USER MOD reduce.3.24.130724 H: found=0, std=0, add=1276, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1068 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 GLN : amide:sc= -0.839 K(o=-0.84,f=-4.5!) USER MOD Set 1.2: A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 85 GLN : amide:sc= -2.17 K(o=-2.3,f=-8.6!) USER MOD Set 2.2: A 148 THR OG1 : rot 162:sc= -0.086! USER MOD Set 3.1: A 21 SER OG : rot -13:sc= 0.844 USER MOD Set 3.2: A 27 ASN : amide:sc= -1.32 K(o=-0.48,f=-3.3!) USER MOD Set 4.1: A 8 LYS NZ :NH3+ -111:sc= -0.0981 (180deg=-0.321) USER MOD Set 4.2: A 9 ASN : amide:sc= -0.187 K(o=-0.29,f=-1.7!) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0272 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -5 MET N :NH3+ 150:sc= -0.0762 (180deg=-1.11) USER MOD Single : A 10 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 11 THR OG1 : rot -13:sc= 0.571 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.971 K(o=-0.97,f=-7.3!) USER MOD Single : A 17 MET CE :methyl 180:sc= -2.56! (180deg=-2.56!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 114:sc= 1.91 USER MOD Single : A 22 SER OG : rot -53:sc= 0.524 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -6.2 X(o=-6.2,f=-6.1) USER MOD Single : A 42 ASN : amide:sc= -2.34 K(o=-2.3,f=-5.7!) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= -0.0181 (180deg=-0.0181) USER MOD Single : A 47 ASN : amide:sc= -1.32 X(o=-1.3,f=-1.6) USER MOD Single : A 50 THR OG1 : rot 180:sc= -2.78! USER MOD Single : A 52 GLN :FLIP amide:sc= -0.994 F(o=-1.8,f=-0.99) USER MOD Single : A 53 SER OG : rot -48:sc= 0.106 USER MOD Single : A 54 ASN : amide:sc= -0.0717 K(o=-0.072,f=-1.2) USER MOD Single : A 55 SER OG : rot 180:sc= 0.119 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -1.19 K(o=-1.2,f=-4.7!) USER MOD Single : A 66 THR OG1 : rot -31:sc= 0.228 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.0148 K(o=-0.015,f=-0.58) USER MOD Single : A 71 THR OG1 : rot 130:sc= -0.238 USER MOD Single : A 75 THR OG1 : rot -100:sc= -1.46 USER MOD Single : A 76 GLN : amide:sc= -0.399 X(o=-0.4,f=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.0245 X(o=-0.025,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 143:sc= -1.22 (180deg=-2.79!) USER MOD Single : A 94 HIS : no HD1:sc= -2.17 X(o=-2.2,f=-2.5!) USER MOD Single : A 95 SER OG : rot 25:sc= 1.07 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc=-0.000621 USER MOD Single : A 114 GLN : amide:sc= -1.64 X(o=-1.6,f=-1.3) USER MOD Single : A 116 ASN : amide:sc= -3.53! C(o=-3.5!,f=-9!) USER MOD Single : A 119 ASN :FLIP amide:sc= -5.17! C(o=-7.9!,f=-5.2!) USER MOD Single : A 120 ASN : amide:sc=-0.00234 X(o=-0.0023,f=0) USER MOD Single : A 121 SER OG : rot -75:sc= 1.3 USER MOD Single : A 122 HIS : no HD1:sc= -0.311 K(o=-0.31,f=-2) USER MOD Single : A 123 LYS NZ :NH3+ -117:sc= -0.11 (180deg=-0.859) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -3.01! C(o=-3!,f=-8.4!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 MET CE :methyl -155:sc= -0.336 (180deg=-1.01) USER MOD Single : A 135 TYR OH : rot 0:sc= -0.23 USER MOD Single : A 142 SER OG : rot 180:sc=-0.00916 USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 ASN : amide:sc= -1.77 K(o=-1.8,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -5 9.474 26.985 -24.237 1.00 0.00 N ATOM 2 CA MET A -5 8.226 26.870 -24.983 1.00 52.33 C ATOM 3 C MET A -5 7.689 25.443 -24.927 1.00 34.32 C ATOM 4 O MET A -5 7.103 24.951 -25.890 1.00 3.43 O ATOM 5 CB MET A -5 8.437 27.290 -26.438 1.00 53.14 C ATOM 6 CG MET A -5 9.679 26.688 -27.072 1.00 5.42 C ATOM 7 SD MET A -5 10.952 27.918 -27.414 1.00 61.31 S ATOM 8 CE MET A -5 11.426 27.462 -29.079 1.00 42.33 C ATOM 0 H1 MET A -5 10.066 27.726 -24.664 1.00 0.00 H new ATOM 0 H2 MET A -5 9.266 27.234 -23.249 1.00 0.00 H new ATOM 0 H3 MET A -5 9.981 26.077 -24.266 1.00 0.00 H new ATOM 0 HA MET A -5 7.494 27.534 -24.523 1.00 52.33 H new ATOM 0 HB2 MET A -5 7.564 26.998 -27.022 1.00 53.14 H new ATOM 0 HB3 MET A -5 8.505 28.377 -26.487 1.00 53.14 H new ATOM 0 HG2 MET A -5 10.086 25.924 -26.409 1.00 5.42 H new ATOM 0 HG3 MET A -5 9.402 26.189 -28.001 1.00 5.42 H new ATOM 0 HE1 MET A -5 12.209 28.134 -29.431 1.00 42.33 H new ATOM 0 HE2 MET A -5 11.798 26.437 -29.084 1.00 42.33 H new ATOM 0 HE3 MET A -5 10.560 27.537 -29.737 1.00 42.33 H new ATOM 16 N LYS A -4 7.892 24.784 -23.791 1.00 21.13 N ATOM 17 CA LYS A -4 7.427 23.414 -23.607 1.00 53.50 C ATOM 18 C LYS A -4 6.348 23.345 -22.532 