.00 2.27 H new ATOM 0 HG21 THR A 66 -4.747 6.650 -4.703 1.00 1.90 H new ATOM 0 HG22 THR A 66 -5.567 5.677 -3.459 1.00 1.90 H new ATOM 0 HG23 THR A 66 -6.189 5.697 -5.126 1.00 1.90 H new ATOM 1069 N LEU A 67 -8.367 4.913 -2.360 1.00 1.34 N ATOM 1070 CA LEU A 67 -8.298 3.941 -1.280 1.00 1.26 C ATOM 1071 C LEU A 67 -7.331 2.823 -1.640 1.00 1.12 C ATOM 1072 O LEU A 67 -7.128 2.521 -2.819 1.00 1.08 O ATOM 1073 CB LEU A 67 -9.684 3.346 -1.001 1.00 1.27 C ATOM 1074 CG LEU A 67 -10.640 4.219 -0.176 1.00 1.51 C ATOM 1075 CD1 LEU A 67 -11.215 5.358 -1.010 1.00 1.56 C ATOM 1076 CD2 LEU A 67 -11.762 3.370 0.401 1.00 1.64 C ATOM 0 H LEU A 67 -8.878 4.588 -3.181 1.00 1.34 H new ATOM 0 HA LEU A 67 -7.944 4.452 -0.385 1.00 1.26 H new ATOM 0 HB2 LEU A 67 -10.160 3.123 -1.956 1.00 1.27 H new ATOM 0 HB3 LEU A 67 -9.552 2.397 -0.482 1.00 1.27 H new ATOM 0 HG LEU A 67 -10.069 4.659 0.642 1.00 1.51 H new ATOM 0 HD11 LEU A 67 -11.887 5.956 -0.395 1.00 1.56 H new ATOM 0 HD12 LEU A 67 -10.403 5.986 -1.376 1.00 1.56 H new ATOM 0 HD13 LEU A 67 -11.766 4.947 -1.856 1.00 1.56 H new ATOM 0 HD21 LEU A 67 -12.433 4.001 0.984 1.00 1.64 H new ATOM 0 HD22 LEU A 67 -12.318 2.902 -0.411 1.00 1.64 H new ATOM 0 HD23 LEU A 67 -11.340 2.598 1.044 1.00 1.64 H new ATOM 1088 N HIS A 68 -6.724 2.222 -0.633 1.00 1.19 N ATOM 1089 CA HIS A 68 -5.797 1.128 -0.852 1.00 1.18 C ATOM 1090 C HIS A 68 -6.383 -0.149 -0.277 1.00 1.29 C ATOM 1091 O HIS A 68 -6.798 -0.177 0.883 1.00 1.43 O ATOM 1092 CB HIS A 68 -4.439 1.419 -0.207 1.00 1.29 C ATOM 1093 CG HIS A 68 -3.639 2.468 -0.915 1.00 0.94 C ATOM 1094 ND1 HIS A 68 -2.713 3.266 -0.275 1.00 0.97 N ATOM 1095 CD2 HIS A 68 -3.628 2.853 -2.213 1.00 0.99 C ATOM 1096 CE1 HIS A 68 -2.173 4.095 -1.148 1.00 0.86 C ATOM 1097 NE2 HIS A 68 -2.709 3.864 -2.329 1.00 0.95 N ATOM 0 H HIS A 68 -6.857 2.474 0.346 1.00 1.19 H new ATOM 0 HA HIS A 68 -5.641 1.012 -1.925 1.00 1.18 H new ATOM 0 HB2 HIS A 68 -4.598 1.733 0.824 1.00 1.29 H new ATOM 0 HB3 HIS A 68 -3.860 0.496 -0.173 1.00 1.29 H new ATOM 0 HD2 HIS A 68 -4.231 2.441 -3.009 1.00 0.99 H new ATOM 0 HE1 HIS A 68 -1.419 4.837 -0.931 1.00 0.86 H new ATOM 0 HE2 HIS A 68 -2.478 4.358 -3.191 1.00 0.95 H new ATOM 1106 N LEU A 69 -6.429 -1.194 -1.088 1.00 1.30 N ATOM 1107 CA LEU A 69 -6.984 -2.466 -0.654 1.00 1.47 C ATOM 1108 C LEU A 69 -5.878 -3.480 -0.395 1.00 1.75 C ATOM 1109 O LEU A 69 -5.232 -3.968 -1.325 1.00 1.81 O ATOM 1110 CB LEU A 69 -7.958 -3.007 -1.703 1.00 1.39 C ATOM 1111 CG LEU A 69 -8.646 -4.329 -1.343 1.00 1.62 C ATOM 1112 CD1 LEU A 69 -9.547 -4.160 -0.128 1.00 1.66 C ATOM 1113 CD2 LEU A 69 -9.446 -4.849 -2.526 1.00 1.62 C ATOM 0 H LEU A 69 -6.089 -1.186 -2.050 1.00 1.30 H new ATOM 0 HA LEU A 69 -7.524 -2.300 0.278 1.00 1.47 H new ATOM 0 HB2 LEU A 69 -8.726 -2.255 -1.883 1.00 1.39 H new ATOM 0 HB3 LEU A 69 -7.418 -3.142 -2.640 1.00 1.39 H new ATOM 0 HG LEU A 69 -7.874 -5.057 -1.095 1.00 1.62 H new ATOM 0 HD11 LEU A 69 -10.023 -5.112 0.107 1.00 1.66 H new ATOM 0 HD12 LEU A 69 -8.951 -3.832 0.724 1.00 1.66 H new ATOM 0 HD13 LEU A 69 -10.313 -3.415 -0.344 1.00 1.66 H new ATOM 0 HD21 LEU A 69 -9.928 -5.788 -2.255 1.00 1.62 H new ATOM 0 HD22 LEU A 69 -10.205 -4.117 -2.801 1.00 1.62 H new ATOM 0 HD23 LEU A 69 -8.779 -5.015 -3.372 1.00 1.62 H new ATOM 1125 N VAL A 70 -5.657 -3.769 0.876 1.00 1.96 N ATOM 1126 CA VAL A 70 -4.650 -4.734 1.285 1.00 2.26 C ATOM 1127 C VAL A 70 -5.315 -6.078 1.558 1.00 2.54 C ATOM 1128 O VAL A 70 -6.382 -6.134 2.170 1.00 2.57 O ATOM 1129 CB VAL A 70 -3.892 -4.262 2.550 1.00 2.40 C ATOM 1130 CG1 VAL A 70 -2.855 -5.288 2.988 1.00 2.76 C ATOM 1131 CG2 VAL A 70 -3.238 -2.911 2.305 1.00 2.12 C ATOM 0 H VAL A 70 -6.167 -3.344 1.650 1.00 1.96 H new ATOM 0 HA VAL A 70 -3.926 -4.832 0.476 1.00 2.26 H new ATOM 0 HB VAL A 70 -4.618 -4.157 3.356 1.00 2.40 H new ATOM 0 HG11 VAL A 70 -2.340 -4.927 3.878 1.00 2.76 H new ATOM 0 HG12 VAL A 70 -3.350 -6.233 3.213 1.00 2.76 H new ATOM 0 HG13 VAL A 70 -2.132 -5.439 2.187 1.00 2.76 H new ATOM 0 HG21 VAL A 70 -2.710 -2.594 3.204 1.00 2.12 H new ATOM 0 HG22 VAL A 70 -2.532 -2.993 1.479 1.00 2.12 H new ATOM 0 HG23 VAL A 70 -4.003 -2.176 2.056 1.00 2.12 H new ATOM 1141 N LEU A 71 -4.700 -7.153 1.095 1.00 2.78 N ATOM 1142 CA LEU A 71 -5.250 -8.484 1.294 1.00 3.08 C ATOM 1143 C LEU A 71 -4.457 -9.229 2.356 1.00 3.43 C ATOM 1144 O LEU A 71 -3.251 -9.437 2.209 1.00 3.76 O ATOM 1145 CB LEU A 71 -5.238 -9.270 -0.019 1.00 3.24 C ATOM 1146 CG LEU A 71 -5.915 -8.571 -1.202 1.00 2.99 C ATOM 1147 CD1 LEU A 71 -5.842 -9.446 -2.444 1.00 3.26 C ATOM 1148 CD2 LEU A 71 -7.361 -8.233 -0.869 1.00 2.80 C ATOM 0 H LEU A 71 -3.820 -7.131 0.579 1.00 2.78 H new ATOM 0 HA LEU A 71 -6.282 -8.384 1.631 1.00 3.08 H new ATOM 0 HB2 LEU A 71 -4.203 -9.483 -0.287 1.00 3.24 H new ATOM 0 HB3 LEU A 71 -5.729 -10.229 0.145 1.00 3.24 H new ATOM 0 HG LEU A 71 -5.386 -7.640 -1.403 1.00 2.99 H new ATOM 0 HD11 LEU A 71 -6.327 -8.937 -3.277 1.00 3.26 H new ATOM 0 HD12 LEU A 71 -4.798 -9.637 -2.694 1.00 3.26 H new ATOM 0 HD13 LEU A 71 -6.348 -10.392 -2.253 1.00 3.26 H new ATOM 0 HD21 LEU A 71 -7.824 -7.737 -1.722 1.00 2.80 H new ATOM 0 HD22 LEU A 71 -7.906 -9.149 -0.642 1.00 2.80 H new ATOM 0 HD23 LEU A 71 -7.390 -7.570 -0.004 1.00 2.80 H new ATOM 1160 N ARG A 72 -5.132 -9.615 3.431 1.00 3.41 N ATOM 1161 CA ARG A 72 -4.482 -10.341 4.512 1.00 3.74 C ATOM 1162 C ARG A 72 -4.244 -11.790 4.104 1.00 4.09 C ATOM 1163 O ARG A 72 -5.081 -12.671 4.338 1.00 4.24 O ATOM 1164 CB ARG A 72 -5.308 -10.277 5.801 1.00 3.84 C ATOM 1165 CG ARG A 72 -4.676 -11.035 6.962 1.00 4.28 C ATOM 1166 CD ARG A 72 -4.944 -10.353 8.295 1.00 4.13 C ATOM 1167 NE ARG A 72 -3.996 -9.268 8.548 1.00 4.26 N ATOM 1168 CZ ARG A 72 -3.591 -8.898 9.759 1.00 4.47 C ATOM 1169 NH1 ARG A 72 -4.060 -9.517 10.837 1.00 4.60 N ATOM 1170 NH2 ARG A 72 -2.710 -7.914 9.893 1.00 4.92 N ATOM 0 H ARG A 72 -6.126 -9.438 3.577 1.00 3.41 H new ATOM 0 HA ARG A 72 -3.521 -9.866 4.708 1.00 3.74 H new ATOM 0 HB2 ARG A 72 -5.441 -9.234 6.087 1.00 3.84 H new ATOM 0 HB3 ARG A 72 -6.301 -10.684 5.608 1.00 3.84 H new ATOM 0 HG2 ARG A 72 -5.068 -12.052 6.989 1.00 4.28 H new ATOM 0 HG3 ARG A 72 -3.600 -11.112 6.803 1.00 4.28 H new ATOM 0 HD2 ARG A 72 -5.960 -9.958 8.304 1.00 4.13 H new ATOM 0 HD3 ARG A 72 -4.880 -11.087 9.099 1.00 4.13 H new ATOM 0 HE ARG A 72 -3.622 -8.763 7.744 1.00 4.26 H new ATOM 0 HH11 ARG A 72 -4.732 -10.278 10.736 1.00 4.60 H new ATOM 0 HH12 ARG A 72 -3.748 -9.232 11.765 1.00 4.60 H new ATOM 0 HH21 ARG A 72 -2.344 -7.441 9.067 1.00 4.92 H new ATOM 0 HH22 ARG A 72 -2.400 -7.630 10.822 1.00 4.92 H new ATOM 1184 N LEU A 73 -3.109 -12.022 3.467 1.00 4.33 N ATOM 1185 CA LEU A 73 -2.738 -13.353 3.017 1.00 4.80 C ATOM 1186 C LEU A 73 -2.177 -14.159 4.176 1.00 5.06 C ATOM 1187 O LEU A 73 -1.312 -13.680 4.912 1.00 4.96 O ATOM 1188 CB LEU A 73 -1.711 -13.272 1.886 1.00 4.94 C ATOM 1189 CG LEU A 73 -2.148 -12.456 0.669 1.00 5.10 C ATOM 1190 CD1 LEU A 73 -1.035 -12.401 -0.365 1.00 5.51 C ATOM 1191 CD2 LEU A 73 -3.415 -13.038 0.058 1.00 5.51 C ATOM 0 H LEU A 73 -2.423 -11.299 3.248 1.00 4.33 H new ATOM 0 HA LEU A 73 -3.630 -13.851 2.638 1.00 4.80 H new ATOM 0 HB2 LEU A 73 -0.791 -12.841 2.282 1.00 4.94 H new ATOM 0 HB3 LEU A 73 -1.474 -14.284 1.559 1.00 4.94 H new ATOM 0 HG LEU A 73 -2.362 -11.440 0.999 1.00 5.10 H new ATOM 0 HD11 LEU A 73 -1.365 -11.816 -1.224 1.00 5.51 H new ATOM 0 HD12 LEU A 73 -0.153 -11.935 0.074 1.00 5.51 H new ATOM 0 HD13 LEU A 73 -0.788 -13.412 -0.688 1.00 5.51 H new ATOM 0 HD21 LEU A 73 -3.709 -12.443 -0.806 1.00 5.51 H new ATOM 0 HD22 LEU A 73 -3.229 -14.065 -0.255 1.00 5.51 H new ATOM 0 HD23 LEU A 73 -4.216 -13.023 0.798 1.00 5.51 H new ATOM 1203 N ARG A 74 -2.668 -15.380 4.329 1.00 5.50 N ATOM 1204 CA ARG A 74 -2.231 -16.249 5.416 1.00 5.90 C ATOM 1205 C ARG A 74 -0.872 -16.862 5.106 1.00 6.13 C ATOM 1206 O ARG A 74 -0.103 -17.192 6.008 1.00 6.31 O ATOM 1207 CB ARG A 74 -3.269 -17.345 5.669 1.00 6.43 C ATOM 1208 CG ARG A 74 -4.701 -16.828 5.738 1.00 6.71 C ATOM 1209 CD ARG A 74 -4.881 -15.802 6.849 1.00 6.88 C ATOM 1210 NE ARG A 74 -5.691 -14.665 6.412 1.00 7.04 N ATOM 1211 CZ ARG A 74 -6.657 -14.113 7.143 1.00 7.36 C ATOM 1212 NH1 ARG A 74 -6.919 -14.572 8.361 1.00 7.52 N ATOM 1213 NH2 ARG A 74 -7.363 -13.103 6.650 1.00 7.78 N ATOM 0 H ARG A 74 -3.370 -15.793 3.715 1.00 5.50 H new ATOM 0 HA ARG A 74 -2.133 -15.646 6.319 1.00 5.90 H new ATOM 0 HB2 ARG A 74 -3.199 -18.090 4.876 1.00 6.43 H new ATOM 0 HB3 ARG A 74 -3.029 -17.851 6.604 1.00 6.43 H new ATOM 0 HG2 ARG A 74 -4.972 -16.379 4.782 1.00 6.71 H new ATOM 0 HG3 ARG A 74 -5.381 -17.664 5.902 1.00 6.71 H new ATOM 0 HD2 ARG A 74 -5.354 -16.276 7.709 1.00 6.88 H new ATOM 0 HD3 ARG A 74 -3.904 -15.447 7.178 1.00 6.88 H new ATOM 0 HE ARG A 74 -5.504 -14.271 5.490 1.00 7.04 H new ATOM 0 HH11 ARG A 74 -6.379 -15.350 8.740 1.00 7.52 H new ATOM 0 HH12 ARG A 74 -7.660 -14.146 8.918 1.00 7.52 H new ATOM 0 HH21 ARG A 74 -7.165 -12.752 5.713 1.00 7.78 H new ATOM 0 HH22 ARG A 74 -8.104 -12.678 7.208 1.00 7.78 H new ATOM 1227 N GLY A 75 -0.583 -17.012 3.827 1.00 6.32 N ATOM 1228 CA GLY A 75 0.685 -17.565 3.416 1.00 6.65 C ATOM 1229 C GLY A 75 1.525 -16.541 2.684 1.00 6.94 C ATOM 1230 O GLY A 75 1.012 -15.505 2.254 1.00 7.03 O ATOM 0 H GLY A 75 -1.208 -16.759 3.062 1.00 6.32 H new ATOM 0 HA2 GLY A 75 1.227 -17.924 4.291 1.00 6.65 H new ATOM 0 HA3 GLY A 75 0.515 -18.427 2.770 1.00 6.65 H new ATOM 1234 N GLY A 76 2.808 -16.815 2.536 1.00 7.33 N ATOM 1235 CA GLY A 76 3.677 -15.894 1.839 1.00 7.78 C ATOM 1236 C GLY A 76 4.956 -16.555 1.393 1.00 8.66 C ATOM 1237 O GLY A 76 5.968 -15.845 1.222 1.00 9.25 O ATOM 1238 OXT GLY A 76 4.955 -17.790 1.215 1.00 8.95 O ATOM 0 H GLY A 76 3.264 -17.658 2.885 1.00 7.33 H new ATOM 0 