1.00 74.13 C ATOM 19 O LYS A -4 6.033 24.347 -21.890 1.00 41.44 O ATOM 20 CB LYS A -4 8.597 22.503 -23.229 1.00 11.24 C ATOM 21 CG LYS A -4 8.652 21.217 -24.036 1.00 73.20 C ATOM 22 CD LYS A -4 8.645 19.993 -23.134 1.00 11.31 C ATOM 23 CE LYS A -4 8.665 18.705 -23.944 1.00 34.31 C ATOM 24 NZ LYS A -4 7.505 17.829 -23.618 1.00 3.54 N ATOM 0 H LYS A -4 8.376 25.177 -22.983 1.00 21.13 H new ATOM 0 HA LYS A -4 6.998 23.073 -24.549 1.00 53.50 H new ATOM 0 HB2 LYS A -4 9.531 23.049 -23.367 1.00 11.24 H new ATOM 0 HB3 LYS A -4 8.526 22.255 -22.170 1.00 11.24 H new ATOM 0 HG2 LYS A -4 7.800 21.175 -24.715 1.00 73.20 H new ATOM 0 HG3 LYS A -4 9.551 21.211 -24.652 1.00 73.20 H new ATOM 0 HD2 LYS A -4 9.511 20.022 -22.473 1.00 11.31 H new ATOM 0 HD3 LYS A -4 7.759 20.012 -22.500 1.00 11.31 H new ATOM 0 HE2 LYS A -4 8.653 18.944 -25.007 1.00 34.31 H new ATOM 0 HE3 LYS A -4 9.593 18.167 -23.749 1.00 34.31 H new ATOM 0 HZ1 LYS A -4 7.554 16.962 -24.190 1.00 3.54 H new ATOM 0 HZ2 LYS A -4 7.531 17.580 -22.609 1.00 3.54 H new ATOM 0 HZ3 LYS A -4 6.620 18.333 -23.828 1.00 3.54 H new ATOM 34 N SER A -3 5.786 22.156 -22.340 1.00 75.12 N ATOM 35 CA SER A -3 4.740 21.958 -21.343 1.00 32.42 C ATOM 36 C SER A -3 4.908 20.615 -20.639 1.00 31.50 C ATOM 37 O SER A -3 5.550 19.704 -21.160 1.00 31.31 O ATOM 38 CB SER A -3 3.360 22.033 -21.999 1.00 61.11 C ATOM 39 OG SER A -3 2.482 22.854 -21.249 1.00 11.32 O ATOM 0 H SER A -3 6.037 21.316 -22.861 1.00 75.12 H new ATOM 0 HA SER A -3 4.825 22.751 -20.600 1.00 32.42 H new ATOM 0 HB2 SER A -3 3.456 22.427 -23.011 1.00 61.11 H new ATOM 0 HB3 SER A -3 2.940 21.031 -22.086 1.00 61.11 H new ATOM 0 HG SER A -3 1.608 22.887 -21.690 1.00 11.32 H new ATOM 44 N GLY A -2 4.325 20.500 -19.449 1.00 24.31 N ATOM 45 CA GLY A -2 4.422 19.266 -18.692 1.00 61.14 C ATOM 46 C GLY A -2 3.088 18.556 -18.568 1.00 11.12 C ATOM 47 O GLY A -2 2.277 18.890 -17.704 1.00 42.21 O ATOM 0 H GLY A -2 3.788 21.239 -18.996 1.00 24.31 H new ATOM 0 HA2 GLY A -2 5.140 18.603 -19.175 1.00 61.14 H new ATOM 0 HA3 GLY A -2 4.808 19.483 -17.696 1.00 61.14 H new ATOM 51 N HIS A -1 2.860 17.574 -19.434 1.00 43.13 N ATOM 52 CA HIS A -1 1.614 16.815 -19.419 1.00 32.21 C ATOM 53 C HIS A -1 1.671 15.699 -18.381 1.00 22.43 C ATOM 54 O HIS A -1 0.756 15.540 -17.574 1.00 12.20 O ATOM 55 CB HIS A -1 1.333 16.227 -20.802 1.00 13.22 C ATOM 56 CG HIS A -1 -0.119 16.226 -21.169 1.00 20.11 C ATOM 57 ND1 HIS A -1 -1.089 15.622 -20.397 1.00 40.34 N ATOM 58 CD2 HIS A -1 -0.765 16.761 -22.231 1.00 42.41 C ATOM 59 CE1 HIS A -1 -2.269 15.785 -20.970 1.00 10.05 C ATOM 60 NE2 HIS A -1 -2.099 16.473 -22.085 1.00 31.52 N ATOM 0 H HIS A -1 3.521 17.285 -20.155 1.00 43.13 H new ATOM 0 HA HIS A -1 0.806 17.496 -19.151 1.00 32.21 H new ATOM 0 HB2 HIS A -1 1.888 16.795 -21.549 1.00 13.22 H new ATOM 0 HB3 HIS A -1 1.709 15.204 -20.836 1.00 13.22 H new ATOM 0 HD2 HIS A -1 -0.314 17.312 -23.043 1.00 42.41 H new ATOM 0 HE1 HIS A -1 -3.212 15.418 -20.591 1.00 10.05 H new ATOM 0 HE2 HIS A -1 -2.839 16.746 -22.732 1.00 31.52 H new ATOM 67 N GLY A 0 2.752 14.925 -18.408 1.00 13.33 N ATOM 68 CA GLY A 0 2.908 13.833 -17.465 1.00 12.41 C ATOM 69 C GLY A 0 2.903 14.305 -16.025 1.00 54.14 C ATOM 70 O GLY A 0 3.669 15.195 -15.652 1.00 23.23 O ATOM 0 H GLY A 0 3.523 15.035 -19.067 1.00 13.33 H new ATOM 0 HA2 GLY A 0 2.102 13.113 -17.611 1.00 12.41 H new ATOM 0 HA3 GLY A 0 3.843 13.311 -17.670 1.00 12.41 H new ATOM 74 N CYS A 1 2.035 13.711 -15.212 1.00 44.24 N ATOM 75 CA CYS A 1 1.931 14.077 -13.805 1.00 3.01 C ATOM 76 C CYS A 1 2.256 12.886 -12.908 1.00 42.32 C ATOM 77 O CYS A 1 2.395 13.031 -11.694 1.00 20.25 O ATOM 78 CB CYS A 1 0.524 14.595 -13.494 1.00 13.23 C ATOM 79 SG CYS A 1 0.364 15.368 -11.853 1.00 63.52 S ATOM 0 H CYS A 1 1.393 12.974 -15.504 1.00 44.24 H new ATOM 0 HA CYS A 1 2.655 14.868 -13.606 1.00 3.01 H new ATOM 0 HB2 CYS A 1 0.239 15.321 -14.255 1.00 13.23 H new ATOM 0 HB3 CYS A 1 -0.181 13.766 -13.564 1.00 13.23 H new ATOM 83 N SER A 2 2.374 11.710 -13.515 1.00 5.35 N ATOM 84 CA SER A 2 2.680 10.493 -12.772 1.00 63.54 C ATOM 85 C SER A 2 4.140 10.094 -12.959 1.00 2.34 C ATOM 86 O SER A 2 4.501 9.470 -13.957 1.00 31.35 O ATOM 87 CB SER A 2 1.766 9.352 -13.223 1.00 61.34 C ATOM 88 OG SER A 2 1.461 9.458 -14.603 1.00 73.22 O ATOM 0 H SER A 2 2.262 11.574 -14.520 1.00 5.35 H new ATOM 0 HA SER A 2 2.509 10.690 -11.714 1.00 63.54 H new ATOM 0 HB2 SER A 2 2.250 8.395 -13.027 1.00 61.34 H new ATOM 0 HB3 SER A 2 0.844 9.369 -12.641 1.00 61.34 H new ATOM 0 HG SER A 2 0.877 8.716 -14.867 1.00 73.22 H new ATOM 93 N GLU A 3 4.976 10.459 -11.992 1.00 44.51 N ATOM 94 CA GLU A 3 6.398 10.140 -12.050 1.00 40.21 C ATOM 95 C GLU A 3 6.769 9.116 -10.982 1.00 15.34 C ATOM 96 O GLU A 3 6.125 9.008 -9.939 1.00 11.41 O ATOM 97 CB GLU A 3 7.235 11.408 -11.872 1.00 15.20 C ATOM 98 CG GLU A 3 6.712 12.600 -12.656 1.00 63.11 C ATOM 99 CD GLU A 3 6.734 12.366 -14.154 1.00 51.12 C ATOM 100 OE1 GLU A 3 7.842 12.281 -14.724 1.00 40.21 O ATOM 101 OE2 GLU A 3 5.644 12.270 -14.757 1.00 25.45 O ATOM 0 H GLU A 3 4.693 10.976 -11.159 1.00 44.51 H new ATOM 0 HA GLU A 3 6.609 9.710 -13.029 1.00 40.21 H new ATOM 0 HB2 GLU A 3 7.267 11.666 -10.813 1.00 15.20 H new ATOM 0 HB3 GLU A 3 8.260 11.203 -12.181 1.00 15.20 H new ATOM 0 HG2 GLU A 3 5.692 12.818 -12.341 1.00 63.11 H new ATOM 0 HG3 GLU A 3 7.313 13.478 -12.420 1.00 63.11 H new ATOM 106 N PRO A 4 7.835 8.345 -11.247 1.00 52.23 N ATOM 107 CA PRO A 4 8.318 7.317 -10.322 1.00 21.31 C ATOM 108 C PRO A 4 8.940 7.914 -9.064 1.00 21.32 C ATOM 109 O PRO A 4 8.799 9.108 -8.797 1.00 21.40 O ATOM 110 CB PRO A 4 9.375 6.572 -11.140 1.00 10.04 C ATOM 111 CG PRO A 4 9.844 7.565 -12.147 1.00 21.41 C ATOM 112 CD PRO A 4 8.651 8.420 -12.471 1.00 60.34 C ATOM 0 HA PRO A 4 7.510 6.680 -9.963 1.00 21.31 H new ATOM 0 HB2 PRO A 4 10.196 6.230 -10.509 1.00 10.04 H new ATOM 0 HB3 PRO A 4 8.954 5.689 -11.621 1.00 10.04 H new ATOM 0 HG2 PRO A 4 10.660 8.168 -11.750 1.00 21.41 H new ATOM 0 HG3 PRO A 4 10.221 7.067 -13.040 1.00 21.41 H new ATOM 0 HD2 PRO A 4 8.942 9.446 -12.698 1.00 60.34 H new ATOM 0 HD3 PRO A 4 8.110 8.043 -13.339 1.00 60.34 H new ATOM 117 N LEU A 5 9.629 7.077 -8.296 1.00 32.13 N ATOM 118 CA LEU A 5 10.274 7.523 -7.066 1.00 14.22 C ATOM 119 C LEU A 5 11.768 7.220 -7.094 1.00 11.23 C ATOM 120 O LEU A 5 12.501 7.572 -6.171 1.00 71.11 O ATOM 121 CB LEU A 5 9.628 6.849 -5.854 1.00 11.30 C ATOM 122 CG LEU A 5 9.316 5.359 -6.003 1.00 73.02 C ATOM 123 CD1 LEU A 5 8.096 5.155 -6.887 1.00 44.30 C ATOM 124 CD2 LEU A 5 10.518 4.616 -6.568 1.00 72.32 C ATOM 0 H LEU A 5 9.755 6.086 -8.503 1.00 32.13 H new ATOM 0 HA LEU A 5 10.142 8.602 -6.987 1.00 14.22 H new ATOM 0 HB2 LEU A 5 10.289 6.978 -4.997 1.00 11.30 H new ATOM 0 HB3 LEU A 5 8.700 7.373 -5.623 1.00 11.30 H new ATOM 0 HG LEU A 5 9.095 4.953 -5.016 1.00 73.02 H new ATOM 0 HD11 LEU A 5 7.889 4.089 -6.982 1.00 44.30 H new ATOM 0 HD12 LEU A 5 7.236 5.653 -6.440 1.00 44.30 H new ATOM 0 HD13 LEU A 5 8.287 5.576 -7.874 1.00 44.30 H new ATOM 0 HD21 LEU A 5 10.278 3.557 -6.667 1.00 72.32 H new ATOM 0 HD22 LEU A 5 10.771 5.024 -7.547 1.00 72.32 H new ATOM 0 HD23 LEU A 5 11.368 4.734 -5.895 1.00 72.32 H new ATOM 135 N GLY A 6 12.214 6.566 -8.162 1.00 22.04 N ATOM 136 CA GLY A 6 13.620 6.228 -8.292 1.00 32.42 C ATOM 137 C GLY A 6 13.949 5.625 -9.643 1.00 35.43 C ATOM 138 O GLY A 6 14.873 4.819 -9.762 1.00 3.52 O ATOM 0 H GLY A 6 11.627 6.264 -8.940 1.00 22.04 H new ATOM 0 HA2 GLY A 6 14.221 7.125 -8.142 1.00 32.42 H new ATOM 0 HA3 GLY A 6 13.895 5.524 -7.507 1.00 32.42 H new ATOM 142 N LEU A 7 13.192 6.014 -10.662 1.00 60.22 N ATOM 143 CA LEU A 7 13.407 5.505 -12.012 1.00 4.42 C ATOM 144 C LEU A 7 13.378 6.639 -13.032 1.00 4.32 C ATOM 145 O LEU A 7 13.088 6.422 -14.210 1.00 21.13 O ATOM 146 CB LEU A 7 12.343 4.463 -12.361 1.00 25.44 C ATOM 147 CG LEU A 7 12.347 3.189 -11.514 1.00 12.14 C ATOM 148 CD1 LEU A 7 10.926 2.720 -11.249 1.00 25.54 C ATOM 149 CD2 LEU A 7 13.154 2.095 -12.198 1.00 51.22 C ATOM 0 H LEU A 7 12.424 6.680 -10.580 1.00 60.22 H new ATOM 0 HA LEU A 7 14.390 5.036 -12.045 1.00 4.42 H new ATOM 0 HB2 LEU A 7 11.362 4.931 -12.273 1.00 25.44 H new ATOM 0 HB3 LEU A 7 12.469 4.181 -13.406 1.00 25.44 H new ATOM 0 HG LEU A 7 12.818 3.414 -10.557 1.00 12.14 H new ATOM 0 HD11 LEU A 7 10.949 1.813 -10.645 1.00 25.54 H new ATOM 0 HD12 LEU A 7 10.380 3.498 -10.715 1.00 25.54 H new ATOM 0 HD13 LEU A 7 10.429 2.513 -12.196 1.00 25.54 H new ATOM 0 HD21 LEU A 7 13.145 1.197 -11.581 1.00 51.22 H new ATOM 0 HD22 LEU A 7 12.714 1.872 -13.170 1.00 51.22 H new ATOM 0 HD23 LEU A 7 14.182 2.432 -12.334 1.00 51.22 H new ATOM 160 N LYS A 8 13.682 7.848 -12.574 1.00 4.34 N ATOM 161 CA LYS A 8 13.695 9.016 -13.446 1.00 61.14 C ATOM 162 C LYS A 8 14.858 9.940 -13.101 1.00 73.34 C ATOM 163 O LYS A 8 15.857 9.989 -13.816 1.00 52.52 O ATOM 164 CB LYS A 8 12.372 9.778 -13.332 1.00 11.32 C ATOM 165 CG LYS A 8 12.327 11.046 -14.167 1.00 73.31 C ATOM 166 CD LYS A 8 12.448 10.741 -15.650 1.00 52.44 C ATOM 167 CE LYS A 8 13.733 11.311 -16.234 1.00 72.14 C ATOM 168 NZ LYS A 8 13.771 12.797 -16.142 1.00 20.32 N ATOM 0 H LYS A 8 13.923 8.045 -11.603 1.00 4.34 H new ATOM 0 HA LYS A 8 13.821 8.671 -14.472 1.00 61.14 H new ATOM 0 HB2 LYS A 8 11.557 9.122 -13.638 1.00 11.32 H new ATOM 0 HB3 LYS A 8 12.199 10.035 -12.287 1.00 11.32 H new ATOM 0 HG2 LYS A 8 11.392 11.574 -13.978 1.00 73.31 H new ATOM 0 HG3 LYS A 8 13.136 11.711 -13.864 1.00 73.31 H new ATOM 0 HD2 LYS A 8 12.425 9.662 -15.804 1.00 52.44 H new ATOM 0 HD3 LYS A 8 11.591 11.157 -16.179 1.00 52.44 H new ATOM 0 HE2 LYS A 8 14.589 10.892 -15.706 1.00 72.14 H new ATOM 0 HE3 LYS A 8 13.823 11.009 -17.277 1.00 72.14 H new ATOM 0 HZ1 LYS A 8 13.695 13.206 -17.095 1.00 20.32 H new ATOM 0 HZ2 LYS A 8 12.977 13.129 -15.559 1.00 20.32 H new ATOM 0 HZ3 LYS A 8 14.668 13.095 -15.708 1.00 20.32 H new ATOM 178 N ASN A 9 14.721 10.671 -11.999 1.00 30.31 N ATOM 179 CA ASN A 9 15.761 11.593 -11.558 1.00 4.24 C ATOM 180 C ASN A 9 16.098 11.370 -10.087 1.00 21.12 C ATOM 181 O ASN A 9 17.259 11.440 -9.689 1.00 11.04 O ATOM 182 CB ASN A 9 15.316 13.040 -11.778 1.00 25.32 C ATOM 183 CG ASN A 9 15.770 13.588 -13.117 1.00 31.03 C ATOM 184 OD1 ASN A 9 16.790 13.162 -13.661 1.00 63.42 O ATOM 185 ND2 ASN A 9 15.015 14.538 -13.654 1.00 43.31 N ATOM 0 H ASN A 9 13.899 10.642 -11.395 1.00 30.31 H new ATOM 0 HA ASN A 9 16.656 11.402 -12.150 1.00 4.24 H new ATOM 0 HB2 ASN A 9 14.229 13.096 -11.715 1.00 25.32 H new ATOM 0 HB3 ASN A 9 15.714 13.665 -10.979 1.00 25.32 H new ATOM 0 HD21 ASN A 9 15.271 14.946 -14.553 1.00 43.31 H new ATOM 0 HD22 ASN A 9 14.178 14.860 -13.168 1.00 43.31 H new ATOM 191 N ASN A 10 15.072 11.101 -9.285 1.00 53.51 N ATOM 192 CA ASN A 10 15.260 10.869 -7.858 1.00 65.40 C ATOM 193 C ASN A 10 16.248 9.733 -7.617 1.00 3.34 C ATOM 194 O ASN A 10 17.128 9.830 -6.760 1.00 72.44 O ATOM 195 CB ASN A 10 13.920 10.543 -7.194 1.00 70.15 C ATOM 196 CG ASN A 10 13.116 11.789 -6.872 1.00 41.41 C ATOM 197 OD1 ASN A 10 13.050 12.712 -7.825 1.00 43.53 O flip ATOM 198 ND2 ASN A 10 12.561 11.919 -5.781 1.00 0.53 N flip ATOM 0 H ASN A 10 14.104 11.039 -9.599 1.00 53.51 H new ATOM 0 HA ASN A 10 15.666 11.779 -7.417 1.00 65.40 H new ATOM 0 HB2 ASN A 10 13.338 9.899 -7.853 1.00 70.15 H new ATOM 0 HB3 ASN A 10 14.099 9.982 -6.277 1.00 70.15 H new ATOM 0 HD21 ASN A 10 12.639 11.184 -5.078 1.00 0.53 H new ATOM 0 HD22 ASN A 10 12.023 12.762 -5.580 1.00 0.53 H new ATOM 204 N THR A 11 16.099 8.654 -8.380 1.00 24.30 N ATOM 205 CA THR A 11 16.978 7.498 -8.249 1.00 44.23 C ATOM 206 C THR A 11 17.122 7.079 -6.791 1.00 12.22 C ATOM 207 O THR A 11 18.213 6.725 -6.342 1.00 0.31 O ATOM 208 CB THR A 11 18.375 7.787 -8.830 1.00 62.11 C ATOM 209 OG1 THR A 11 19.083 8.693 -7.976 1.00 4.15 O ATOM 210 CG2 THR A 11 18.269 8.378 -10.228 1.00 73.13 C ATOM 0 H THR A 11 15.378 8.557 -9.095 1.00 24.30 H new ATOM 0 HA THR A 11 16.519 6.686 -8.813 1.00 44.23 H new ATOM 0 HB THR A 11 18.920 6.845 -8.892 1.00 62.11 H new ATOM 0 HG1 THR A 11 18.460 9.089 -7.332 1.00 4.15 H new ATOM 0 HG21 THR A 11 19.268 8.573 -10.617 1.00 73.13 H new ATOM 0 HG22 THR A 11 17.756 7.674 -10.883 1.00 73.13 H new ATOM 0 HG23 THR A 11 17.707 9.311 -10.187 1.00 73.13 H new ATOM 218 N ILE A 12 16.017 7.121 -6.056 1.00 24.11 N ATOM 219 CA ILE A 12 16.021 6.742 -4.648 1.00 54.33 C ATOM 220 C ILE A 12 16.660 5.372 -4.448 1.00 1.40 C ATOM 221 O ILE A 12 16.318 4.397 -5.118 1.00 33.51 O ATOM 222 CB ILE A 12 14.596 6.722 -4.066 1.00 63.35 C ATOM 223 CG1 ILE A 12 14.090 8.148 -3.845 1.00 13.32 C ATOM 224 CG2 ILE A 12 14.567 5.936 -2.764 1.00 71.45 C ATOM 225 CD1 ILE A 12 14.876 8.914 -2.803 1.00 24.24 C ATOM 0 H ILE A 12 15.107 7.414 -6.411 1.00 24.11 H new ATOM 0 HA ILE A 12 16.609 7.494 -4.121 1.00 54.33 H new ATOM 0 HB ILE A 12 13.936 6.230 -4.780 1.00 63.35 H new ATOM 0 HG12 ILE A 12 14.131 8.690 -4.790 1.00 13.32 H new ATOM 0 HG13 ILE A 12 13.043 8.111 -3.544 1.00 13.32 H new ATOM 0 HG21 ILE A 12 13.553 5.931 -2.365 1.00 71.45 H new ATOM 0 HG22 ILE A 12 14.889 4.911 -2.950 1.00 71.45 H new ATOM 0 HG23 ILE A 12 15.239 6.402 -2.043 1.00 71.45 H new ATOM 0 HD11 ILE A 12 14.461 9.917 -2.699 1.00 24.24 H new ATOM 0 HD12 ILE A 12 14.815 8.395 -1.847 1.00 24.24 H new ATOM 0 HD13 ILE A 12 15.919 8.983 -3.112 1.00 24.24 H new ATOM 236 N PRO A 13 17.609 5.295 -3.505 1.00 21.24 N ATOM 237 CA PRO A 13 18.315 4.048 -3.192 1.00 64.14 C ATOM 238 C PRO A 13 17.413 3.027 -2.508 1.00 22.22 C ATOM 239 O PRO