HA2 GLY A 76 3.156 -15.489 0.971 1.00 7.78 H new ATOM 0 HA3 GLY A 76 3.912 -15.052 2.491 1.00 7.78 H new TER 1242 GLY A 76 ATOM 1243 N ASP B 2 2.768 6.756 -5.133 1.00 1.27 N ATOM 1244 CA ASP B 2 1.711 6.298 -4.200 1.00 1.16 C ATOM 1245 C ASP B 2 2.218 5.101 -3.411 1.00 0.94 C ATOM 1246 O ASP B 2 1.618 4.021 -3.432 1.00 1.22 O ATOM 1247 CB ASP B 2 0.443 5.936 -4.982 1.00 1.31 C ATOM 1248 CG ASP B 2 -0.755 5.689 -4.088 1.00 1.40 C ATOM 1249 OD1 ASP B 2 -0.833 6.302 -3.005 1.00 1.51 O ATOM 1250 OD2 ASP B 2 -1.638 4.887 -4.474 1.00 1.62 O ATOM 0 HA ASP B 2 1.465 7.100 -3.504 1.00 1.16 H new ATOM 0 HB2 ASP B 2 0.210 6.742 -5.678 1.00 1.31 H new ATOM 0 HB3 ASP B 2 0.633 5.044 -5.579 1.00 1.31 H new ATOM 1255 N LEU B 3 3.334 5.305 -2.716 1.00 0.85 N ATOM 1256 CA LEU B 3 3.963 4.250 -1.939 1.00 0.65 C ATOM 1257 C LEU B 3 3.021 3.693 -0.886 1.00 0.64 C ATOM 1258 O LEU B 3 2.676 4.371 0.083 1.00 0.82 O ATOM 1259 CB LEU B 3 5.246 4.757 -1.283 1.00 0.60 C ATOM 1260 CG LEU B 3 6.086 3.691 -0.576 1.00 0.64 C ATOM 1261 CD1 LEU B 3 6.472 2.572 -1.535 1.00 0.73 C ATOM 1262 CD2 LEU B 3 7.331 4.319 0.018 1.00 0.78 C ATOM 0 H LEU B 3 3.822 6.200 -2.678 1.00 0.85 H new ATOM 0 HA LEU B 3 4.212 3.442 -2.627 1.00 0.65 H new ATOM 0 HB2 LEU B 3 5.861 5.233 -2.047 1.00 0.60 H new ATOM 0 HB3 LEU B 3 4.984 5.528 -0.559 1.00 0.60 H new ATOM 0 HG LEU B 3 5.484 3.260 0.224 1.00 0.64 H new ATOM 0 HD11 LEU B 3 7.068 1.829 -1.006 1.00 0.73 H new ATOM 0 HD12 LEU B 3 5.570 2.102 -1.927 1.00 0.73 H new ATOM 0 HD13 LEU B 3 7.054 2.984 -2.359 1.00 0.73 H new ATOM 0 HD21 LEU B 3 7.922 3.552 0.519 1.00 0.78 H new ATOM 0 HD22 LEU B 3 7.924 4.773 -0.776 1.00 0.78 H new ATOM 0 HD23 LEU B 3 7.044 5.084 0.739 1.00 0.78 H new ATOM 1274 N THR B 4 2.608 2.458 -1.100 1.00 0.71 N ATOM 1275 CA THR B 4 1.717 1.780 -0.187 1.00 0.77 C ATOM 1276 C THR B 4 2.486 0.752 0.639 1.00 0.63 C ATOM 1277 O THR B 4 2.649 -0.399 0.229 1.00 0.63 O ATOM 1278 CB THR B 4 0.572 1.086 -0.951 1.00 0.97 C ATOM 1279 OG1 THR B 4 -0.008 1.993 -1.898 1.00 1.00 O ATOM 1280 CG2 THR B 4 -0.504 0.596 0.005 1.00 1.13 C ATOM 0 H THR B 4 2.881 1.901 -1.910 1.00 0.71 H new ATOM 0 HA THR B 4 1.287 2.526 0.481 1.00 0.77 H new ATOM 0 HB THR B 4 0.990 0.226 -1.475 1.00 0.97 H new ATOM 0 HG1 THR B 4 -0.733 1.543 -2.380 1.00 1.00 H new ATOM 0 HG21 THR B 4 -1.299 0.111 -0.560 1.00 1.13 H new ATOM 0 HG22 THR B 4 -0.070 -0.117 0.706 1.00 1.13 H new ATOM 0 HG23 THR B 4 -0.915 1.443 0.555 1.00 1.13 H new ATOM 1288 N ILE B 5 2.989 1.181 1.785 1.00 0.69 N ATOM 1289 CA ILE B 5 3.728 0.294 2.663 1.00 0.63 C ATOM 1290 C ILE B 5 2.763 -0.390 3.618 1.00 0.75 C ATOM 1291 O ILE B 5 2.058 0.273 4.381 1.00 0.92 O ATOM 1292 CB ILE B 5 4.801 1.039 3.484 1.00 0.72 C ATOM 1293 CG1 ILE B 5 5.473 2.128 2.643 1.00 0.82 C ATOM 1294 CG2 ILE B 5 5.838 0.052 4.002 1.00 0.71 C ATOM 1295 CD1 ILE B 5 6.332 3.079 3.451 1.00 1.12 C ATOM 0 H ILE B 5 2.898 2.138 2.127 1.00 0.69 H new ATOM 0 HA ILE B 5 4.237 -0.436 2.034 1.00 0.63 H new ATOM 0 HB ILE B 5 4.315 1.520 4.333 1.00 0.72 H new ATOM 0 HG12 ILE B 5 6.090 1.655 1.879 1.00 0.82 H new ATOM 0 HG13 ILE B 5 4.704 2.700 2.123 1.00 0.82 H new ATOM 0 HG21 ILE B 5 6.592 0.586 4.580 1.00 0.71 H new ATOM 0 HG22 ILE B 5 5.351 -0.688 4.637 1.00 0.71 H new ATOM 0 HG23 ILE B 5 6.315 -0.450 3.160 1.00 0.71 H new ATOM 0 HD11 ILE B 5 6.775 3.822 2.788 1.00 1.12 H new ATOM 0 HD12 ILE B 5 5.716 3.580 4.198 1.00 1.12 H new ATOM 0 HD13 ILE B 5 7.124 2.520 3.949 1.00 1.12 H new ATOM 1307 N SER B 6 2.709 -1.706 3.554 1.00 0.74 N ATOM 1308 CA SER B 6 1.824 -2.467 4.417 1.00 0.92 C ATOM 1309 C SER B 6 2.597 -3.540 5.173 1.00 0.87 C ATOM 1310 O SER B 6 3.029 -4.540 4.594 1.00 0.86 O ATOM 1311 CB SER B 6 0.705 -3.098 3.585 1.00 1.10 C ATOM 1312 OG SER B 6 0.363 -2.259 2.493 1.00 1.30 O ATOM 0 H SER B 6 3.267 -2.271 2.914 1.00 0.74 H new ATOM 0 HA SER B 6 1.383 -1.791 5.150 1.00 0.92 H new ATOM 0 HB2 SER B 6 1.024 -4.073 3.216 1.00 1.10 H new ATOM 0 HB3 SER B 6 -0.171 -3.265 4.211 1.00 1.10 H new ATOM 0 HG SER B 6 -0.352 -2.678 1.970 1.00 1.30 H new ATOM 1318 N ASN B 7 2.799 -3.311 6.460 1.00 0.90 N ATOM 1319 CA ASN B 7 3.496 -4.265 7.305 1.00 0.91 C ATOM 1320 C ASN B 7 2.473 -5.193 7.932 1.00 0.93 C ATOM 1321 O ASN B 7 2.008 -4.960 9.048 1.00 1.02 O ATOM 1322 CB ASN B 7 4.296 -3.544 8.393 1.00 0.96 C ATOM 1323 CG ASN B 7 5.323 -4.439 9.062 1.00 1.03 C ATOM 1324 OD1 ASN B 7 5.170 -5.659 9.108 1.00 1.04 O ATOM 1325 ND2 ASN B 7 6.376 -3.835 9.592 1.00 1.27 N ATOM 0 H ASN B 7 2.488 -2.468 6.944 1.00 0.90 H new ATOM 0 HA ASN B 7 4.199 -4.839 6.701 1.00 0.91 H new ATOM 0 HB2 ASN B 7 4.802 -2.684 7.955 1.00 0.96 H new ATOM 0 HB3 ASN B 7 3.609 -3.160 9.148 1.00 0.96 H new ATOM 0 HD21 ASN B 7 7.097 -4.384 10.060 1.00 1.27 H new ATOM 0 HD22 ASN B 7 6.466 -2.821 9.532 1.00 1.27 H new ATOM 1332 N GLU B 8 2.112 -6.238 7.200 1.00 0.97 N ATOM 1333 CA GLU B 8 1.119 -7.195 7.667 1.00 1.04 C ATOM 1334 C GLU B 8 1.676 -8.128 8.742 1.00 1.10 C ATOM 1335 O GLU B 8 0.987 -9.033 9.206 1.00 1.17 O ATOM 1336 CB GLU B 8 0.558 -8.001 6.496 1.00 1.18 C ATOM 1337 CG GLU B 8 -0.648 -7.343 5.842 1.00 1.29 C ATOM 1338 CD GLU B 8 -1.848 -7.262 6.772 1.00 1.83 C ATOM 1339 OE1 GLU B 8 -1.808 -6.485 7.751 1.00 2.53 O ATOM 1340 OE2 GLU B 8 -2.837 -7.980 6.534 1.00 2.21 O ATOM 0 H GLU B 8 2.494 -6.445 6.277 1.00 0.97 H new ATOM 0 HA GLU B 8 0.311 -6.623 8.123 1.00 1.04 H new ATOM 0 HB2 GLU B 8 1.340 -8.137 5.749 1.00 1.18 H new ATOM 0 HB3 GLU B 8 0.277 -8.994 6.848 1.00 1.18 H new ATOM 0 HG2 GLU B 8 -0.377 -6.339 5.517 1.00 1.29 H new ATOM 0 HG3 GLU B 8 -0.923 -7.904 4.949 1.00 1.29 H new ATOM 1347 N LEU B 9 2.928 -7.917 9.130 1.00 1.13 N ATOM 1348 CA LEU B 9 3.529 -8.726 10.176 1.00 1.25 C ATOM 1349 C LEU B 9 3.098 -8.182 11.530 1.00 1.32 C ATOM 1350 O LEU B 9 2.927 -8.932 12.491 1.00 1.38 O ATOM 1351 CB LEU B 9 5.054 -8.732 10.058 1.00 1.29 C ATOM 1352 CG LEU B 9 5.613 -9.626 8.947 1.00 1.29 C ATOM 1353 CD1 LEU B 9 7.126 -9.507 8.874 1.00 1.44 C ATOM 1354 CD2 LEU B 9 5.207 -11.076 9.174 1.00 1.46 C ATOM 0 H LEU B 9 3.539 -7.200 8.739 1.00 1.13 H new ATOM 0 HA LEU B 9 3.190 -9.756 10.071 1.00 1.25 H new ATOM 0 HB2 LEU B 9 5.394 -7.711 9.888 1.00 1.29 H new ATOM 0 HB3 LEU B 9 5.476 -9.054 11.010 1.00 1.29 H new ATOM 0 HG LEU B 9 5.194 -9.293 7.997 1.00 1.29 H new ATOM 0 HD11 LEU B 9 7.504 -10.150 8.079 1.00 1.44 H new ATOM 0 HD12 LEU B 9 7.400 -8.473 8.666 1.00 1.44 H new ATOM 0 HD13 LEU B 9 7.561 -9.813 9.825 1.00 1.44 H new ATOM 0 HD21 LEU B 9 5.613 -11.697 8.375 1.00 1.46 H new ATOM 0 HD22 LEU B 9 5.597 -11.417 10.133 1.00 1.46 H new ATOM 0 HD23 LEU B 9 4.120 -11.153 9.177 1.00 1.46 H new ATOM 1366 N THR B 10 2.912 -6.870 11.588 1.00 1.41 N ATOM 1367 CA THR B 10 2.474 -6.210 12.805 1.00 1.53 C ATOM 1368 C THR B 10 1.097 -5.580 12.602 1.00 1.49 C ATOM 1369 O THR B 10 0.482 -5.080 13.542 1.00 1.67 O ATOM 1370 CB THR B 10 3.483 -5.127 13.234 1.00 1.63 C ATOM 1371 OG1 THR B 10 4.135 -4.589 12.075 1.00 1.65 O ATOM 1372 CG2 THR B 10 4.523 -5.694 14.186 1.00 1.95 C ATOM 0 H THR B 10 3.060 -6.240 10.799 1.00 1.41 H new ATOM 0 HA THR B 10 2.411 -6.961 13.592 1.00 1.53 H new ATOM 0 HB THR B 10 2.938 -4.338 13.752 1.00 1.63 H new ATOM 0 HG1 THR B 10 4.399 -3.661 12.249 1.00 1.65 H new ATOM 0 HG21 THR B 10 5.222 -4.908 14.472 1.00 1.95 H new ATOM 0 HG22 THR B 10 4.028 -6.081 15.077 1.00 1.95 H new ATOM 0 HG23 THR B 10 5.066 -6.500 13.693 1.00 1.95 H new ATOM 1380 N GLY B 11 0.614 -5.622 11.361 1.00 1.29 N ATOM 1381 CA GLY B 11 -0.679 -5.049 11.039 1.00 1.26 C ATOM 1382 C GLY B 11 -0.645 -3.534 11.022 1.00 1.28 C ATOM 1383 O GLY B 11 -1.645 -2.878 11.323 1.00 1.46 O ATOM 0 H GLY B 11 1.100 -6.046 10.571 1.00 1.29 H new ATOM 0 HA2 GLY B 11 -1.004 -5.414 10.065 1.00 1.26 H new ATOM 0 HA3 GLY B 11 -1.416 -5.386 11.768 1.00 1.26 H new ATOM 1387 N GLU B 12 0.502 -2.982 10.651 1.00 1.20 N ATOM 1388 CA GLU B 12 0.681 -1.537 10.609 1.00 1.25 C ATOM 1389 C GLU B 12 0.718 -1.030 9.173 1.00 1.09 C ATOM 1390 O GLU B 12 1.570 -1.437 8.382 1.00 0.92 O ATOM 1391 CB GLU B 12 1.973 -1.142 11.326 1.00 1.42 C ATOM 1392 CG GLU B 12 2.103 -1.743 12.712 1.00 1.45 C ATOM 1393 CD GLU B 12 3.511 -1.666 13.252 1.00 2.11 C ATOM 1394 OE1 GLU B 12 4.467 -1.766 12.453 1.00 2.73 O ATOM 1395 OE2 GLU B 12 3.673 -1.511 14.478 1.00 2.60 O ATOM 0 H GLU B 12 1.326 -3.516 10.374 1.00 1.20 H new ATOM 0 HA GLU B 12 -0.169 -1.080 11.116 1.00 1.25 H new ATOM 0 HB2 GLU B 12 2.825 -1.454 10.722 1.00 1.42 H new ATOM 0 HB3 GLU B 12 2.019 -0.056 11.404 1.00 1.42 H new ATOM 0 HG2 GLU B 12 1.428 -1.224 13.393 1.00 1.45 H new ATOM 0 HG3 GLU B 12 1.786 -2.786 12.682 1.00 1.45 H new ATOM 1402 N ILE B 13 -0.213 -0.153 8.840 1.00 1.25 N ATOM 1403 CA ILE B 13 -0.270 0.421 7.508 1.00 1.18 C ATOM 1404 C ILE B 13 0.240 1.851 7.571 1.00 1.19 C ATOM 1405 O ILE B 13 -0.077 2.589 8.507 1.00 1.35 O ATOM 1406 CB ILE B 13 -1.698 0.399 6.918 1.00 1.40 C ATOM 1407 CG1 ILE B 13 -2.402 -0.931 7.237 1.00 1.47 C ATOM 1408 CG2 ILE B 13 -1.645 0.633 5.410 1.00 1.48 C ATOM 1409 CD1 ILE B 13 -1.729 -2.148 6.635 1.00 1.39 C ATOM 0 H ILE B 13 -0.940 0.177 9.475 1.00 1.25 H new ATOM 0 HA ILE B 13 0.355 -0.184 6.851 1.00 1.18 H new ATOM 0 HB ILE B 13 -2.275 1.202 7.377 1.00 1.40 H new ATOM 0 HG12 ILE B 13 -2.450 -1.054 8.319 1.00 1.47 H new ATOM 0 HG13 ILE B 13 -3.429 -0.882 6.876 1.00 1.47 H new ATOM 0 HG21 ILE B 13 -2.656 0.616 5.003 1.00 1.48 H new ATOM 0 HG22 ILE B 13 -1.189 1.602 5.208 1.00 1.48 H new ATOM 0 HG23 ILE B 13 -1.052 -0.152 4.941 1.00 1.48 H new ATOM 0 HD11 ILE B 13 -2.287 -3.044 6.907 1.00 1.39 H new ATOM 0 HD12 ILE B 13 -1.705 -2.051 5.550 1.00 1.39 H new ATOM 0 HD13 ILE B 13 -0.710 -2.226 7.015 1.00 1.39 H new ATOM 1421 N TYR B 14 1.032 2.239 6.588 1.00 1.08 N ATOM 1422 