A 13 16.189 3.162 -2.516 1.00 11.32 O ATOM 240 CB PRO A 13 19.429 4.498 -2.244 1.00 51.04 C ATOM 241 CG PRO A 13 18.912 5.747 -1.619 1.00 55.13 C ATOM 242 CD PRO A 13 18.068 6.417 -2.668 1.00 44.13 C ATOM 0 HA PRO A 13 18.678 3.549 -4.091 1.00 64.14 H new ATOM 0 HB2 PRO A 13 19.641 3.737 -1.492 1.00 51.04 H new ATOM 0 HB3 PRO A 13 20.358 4.680 -2.783 1.00 51.04 H new ATOM 0 HG2 PRO A 13 18.324 5.523 -0.729 1.00 55.13 H new ATOM 0 HG3 PRO A 13 19.731 6.394 -1.305 1.00 55.13 H new ATOM 0 HD2 PRO A 13 17.231 6.957 -2.226 1.00 44.13 H new ATOM 0 HD3 PRO A 13 18.644 7.140 -3.246 1.00 44.13 H new ATOM 247 N ASP A 14 18.024 2.006 -1.917 1.00 70.33 N ATOM 248 CA ASP A 14 17.276 0.963 -1.226 1.00 45.34 C ATOM 249 C ASP A 14 16.927 1.394 0.194 1.00 61.31 C ATOM 250 O ASP A 14 17.178 0.665 1.155 1.00 55.54 O ATOM 251 CB ASP A 14 18.081 -0.337 -1.195 1.00 32.33 C ATOM 252 CG ASP A 14 19.529 -0.111 -0.804 1.00 61.40 C ATOM 253 OD1 ASP A 14 19.769 0.481 0.270 1.00 44.34 O ATOM 254 OD2 ASP A 14 20.421 -0.527 -1.572 1.00 12.15 O ATOM 0 H ASP A 14 19.036 1.879 -1.903 1.00 70.33 H new ATOM 0 HA ASP A 14 16.348 0.793 -1.773 1.00 45.34 H new ATOM 0 HB2 ASP A 14 17.621 -1.029 -0.490 1.00 32.33 H new ATOM 0 HB3 ASP A 14 18.042 -0.809 -2.177 1.00 32.33 H new ATOM 258 N SER A 15 16.346 2.583 0.321 1.00 73.34 N ATOM 259 CA SER A 15 15.967 3.114 1.625 1.00 41.41 C ATOM 260 C SER A 15 14.559 3.701 1.584 1.00 24.13 C ATOM 261 O SER A 15 14.191 4.514 2.431 1.00 63.34 O ATOM 262 CB SER A 15 16.964 4.183 2.073 1.00 34.44 C ATOM 263 OG SER A 15 17.727 3.737 3.181 1.00 33.33 O ATOM 0 H SER A 15 16.128 3.197 -0.464 1.00 73.34 H new ATOM 0 HA SER A 15 15.979 2.293 2.342 1.00 41.41 H new ATOM 0 HB2 SER A 15 17.629 4.433 1.247 1.00 34.44 H new ATOM 0 HB3 SER A 15 16.429 5.095 2.339 1.00 34.44 H new ATOM 0 HG SER A 15 18.358 4.438 3.447 1.00 33.33 H new ATOM 268 N GLN A 16 13.778 3.282 0.594 1.00 3.11 N ATOM 269 CA GLN A 16 12.412 3.766 0.441 1.00 30.21 C ATOM 270 C GLN A 16 11.409 2.729 0.936 1.00 45.34 C ATOM 271 O GLN A 16 10.491 3.048 1.690 1.00 14.23 O ATOM 272 CB GLN A 16 12.130 4.110 -1.021 1.00 41.44 C ATOM 273 CG GLN A 16 12.569 3.029 -1.996 1.00 22.05 C ATOM 274 CD GLN A 16 12.339 3.418 -3.443 1.00 51.32 C ATOM 275 OE1 GLN A 16 11.997 4.563 -3.743 1.00 71.31 O ATOM 276 NE2 GLN A 16 12.527 2.467 -4.350 1.00 51.30 N ATOM 0 H GLN A 16 14.068 2.608 -0.114 1.00 3.11 H new ATOM 0 HA GLN A 16 12.303 4.667 1.045 1.00 30.21 H new ATOM 0 HB2 GLN A 16 11.062 4.287 -1.144 1.00 41.44 H new ATOM 0 HB3 GLN A 16 12.638 5.041 -1.271 1.00 41.44 H new ATOM 0 HG2 GLN A 16 13.627 2.817 -1.845 1.00 22.05 H new ATOM 0 HG3 GLN A 16 12.026 2.109 -1.781 1.00 22.05 H new ATOM 0 HE21 GLN A 16 12.810 1.532 -4.057 1.00 51.30 H new ATOM 0 HE22 GLN A 16 12.388 2.671 -5.340 1.00 51.30 H new ATOM 283 N MET A 17 11.590 1.485 0.502 1.00 61.03 N ATOM 284 CA MET A 17 10.700 0.401 0.901 1.00 42.12 C ATOM 285 C MET A 17 11.299 -0.397 2.055 1.00 54.02 C ATOM 286 O MET A 17 12.504 -0.345 2.299 1.00 54.15 O ATOM 287 CB MET A 17 10.426 -0.525 -0.286 1.00 65.32 C ATOM 288 CG MET A 17 10.040 0.214 -1.556 1.00 51.51 C ATOM 289 SD MET A 17 8.994 -0.772 -2.644 1.00 24.35 S ATOM 290 CE MET A 17 7.560 -1.022 -1.599 1.00 43.53 C ATOM 0 H MET A 17 12.344 1.204 -0.125 1.00 61.03 H new ATOM 0 HA MET A 17 9.760 0.840 1.235 1.00 42.12 H new ATOM 0 HB2 MET A 17 11.315 -1.125 -0.481 1.00 65.32 H new ATOM 0 HB3 MET A 17 9.626 -1.216 -0.020 1.00 65.32 H new ATOM 0 HG2 MET A 17 9.518 1.134 -1.292 1.00 51.51 H new ATOM 0 HG3 MET A 17 10.944 0.503 -2.092 1.00 51.51 H new ATOM 0 HE1 MET A 17 6.820 -1.617 -2.133 1.00 43.53 H new ATOM 0 HE2 MET A 17 7.859 -1.545 -0.690 1.00 43.53 H new ATOM 0 HE3 MET A 17 7.128 -0.056 -1.337 1.00 43.53 H new ATOM 298 N SER A 18 10.449 -1.134 2.763 1.00 20.21 N ATOM 299 CA SER A 18 10.894 -1.939 3.894 1.00 63.42 C ATOM 300 C SER A 18 9.720 -2.679 4.530 1.00 13.35 C ATOM 301 O SER A 18 8.695 -2.079 4.851 1.00 41.01 O ATOM 302 CB SER A 18 11.580 -1.056 4.938 1.00 73.13 C ATOM 303 OG SER A 18 10.906 0.183 5.080 1.00 25.03 O ATOM 0 H SER A 18 9.448 -1.190 2.573 1.00 20.21 H new ATOM 0 HA SER A 18 11.608 -2.675 3.525 1.00 63.42 H new ATOM 0 HB2 SER A 18 11.603 -1.573 5.897 1.00 73.13 H new ATOM 0 HB3 SER A 18 12.615 -0.879 4.646 1.00 73.13 H new ATOM 0 HG SER A 18 11.363 0.729 5.754 1.00 25.03 H new ATOM 308 N ALA A 19 9.880 -3.986 4.708 1.00 60.34 N ATOM 309 CA ALA A 19 8.836 -4.809 5.307 1.00 33.31 C ATOM 310 C ALA A 19 9.357 -5.553 6.532 1.00 1.31 C ATOM 311 O ALA A 19 10.566 -5.659 6.737 1.00 53.33 O ATOM 312 CB ALA A 19 8.286 -5.792 4.284 1.00 13.54 C ATOM 0 H ALA A 19 10.722 -4.498 4.446 1.00 60.34 H new ATOM 0 HA ALA A 19 8.030 -4.150 5.631 1.00 33.31 H new ATOM 0 HB1 ALA A 19 7.508 -6.400 4.745 1.00 13.54 H new ATOM 0 HB2 ALA A 19 7.866 -5.243 3.441 1.00 13.54 H new ATOM 0 HB3 ALA A 19 9.090 -6.438 3.932 1.00 13.54 H new ATOM 318 N SER A 20 8.438 -6.066 7.342 1.00 33.33 N ATOM 319 CA SER A 20 8.805 -6.797 8.549 1.00 34.24 C ATOM 320 C SER A 20 9.831 -7.883 8.236 1.00 74.04 C ATOM 321 O SER A 20 10.866 -7.982 8.894 1.00 1.13 O ATOM 322 CB SER A 20 7.565 -7.421 9.192 1.00 45.24 C ATOM 323 OG SER A 20 7.531 -7.169 10.586 1.00 63.15 O ATOM 0 H SER A 20 7.433 -5.989 7.185 1.00 33.33 H new ATOM 0 HA SER A 20 9.251 -6.091 9.249 1.00 34.24 H new ATOM 0 HB2 SER A 20 6.667 -7.017 8.724 1.00 45.24 H new ATOM 0 HB3 SER A 20 7.561 -8.496 9.014 1.00 45.24 H new ATOM 0 HG SER A 20 6.769 -6.590 10.795 1.00 63.15 H new ATOM 328 N SER A 21 9.533 -8.695 7.227 1.00 23.22 N ATOM 329 CA SER A 21 10.425 -9.777 6.828 1.00 25.11 C ATOM 330 C SER A 21 10.105 -10.252 5.415 1.00 44.33 C ATOM 331 O SER A 21 8.953 -10.212 4.980 1.00 35.25 O ATOM 332 CB SER A 21 10.314 -10.946 7.808 1.00 23.14 C ATOM 333 OG SER A 21 10.688 -10.553 9.117 1.00 14.22 O ATOM 0 H SER A 21 8.681 -8.624 6.671 1.00 23.22 H new ATOM 0 HA SER A 21 11.446 -9.396 6.842 1.00 25.11 H new ATOM 0 HB2 SER A 21 9.291 -11.321 7.816 1.00 23.14 H new ATOM 0 HB3 SER A 21 10.951 -11.765 7.475 1.00 23.14 H new ATOM 0 HG SER A 21 11.134 -9.681 9.082 1.00 14.22 H new ATOM 338 N SER A 22 11.132 -10.701 4.700 1.00 23.25 N ATOM 339 CA SER A 22 10.963 -11.180 3.334 1.00 63.55 C ATOM 340 C SER A 22 11.202 -12.685 3.251 1.00 34.35 C ATOM 341 O SER A 22 11.660 -13.305 4.212 1.00 30.41 O ATOM 342 CB SER A 22 11.918 -10.447 2.391 1.00 2.14 C ATOM 343 OG SER A 22 11.591 -9.071 2.301 1.00 42.00 O ATOM 0 H SER A 22 12.091 -10.743 5.045 1.00 23.25 H new ATOM 0 HA SER A 22 9.936 -10.976 3.029 1.00 63.55 H new ATOM 0 HB2 SER A 22 12.942 -10.558 2.747 1.00 2.14 H new ATOM 0 HB3 SER A 22 11.874 -10.900 1.400 1.00 2.14 H new ATOM 0 HG SER A 22 10.644 -8.974 2.069 1.00 42.00 H new ATOM 348 N TYR A 23 10.891 -13.266 2.098 1.00 55.42 N ATOM 349 CA TYR A 23 11.070 -14.697 1.890 1.00 14.14 C ATOM 350 C TYR A 23 12.530 -15.097 2.087 1.00 41.21 C ATOM 351 O TYR A 23 12.845 -16.275 2.255 1.00 13.44 O ATOM 352 CB TYR A 23 10.607 -15.091 0.487 1.00 62.45 C ATOM 353 CG TYR A 23 10.892 -16.535 0.138 1.00 0.23 C ATOM 354 CD1 TYR A 23 10.562 -17.560 1.016 1.00 72.13 C ATOM 355 CD2 TYR A 23 11.492 -16.874 -1.068 1.00 15.15 C ATOM 356 CE1 TYR A 23 10.822 -18.880 0.702 1.00 71.32 C ATOM 357 CE2 TYR A 23 11.754 -18.191 -1.391 1.00 55.31 C ATOM 358 CZ TYR A 23 11.417 -19.191 -0.502 1.00 43.24 C ATOM 359 OH TYR A 23 11.677 -20.505 -0.820 1.00 75.22 O ATOM 0 H TYR A 23 10.513 -12.767 1.293 1.00 55.42 H new ATOM 0 HA TYR A 23 10.464 -15.225 2.627 1.00 14.14 H new ATOM 0 HB2 TYR A 23 9.535 -14.910 0.403 1.00 62.45 H new ATOM 0 HB3 TYR A 23 11.097 -14.446 -0.243 1.00 62.45 H new ATOM 0 HD1 TYR A 23 10.094 -17.321 1.960 1.00 72.13 H new ATOM 0 HD2 TYR A 23 11.758 -16.094 -1.766 1.00 15.15 H new ATOM 0 HE1 TYR A 23 10.560 -19.665 1.397 1.00 71.32 H new ATOM 0 HE2 TYR A 23 12.220 -18.437 -2.334 1.00 55.31 H new ATOM 0 HH TYR A 23 12.097 -20.551 -1.704 1.00 75.22 H new ATOM 368 N LYS A 24 13.416 -14.108 2.063 1.00 60.31 N ATOM 369 CA LYS A 24 14.843 -14.353 2.241 1.00 62.14 C ATOM 370 C LYS A 24 15.083 -15.418 3.307 1.00 55.41 C ATOM 371 O LYS A 24 15.588 -16.502 3.015 1.00 1.54 O ATOM 372 CB LYS A 24 15.560 -13.058 2.627 1.00 21.11 C ATOM 373 CG LYS A 24 17.069 -13.202 2.719 1.00 63.03 C ATOM 374 CD LYS A 24 17.762 -12.591 1.512 1.00 43.14 C ATOM 375 CE LYS A 24 17.576 -13.448 0.269 1.00 4.12 C ATOM 376 NZ LYS A 24 18.874 -13.759 -0.390 1.00 14.13 N ATOM 0 H LYS A 24 13.171 -13.128 1.922 1.00 60.31 H new ATOM 0 HA LYS A 24 15.245 -14.714 1.295 1.00 62.14 H new ATOM 0 HB2 LYS A 24 15.321 -12.288 1.894 1.00 21.11 H new ATOM 0 HB3 LYS A 24 15.177 -12.713 3.588 1.00 21.11 H new ATOM 0 HG2 LYS A 24 17.427 -12.719 3.628 1.00 63.03 H new ATOM 0 HG3 LYS A 24 17.331 -14.257 2.794 1.00 63.03 H new ATOM 0 HD2 LYS A 24 17.364 -11.593 1.330 1.00 43.14 H new ATOM 0 HD3 LYS A 24 18.826 -12.477 1.721 1.00 43.14 H new ATOM 0 HE2 LYS A 24 17.075 -14.377 0.540 1.00 4.12 H new ATOM 0 HE3 LYS A 24 16.926 -12.929 -0.436 1.00 4.12 H new ATOM 0 HZ1 