CA TYR B 14 1.616 3.568 6.568 1.00 1.15 C ATOM 1423 C TYR B 14 0.932 4.452 5.538 1.00 1.19 C ATOM 1424 O TYR B 14 0.121 3.980 4.737 1.00 1.20 O ATOM 1425 CB TYR B 14 3.116 3.466 6.287 1.00 1.09 C ATOM 1426 CG TYR B 14 3.808 2.417 7.138 1.00 1.10 C ATOM 1427 CD1 TYR B 14 3.746 1.071 6.799 1.00 1.04 C ATOM 1428 CD2 TYR B 14 4.506 2.769 8.286 1.00 1.30 C ATOM 1429 CE1 TYR B 14 4.356 0.111 7.574 1.00 1.10 C ATOM 1430 CE2 TYR B 14 5.123 1.809 9.066 1.00 1.33 C ATOM 1431 CZ TYR B 14 5.042 0.483 8.704 1.00 1.20 C ATOM 1432 OH TYR B 14 5.656 -0.479 9.467 1.00 1.27 O ATOM 0 H TYR B 14 1.286 1.653 5.793 1.00 1.08 H new ATOM 0 HA TYR B 14 1.468 4.029 7.544 1.00 1.15 H new ATOM 0 HB2 TYR B 14 3.268 3.230 5.234 1.00 1.09 H new ATOM 0 HB3 TYR B 14 3.581 4.436 6.466 1.00 1.09 H new ATOM 0 HD1 TYR B 14 3.209 0.772 5.911 1.00 1.04 H new ATOM 0 HD2 TYR B 14 4.568 3.808 8.574 1.00 1.30 H new ATOM 0 HE1 TYR B 14 4.295 -0.930 7.295 1.00 1.10 H new ATOM 0 HE2 TYR B 14 5.665 2.097 9.954 1.00 1.33 H new ATOM 0 HH TYR B 14 6.460 -0.798 9.006 1.00 1.27 H new ATOM 1442 N GLY B 15 1.261 5.735 5.564 1.00 1.27 N ATOM 1443 CA GLY B 15 0.668 6.676 4.638 1.00 1.35 C ATOM 1444 C GLY B 15 1.298 6.607 3.262 1.00 1.22 C ATOM 1445 O GLY B 15 2.399 6.078 3.111 1.00 1.25 O ATOM 0 H GLY B 15 1.933 6.143 6.215 1.00 1.27 H new ATOM 0 HA2 GLY B 15 -0.400 6.477 4.556 1.00 1.35 H new ATOM 0 HA3 GLY B 15 0.774 7.686 5.033 1.00 1.35 H new ATOM 1449 N PRO B 16 0.612 7.137 2.236 1.00 1.22 N ATOM 1450 CA PRO B 16 1.116 7.133 0.860 1.00 1.19 C ATOM 1451 C PRO B 16 2.249 8.138 0.667 1.00 1.20 C ATOM 1452 O PRO B 16 2.039 9.352 0.738 1.00 1.51 O ATOM 1453 CB PRO B 16 -0.109 7.529 0.035 1.00 1.38 C ATOM 1454 CG PRO B 16 -0.979 8.309 0.960 1.00 1.53 C ATOM 1455 CD PRO B 16 -0.709 7.786 2.346 1.00 1.43 C ATOM 0 HA PRO B 16 1.538 6.170 0.574 1.00 1.19 H new ATOM 0 HB2 PRO B 16 0.178 8.126 -0.831 1.00 1.38 H new ATOM 0 HB3 PRO B 16 -0.629 6.648 -0.343 1.00 1.38 H new ATOM 0 HG2 PRO B 16 -0.755 9.374 0.897 1.00 1.53 H new ATOM 0 HG3 PRO B 16 -2.030 8.188 0.698 1.00 1.53 H new ATOM 0 HD2 PRO B 16 -0.697 8.591 3.080 1.00 1.43 H new ATOM 0 HD3 PRO B 16 -1.476 7.078 2.661 1.00 1.43 H new ATOM 1463 N ILE B 17 3.450 7.632 0.435 1.00 0.97 N ATOM 1464 CA ILE B 17 4.612 8.490 0.238 1.00 1.05 C ATOM 1465 C ILE B 17 4.817 8.766 -1.248 1.00 1.06 C ATOM 1466 O ILE B 17 4.552 7.898 -2.089 1.00 1.06 O ATOM 1467 CB ILE B 17 5.892 7.856 0.832 1.00 1.04 C ATOM 1468 CG1 ILE B 17 5.648 7.432 2.286 1.00 1.14 C ATOM 1469 CG2 ILE B 17 7.068 8.821 0.742 1.00 1.28 C ATOM 1470 CD1 ILE B 17 6.877 6.877 2.977 1.00 1.32 C ATOM 0 H ILE B 17 3.647 6.633 0.378 1.00 0.97 H new ATOM 0 HA ILE B 17 4.423 9.428 0.760 1.00 1.05 H new ATOM 0 HB ILE B 17 6.140 6.970 0.248 1.00 1.04 H new ATOM 0 HG12 ILE B 17 5.284 8.291 2.849 1.00 1.14 H new ATOM 0 HG13 ILE B 17 4.860 6.679 2.308 1.00 1.14 H new ATOM 0 HG21 ILE B 17 7.956 8.353 1.166 1.00 1.28 H new ATOM 0 HG22 ILE B 17 7.254 9.072 -0.302 1.00 1.28 H new ATOM 0 HG23 ILE B 17 6.837 9.730 1.298 1.00 1.28 H new ATOM 0 HD11 ILE B 17 6.625 6.600 4.001 1.00 1.32 H new ATOM 0 HD12 ILE B 17 7.231 5.997 2.439 1.00 1.32 H new ATOM 0 HD13 ILE B 17 7.661 7.634 2.989 1.00 1.32 H new ATOM 1482 N GLU B 18 5.261 9.972 -1.570 1.00 1.17 N ATOM 1483 CA GLU B 18 5.498 10.352 -2.951 1.00 1.24 C ATOM 1484 C GLU B 18 6.921 9.984 -3.352 1.00 1.25 C ATOM 1485 O GLU B 18 7.887 10.434 -2.733 1.00 1.35 O ATOM 1486 CB GLU B 18 5.259 11.849 -3.147 1.00 1.42 C ATOM 1487 CG GLU B 18 4.996 12.234 -4.594 1.00 1.57 C ATOM 1488 CD GLU B 18 3.840 11.461 -5.196 1.00 2.25 C ATOM 1489 OE1 GLU B 18 4.061 10.329 -5.679 1.00 2.58 O ATOM 1490 OE2 GLU B 18 2.703 11.976 -5.187 1.00 3.01 O ATOM 0 H GLU B 18 5.464 10.705 -0.890 1.00 1.17 H new ATOM 0 HA GLU B 18 4.799 9.810 -3.588 1.00 1.24 H new ATOM 0 HB2 GLU B 18 4.410 12.157 -2.537 1.00 1.42 H new ATOM 0 HB3 GLU B 18 6.128 12.399 -2.785 1.00 1.42 H new ATOM 0 HG2 GLU B 18 4.784 13.302 -4.650 1.00 1.57 H new ATOM 0 HG3 GLU B 18 5.895 12.056 -5.184 1.00 1.57 H new ATOM 1497 N VAL B 19 7.043 9.157 -4.377 1.00 1.20 N ATOM 1498 CA VAL B 19 8.345 8.715 -4.854 1.00 1.20 C ATOM 1499 C VAL B 19 8.681 9.341 -6.201 1.00 1.25 C ATOM 1500 O VAL B 19 7.798 9.828 -6.913 1.00 1.32 O ATOM 1501 CB VAL B 19 8.409 7.178 -4.981 1.00 1.16 C ATOM 1502 CG1 VAL B 19 8.374 6.517 -3.611 1.00 1.13 C ATOM 1503 CG2 VAL B 19 7.276 6.669 -5.858 1.00 1.14 C ATOM 0 H VAL B 19 6.253 8.776 -4.898 1.00 1.20 H new ATOM 0 HA VAL B 19 9.077 9.040 -4.115 1.00 1.20 H new ATOM 0 HB VAL B 19 9.354 6.913 -5.455 1.00 1.16 H new ATOM 0 HG11 VAL B 19 8.420 5.434 -3.728 1.00 1.13 H new ATOM 0 HG12 VAL B 19 9.227 6.855 -3.022 1.00 1.13 H new ATOM 0 HG13 VAL B 19 7.450 6.787 -3.100 1.00 1.13 H new ATOM 0 HG21 VAL B 19 7.336 5.584 -5.937 1.00 1.14 H new ATOM 0 HG22 VAL B 19 6.320 6.948 -5.415 1.00 1.14 H new ATOM 0 HG23 VAL B 19 7.359 7.110 -6.851 1.00 1.14 H new ATOM 1513 N SER B 20 9.958 9.320 -6.542 1.00 1.27 N ATOM 1514 CA SER B 20 10.432 9.876 -7.794 1.00 1.32 C ATOM 1515 C SER B 20 11.419 8.920 -8.444 1.00 1.27 C ATOM 1516 O SER B 20 11.997 8.062 -7.772 1.00 1.21 O ATOM 1517 CB SER B 20 11.085 11.238 -7.536 1.00 1.41 C ATOM 1518 OG SER B 20 11.538 11.842 -8.738 1.00 1.53 O ATOM 0 H SER B 20 10.692 8.918 -5.959 1.00 1.27 H new ATOM 0 HA SER B 20 9.591 10.015 -8.473 1.00 1.32 H new ATOM 0 HB2 SER B 20 10.369 11.897 -7.045 1.00 1.41 H new ATOM 0 HB3 SER B 20 11.925 11.115 -6.852 1.00 1.41 H new ATOM 0 HG SER B 20 11.947 12.709 -8.535 1.00 1.53 H new ATOM 1524 N GLU B 21 11.610 9.067 -9.749 1.00 1.33 N ATOM 1525 CA GLU B 21 12.526 8.215 -10.490 1.00 1.34 C ATOM 1526 C GLU B 21 13.976 8.561 -10.156 1.00 1.38 C ATOM 1527 O GLU B 21 14.859 7.704 -10.209 1.00 1.42 O ATOM 1528 CB GLU B 21 12.281 8.354 -11.999 1.00 1.43 C ATOM 1529 CG GLU B 21 12.349 9.790 -12.502 1.00 1.51 C ATOM 1530 CD GLU B 21 12.491 9.875 -14.005 1.00 1.66 C ATOM 1531 OE1 GLU B 21 13.515 9.399 -14.536 1.00 1.79 O ATOM 1532 OE2 GLU B 21 11.586 10.419 -14.666 1.00 1.79 O ATOM 0 H GLU B 21 11.140 9.772 -10.316 1.00 1.33 H new ATOM 0 HA GLU B 21 12.343 7.181 -10.198 1.00 1.34 H new ATOM 0 HB2 GLU B 21 13.019 7.756 -12.534 1.00 1.43 H new ATOM 0 HB3 GLU B 21 11.301 7.941 -12.238 1.00 1.43 H new ATOM 0 HG2 GLU B 21 11.448 10.321 -12.196 1.00 1.51 H new ATOM 0 HG3 GLU B 21 13.192 10.296 -12.032 1.00 1.51 H new ATOM 1539 N ASP B 22 14.207 9.822 -9.797 1.00 1.41 N ATOM 1540 CA ASP B 22 15.547 10.298 -9.455 1.00 1.48 C ATOM 1541 C ASP B 22 15.885 9.956 -8.008 1.00 1.44 C ATOM 1542 O ASP B 22 16.995 10.208 -7.536 1.00 1.50 O ATOM 1543 CB ASP B 22 15.651 11.815 -9.657 1.00 1.58 C ATOM 1544 CG ASP B 22 15.125 12.281 -11.003 1.00 1.99 C ATOM 1545 OD1 ASP B 22 13.914 12.574 -11.103 1.00 2.33 O ATOM 1546 OD2 ASP B 22 15.924 12.370 -11.964 1.00 2.28 O ATOM 0 H ASP B 22 13.481 10.536 -9.735 1.00 1.41 H new ATOM 0 HA ASP B 22 16.257 9.801 -10.116 1.00 1.48 H new ATOM 0 HB2 ASP B 22 15.097 12.318 -8.865 1.00 1.58 H new ATOM 0 HB3 ASP B 22 16.694 12.117 -9.558 1.00 1.58 H new ATOM 1551 N MET B 23 14.914 9.397 -7.301 1.00 1.35 N ATOM 1552 CA MET B 23 15.105 9.015 -5.909 1.00 1.32 C ATOM 1553 C MET B 23 15.864 7.698 -5.829 1.00 1.27 C ATOM 1554 O MET B 23 15.494 6.713 -6.473 1.00 1.20 O ATOM 1555 CB MET B 23 13.751 8.904 -5.199 1.00 1.24 C ATOM 1556 CG MET B 23 13.852 8.641 -3.705 1.00 1.24 C ATOM 1557 SD MET B 23 12.257 8.793 -2.870 1.00 1.22 S ATOM 1558 CE MET B 23 12.711 8.346 -1.195 1.00 1.32 C ATOM 0 H MET B 23 13.984 9.197 -7.669 1.00 1.35 H new ATOM 0 HA MET B 23 15.693 9.784 -5.408 1.00 1.32 H new ATOM 0 HB2 MET B 23 13.193 9.827 -5.357 1.00 1.24 H new ATOM 0 HB3 MET B 23 13.176 8.101 -5.660 1.00 1.24 H new ATOM 0 HG2 MET B 23 14.251 7.640 -3.541 1.00 1.24 H new ATOM 0 HG3 MET B 23 14.559 9.342 -3.262 1.00 1.24 H new ATOM 0 HE1 MET B 23 11.813 8.098 -0.629 1.00 1.32 H new ATOM 0 HE2 MET B 23 13.377 7.483 -1.216 1.00 1.32 H new ATOM 0 HE3 MET B 23 13.220 9.185 -0.720 1.00 1.32 H new ATOM 1568 N ALA B 24 16.936 7.694 -5.052 1.00 1.33 N ATOM 1569 CA ALA B 24 17.757 6.504 -4.891 1.00 1.30 C ATOM 1570 C ALA B 24 16.987 5.393 -4.197 1.00 1.16 C ATOM 1571 O ALA B 24 16.152 5.651 -3.326 1.00 1.17 O ATOM 1572 CB ALA B 24 19.013 6.826 -4.105 1.00 1.40 C ATOM 0 H ALA B 24 17.258 8.504 -4.522 1.00 1.33 H new ATOM 0 HA ALA B 24 18.037 6.159 -5.887 1.00 1.30 H new ATOM 0 HB1 ALA B 24 19.615 5.924 -3.995 1.00 1.40 H new ATOM 0 HB2 ALA B 24 19.590 7.584 -4.635 1.00 1.40 H new ATOM 0 HB3 ALA B 24 18.739 7.202 -3.119 1.00 1.40 H new ATOM 1578 N LEU B 25 17.290 4.157 -4.572 1.00 1.07 N ATOM 1579 CA LEU B 25 16.637 2.998 -3.982 1.00 0.95 C ATOM 1580 C LEU B 25 16.990 2.908 -2.506 1.00 0.93 C ATOM 1581 O LEU B 25 16.125 2.687 -1.662 1.00 0.88 O ATOM 1582 CB LEU B 25 17.064 1.711 -4.707 1.00 0.92 C ATOM 1583 CG LEU B 25 16.679 0.399 -4.007 1.00 1.05 C ATOM 1584 CD1 LEU B 25 15.176 0.177 -4.053 1.00 1.26 C ATOM 1585 CD2 LEU B 25 17.407 -0.776 -4.641 1.00 1.38 C ATOM 0 H LEU B 25 17.985 3.932 -5.284 1.00 1.07 H new ATOM 0 HA LEU B 25 15.558 3.110 -4.088 1.00 0.95 H new ATOM 0 HB2 LEU B 25 16.624 1.713 -5.704 1.00 0.92 H new ATOM 0 HB3 LEU B 25 18.146 1.730 -4.836 1.00 0.92 H new ATOM 0 HG LEU B 25 16.979 0.474 -2.962 1.00 1.05 H new ATOM 0 HD11 LEU B 25 14.931 -0.759 -3.550 1.00 1.26 H new ATOM 0 HD12 LEU B 25 14.671 1.002 -3.551 1.00 1.26 H new ATOM 0 HD13 LEU B 25 14.847 0.128 -5.091 1.00 1.26 H new ATOM 0 HD21 LEU B 25 17.123 -1.697 -4.133 1.00 1.38 H new ATOM 0 HD22 LEU B 25 17.138 -0.845 -5.695 1.00 1.38 H new ATOM 0 HD23 LEU B 25 18.483 -0.629 -4.550 1.00 1.38 H new ATOM 1597 N THR B 26 18.265 3.119 -2.206 1.00 1.01 N ATOM 1598 CA THR B 26 18.765 3.059 -0.842 1.00 1.04 C ATOM 1599 C THR B 26 18.129 4.129 0.040 1.00 1.09 C ATOM 1600 O THR B 26 17.955 3.922 1.239 1.00 1.10 O ATOM 1601 CB THR B 26 20.290 3.213 -0.832 1.00 1.14 C ATOM 1602 OG1 THR B 26 20.760 3.333 -2.181 1.00 1.26 O ATOM 1603 CG2 THR B 26 20.948 2.016 -0.165 1.00 1.22 C ATOM 0 H THR B 26 18.979 3.336 -2.901 1.00 1.01 H new ATOM 0 HA THR B 26 18.495 2.085 -0.434 1.00 1.04 H new ATOM 0 HB THR B 26 20.550 4.107 -0.266 1.00 1.14 H new ATOM 0 HG1 THR B 26 21.735 3.433 -2.180 1.00 1.26 H new ATOM 0 HG21 THR B 26 22.030 2.147 -0.169 1.00 1.22 H new ATOM 0 HG22 THR B 26 20.596 1.934 0.863 1.00 1.22 H new ATOM 0 HG23 THR B 26 20.690 1.108 -0.710 1.00 1.22 H new ATOM 1611 N ASP B 27 17.776 5.265 -0.557 1.00 1.15 N ATOM 1612 CA ASP B 27 17.137 6.349 0.191 1.00 1.23 C ATOM 1613 C ASP B 27 15.761 5.891 0.662 1.00 1.13 C ATOM 1614 O ASP B 27 15.373 6.110 1.810 1.00 1.17 O ATOM 1615 CB ASP B 27 17.012 7.615 -0.665 1.00 1.34 C ATOM 1616 CG ASP B 27 16.550 8.819 0.142 1.00 1.47 C ATOM 1617 OD1 ASP B 27 15.333 8.978 0.350 1.00 1.48 O ATOM 1618 OD2 ASP B 27 17.410 9.614 0.575 1.00 1.65 O ATOM 0 H ASP B 27 17.919 5.460 -1.548 1.00 1.15 H new ATOM 0 HA ASP B 27 17.758 6.593 1.053 1.00 1.23 H new ATOM 0 HB2 ASP B 27 17.976 7.837 -1.123 1.00 1.34 H new ATOM 0 HB3 ASP B 27 16.307 7.433 -1.477 1.00 1.34 H new ATOM 1623 N LEU B 28 15.046 5.223 -0.236 1.00 1.02 N ATOM 1624 CA LEU B 28 13.724 4.695 0.073 1.00 0.92 C ATOM 1625 C LEU B 28 13.858 3.576 1.100 1.00 0.88 C ATOM 1626 O LEU B 28 13.082 3.490 2.054 1.00 0.88 O ATOM 1627 CB LEU B 28 13.047 4.183 -1.209 1.00 0.85 C ATOM 1628 CG LEU B 28 11.516 4.040 -1.150 1.00 0.79 C ATOM 1629 CD1 LEU B 28 11.115 2.691 -0.565 1.00 0.90 C ATOM 1630 CD2 LEU B 28 10.897 5.173 -0.338 1.00 1.00 C ATOM 0 H LEU B 28 15.362 5.034 -1.187 1.00 1.02 H new ATOM 0 HA LEU B 28 13.101 5.486 0.491 1.00 0.92 H new ATOM 0 HB2 LEU B 28 13.298 4.861 -2.025 1.00 0.85 H new ATOM 0 HB3 LEU B 28 13.474 3.212 -1.459 1.00 0.85 H new ATOM 0 HG LEU B 28 11.137 4.097 -2.170 1.00 0.79 H new ATOM 0 HD11 LEU B 28 10.028 2.616 -0.535 1.00 0.90 H new ATOM 0 HD12 LEU B 28 11.517 1.891 -1.187 1.00 0.90 H new ATOM 0 HD13 LEU B 28 11.513 2.600 0.446 1.00 0.90 H new ATOM 0 HD21 LEU B 28 9.814 5.051 -0.310 1.00 1.00 H new ATOM 0 HD22 LEU B 28 11.291 5.150 0.678 1.00 1.00 H new ATOM 0 HD23 LEU B 28 11.143 6.129 -0.801 1.00 1.00 H new ATOM 1642 N ILE B 29 14.865 2.730 0.900 1.00 0.87 N ATOM 1643 CA ILE B 29 15.141 1.622 1.808 1.00 0.85 C ATOM 1644 C ILE B 29 15.456 2.155 3.204 1.00 0.95 C ATOM 1645 O ILE B 29 15.072 1.556 4.206 1.00 0.94 O ATOM 1646 CB ILE B 29 16.316 0.755 1.302 1.00 0.87 C ATOM 1647 CG1 ILE B 29 15.968 0.099 -0.038 1.00 0.79 C ATOM 1648 CG2 ILE B 29 16.699 -0.308 2.326 1.00 0.91 C ATOM 1649 CD1 ILE B 29 14.832 -0.905 0.039 1.00 0.71 C ATOM 0 H ILE B 29 15.508 2.792 0.110 1.00 0.87 H new ATOM 0 HA ILE B 29 14.250 0.995 1.849 1.00 0.85 H new ATOM 0 HB ILE B 29 17.173 1.412 1.157 1.00 0.87 H new ATOM 0 HG12 ILE B 29 15.702 0.878 -0.753 1.00 0.79 H new ATOM 0 HG13 ILE B 29 16.855 -0.401 -0.426 1.00 0.79 H new ATOM 0 HG21 ILE B 29 17.528 -0.902 1.941 1.00 0.91 H new ATOM 0 HG22 ILE B 29 16.999 0.174 3.256 1.00 0.91 H new ATOM 0 HG23 ILE B 29 15.844 -0.958 2.513 1.00 0.91 H new ATOM 0 HD11 ILE B 29 14.648 -1.323 -0.951 1.00 0.71 H new ATOM 0 HD12 ILE B 29 15.101 -1.706 0.727 1.00 0.71 H new ATOM 0 HD13 ILE B 29 13.930 -0.407 0.396 1.00 0.71 H new ATOM 1661 N ALA B 30 16.152 3.288 3.257 1.00 1.07 N ATOM 1662 CA ALA B 30 16.498 3.919 4.526 1.00 1.19 C ATOM 1663 C ALA B 30 15.230 4.294 5.286 1.00 1.19 C ATOM 1664 O ALA B 30 15.085 3.974 6.465 1.00 1.24 O ATOM 1665 CB ALA B 30 17.362 5.150 4.293 1.00 1.31 C ATOM 0 H ALA B 30 16.488 3.788 2.434 1.00 1.07 H new ATOM 0 HA ALA B 30 17.069 3.209 5.124 1.00 1.19 H new ATOM 0 HB1 ALA B 30 17.610 5.607 5.251 1.00 1.31 H new ATOM 0 HB2 ALA B 30 18.279 4.859 3.781 1.00 1.31 H new ATOM 0 HB3 ALA B 30 16.816 5.867 3.679 1.00 1.31 H new ATOM 1671 N LEU B 31 14.303 4.951 4.594 1.00 1.17 N ATOM 1672 CA LEU B 31 13.036 5.350 5.196 1.00 1.19 C ATOM 1673 C LEU B 31 12.263 4.116 5.641 1.00 1.10 C ATOM 1674 O LEU B 31 11.629 4.105 6.695 1.00 1.15 O ATOM 1675 CB LEU B 31 12.191 6.152 4.204 1.00 1.17 C ATOM 1676 CG LEU B 31 12.804 7.473 3.730 1.00 1.29 C ATOM 1677 CD1 LEU B 31 11.897 8.136 2.702 1.00 1.26 C ATOM 1678 CD2 LEU B 31 13.048 8.407 4.911 1.00 1.46 C ATOM 0 H LEU B 31 14.407 5.218 3.615 1.00 1.17 H new ATOM 0 HA LEU B 31 13.251 5.979 6.060 1.00 1.19 H new ATOM 0 HB2 LEU B 31 11.997 5.528 3.331 1.00 1.17 H new ATOM 0 HB3 LEU B 31 11.226 6.364 4.664 1.00 1.17 H new ATOM 0 HG LEU B 31 13.764 7.260 3.260 1.00 1.29 H new ATOM 0 HD11 LEU B 31 12.344 9.074 2.373 1.00 1.26 H new ATOM 0 HD12 LEU B 31 11.773 7.473 1.845 1.00 1.26 H new ATOM 0 HD13 LEU B 31 10.924 8.336 3.150 1.00 1.26 H new ATOM 0 HD21 LEU B 31 13.484 9.340 4.553 1.00 1.46 H new ATOM 0 HD22 LEU B 31 12.102 8.616 5.411 1.00 1.46 H new ATOM 0 HD23 LEU B 31 13.733 7.933 5.614 1.00 1.46 H new ATOM 1690 N LEU B 32 12.348 3.076 4.828 1.00 0.99 N ATOM 1691 CA LEU B 32 11.677 1.813 5.096 1.00 0.91 C ATOM 1692 C LEU B 32 12.234 1.156 6.357 1.00 0.96 C ATOM 1693 O LEU B 32 11.486 0.636 7.182 1.00 0.98 O ATOM 1694 CB LEU B 32 11.861 0.876 3.903 1.00 0.79 C ATOM 1695 CG LEU B 32 10.686 -0.053 3.603 1.00 0.71 C ATOM 1696 CD1 LEU B 32 9.534 0.729 2.995 1.00 1.01 C ATOM 1697 CD2 LEU B 32 11.127 -1.170 2.672 1.00 0.60 C ATOM 0 H LEU B 32 12.885 3.083 3.961 1.00 0.99 H new ATOM 0 HA LEU B 32 10.616 2.010 5.252 1.00 0.91 H new ATOM 0 HB2 LEU B 32 12.058 1.480 3.017 1.00 0.79 H new ATOM 0 HB3 LEU B 32 12.747 0.266 4.077 1.00 0.79 H new ATOM 0 HG LEU B 32 10.341 -0.497 4.537 1.00 0.71 H new ATOM 0 HD11 LEU B 32 8.705 0.053 2.787 1.00 1.01 H new ATOM 0 HD12 LEU B 32 9.208 1.499 3.694 1.00 1.01 H new ATOM 0 HD13 LEU B 32 9.862 1.197 2.067 1.00 1.01 H new ATOM 0 HD21 LEU B 32 10.282 -1.826 2.465 1.00 0.60 H new ATOM 0 HD22 LEU B 32 11.492 -0.742 1.738 1.00 0.60 H new ATOM 0 HD23 LEU B 32 11.924 -1.744 3.144 1.00 0.60 H new ATOM 1709 N GLN B 33 13.549 1.194 6.510 1.00 1.01 N ATOM 1710 CA GLN B 33 14.200 0.590 7.665 1.00 1.09 C ATOM 1711 C GLN B 33 14.017 1.438 8.923 1.00 1.21 C ATOM 1712 O GLN B 33 14.136 0.939 10.042 1.00 1.28 O ATOM 1713 CB GLN B 33 15.689 0.383 7.390 1.00 1.12 C ATOM 1714 CG GLN B 33 15.963 -0.618 6.283 1.00 1.03 C ATOM 1715 CD GLN B 33 17.416 -1.034 6.215 1.00 1.17 C ATOM 1716 OE1 GLN B 33 17.828 -2.009 6.852 1.00 1.25 O ATOM 1717 NE2 GLN B 33 18.203 -0.304 5.439 1.00 1.42 N ATOM 0 H GLN B 33 14.187 1.637 5.849 1.00 1.01 H new ATOM 0 HA GLN B 33 13.727 -0.377 7.838 1.00 1.09 H new ATOM 0 HB2 GLN B 33 16.138 1.340 7.124 1.00 1.12 H new ATOM 0 HB3 GLN B 33 16.176 0.045 8.304 1.00 1.12 H new ATOM 0 HG2 GLN B 33 15.344 -1.502 6.437 1.00 1.03 H new ATOM 0 HG3 GLN B 33 15.669 -0.185 5.327 1.00 1.03 H new ATOM 0 HE21 GLN B 33 17.821 0.493 4.931 1.00 1.42 H new ATOM 0 HE22 GLN B 33 19.192 -0.539 5.350 1.00 1.42 H new ATOM 1726 N ALA B 34 13.721 2.716 8.735 1.00 1.28 N ATOM 1727 CA ALA B 34 13.540 3.632 9.858 1.00 1.40 C ATOM 1728 C ALA B 34 12.083 3.705 10.312 1.00 1.40 C ATOM 1729 O ALA B 34 11.752 3.331 11.438 1.00 1.47 O ATOM 1730 CB ALA B 34 14.042 5.021 9.480 1.00 1.47 C ATOM 0 H ALA B 34 13.601 3.144 7.817 1.00 1.28 H new ATOM 0 HA ALA B 34 14.122 3.246 10.695 1.00 1.40 H new ATOM 0 HB1 ALA B 34 13.904 5.699 10.322 1.00 1.47 H new ATOM 0 HB2 ALA B 34 15.101 4.969 9.226 1.00 1.47 H new ATOM 0 HB3 ALA B 34 13.481 5.390 8.621 1.00 1.47 H new ATOM 1736 N ASP B 35 11.224 4.183 9.425 1.00 1.34 N ATOM 1737 CA ASP B 35 9.804 4.346 9.726 1.00 1.35 C ATOM 1738 C ASP B 35 9.085 3.007 9.842 1.00 1.29 C ATOM 1739 O ASP B 35 8.495 2.696 10.880 1.00 1.36 O ATOM 1740 CB ASP B 35 9.135 5.196 8.645 1.00 1.32 C ATOM 1741 CG ASP B 35 7.830 5.809 9.110 1.00 1.36 C ATOM 1742 OD1 ASP B 35 6.784 5.132 9.040 1.00 1.42 O ATOM 1743 OD2 ASP B 35 7.848 6.981 9.545 1.00 1.56 O ATOM 0 H ASP B 35 11.486 4.468 8.481 1.00 1.34 H new ATOM 0 HA ASP B 35 9.731 4.847 10.691 1.00 1.35 H new ATOM 0 HB2 ASP B 35 9.816 5.990 8.339 1.00 1.32 H new ATOM 0 HB3 ASP B 35 8.949 4.579 7.766 1.00 1.32 H new ATOM 1748 N CYS B 36 9.145 2.217 8.780 1.00 1.16 N ATOM 1749 CA CYS B 36 8.473 0.920 8.748 1.00 1.10 C ATOM 1750 C CYS B 36 9.146 -0.088 9.677 1.00 1.14 C ATOM 1751 O CYS B 36 8.480 -0.895 10.326 1.00 1.21 O ATOM 1752 CB CYS B 36 8.439 0.379 7.315 1.00 0.98 C ATOM 1753 SG CYS B 36 7.552 -1.183 7.138 1.00 0.97 S ATOM 0 H CYS B 36 9.652 2.449 7.926 1.00 1.16 H new ATOM 0 HA CYS B 36 7.453 1.066 9.102 1.00 1.10 H new ATOM 0 HB2 CYS B 36 7.975 1.123 6.668 1.00 0.98 H new ATOM 0 HB3 CYS B 36 9.462 0.245 6.964 1.00 0.98 H new ATOM 0 HG CYS B 36 6.272 -0.962 7.182 1.00 0.97 H new ATOM 1759 N GLY B 37 10.467 -0.031 9.746 1.00 1.14 N ATOM 1760 CA GLY B 37 11.208 -0.951 10.584 1.00 1.18 C ATOM 1761 C GLY B 37 11.763 -2.113 9.786 1.00 1.08 C ATOM 1762 O GLY B 37 12.057 -3.180 10.332 1.00 1.10 O ATOM 0 H GLY B 37 11.042 0.639 9.234 1.00 1.14 H new ATOM 0 HA2 GLY B 37 12.026 -0.421 11.072 1.00 1.18 H new ATOM 0 HA3 GLY B 37 10.558 -1.329 11.373 1.00 1.18 H new ATOM 1766 N PHE B 38 11.891 -1.907 8.479 1.00 0.99 N ATOM 1767 CA PHE B 38 12.416 -2.924 7.580 1.00 0.89 C ATOM 1768 C PHE B 38 13.881 -3.198 7.912 1.00 0.94 C ATOM 1769 O PHE B 38 14.545 -2.375 8.534 1.00 1.05 O ATOM 1770 CB PHE B 38 12.259 -2.463 6.121 1.00 0.78 C ATOM 1771 CG PHE B 38 12.887 -3.382 5.103 1.00 0.71 C ATOM 1772 CD1 PHE B 38 12.420 -4.678 4.939 1.00 0.66 C ATOM 1773 CD2 PHE B 38 13.940 -2.946 4.315 1.00 0.76 C ATOM 1774 CE1 PHE B 38 12.996 -5.522 4.011 1.00 0.67 C ATOM 1775 CE2 PHE B 38 14.519 -3.788 3.382 1.00 0.75 C ATOM 1776 CZ PHE B 38 14.046 -5.078 3.230 1.00 0.71 C ATOM 0 H PHE B 38 11.635 -1.035 8.017 1.00 0.99 H new ATOM 0 