LYS A 24 18.704 -14.344 -1.233 1.00 14.13 H new ATOM 0 HZ2 LYS A 24 19.341 -12.874 -0.672 1.00 14.13 H new ATOM 0 HZ3 LYS A 24 19.485 -14.277 0.274 1.00 14.13 H new ATOM 386 N THR A 25 14.716 -15.102 4.545 1.00 55.24 N ATOM 387 CA THR A 25 14.892 -16.030 5.655 1.00 45.43 C ATOM 388 C THR A 25 14.431 -15.410 6.969 1.00 52.00 C ATOM 389 O THR A 25 13.701 -16.036 7.738 1.00 55.34 O ATOM 390 CB THR A 25 16.362 -16.467 5.795 1.00 11.43 C ATOM 391 OG1 THR A 25 16.551 -17.161 7.032 1.00 13.24 O ATOM 392 CG2 THR A 25 17.292 -15.264 5.734 1.00 3.22 C ATOM 0 H THR A 25 14.295 -14.210 4.804 1.00 55.24 H new ATOM 0 HA THR A 25 14.280 -16.905 5.435 1.00 45.43 H new ATOM 0 HB THR A 25 16.601 -17.133 4.966 1.00 11.43 H new ATOM 0 HG1 THR A 25 17.488 -17.437 7.113 1.00 13.24 H new ATOM 0 HG21 THR A 25 18.325 -15.597 5.835 1.00 3.22 H new ATOM 0 HG22 THR A 25 17.167 -14.755 4.778 1.00 3.22 H new ATOM 0 HG23 THR A 25 17.051 -14.577 6.545 1.00 3.22 H new ATOM 400 N TRP A 26 14.860 -14.179 7.220 1.00 11.21 N ATOM 401 CA TRP A 26 14.490 -13.474 8.442 1.00 11.43 C ATOM 402 C TRP A 26 15.138 -12.094 8.492 1.00 65.22 C ATOM 403 O TRP A 26 15.652 -11.604 7.488 1.00 51.31 O ATOM 404 CB TRP A 26 14.902 -14.290 9.669 1.00 54.22 C ATOM 405 CG TRP A 26 13.793 -14.469 10.662 1.00 2.41 C ATOM 406 CD1 TRP A 26 12.628 -15.156 10.473 1.00 14.03 C ATOM 407 CD2 TRP A 26 13.746 -13.952 11.996 1.00 52.53 C ATOM 408 NE1 TRP A 26 11.859 -15.096 11.611 1.00 23.02 N ATOM 409 CE2 TRP A 26 12.523 -14.364 12.559 1.00 61.21 C ATOM 410 CE3 TRP A 26 14.619 -13.181 12.770 1.00 65.44 C ATOM 411 CZ2 TRP A 26 12.153 -14.032 13.859 1.00 75.34 C ATOM 412 CZ3 TRP A 26 14.249 -12.852 14.061 1.00 65.02 C ATOM 413 CH2 TRP A 26 13.026 -13.277 14.595 1.00 73.23 C ATOM 0 H TRP A 26 15.465 -13.648 6.594 1.00 11.21 H new ATOM 0 HA TRP A 26 13.408 -13.346 8.446 1.00 11.43 H new ATOM 0 HB2 TRP A 26 15.251 -15.270 9.344 1.00 54.22 H new ATOM 0 HB3 TRP A 26 15.743 -13.798 10.158 1.00 54.22 H new ATOM 0 HD1 TRP A 26 12.352 -15.670 9.564 1.00 14.03 H new ATOM 0 HE1 TRP A 26 10.942 -15.527 11.730 1.00 23.02 H new ATOM 0 HE3 TRP A 26 15.564 -12.849 12.367 1.00 65.44 H new ATOM 0 HZ2 TRP A 26 11.210 -14.359 14.273 1.00 75.34 H new ATOM 0 HZ3 TRP A 26 14.915 -12.257 14.668 1.00 65.02 H new ATOM 0 HH2 TRP A 26 12.767 -13.004 15.607 1.00 73.23 H new ATOM 423 N ASN A 27 15.107 -11.474 9.667 1.00 51.33 N ATOM 424 CA ASN A 27 15.691 -10.150 9.847 1.00 54.31 C ATOM 425 C ASN A 27 17.066 -10.246 10.500 1.00 40.31 C ATOM 426 O ASN A 27 18.092 -10.067 9.841 1.00 35.14 O ATOM 427 CB ASN A 27 14.769 -9.274 10.699 1.00 2.11 C ATOM 428 CG ASN A 27 13.969 -10.082 11.701 1.00 64.51 C ATOM 429 OD1 ASN A 27 14.359 -10.217 12.860 1.00 73.13 O ATOM 430 ND2 ASN A 27 12.841 -10.627 11.257 1.00 52.31 N ATOM 0 H ASN A 27 14.684 -11.867 10.508 1.00 51.33 H new ATOM 0 HA ASN A 27 15.807 -9.695 8.863 1.00 54.31 H new ATOM 0 HB2 ASN A 27 15.365 -8.531 11.229 1.00 2.11 H new ATOM 0 HB3 ASN A 27 14.086 -8.729 10.048 1.00 2.11 H new ATOM 0 HD21 ASN A 27 12.261 -11.183 11.886 1.00 52.31 H new ATOM 0 HD22 ASN A 27 12.555 -10.489 10.288 1.00 52.31 H new ATOM 436 N LEU A 28 17.080 -10.529 11.798 1.00 51.22 N ATOM 437 CA LEU A 28 18.329 -10.650 12.541 1.00 2.52 C ATOM 438 C LEU A 28 19.224 -9.437 12.303 1.00 25.12 C ATOM 439 O LEU A 28 18.790 -8.435 11.736 1.00 13.51 O ATOM 440 CB LEU A 28 19.065 -11.929 12.136 1.00 14.01 C ATOM 441 CG LEU A 28 18.234 -13.212 12.146 1.00 3.12 C ATOM 442 CD1 LEU A 28 19.032 -14.370 11.566 1.00 14.44 C ATOM 443 CD2 LEU A 28 17.769 -13.537 13.558 1.00 11.21 C ATOM 0 H LEU A 28 16.240 -10.679 12.357 1.00 51.22 H new ATOM 0 HA LEU A 28 18.088 -10.698 13.603 1.00 2.52 H new ATOM 0 HB2 LEU A 28 19.470 -11.790 11.134 1.00 14.01 H new ATOM 0 HB3 LEU A 28 19.914 -12.064 12.807 1.00 14.01 H new ATOM 0 HG LEU A 28 17.354 -13.056 11.523 1.00 3.12 H new ATOM 0 HD11 LEU A 28 18.424 -15.275 11.581 1.00 14.44 H new ATOM 0 HD12 LEU A 28 19.313 -14.139 10.539 1.00 14.44 H new ATOM 0 HD13 LEU A 28 19.931 -14.527 12.162 1.00 14.44 H new ATOM 0 HD21 LEU A 28 17.179 -14.453 13.545 1.00 11.21 H new ATOM 0 HD22 LEU A 28 18.636 -13.673 14.204 1.00 11.21 H new ATOM 0 HD23 LEU A 28 17.158 -12.718 13.938 1.00 11.21 H new ATOM 454 N ARG A 29 20.476 -9.539 12.737 1.00 53.40 N ATOM 455 CA ARG A 29 21.433 -8.451 12.570 1.00 65.52 C ATOM 456 C ARG A 29 21.562 -8.062 11.100 1.00 52.24 C ATOM 457 O ARG A 29 21.217 -8.837 10.209 1.00 23.31 O ATOM 458 CB ARG A 29 22.800 -8.857 13.123 1.00 