HA PHE B 38 11.855 -3.850 7.708 1.00 0.89 H new ATOM 0 HB2 PHE B 38 11.197 -2.365 5.897 1.00 0.78 H new ATOM 0 HB3 PHE B 38 12.700 -1.471 6.017 1.00 0.78 H new ATOM 0 HD1 PHE B 38 11.597 -5.030 5.544 1.00 0.66 H new ATOM 0 HD2 PHE B 38 14.313 -1.939 4.430 1.00 0.76 H new ATOM 0 HE1 PHE B 38 12.626 -6.530 3.895 1.00 0.67 H new ATOM 0 HE2 PHE B 38 15.339 -3.438 2.773 1.00 0.75 H new ATOM 0 HZ PHE B 38 14.496 -5.737 2.503 1.00 0.71 H new ATOM 1786 N ASP B 39 14.365 -4.360 7.514 1.00 0.90 N ATOM 1787 CA ASP B 39 15.746 -4.741 7.756 1.00 0.96 C ATOM 1788 C ASP B 39 16.249 -5.571 6.588 1.00 0.91 C ATOM 1789 O ASP B 39 15.536 -6.436 6.092 1.00 0.86 O ATOM 1790 CB ASP B 39 15.865 -5.535 9.055 1.00 1.02 C ATOM 1791 CG ASP B 39 17.289 -5.599 9.553 1.00 1.33 C ATOM 1792 OD1 ASP B 39 17.700 -4.687 10.290 1.00 1.63 O ATOM 1793 OD2 ASP B 39 18.001 -6.561 9.206 1.00 1.46 O ATOM 0 H ASP B 39 13.817 -5.063 7.017 1.00 0.90 H new ATOM 0 HA ASP B 39 16.352 -3.840 7.851 1.00 0.96 H new ATOM 0 HB2 ASP B 39 15.235 -5.078 9.818 1.00 1.02 H new ATOM 0 HB3 ASP B 39 15.491 -6.546 8.897 1.00 1.02 H new ATOM 1798 N LYS B 40 17.463 -5.307 6.142 1.00 1.00 N ATOM 1799 CA LYS B 40 18.025 -6.042 5.016 1.00 1.00 C ATOM 1800 C LYS B 40 18.748 -7.306 5.465 1.00 1.04 C ATOM 1801 O LYS B 40 19.352 -8.006 4.651 1.00 1.14 O ATOM 1802 CB LYS B 40 18.971 -5.147 4.221 1.00 1.12 C ATOM 1803 CG LYS B 40 18.305 -4.480 3.027 1.00 1.10 C ATOM 1804 CD LYS B 40 17.878 -5.505 1.985 1.00 1.08 C ATOM 1805 CE LYS B 40 18.157 -5.014 0.574 1.00 1.36 C ATOM 1806 NZ LYS B 40 19.608 -4.783 0.345 1.00 1.71 N ATOM 0 H LYS B 40 18.078 -4.595 6.536 1.00 1.00 H new ATOM 0 HA LYS B 40 17.196 -6.348 4.377 1.00 1.00 H new ATOM 0 HB2 LYS B 40 19.373 -4.378 4.881 1.00 1.12 H new ATOM 0 HB3 LYS B 40 19.816 -5.741 3.872 1.00 1.12 H new ATOM 0 HG2 LYS B 40 17.435 -3.915 3.362 1.00 1.10 H new ATOM 0 HG3 LYS B 40 18.994 -3.766 2.576 1.00 1.10 H new ATOM 0 HD2 LYS B 40 18.407 -6.442 2.157 1.00 1.08 H new ATOM 0 HD3 LYS B 40 16.814 -5.715 2.095 1.00 1.08 H new ATOM 0 HE2 LYS B 40 17.788 -5.746 -0.145 1.00 1.36 H new ATOM 0 HE3 LYS B 40 17.609 -4.088 0.397 1.00 1.36 H new ATOM 0 HZ1 LYS B 40 19.829 -4.933 -0.660 1.00 1.71 H new ATOM 0 HZ2 LYS B 40 19.850 -3.807 0.610 1.00 1.71 H new ATOM 0 HZ3 LYS B 40 20.161 -5.447 0.924 1.00 1.71 H new ATOM 1820 N THR B 41 18.678 -7.604 6.751 1.00 1.04 N ATOM 1821 CA THR B 41 19.335 -8.786 7.285 1.00 1.09 C ATOM 1822 C THR B 41 18.324 -9.774 7.872 1.00 1.17 C ATOM 1823 O THR B 41 18.409 -10.977 7.629 1.00 1.33 O ATOM 1824 CB THR B 41 20.368 -8.406 8.363 1.00 1.24 C ATOM 1825 OG1 THR B 41 20.507 -6.976 8.424 1.00 1.22 O ATOM 1826 CG2 THR B 41 21.718 -9.038 8.068 1.00 1.51 C ATOM 0 H THR B 41 18.176 -7.047 7.442 1.00 1.04 H new ATOM 0 HA THR B 41 19.849 -9.267 6.453 1.00 1.09 H new ATOM 0 HB THR B 41 20.013 -8.780 9.323 1.00 1.24 H new ATOM 0 HG1 THR B 41 19.696 -6.585 8.811 1.00 1.22 H new ATOM 0 HG21 THR B 41 22.430 -8.755 8.843 1.00 1.51 H new ATOM 0 HG22 THR B 41 21.615 -10.123 8.049 1.00 1.51 H new ATOM 0 HG23 THR B 41 22.079 -8.690 7.100 1.00 1.51 H new ATOM 1834 N LYS B 42 17.364 -9.265 8.639 1.00 1.19 N ATOM 1835 CA LYS B 42 16.357 -10.120 9.265 1.00 1.29 C ATOM 1836 C LYS B 42 14.942 -9.758 8.814 1.00 1.21 C ATOM 1837 O LYS B 42 14.008 -9.722 9.616 1.00 1.41 O ATOM 1838 CB LYS B 42 16.473 -10.023 10.787 1.00 1.49 C ATOM 1839 CG LYS B 42 16.382 -8.600 11.314 1.00 1.54 C ATOM 1840 CD LYS B 42 16.682 -8.537 12.798 1.00 1.65 C ATOM 1841 CE LYS B 42 16.734 -7.100 13.288 1.00 1.87 C ATOM 1842 NZ LYS B 42 17.159 -7.011 14.707 1.00 1.99 N ATOM 0 H LYS B 42 17.261 -8.271 8.842 1.00 1.19 H new ATOM 0 HA LYS B 42 16.544 -11.147 8.950 1.00 1.29 H new ATOM 0 HB2 LYS B 42 15.684 -10.621 11.242 1.00 1.49 H new ATOM 0 HB3 LYS B 42 17.423 -10.457 11.099 1.00 1.49 H new ATOM 0 HG2 LYS B 42 17.083 -7.965 10.773 1.00 1.54 H new ATOM 0 HG3 LYS B 42 15.384 -8.205 11.126 1.00 1.54 H new ATOM 0 HD2 LYS B 42 15.918 -9.085 13.350 1.00 1.65 H new ATOM 0 HD3 LYS B 42 17.634 -9.028 13.000 1.00 1.65 H new ATOM 0 HE2 LYS B 42 17.424 -6.530 12.666 1.00 1.87 H new ATOM 0 HE3 LYS B 42 15.751 -6.643 13.175 1.00 1.87 H new ATOM 0 HZ1 LYS B 42 17.181 -6.014 15.001 1.00 1.99 H new ATOM 0 HZ2 LYS B 42 16.486 -7.533 15.304 1.00 1.99 H new ATOM 0 HZ3 LYS B 42 18.108 -7.424 14.812 1.00 1.99 H new ATOM 1856 N HIS B 43 14.786 -9.488 7.529 1.00 0.97 N ATOM 1857 CA HIS B 43 13.482 -9.148 6.967 1.00 0.86 C ATOM 1858 C HIS B 43 13.487 -9.390 5.465 1.00 0.79 C ATOM 1859 O HIS B 43 14.533 -9.295 4.821 1.00 0.83 O ATOM 1860 CB HIS B 43 13.119 -7.683 7.250 1.00 0.84 C ATOM 1861 CG HIS B 43 12.225 -7.473 8.438 1.00 0.95 C ATOM 1862 ND1 HIS B 43 12.522 -6.592 9.460 1.00 1.18 N ATOM 1863 CD2 HIS B 43 11.023 -8.013 8.750 1.00 1.07 C ATOM 1864 CE1 HIS B 43 11.541 -6.597 10.342 1.00 1.32 C ATOM 1865 NE2 HIS B 43 10.620 -7.450 9.936 1.00 1.27 N ATOM 0 H HIS B 43 15.547 -9.497 6.850 1.00 0.97 H new ATOM 0 HA HIS B 43 12.735 -9.785 7.440 1.00 0.86 H new ATOM 0 HB2 HIS B 43 14.039 -7.118 7.401 1.00 0.84 H new ATOM 0 HB3 HIS B 43 12.631 -7.268 6.368 1.00 0.84 H new ATOM 0 HD2 HIS B 43 10.482 -8.749 8.174 1.00 1.07 H new ATOM 0 HE1 HIS B 43 11.499 -6.004 11.243 1.00 1.32 H new ATOM 0 HE2 HIS B 43 9.749 -7.658 10.424 1.00 1.27 H new ATOM 1874 N ASP B 44 12.326 -9.703 4.913 1.00 0.78 N ATOM 1875 CA ASP B 44 12.205 -9.954 3.486 1.00 0.76 C ATOM 1876 C ASP B 44 11.298 -8.906 2.847 1.00 0.65 C ATOM 1877 O ASP B 44 10.173 -8.671 3.302 1.00 0.61 O ATOM 1878 CB ASP B 44 11.668 -11.370 3.232 1.00 0.90 C ATOM 1879 CG ASP B 44 12.670 -12.453 3.592 1.00 1.05 C ATOM 1880 OD1 ASP B 44 13.652 -12.640 2.838 1.00 1.18 O ATOM 1881 OD2 ASP B 44 12.485 -13.129 4.627 1.00 1.17 O ATOM 0 H ASP B 44 11.452 -9.789 5.432 1.00 0.78 H new ATOM 0 HA ASP B 44 13.192 -9.882 3.030 1.00 0.76 H new ATOM 0 HB2 ASP B 44 10.757 -11.517 3.812 1.00 0.90 H new ATOM 0 HB3 ASP B 44 11.396 -11.468 2.181 1.00 0.90 H new ATOM 1886 N LEU B 45 11.794 -8.263 1.802 1.00 0.64 N ATOM 1887 CA LEU B 45 11.035 -7.226 1.115 1.00 0.55 C ATOM 1888 C LEU B 45 10.284 -7.791 -0.084 1.00 0.59 C ATOM 1889 O LEU B 45 10.894 -8.301 -1.026 1.00 0.65 O ATOM 1890 CB LEU B 45 11.965 -6.100 0.660 1.00 0.49 C ATOM 1891 CG LEU B 45 11.271 -4.918 -0.025 1.00 0.41 C ATOM 1892 CD1 LEU B 45 10.155 -4.361 0.851 1.00 0.42 C ATOM 1893 CD2 LEU B 45 12.280 -3.829 -0.353 1.00 0.43 C ATOM 0 H LEU B 45 12.719 -8.440 1.410 1.00 0.64 H new ATOM 0 HA LEU B 45 10.304 -6.828 1.819 1.00 0.55 H new ATOM 0 HB2 LEU B 45 12.510 -5.728 1.527 1.00 0.49 H new ATOM 0 HB3 LEU B 45 12.703 -6.515 -0.026 1.00 0.49 H new ATOM 0 HG LEU B 45 10.828 -5.276 -0.954 1.00 0.41 H new ATOM 0 HD11 LEU B 45 9.678 -3.523 0.343 1.00 0.42 H new ATOM 0 HD12 LEU B 45 9.416 -5.140 1.038 1.00 0.42 H new ATOM 0 HD13 LEU B 45 10.572 -4.021 1.799 1.00 0.42 H new ATOM 0 HD21 LEU B 45 11.772 -2.996 -0.839 1.00 0.43 H new ATOM 0 HD22 LEU B 45 12.750 -3.480 0.566 1.00 0.43 H new ATOM 0 HD23 LEU B 45 13.042 -4.229 -1.022 1.00 0.43 H new ATOM 1905 N TYR B 46 8.963 -7.687 -0.047 1.00 0.61 N ATOM 1906 CA TYR B 46 8.124 -8.175 -1.130 1.00 0.68 C ATOM 1907 C TYR B 46 7.724 -7.018 -2.041 1.00 0.62 C ATOM 1908 O TYR B 46 6.948 -6.140 -1.655 1.00 0.53 O ATOM 1909 CB TYR B 46 6.874 -8.867 -0.572 1.00 0.77 C ATOM 1910 CG TYR B 46 7.128 -10.242 0.021 1.00 0.91 C ATOM 1911 CD1 TYR B 46 8.407 -10.643 0.404 1.00 0.98 C ATOM 1912 CD2 TYR B 46 6.081 -11.137 0.213 1.00 1.20 C ATOM 1913 CE1 TYR B 46 8.630 -11.890 0.953 1.00 1.18 C ATOM 1914 CE2 TYR B 46 6.300 -12.386 0.760 1.00 1.41 C ATOM 1915 CZ TYR B 46 7.574 -12.756 1.128 1.00 1.34 C ATOM 1916 OH TYR B 46 7.796 -13.994 1.683 1.00 1.60 O ATOM 0 H TYR B 46 8.448 -7.266 0.726 1.00 0.61 H new ATOM 0 HA TYR B 46 8.691 -8.903 -1.710 1.00 0.68 H new ATOM 0 HB2 TYR B 46 6.433 -8.230 0.195 1.00 0.77 H new ATOM 0 HB3 TYR B 46 6.138 -8.960 -1.371 1.00 0.77 H new ATOM 0 HD1 TYR B 46 9.238 -9.966 0.269 1.00 0.98 H new ATOM 0 HD2 TYR B 46 5.079 -10.850 -0.071 1.00 1.20 H new ATOM 0 HE1 TYR B 46 9.628 -12.185 1.244 1.00 1.18 H new ATOM 0 HE2 TYR B 46 5.475 -13.070 0.898 1.00 1.41 H new ATOM 0 HH TYR B 46 7.242 -14.661 1.226 1.00 1.60 H new ATOM 1926 N TYR B 47 8.273 -7.016 -3.240 1.00 0.74 N ATOM 1927 CA TYR B 47 7.995 -5.978 -4.209 1.00 0.75 C ATOM 1928 C TYR B 47 6.919 -6.449 -5.180 1.00 0.77 C ATOM 1929 O TYR B 47 7.193 -7.262 -6.068 1.00 0.83 O ATOM 1930 CB TYR B 47 9.276 -5.608 -4.959 1.00 0.84 C ATOM 1931 CG TYR B 47 9.064 -4.609 -6.075 1.00 0.94 C ATOM 1932 CD1 TYR B 47 8.658 -3.309 -5.802 1.00 1.06 C ATOM 1933 CD2 TYR B 47 9.272 -4.967 -7.401 1.00 1.25 C ATOM 1934 CE1 TYR B 47 8.465 -2.393 -6.823 1.00 1.41 C ATOM 1935 CE2 TYR B 47 9.081 -4.061 -8.425 1.00 1.56 C ATOM 1936 CZ TYR B 47 8.680 -2.775 -8.134 1.00 1.63 C ATOM 1937 OH TYR B 47 8.492 -1.870 -9.155 1.00 2.06 O ATOM 0 H TYR B 47 8.922 -7.732 -3.568 1.00 0.74 H new ATOM 0 HA TYR B 47 7.629 -5.091 -3.692 1.00 0.75 H new ATOM 0 HB2 TYR B 47 9.996 -5.199 -4.250 1.00 0.84 H new ATOM 0 HB3 TYR B 47 9.717 -6.514 -5.374 1.00 0.84 H new ATOM 0 HD1 TYR B 47 8.490 -3.008 -4.778 1.00 1.06 H new ATOM 0 HD2 TYR B 47 9.589 -5.973 -7.635 1.00 1.25 H new ATOM 0 HE1 TYR B 47 8.148 -1.386 -6.596 1.00 1.41 H new ATOM 0 HE2 TYR B 47 9.245 -4.359 -9.450 1.00 1.56 H new ATOM 0 HH TYR B 47 8.687 -2.300 -10.014 1.00 2.06 H new ATOM 1947 N ASN B 48 5.700 -5.946 -4.989 1.00 0.78 N ATOM 1948 CA ASN B 48 4.553 -6.297 -5.833 1.00 0.84 C ATOM 1949 C ASN B 48 4.161 -7.763 -5.642 1.00 0.89 C ATOM 1950 O ASN B 48 3.210 -8.066 -4.923 1.00 0.94 O ATOM 1951 CB ASN B 48 4.847 -6.004 -7.313 1.00 0.91 C ATOM 1952 CG ASN B 48 3.660 -6.263 -8.225 1.00 1.49 C ATOM 1953 OD1 ASN B 48 3.818 -6.796 -9.319 1.00 2.27 O ATOM 1954 ND2 ASN B 48 2.468 -5.876 -7.793 1.00 1.79 N ATOM 0 H ASN B 48 5.477 -5.284 -4.246 1.00 0.78 H new ATOM 0 HA ASN B 48 3.711 -5.677 -5.525 1.00 0.84 H new ATOM 0 HB2 ASN B 48 5.155 -4.963 -7.416 1.00 0.91 H new ATOM 0 HB3 ASN B 48 5.687 -6.618 -7.638 1.00 0.91 H new ATOM 0 HD21 ASN B 48 1.643 -6.018 -8.376 1.00 1.79 H new ATOM 0 HD22 ASN B 48 2.375 -5.436 -6.877 1.00 1.79 H new ATOM 1961 N MET B 49 4.905 -8.666 -6.274 1.00 0.94 N ATOM 1962 CA MET B 49 4.633 -10.098 -6.176 1.00 1.05 C ATOM 1963 C MET B 49 5.931 -10.904 -6.206 1.00 1.12 C ATOM 1964 O MET B 49 5.917 -12.108 -6.452 1.00 1.28 O ATOM 1965 CB MET B 49 3.707 -10.551 -7.312 1.00 1.16 C ATOM 1966 CG MET B 49 2.230 -10.312 -7.027 1.00 1.25 C ATOM 1967 SD MET B 49 1.160 -10.747 -8.413 1.00 1.34 S ATOM 1968 CE MET B 49 1.761 -9.622 -9.673 1.00 1.57 C ATOM 0 H MET B 49 5.704 -8.431 -6.862 1.00 0.94 H new ATOM 0 HA MET B 49 4.136 -10.279 -5.223 1.00 1.05 H new ATOM 0 HB2 MET B 49 3.982 -10.024 -8.226 1.00 1.16 H new ATOM 0 HB3 MET B 49 3.865 -11.613 -7.497 1.00 1.16 H new ATOM 0 HG2 MET B 49 1.936 -10.894 -6.153 1.00 1.25 H new ATOM 0 HG3 MET B 49 2.080 -9.262 -6.776 1.00 1.25 H new ATOM 0 HE1 MET B 49 0.984 -9.465 -10.421 1.00 1.57 H new ATOM 0 HE2 MET B 49 2.022 -8.668 -9.215 1.00 1.57 H new ATOM 0 HE3 MET B 49 2.643 -10.048 -10.150 1.00 1.57 H new ATOM 1978 N ASP B 50 7.047 -10.236 -5.936 1.00 1.04 N ATOM 1979 CA ASP B 50 8.352 -10.896 -5.929 1.00 1.12 C ATOM 1980 C ASP B 50 9.187 -10.411 -4.747 1.00 0.98 C ATOM 1981 O ASP B 50 8.804 -9.465 -4.064 1.00 0.85 O ATOM 1982 CB ASP B 50 9.093 -10.638 -7.246 1.00 1.22 C ATOM 1983 CG ASP B 50 10.361 -11.465 -7.370 1.00 1.41 C ATOM 1984 OD1 ASP B 50 10.358 -12.628 -6.921 1.00 1.95 O ATOM 1985 OD2 ASP B 50 11.363 -10.948 -7.902 1.00 1.26 O ATOM 0 H ASP B 50 7.077 -9.240 -5.719 1.00 1.04 H new ATOM 0 HA ASP B 50 8.194 -11.970 -5.827 1.00 1.12 H new ATOM 0 HB2 ASP B 50 8.432 -10.865 -8.082 1.00 1.22 H new ATOM 0 HB3 ASP B 50 9.345 -9.580 -7.317 1.00 1.22 H new ATOM 1990 N ILE B 51 10.318 -11.053 -4.506 1.00 1.10 N ATOM 1991 CA ILE B 51 11.186 -10.678 -3.398 1.00 1.00 C ATOM 1992 C ILE B 51 12.382 -9.867 -3.894 1.00 0.92 C ATOM 1993 O ILE B 51 12.925 -10.133 -4.969 1.00 1.01 O ATOM 1994 CB ILE B 51 11.691 -11.923 -2.633 1.00 1.12 C ATOM 1995 CG1 ILE B 51 10.506 -12.797 -2.206 1.00 1.24 C ATOM 1996 CG2 ILE B 51 12.516 -11.511 -1.415 1.00 1.08 C ATOM 1997 CD1 ILE B 51 10.905 -14.025 -1.416 1.00 1.56 C ATOM 0 H ILE B 51 10.658 -11.837 -5.062 1.00 1.10 H new ATOM 0 HA ILE B 51 10.594 -10.065 -2.718 1.00 1.00 H new ATOM 0 HB ILE B 51 12.332 -12.501 -3.298 1.00 1.12 H new ATOM 0 HG12 ILE B 51 9.822 -12.197 -1.606 1.00 1.24 H new ATOM 0 HG13 ILE B 51 9.959 -13.111 -3.095 1.00 1.24 H new ATOM 0 HG21 ILE B 51 12.861 -12.402 -0.891 1.00 1.08 H new ATOM 0 HG22 ILE B 51 13.376 -10.925 -1.739 1.00 1.08 H new ATOM 0 HG23 ILE B 51 11.900 -10.912 -0.744 1.00 1.08 H new ATOM 0 HD11 ILE B 51 10.013 -14.592 -1.150 1.00 1.56 H new ATOM 0 HD12 ILE B 51 11.565 -14.648 -2.020 1.00 1.56 H new ATOM 0 HD13 ILE B 51 11.425 -13.720 -0.508 1.00 1.56 H new ATOM 2009 N LEU B 52 12.780 -8.871 -3.111 1.00 0.79 N ATOM 2010 CA LEU B 52 13.914 -8.026 -3.462 1.00 0.73 C ATOM 2011 C LEU B 52 15.223 -8.779 -3.223 1.00 0.78 C ATOM 2012 O LEU B 52 15.799 -8.726 -2.134 1.00 0.80 O ATOM 2013 CB LEU B 52 13.885 -6.724 -2.647 1.00 0.64 C ATOM 2014 CG LEU B 52 14.314 -5.452 -3.394 1.00 0.76 C ATOM 2015 CD1 LEU B 52 15.708 -5.606 -3.983 1.00 0.97 C ATOM 2016 CD2 LEU B 52 13.303 -5.098 -4.477 1.00 0.90 C ATOM 0 H LEU B 52 12.333 -8.629 -2.227 1.00 0.79 H new ATOM 0 HA LEU B 52 13.847 -7.770 -4.519 1.00 0.73 H new ATOM 0 HB2 LEU B 52 12.873 -6.577 -2.271 1.00 0.64 H new ATOM 0 HB3 LEU B 52 14.533 -6.848 -1.779 1.00 0.64 H new ATOM 0 HG LEU B 52 14.345 -4.633 -2.675 1.00 0.76 H new ATOM 0 HD11 LEU B 52 15.985 -4.691 -4.506 1.00 0.97 H new ATOM 0 HD12 LEU B 52 16.422 -5.797 -3.182 1.00 0.97 H new ATOM 0 HD13 LEU B 52 15.717 -6.441 -4.684 1.00 0.97 H new ATOM 0 HD21 LEU B 52 13.625 -4.194 -4.994 1.00 0.90 H new ATOM 0 HD22 LEU B 52 13.232 -5.919 -5.191 1.00 0.90 H new ATOM 0 HD23 LEU B 52 12.327 -4.927 -4.022 1.00 0.90 H new ATOM 2028 N ASP B 53 15.672 -9.485 -4.247 1.00 0.85 N ATOM 2029 CA ASP B 53 16.903 -10.260 -4.172 1.00 0.91 C ATOM 2030 C ASP B 53 18.119 -9.398 -4.520 1.00 0.85 C ATOM 2031 O ASP B 53 17.977 -8.332 -5.115 1.00 0.81 O ATOM 2032 CB ASP B 53 16.818 -11.453 -5.128 1.00 1.05 C ATOM 2033 CG ASP B 53 18.020 -12.369 -5.029 1.00 1.12 C ATOM 2034 OD1 ASP B 53 18.193 -13.018 -3.977 1.00 1.21 O ATOM 2035 OD2 ASP B 53 18.799 -12.433 -5.999 1.00 1.17 O ATOM 0 H ASP B 53 15.199 -9.538 -5.149 1.00 0.85 H new ATOM 0 HA ASP B 53 17.023 -10.618 -3.149 1.00 0.91 H new ATOM 0 HB2 ASP B 53 15.914 -12.022 -4.912 1.00 1.05 H new ATOM 0 HB3 ASP B 53 16.728 -11.088 -6.151 1.00 1.05 H new ATOM 2040 N SER B 54 19.309 -9.869 -4.151 1.00 0.89 N ATOM 2041 CA SER B 54 20.556 -9.158 -4.421 1.00 0.89 C ATOM 2042 C SER B 54 20.773 -8.967 -5.921 1.00 0.95 C ATOM 2043 O SER B 54 21.488 -8.059 -6.346 1.00 1.00 O ATOM 2044 CB SER B 54 21.721 -9.937 -3.814 1.00 0.97 C ATOM 2045 OG SER B 54 21.331 -10.548 -2.592 1.00 0.96 O ATOM 0 H SER B 54 19.435 -10.753 -3.657 1.00 0.89 H new ATOM 0 HA SER B 54 20.498 -8.169 -3.967 1.00 0.89 H new ATOM 0 HB2 SER B 54 22.061 -10.699 -4.516 1.00 0.97 H new ATOM 0 HB3 SER B 54 22.562 -9.266 -3.639 1.00 0.97 H new ATOM 0 HG SER B 54 22.089 -11.044 -2.218 1.00 0.96 H new ATOM 2051 N ASN B 55 20.164 -9.839 -6.718 1.00 1.00 N ATOM 2052 CA ASN B 55 20.276 -9.747 -8.168 1.00 1.11 C ATOM 2053 C ASN B 55 19.568 -8.490 -8.668 1.00 1.10 C ATOM 2054 O ASN B 55 19.936 -7.921 -9.695 1.00 1.19 O ATOM 2055 CB ASN B 55 19.682 -10.987 -8.844 1.00 1.22 C ATOM 2056 CG ASN B 55 20.648 -12.157 -8.886 1.00 1.52 C ATOM 2057 OD1 ASN B 55 21.375 -12.346 -9.861 1.00 1.82 O ATOM 2058 ND2 ASN B 55 20.662 -12.951 -7.829 1.00 1.89 N ATOM 0 H ASN B 55 19.590 -10.614 -6.385 1.00 1.00 H new ATOM 0 HA ASN B 55 21.334 -9.691 -8.426 1.00 1.11 H new ATOM 0 HB2 ASN B 55 18.779 -11.287 -8.312 1.00 1.22 H new ATOM 0 HB3 ASN B 55 19.383 -10.732 -9.861 1.00 1.22 H new ATOM 0 HD21 ASN B 55 21.291 -13.754 -7.802 1.00 1.89 H new ATOM 0 HD22 ASN B 55 20.044 -12.761 -7.040 1.00 1.89 H new ATOM 2065 N ARG B 56 18.567 -8.047 -7.913 1.00 1.00 N ATOM 2066 CA ARG B 56 17.799 -6.864 -8.269 1.00 0.99 C ATOM 2067 C ARG B 56 18.448 -5.616 -7.685 1.00 0.97 C ATOM 2068 O ARG B 56 17.911 -4.985 -6.779 1.00 0.96 O ATOM 2069 CB ARG B 56 16.355 -6.983 -7.773 1.00 0.95 C ATOM 2070 CG ARG B 56 15.630 -8.226 -8.265 1.00 1.04 C ATOM 2071 CD ARG B 56 14.138 -7.980 -8.397 1.00 1.13 C ATOM 2072 NE ARG B 56 13.401 -9.195 -8.738 1.00 1.20 N ATOM 2073 CZ ARG B 56 13.364 -9.740 -9.954 1.00 1.47 C ATOM 2074 NH1 ARG B 56 14.010 -9.182 -10.971 1.00 1.69 N ATOM 2075 NH2 ARG B 56 12.654 -10.841 -10.149 1.00 1.62 N ATOM 0 H ARG B 56 18.269 -8.495 -7.046 1.00 1.00 H new ATOM 0 HA ARG B 56 17.786 -6.782 -9.356 1.00 0.99 H new ATOM 0 HB2 ARG B 56 16.355 -6.983 -6.683 1.00 0.95 H new ATOM 0 HB3 ARG B 56 15.799 -6.101 -8.091 1.00 0.95 H new ATOM 0 HG2 ARG B 56 16.037 -8.529 -9.230 1.00 1.04 H new ATOM 0 HG3 ARG B 56 15.805 -9.049 -7.572 1.00 1.04 H new ATOM 0 HD2 ARG B 56 13.755 -7.577 -7.460 1.00 1.13 H new ATOM 0 HD3 ARG B 56 13.963 -7.225 -9.164 1.00 1.13 H new ATOM 0 HE ARG B 56 12.879 -9.658 -7.994 1.00 1.20 H new ATOM 0 HH11 ARG B 56 14.544 -8.325 -10.827 1.00 1.69 H new ATOM 0 HH12 ARG B 56 13.972 -9.611 -11.896 1.00 1.69 H new ATOM 0 HH21 ARG B 56 12.143 -11.263 -9.373 1.00 1.62 H new ATOM 0 HH22 ARG B 56 12.618 -11.267 -11.075 1.00 1.62 H new ATOM 2089 N THR B 57 19.615 -5.273 -8.204 1.00 1.01 N ATOM 2090 CA THR B 57 20.338 -4.096 -7.742 1.00 1.01 C ATOM 2091 C THR B 57 19.913 -2.863 -8.538 1.00 0.98 C ATOM 2092 O THR B 57 20.467 -1.772 -8.370 1.00 1.00 O ATOM 2093 CB THR B 57 21.870 -4.301 -7.861 1.00 1.06 C ATOM 2094 OG1 THR B 57 22.571 -3.130 -7.419 1.00 1.06 O ATOM 2095 CG2 THR B 57 22.269 -4.624 -9.296 1.00 1.09 C ATOM 0 H THR B 57 20.084 -5.792 -8.946 1.00 1.01 H new ATOM 0 HA THR B 57 20.093 -3.943 -6.691 1.00 1.01 H new ATOM 0 HB THR B 57 22.142 -5.143 -7.225 1.00 1.06 H new ATOM 0 HG1 THR B 57 22.000 -2.343 -7.538 1.00 1.06 H new ATOM 0 HG21 THR B 57 23.349 -4.763 -9.351 1.00 1.09 H new ATOM 0 HG22 THR B 57 21.769 -5.538 -9.616 1.00 1.09 H new ATOM 0 HG23 THR B 57 21.975 -3.802 -9.949 1.00 1.09 H new ATOM 2103 N GLN B 58 18.921 -3.051 -9.398 1.00 1.01 N ATOM 2104 CA GLN B 58 18.404 -1.979 -10.235 1.00 1.02 C ATOM 2105 C GLN B 58 17.696 -0.933 -9.383 1.00 1.01 C ATOM 2106 O GLN B 58 17.083 -1.261 -8.369 1.00 1.01 O ATOM 2107 CB GLN B 58 17.430 -2.545 -11.268 1.00 1.06 C ATOM 2108 CG GLN B 58 17.927 -3.812 -11.949 1.00 1.18 C ATOM 2109 CD GLN B 58 16.828 -4.843 -12.131 1.00 1.20 C ATOM 2110 OE1 GLN B 58 16.588 -5.674 -11.256 1.00 1.31 O ATOM 2111 NE2 GLN B 58 16.160 -4.801 -13.270 1.00 1.32 N ATOM 0 H GLN B 58 18.454 -3.948 -9.534 1.00 1.01 H new ATOM 0 HA GLN B 58 19.241 -1.507 -10.749 1.00 1.02 H new ATOM 0 HB2 GLN B 58 16.478 -2.755 -10.780 1.00 1.06 H new ATOM 0 HB3 GLN B 58 17.238 -1.787 -12.027 1.00 1.06 H new ATOM 0 HG2 GLN B 58 18.346 -3.557 -12.922 1.00 1.18 H new ATOM 0 HG3 GLN B 58 18.734 -4.246 -11.358 1.00 1.18 H new ATOM 0 HE21 GLN B 58 16.390 -4.096 -13.970 1.00 1.32 H new ATOM 0 HE22 GLN B 58 15.414 -5.474 -13.449 1.00 1.32 H new ATOM 2120 N SER B 59 17.782 0.323 -9.797 1.00 1.04 N ATOM 2121 CA SER B 59 17.147 1.409 -9.064 1.00 1.05 C ATOM 2122 C SER B 59 15.638 1.442 -9.335 1.00 1.06 C ATOM 2123 O SER B 59 15.128 0.675 -10.154 1.00 1.07 O ATOM 2124 CB SER B 59 17.800 2.738 -9.437 1.00 1.10 C ATOM 2125 OG SER B 59 19.112 2.533 -9.944 1.00 1.11 O ATOM 0 H SER B 59 18.284 0.615 -10.635 1.00 1.04 H new ATOM 0 HA SER B 59 17.286 1.240 -7.996 1.00 1.05 H new ATOM 0 HB2 SER B 59 17.193 3.249 -10.184 1.00 1.10 H new ATOM 0 HB3 SER B 59 17.841 3.386 -8.562 1.00 1.10 H new ATOM 0 HG SER B 59 19.093 2.566 -10.923 1.00 1.11 H new ATOM 2131 N LEU B 60 14.935 2.351 -8.665 1.00 1.06 N ATOM 2132 CA LEU B 60 13.479 2.472 -8.797 1.00 1.08 C ATOM 2133 C LEU B 60 13.041 2.701 -10.246 1.00 1.14 C ATOM 2134 O LEU B 60 12.101 2.063 -10.725 1.00 1.19 O ATOM 2135 CB LEU B 60 12.960 3.613 -7.921 1.00 1.10 C ATOM 2136 CG LEU B 60 13.400 3.565 -6.452 1.00 1.05 C ATOM 2137 CD1 LEU B 60 12.867 4.772 -5.695 1.00 1.09 C ATOM 2138 CD2 LEU B 60 12.925 2.278 -5.791 1.00 0.97 C ATOM 0 H LEU B 60 15.351 3.022 -8.019 1.00 1.06 H new ATOM 0 HA LEU B 60 13.052 1.525 -8.467 1.00 1.08 H new ATOM 0 HB2 LEU B 60 13.290 4.558 -8.351 1.00 1.10 H new ATOM 0 HB3 LEU B 60 11.871 3.610 -7.957 1.00 1.10 H new ATOM 0 HG LEU B 60 14.489 3.588 -6.422 1.00 1.05 H new ATOM 0 HD11 LEU B 60 13.189 4.721 -4.655 1.00 1.09 H new ATOM 0 HD12 LEU B 60 13.251 5.685 -6.149 1.00 1.09 H new ATOM 0 HD13 LEU B 60 11.778 4.776 -5.738 1.00 1.09 H new ATOM 0 HD21 LEU B 60 13.247 2.263 -4.750 1.00 0.97 H new ATOM 0 HD22 LEU B 60 11.837 2.226 -5.835 1.00 0.97 H new ATOM 0 HD23 LEU B 60 13.350 1.422 -6.314 1.00 0.97 H new ATOM 2150 N LYS B 61 13.730 3.594 -10.944 1.00 1.16 N ATOM 2151 CA LYS B 61 13.387 3.909 -12.335 1.00 1.22 C ATOM 2152 C LYS B 61 13.723 2.755 -13.285 1.00 1.25 C ATOM 2153 O LYS B 61 13.446 2.824 -14.481 1.00 1.34 O ATOM 2154 CB LYS B 61 14.085 5.201 -12.792 1.00 1.27 C ATOM 2155 CG LYS B 61 15.551 5.041 -13.201 1.00 1.27 C ATOM 2156 CD LYS B 61 16.443 4.755 -12.005 1.00 1.45 C ATOM 2157 CE LYS B 61 17.821 5.386 -12.154 1.00 1.31 C ATOM 2158 NZ LYS B 61 18.612 4.758 -13.247 1.00 1.36 N ATOM 0 H LYS B 61 14.527 4.114 -10.577 1.00 1.16 H new ATOM 0 HA LYS B 61 12.308 4.061 -12.372 1.00 1.22 H new ATOM 0 HB2 LYS B 61 13.532 5.614 -13.636 1.00 1.27 H new ATOM 0 HB3 LYS B 61 14.027 5.931 -11.985 1.00 1.27 H new ATOM 0 HG2 LYS B 61 15.640 4.229 -13.923 1.00 1.27 H new ATOM 0 HG3 LYS B 61 15.891 5.949 -13.699 1.00 1.27 H new ATOM 0 HD2 LYS B 61 15.968 5.133 -11.100 1.00 1.45 H new ATOM 0 HD3 LYS B 61 16.550 3.677 -11.882 1.00 1.45 H new ATOM 0 HE2 LYS B 61 17.711 6.452 -12.354 1.00 1.31 H new ATOM 0 HE3 LYS B 61 18.365 5.292 -11.214 1.00 1.31 H new ATOM 0 HZ1 LYS B 61 19.500 5.284 -13.379 1.00 1.36 H new ATOM 0 HZ2 LYS B 61 18.828 3.772 -12.997 1.00 1.36 H new ATOM 0 HZ3 LYS B 61 18.062 4.779 -14.130 1.00 1.36 H new ATOM 2172 N GLU B 62 14.313 1.698 -12.746 1.00 1.20 N ATOM 2173 CA GLU B 62 14.678 0.537 -13.544 1.00 1.23 C ATOM 2174 C GLU B 62 13.830 -0.673 -13.166 1.00 1.22 C ATOM 2175 O GLU B 62 13.518 -1.510 -14.011 1.00 1.30 O ATOM 2176 CB GLU B 62 16.159 0.233 -13.362 1.00 1.22 C ATOM 2177 CG GLU B 62 17.058 1.315 -13.937 1.00 1.29 C ATOM 2178 CD GLU B 62 18.462 1.270 -13.384 1.00 1.46 C ATOM 2179 OE1 GLU B 62 19.257 0.428 -13.845 1.00 1.68 O ATOM 2180 OE2 GLU B 62 18.781 2.095 -12.504 1.00 1.58 O ATOM 0 H GLU B 62 14.550 1.621 -11.757 1.00 1.20 H new ATOM 0 HA GLU B 62 14.488 0.761 -14.594 1.00 1.23 H new ATOM 0 HB2 GLU B 62 16.373 0.116 -12.300 1.00 1.22 H new ATOM 0 HB3 GLU B 62 16.391 -0.718 -13.841 1.00 1.22 H new ATOM 0 HG2 GLU B 62 17.097 1.209 -15.021 1.00 1.29 H new ATOM 0 HG3 GLU B 62 16.622 2.292 -13.727 1.00 1.29 H new ATOM 2187 N LEU B 63 13.462 -0.761 -11.892 1.00 1.15 N ATOM 2188 CA LEU B 63 12.634 -1.858 -11.409 1.00 1.14 C ATOM 2189 C LEU B 63 11.253 -1.791 -12.051 1.00 1.18 C ATOM 2190 O LEU B 63 10.589 -2.810 -12.244 1.00 1.27 O ATOM 2191 CB LEU B 63 12.510 -1.811 -9.883 1.00 1.05 C ATOM 2192 CG LEU B 63 13.783 -2.171 -9.114 1.00 1.05 C ATOM 2193 CD1 LEU B 63 13.633 -1.832 -7.637 1.00 0.95 C ATOM 2194 CD2 LEU B 63 14.116 -3.645 -9.292 1.00 1.19 C ATOM 0 H LEU B 63 13.725 -0.084 -11.175 1.00 1.15 H new ATOM 0 HA LEU B 63 13.110 -2.799 -11.686 1.00 1.14 H new ATOM 0 HB2 LEU B 63 12.200 -0.808 -9.591 1.00 1.05 H new ATOM 0 HB3 LEU B 63 11.716 -2.492 -9.578 1.00 1.05 H new ATOM 0 HG LEU B 63 14.605 -1.581 -9.519 1.00 1.05 H new ATOM 0 HD11 LEU B 63 14.549 -2.096 -7.108 1.00 0.95 H new ATOM 0 HD12 LEU B 63 13.445 -0.764 -7.526 1.00 0.95 H new ATOM 0 HD13 LEU B 63 12.798 -2.393 -7.218 1.00 0.95 H new ATOM 0 HD21 LEU B 63 15.024 -3.882 -8.738 1.00 1.19 H new ATOM 0 HD22 LEU B 63 13.292 -4.252 -8.916 1.00 1.19 H new ATOM 0 HD23 LEU B 63 14.270 -3.858 -10.350 1.00 1.19 H new ATOM 2206 N GLY B 64 10.826 -0.578 -12.377 1.00 1.17 N ATOM 2207 CA GLY B 64 9.544 -0.392 -13.014 1.00 1.23 C ATOM 2208 C GLY B 64 8.543 0.296 -12.116 1.00 1.11 C ATOM 2209 O GLY B 64 7.404 -0.161 -11.988 1.00 1.14 O ATOM 0 H GLY B 64 11.349 0.281 -12.209 1.00 1.17 H new ATOM 0 HA2 GLY B 64 9.676 0.196 -13.922 1.00 1.23 H new ATOM 0 HA3 GLY B 64 9.149 -1.362 -13.316 1.00 1.23 H new ATOM 2213 N LEU B 65 8.964 1.380 -11.477 1.00 1.08 N ATOM 2214 CA LEU B 65 8.072 2.135 -10.612 1.00 1.03 C ATOM 2215 C LEU B 65 7.119 2.960 -11.462 1.00 1.18 C ATOM 2216 O LEU B 65 7.499 3.470 -12.518 1.00 1.40 O ATOM 2217 CB LEU B 65 8.848 3.044 -9.659 1.00 1.07 C ATOM 2218 CG LEU B 65 9.309 2.390 -8.345 1.00 1.11 C ATOM 2219 CD1 LEU B 65 9.449 3.441 -7.256 1.00 1.29 C ATOM 2220 CD2 LEU B 65 8.337 1.302 -7.901 1.00 1.53 C ATOM 0 H LEU B 65 9.911 1.753 -11.542 1.00 1.08 H new ATOM 0 HA LEU B 65 7.507 1.428 -10.005 1.00 1.03 H new ATOM 0 HB2 LEU B 65 9.725 3.424 -10.182 1.00 1.07 H new ATOM 0 HB3 LEU B 65 8.224 3.904 -9.417 1.00 1.07 H new ATOM 0 HG LEU B 65 10.280 1.927 -8.521 1.00 1.11 H new ATOM 0 HD11 LEU B 65 9.776 2.965 -6.331 1.00 1.29 H new ATOM 0 HD12 LEU B 65 10.185 4.185 -7.561 1.00 1.29 H new ATOM 0 HD13 LEU B 65 8.487 3.927 -7.094 1.00 1.29 H new ATOM 0 HD21 LEU B 65 8.689 0.858 -6.970 1.00 1.53 H new ATOM 0 HD22 LEU B 65 7.350 1.737 -7.745 1.00 1.53 H new ATOM 0 HD23 LEU B 65 8.277 0.532 -8.670 1.00 1.53 H new ATOM 2232 N LYS B 66 5.889 3.086 -11.001 1.00 1.17 N ATOM 2233 CA LYS B 66 4.872 3.813 -11.734 1.00 1.37 C ATOM 2234 C LYS B 66 3.986 4.611 -10.786 1.00 1.37 C ATOM 2235 O LYS B 66 4.400 4.955 -9.681 1.00 1.70 O ATOM 2236 CB LYS B 66 4.040 2.819 -12.552 1.00 1.47 C ATOM 2237 CG LYS B 66 3.516 1.649 -11.731 1.00 1.36 C ATOM 2238 CD LYS B 66 3.641 0.338 -12.490 1.00 1.60 C ATOM 2239 CE LYS B 66 3.223 -0.846 -11.632 1.00 1.69 C ATOM 2240 NZ LYS B 66 1.746 -0.926 -11.483 1.00 1.83 N ATOM 0 H LYS B 66 5.569 2.691 -10.116 1.00 1.17 H new ATOM 0 HA LYS B 66 5.351 4.523 -12.408 1.00 1.37 H new ATOM 0 HB2 LYS B 66 3.197 3.345 -13.000 1.00 1.47 H new ATOM 0 HB3 LYS B 66 4.648 2.435 -13.371 1.00 1.47 H new ATOM 0 HG2 LYS B 66 4.070 1.583 -10.794 1.00 1.36 H new ATOM 0 HG3 LYS B 66 2.472 1.823 -11.472 1.00 1.36 H new ATOM 0 HD2 LYS B 66 3.022 0.375 -13.387 1.00 1.60 H new ATOM 0 HD3 LYS B 66 4.671 0.204 -12.819 1.00 1.60 H new ATOM 0 HE2 LYS B 66 3.594 -1.768 -12.080 1.00 1.69 H new ATOM 0 HE3 LYS B 66 3.684 -0.762 -10.648 1.00 1.69 H new ATOM 0 HZ1 LYS B 66 1.512 -1.462 -10.623 1.00 1.83 H new ATOM 0 HZ2 LYS B 66 1.352 0.034 -11.411 1.00 1.83 H new ATOM 0 HZ3 LYS B 66 1.339 -1.406 -12.311 1.00 1.83 H new ATOM 2254 N THR B 67 2.770 4.901 -11.223 1.00 1.37 N ATOM 2255 CA THR B 67 1.815 5.653 -10.423 1.00 1.48 C ATOM 2256 C THR B 67 1.425 4.900 -9.151 1.00 1.26 C ATOM 2257 O THR B 67 1.015 5.502 -8.159 1.00 1.44 O ATOM 2258 CB THR B 67 0.549 5.933 -11.248 1.00 1.81 C ATOM 2259 OG1 THR B 67 0.582 5.155 -12.458 1.00 2.26 O ATOM 2260 CG2 THR B 67 0.442 7.412 -11.585 1.00 2.36 C ATOM 0 H THR B 67 2.418 4.623 -12.139 1.00 1.37 H new ATOM 0 HA THR B 67 2.293 6.589 -10.135 1.00 1.48 H new ATOM 0 HB THR B 67 -0.323 5.652 -10.657 1.00 1.81 H new ATOM 0 HG1 THR B 67 -0.226 5.332 -12.983 1.00 2.26 H new ATOM 0 HG21 THR B 67 -0.461 7.588 -12.169 1.00 2.36 H new ATOM 0 HG22 THR B 67 0.397 7.993 -10.664 1.00 2.36 H new ATOM 0 HG23 THR B 67 1.314 7.717 -12.164 1.00 2.36 H new ATOM 2268 N ASP B 68 1.554 3.582 -9.193 1.00 1.08 N ATOM 2269 CA ASP B 68 1.213 2.736 -8.059 1.00 1.03 C ATOM 2270 C ASP B 68 2.416 1.916 -7.629 1.00 1.00 C ATOM 2271 O ASP B 68 2.800 0.953 -8.296 1.00 1.39 O ATOM 2272 CB ASP B 68 0.051 1.799 -8.404 1.00 1.15 C ATOM 2273 CG ASP B 68 -0.284 1.802 -9.880 1.00 1.01 C ATOM 2274 OD1 ASP B 68 0.478 1.200 -10.664 1.00 1.17 O ATOM 2275 OD2 ASP B 68 -1.304 2.422 -10.256 1.00 1.37 O ATOM 0 H ASP B 68 1.895 3.072 -10.008 1.00 1.08 H new ATOM 0 HA ASP B 68 0.908 3.385 -7.238 1.00 1.03 H new ATOM 0 HB2 ASP B 68 0.304 0.785 -8.095 1.00 1.15 H new ATOM 0 HB3 ASP B 68 -0.830 2.095 -7.835 1.00 1.15 H new ATOM 2280 N ASP B 69 3.016 2.321 -6.530 1.00 0.68 N ATOM 2281 CA ASP B 69 4.169 1.634 -5.982 1.00 0.75 C ATOM 2282 C ASP B 69 3.840 1.116 -4.587 1.00 0.68 C ATOM 2283 O ASP B 69 3.456 1.876 -3.703 1.00 0.72 O ATOM 2284 CB ASP B 69 5.394 2.563 -5.953 1.00 0.81 C ATOM 2285 CG ASP B 69 5.134 3.901 -5.275 1.00 1.52 C ATOM 2286 OD1 ASP B 69 4.219 4.643 -5.715 1.00 2.01 O ATOM 2287 OD2 ASP B 69 5.850 4.221 -4.310 1.00 2.28 O ATOM 0 H ASP B 69 2.720 3.135 -5.991 1.00 0.68 H new ATOM 0 HA ASP B 69 4.415 0.786 -6.621 1.00 0.75 H new ATOM 0 HB2 ASP B 69 6.210 2.057 -5.437 1.00 0.81 H new ATOM 0 HB3 ASP B 69 5.726 2.743 -6.975 1.00 0.81 H new ATOM 2292 N LEU B 70 3.969 -0.186 -4.395 1.00 0.62 N ATOM 2293 CA LEU B 70 3.661 -0.787 -3.108 1.00 0.60 C ATOM 2294 C LEU B 70 4.770 -1.723 -2.646 1.00 0.57 C ATOM 2295 O LEU B 70 5.357 -2.467 -3.438 1.00 0.62 O ATOM 2296 CB LEU B 70 2.277 -1.491 -3.131 1.00 0.67 C ATOM 2297 CG LEU B 70 2.101 -2.779 -3.981 1.00 0.72 C ATOM 2298 CD1 LEU B 70 2.762 -2.674 -5.349 1.00 1.14 C ATOM 2299 CD2 LEU B 70 2.609 -4.008 -3.231 1.00 0.98 C ATOM 0 H LEU B 70 4.283 -0.844 -5.109 1.00 0.62 H new ATOM 0 HA LEU B 70 3.601 0.017 -2.375 1.00 0.60 H new ATOM 0 HB2 LEU B 70 2.016 -1.738 -2.102 1.00 0.67 H new ATOM 0 HB3 LEU B 70 1.544 -0.764 -3.480 1.00 0.67 H new ATOM 0 HG LEU B 70 1.030 -2.892 -4.152 1.00 0.72 H new ATOM 0 HD11 LEU B 70 2.608 -3.602 -5.900 1.00 1.14 H new ATOM 0 HD12 LEU B 70 2.321 -1.845 -5.903 1.00 1.14 H new ATOM 0 HD13 LEU B 70 3.831 -2.500 -5.224 1.00 1.14 H new ATOM 0 HD21 LEU B 70 2.473 -4.894 -3.851 1.00 0.98 H new ATOM 0 HD22 LEU B 70 3.668 -3.883 -3.003 1.00 0.98 H new ATOM 0 HD23 LEU B 70 2.050 -4.125 -2.303 1.00 0.98 H new ATOM 2311 N LEU B 71 5.053 -1.667 -1.355 1.00 0.55 N ATOM 2312 CA LEU B 71 6.086 -2.490 -0.749 1.00 0.53 C ATOM 2313 C LEU B 71 5.511 -3.254 0.439 1.00 0.56 C ATOM 2314 O LEU B 71 4.952 -2.655 1.364 1.00 0.63 O ATOM 2315 CB LEU B 71 7.270 -1.625 -0.292 1.00 0.55 C ATOM 2316 CG LEU B 71 8.473 -1.594 -1.243 1.00 0.57 C ATOM 2317 CD1 LEU B 71 8.101 -0.970 -2.579 1.00 0.64 C ATOM 2318 CD2 LEU B 71 9.623 -0.828 -0.608 1.00 0.60 C ATOM 0 H LEU B 71 4.574 -1.051 -0.699 1.00 0.55 H new ATOM 0 HA LEU B 71 6.444 -3.200 -1.494 1.00 0.53 H new ATOM 0 HB2 LEU B 71 6.917 -0.604 -0.148 1.00 0.55 H new ATOM 0 HB3 LEU B 71 7.607 -1.986 0.680 1.00 0.55 H new ATOM 0 HG LEU B 71 8.787 -2.622 -1.426 1.00 0.57 H new ATOM 0 HD11 LEU B 71 8.974 -0.962 -3.232 1.00 0.64 H new ATOM 0 HD12 LEU B 71 7.305 -1.552 -3.044 1.00 0.64 H new ATOM 0 HD13 LEU B 71 7.757 0.052 -2.420 1.00 0.64 H new ATOM 0 HD21 LEU B 71 10.472 -0.812 -1.292 1.00 0.60 H new ATOM 0 HD22 LEU B 71 9.307 0.194 -0.398 1.00 0.60 H new ATOM 0 HD23 LEU B 71 9.916 -1.316 0.322 1.00 0.60 H new ATOM 2330 N LEU B 72 5.628 -4.573 0.401 1.00 0.54 N ATOM 2331 CA LEU B 72 5.115 -5.415 1.472 1.00 0.59 C ATOM 2332 C LEU B 72 6.258 -5.959 2.317 1.00 0.59 C ATOM 2333 O LEU B 72 7.241 -6.485 1.793 1.00 0.57 O ATOM 2334 CB LEU B 72 4.286 -6.564 0.892 1.00 0.65 C ATOM 2335 CG LEU B 72 3.026 -6.136 0.134 1.00 0.75 C ATOM 2336 CD1 LEU B 72 2.468 -7.304 -0.663 1.00 1.14 C ATOM 2337 CD2 LEU B 72 1.976 -5.601 1.099 1.00 1.13 C ATOM 0 H LEU B 72 6.074 -5.084 -0.361 1.00 0.54 H new ATOM 0 HA LEU B 72 4.473 -4.810 2.111 1.00 0.59 H new ATOM 0 HB2 LEU B 72 4.917 -7.143 0.219 1.00 0.65 H new ATOM 0 HB3 LEU B 72 3.994 -7.228 1.706 1.00 0.65 H new ATOM 0 HG LEU B 72 3.294 -5.338 -0.558 1.00 0.75 H new ATOM 0 HD11 LEU B 72 1.573 -6.986 -1.197 1.00 1.14 H new ATOM 0 HD12 LEU B 72 3.215 -7.646 -1.379 1.00 1.14 H new ATOM 0 HD13 LEU B 72 2.216 -8.119 0.015 1.00 1.14 H new ATOM 0 HD21 LEU B 72 1.088 -5.302 0.542 1.00 1.13 H new ATOM 0 HD22 LEU B 72 1.710 -6.379 1.815 1.00 1.13 H new ATOM 0 HD23 LEU B 72 2.377 -4.739 1.632 1.00 1.13 H new ATOM 2349 N ILE B 73 6.126 -5.810 3.623 1.00 0.63 N ATOM 2350 CA ILE B 73 7.140 -6.280 4.556 1.00 0.66 C ATOM 2351 C ILE B 73 6.745 -7.627 5.149 1.00 0.76 C ATOM 2352 O ILE B 73 5.718 -7.743 5.819 1.00 0.84 O ATOM 2353 CB ILE B 73 7.369 -5.269 5.701 1.00 0.72 C ATOM 2354 CG1 ILE B 73 7.601 -3.863 5.135 1.00 0.68 C ATOM 2355 CG2 ILE B 73 8.547 -5.696 6.570 1.00 0.81 C ATOM 2356 CD1 ILE B 73 8.828 -3.744 4.249 1.00 0.64 C ATOM 0 H ILE B 73 5.322 -5.365 4.066 1.00 0.63 H new ATOM 0 HA ILE B 73 8.067 -6.387 3.994 1.00 0.66 H new ATOM 0 HB ILE B 73 6.475 -5.249 6.324 1.00 0.72 H new ATOM 0 HG12 ILE B 73 6.723 -3.564 4.562 1.00 0.68 H new ATOM 0 HG13 ILE B 73 7.695 -3.161 5.963 1.00 0.68 H new ATOM 0 HG21 ILE B 73 8.691 -4.970 7.370 1.00 0.81 H new ATOM 0 HG22 ILE B 73 8.344 -6.676 7.001 1.00 0.81 H new ATOM 0 HG23 ILE B 73 9.449 -5.747 5.960 1.00 0.81 H new ATOM 0 HD11 ILE B 73 8.920 -2.719 3.890 1.00 0.64 H new ATOM 0 HD12 ILE B 73 9.717 -4.009 4.821 1.00 0.64 H new ATOM 0 HD13 ILE B 73 8.730 -4.419 3.399 1.00 0.64 H new ATOM 2368 N ARG B 74 7.554 -8.642 4.885 1.00 0.79 N ATOM 2369 CA ARG B 74 7.291 -9.979 5.390 1.00 0.91 C ATOM 2370 C ARG B 74 8.594 -10.663 5.794 1.00 0.93 C ATOM 2371 O ARG B 74 9.619 -10.000 5.988 1.00 0.89 O ATOM 2372 CB ARG B 74 6.543 -10.804 4.336 1.00 0.99 C ATOM 2373 CG ARG B 74 5.076 -10.420 4.203 1.00 1.05 C ATOM 2374 CD ARG B 74 4.171 -11.637 4.115 1.00 1.29 C ATOM 2375 NE ARG B 74 2.932 -11.447 4.872 1.00 1.54 N ATOM 2376 CZ ARG B 74 1.855 -12.227 4.752 1.00 1.55 C ATOM 2377 NH1 ARG B 74 1.860 -13.236 3.892 1.00 1.53 N ATOM 2378 NH2 ARG B 74 0.780 -11.999 5.495 1.00 1.89 N ATOM 0 H ARG B 74 8.401 -8.563 4.322 1.00 0.79 H new ATOM 0 HA ARG B 74 6.661 -9.903 6.277 1.00 0.91 H new ATOM 0 HB2 ARG B 74 7.034 -10.679 3.371 1.00 0.99 H new ATOM 0 HB3 ARG B 74 6.613 -11.861 4.594 1.00 0.99 H new ATOM 0 HG2 ARG B 74 4.782 -9.812 5.058 1.00 1.05 H new ATOM 0 HG3 ARG B 74 4.942 -9.805 3.313 1.00 1.05 H new ATOM 0 HD2 ARG B 74 3.932 -11.838 3.071 1.00 1.29 H new ATOM 0 HD3 ARG B 74 4.699 -12.511 4.495 1.00 1.29 H new ATOM 0 HE ARG B 74 2.889 -10.671 5.532 1.00 1.54 H new ATOM 0 HH11 ARG B 74 2.687 -13.416 3.322 1.00 1.53 H new ATOM 0 HH12 ARG B 74 1.037 -13.832 3.800 1.00 1.53 H new ATOM 0 HH21 ARG B 74 0.775 -11.226 6.160 1.00 1.89 H new ATOM 0 HH22 ARG B 74 -0.041 -12.597 5.401 1.00 1.89 H new ATOM 2392 N GLY B 75 8.549 -11.980 5.946 1.00 1.03 N ATOM 2393 CA GLY B 75 9.732 -12.722 6.328 1.00 1.08 C ATOM 2394 C GLY B 75 9.786 -12.986 7.820 1.00 1.15 C ATOM 2395 O GLY B 75 8.911 -13.659 8.370 1.00 1.24 O ATOM 0 H GLY B 75 7.712 -12.548 5.811 1.00 1.03 H new ATOM 0 HA2 GLY B 75 9.752 -13.671 5.792 1.00 1.08 H new ATOM 0 HA3 GLY B 75 10.620 -12.167 6.027 1.00 1.08 H new ATOM 2399 N LYS B 76 10.816 -12.450 8.473 1.00 1.15 N ATOM 2400 CA LYS B 76 11.012 -12.603 9.914 1.00 1.25 C ATOM 2401 C LYS B 76 11.370 -14.042 10.275 1.00 1.34 C ATOM 2402 O LYS B 76 12.520 -14.453 10.133 1.00 1.36 O ATOM 2403 CB LYS B 76 9.772 -12.156 10.701 1.00 1.30 C ATOM 2404 CG LYS B 76 9.747 -10.672 11.028 1.00 1.29 C ATOM 2405 CD LYS B 76 10.860 -10.283 11.991 1.00 1.33 C ATOM 2406 CE LYS B 76 10.669 -10.924 13.355 1.00 1.42 C ATOM 2407 NZ LYS B 76 11.728 -10.511 14.308 1.00 1.50 N ATOM 0 H LYS B 76 11.540 -11.896 8.016 1.00 1.15 H new ATOM 0 HA LYS B 76 11.846 -11.958 10.192 1.00 1.25 H new ATOM 0 HB2 LYS B 76 8.880 -12.406 10.126 1.00 1.30 H new ATOM 0 HB3 LYS B 76 9.721 -12.723 11.631 1.00 1.30 H new ATOM 0 HG2 LYS B 76 9.846 -10.096 10.108 1.00 1.29 H new ATOM 0 HG3 LYS B 76 8.782 -10.413 11.465 1.00 1.29 H new ATOM 0 HD2 LYS B 76 11.822 -10.586 11.578 1.00 1.33 H new ATOM 0 HD3 LYS B 76 10.886 -9.199 12.098 1.00 1.33 H new ATOM 0 HE2 LYS B 76 9.693 -10.648 13.754 1.00 1.42 H new ATOM 0 HE3 LYS B 76 10.676 -12.009 13.251 1.00 1.42 H new ATOM 0 HZ1 LYS B 76 11.565 -10.968 15.228 1.00 1.50 H new ATOM 0 HZ2 LYS B 76 12.657 -10.797 13.939 1.00 1.50 H new ATOM 0 HZ3 LYS B 76 11.705 -9.478 14.426 1.00 1.50 H new ATOM 2421 N ILE B 77 10.382 -14.808 10.728 1.00 1.53 N ATOM 2422 CA ILE B 77 10.612 -16.190 11.125 1.00 1.63 C ATOM 2423 C ILE B 77 9.747 -17.150 10.305 1.00 1.66 C ATOM 2424 O ILE B 77 10.220 -17.747 9.338 1.00 1.70 O ATOM 2425 CB ILE B 77 10.338 -16.402 12.635 1.00 1.76 C ATOM 2426 CG1 ILE B 77 11.098 -15.360 13.467 1.00 1.80 C ATOM 2427 CG2 ILE B 77 10.739 -17.813 13.055 1.00 1.87 C ATOM 2428 CD1 ILE B 77 10.782 -15.408 14.946 1.00 1.94 C ATOM 0 H ILE B 77 9.417 -14.494 10.829 1.00 1.53 H new ATOM 0 HA ILE B 77 11.663 -16.406 10.931 1.00 1.63 H new ATOM 0 HB ILE B 77 9.270 -16.278 12.815 1.00 1.76 H new ATOM 0 HG12 ILE B 77 12.169 -15.510 13.329 1.00 1.80 H new ATOM 0 HG13 ILE B 77 10.864 -14.365 13.087 1.00 1.80 H new ATOM 0 HG21 ILE B 77 10.540 -17.946 14.118 1.00 1.87 H new ATOM 0 HG22 ILE B 77 10.162 -18.540 12.484 1.00 1.87 H new ATOM 0 HG23 ILE B 77 11.802 -17.962 12.863 1.00 1.87 H new ATOM 0 HD11 ILE B 77 11.358 -14.642 15.466 1.00 1.94 H new ATOM 0 HD12 ILE B 77 9.718 -15.227 15.097 1.00 1.94 H new ATOM 0 HD13 ILE B 77 11.043 -16.389 15.342 1.00 1.94 H new ATOM 2440 N SER B 78 8.479 -17.282 10.684 1.00 1.67 N ATOM 2441 CA SER B 78 7.561 -18.176 9.987 1.00 1.74 C ATOM 2442 C SER B 78 7.032 -17.531 8.708 1.00 1.68 C ATOM 2443 O SER B 78 5.888 -17.069 8.650 1.00 1.71 O ATOM 2444 CB SER B 78 6.407 -18.569 10.909 1.00 1.83 C ATOM 2445 OG SER B 78 6.895 -19.125 12.123 1.00 2.24 O ATOM 0 H SER B 78 8.064 -16.781 11.470 1.00 1.67 H new ATOM 0 HA SER B 78 8.107 -19.076 9.705 1.00 1.74 H new ATOM 0 HB2 SER B 78 5.795 -17.694 11.125 1.00 1.83 H new ATOM 0 HB3 SER B 78 5.764 -19.291 10.406 1.00 1.83 H new ATOM 0 HG SER B 78 6.140 -19.368 12.698 1.00 2.24 H new ATOM 2451 N ASN B 79 7.887 -17.505 7.694 1.00 1.63 N ATOM 2452 CA ASN B 79 7.562 -16.931 6.393 1.00 1.59 C ATOM 2453 C ASN B 79 8.753 -17.103 5.460 1.00 1.63 C ATOM 2454 O ASN B 79 8.601 -17.508 4.305 1.00 1.77 O ATOM 2455 CB ASN B 79 7.217 -15.438 6.515 1.00 1.43 C ATOM 2456 CG ASN B 79 6.514 -14.864 5.289 1.00 1.41 C ATOM 2457 OD1 ASN B 79 5.761 -13.899 5.401 1.00 1.57 O ATOM 2458 ND2 ASN B 79 6.754 -15.436 4.118 1.00 1.30 N ATOM 0 H ASN B 79 8.832 -17.884 7.751 1.00 1.63 H new ATOM 0 HA ASN B 79 6.691 -17.450 5.993 1.00 1.59 H new ATOM 0 HB2 ASN B 79 6.581 -15.292 7.388 1.00 1.43 H new ATOM 0 HB3 ASN B 79 8.134 -14.876 6.692 1.00 1.43 H new ATOM 0 HD21 ASN B 79 6.308 -15.077 3.274 1.00 1.30 H new ATOM 0 HD22 ASN B 79 7.385 -16.236 4.061 1.00 1.30 H new ATOM 2465 N SER B 80 9.940 -16.797 5.969 1.00 1.56 N ATOM 2466 CA SER B 80 11.161 -16.911 5.187 1.00 1.65 C ATOM 2467 C SER B 80 11.419 -18.367 4.811 1.00 1.60 C ATOM 2468 O SER B 80 11.449 -19.220 5.721 1.00 1.59 O ATOM 2469 CB SER B 80 12.344 -16.341 5.974 1.00 1.68 C ATOM 2470 OG SER B 80 12.068 -15.022 6.414 1.00 1.68 O ATOM 0 H SER B 80 10.081 -16.467 6.924 1.00 1.56 H new ATOM 0 HA SER B 80 11.044 -16.336 4.268 1.00 1.65 H new ATOM 0 HB2 SER B 80 12.556 -16.978 6.832 1.00 1.68 H new ATOM 0 HB3 SER B 80 13.237 -16.341 5.348 1.00 1.68 H new ATOM 0 HG SER B 80 12.483 -14.379 5.801 1.00 1.68 H new TER 2476 SER B 80