51.40 C ATOM 459 CG ARG A 29 23.024 -8.435 14.566 1.00 70.24 C ATOM 460 CD ARG A 29 22.403 -9.425 15.539 1.00 22.10 C ATOM 461 NE ARG A 29 21.826 -8.761 16.704 1.00 13.43 N ATOM 462 CZ ARG A 29 21.086 -9.383 17.614 1.00 11.31 C ATOM 463 NH1 ARG A 29 20.833 -10.679 17.494 1.00 45.14 N ATOM 464 NH2 ARG A 29 20.597 -8.710 18.647 1.00 32.30 N ATOM 0 H ARG A 29 20.851 -10.363 13.207 1.00 53.40 H new ATOM 0 HA ARG A 29 21.066 -7.588 13.126 1.00 65.52 H new ATOM 0 HB2 ARG A 29 22.905 -9.939 13.050 1.00 51.40 H new ATOM 0 HB3 ARG A 29 23.579 -8.418 12.500 1.00 51.40 H new ATOM 0 HG2 ARG A 29 24.093 -8.354 14.761 1.00 70.24 H new ATOM 0 HG3 ARG A 29 22.595 -7.446 14.728 1.00 70.24 H new ATOM 0 HD2 ARG A 29 21.629 -9.998 15.028 1.00 22.10 H new ATOM 0 HD3 ARG A 29 23.162 -10.136 15.866 1.00 22.10 H new ATOM 0 HE ARG A 29 22.001 -7.764 16.826 1.00 13.43 H new ATOM 0 HH11 ARG A 29 21.207 -11.200 16.701 1.00 45.14 H new ATOM 0 HH12 ARG A 29 20.264 -11.155 18.194 1.00 45.14 H new ATOM 0 HH21 ARG A 29 20.789 -7.713 18.743 1.00 32.30 H new ATOM 0 HH22 ARG A 29 20.029 -9.190 19.345 1.00 32.30 H new ATOM 475 N ALA A 30 22.061 -6.855 10.854 1.00 34.54 N ATOM 476 CA ALA A 30 22.237 -6.363 9.494 1.00 4.11 C ATOM 477 C ALA A 30 20.895 -6.218 8.785 1.00 50.13 C ATOM 478 O ALA A 30 19.838 -6.308 9.410 1.00 54.42 O ATOM 479 CB ALA A 30 23.152 -7.293 8.710 1.00 75.51 C ATOM 0 H ALA A 30 22.351 -6.200 11.580 1.00 34.54 H new ATOM 0 HA ALA A 30 22.699 -5.377 9.548 1.00 4.11 H new ATOM 0 HB1 ALA A 30 23.274 -6.913 7.696 1.00 75.51 H new ATOM 0 HB2 ALA A 30 24.125 -7.343 9.199 1.00 75.51 H new ATOM 0 HB3 ALA A 30 22.713 -8.290 8.673 1.00 75.51 H new ATOM 485 N PHE A 31 20.944 -5.992 7.476 1.00 61.41 N ATOM 486 CA PHE A 31 19.731 -5.832 6.683 1.00 40.41 C ATOM 487 C PHE A 31 18.842 -7.067 6.793 1.00 24.11 C ATOM 488 O PHE A 31 17.819 -7.051 7.477 1.00 1.54 O ATOM 489 CB PHE A 31 20.086 -5.574 5.216 1.00 22.42 C ATOM 490 CG PHE A 31 20.429 -4.142 4.925 1.00 72.00 C ATOM 491 CD1 PHE A 31 19.446 -3.165 4.932 1.00 1.34 C ATOM 492 CD2 PHE A 31 21.734 -3.771 4.646 1.00 20.01 C ATOM 493 CE1 PHE A 31 19.760 -1.845 4.664 1.00 64.44 C ATOM 494 CE2 PHE A 31 22.054 -2.453 4.377 1.00 22.21 C ATOM 495 CZ PHE A 31 21.064 -1.489 4.387 1.00 35.34 C ATOM 0 H PHE A 31 21.810 -5.916 6.943 1.00 61.41 H new ATOM 0 HA PHE A 31 19.182 -4.975 7.073 1.00 40.41 H new ATOM 0 HB2 PHE A 31 20.930 -6.205 4.939 1.00 22.42 H new ATOM 0 HB3 PHE A 31 19.246 -5.872 4.589 1.00 22.42 H new ATOM 0 HD1 PHE A 31 18.424 -3.437 5.149 1.00 1.34 H new ATOM 0 HD2 PHE A 31 22.511 -4.521 4.638 1.00 20.01 H new ATOM 0 HE1 PHE A 31 18.985 -1.093 4.672 1.00 64.44 H new ATOM 0 HE2 PHE A 31 23.075 -2.178 4.160 1.00 22.21 H new ATOM 0 HZ PHE A 31 21.311 -0.458 4.178 1.00 35.34 H new ATOM 504 N GLY A 32 19.240 -8.138 6.112 1.00 61.32 N ATOM 505 CA GLY A 32 18.469 -9.368 6.146 1.00 53.01 C ATOM 506 C GLY A 32 17.538 -9.500 4.957 1.00 74.42 C ATOM 507 O GLY A 32 17.618 -10.469 4.203 1.00 72.51 O ATOM 0 H GLY A 32 20.082 -8.176 5.538 1.00 61.32 H new ATOM 0 HA2 GLY A 32 19.149 -10.219 6.168 1.00 53.01 H new ATOM 0 HA3 GLY A 32 17.886 -9.403 7.066 1.00 53.01 H new ATOM 511 N TRP A 33 16.651 -8.526 4.792 1.00 71.00 N ATOM 512 CA TRP A 33 15.698 -8.539 3.688 1.00 13.10 C ATOM 513 C TRP A 33 16.305 -7.912 2.438 1.00 1.41 C ATOM 514 O TRP A 33 17.315 -7.211 2.511 1.00 32.02 O ATOM 515 CB TRP A 33 14.421 -7.793 4.080 1.00 4.42 C ATOM 516 CG TRP A 33 14.103 -7.887 5.540 1.00 73.42 C ATOM 517 CD1 TRP A 33 13.940 -9.028 6.272 1.00 31.25 C ATOM 518 CD2 TRP A 33 13.906 -6.796 6.447 1.00 3.21 C ATOM 519 NE1 TRP A 33 13.655 -8.713 7.579 1.00 63.44 N ATOM 520 CE2 TRP A 33 13.629 -7.350 7.713 1.00 44.43 C ATOM 521 CE3 TRP A 33 13.940 -5.405 6.313 1.00 25.13 C ATOM 522 CZ2 TRP A 33 13.387 -6.561 8.833 1.00 70.03 C ATOM 523 CZ3 TRP A 33 13.698 -4.624 7.427 1.00 13.33 C ATOM 524 CH2 TRP A 33 13.426 -5.202 8.673 1.00 71.35 C ATOM 0 H TRP A 33 16.572 -7.717 5.408 1.00 71.00 H new ATOM 0 HA TRP A 33 15.450 -9.577 3.467 1.00 13.10 H new ATOM 0 HB2 TRP A 33 14.523 -6.743 3.805 1.00 4.42 H new ATOM 0 HB3 TRP A 33 13.585 -8.193 3.507 1.00 4.42 H new ATOM 0 HD1 TRP A 33 14.023 -10.031 5.881 1.00 31.25 H new ATOM 0 HE1 TRP A 33 13.490 -9.385 8.328 1.00 63.44 H new ATOM 0 HE3 TRP A 33 14.151 -4.949 5.357 1.00 25.13 H new ATOM 0 HZ2 TRP A 33 13.176 -7.005 9.795 1.00 70.03 H new ATOM 0 HZ3 TRP A 33 13.719 -3.548 7.335 1.00 13.33 H new ATOM 0 HH2 TRP A 33 13.243 -4.563 9.524 1.00 71.35 H new ATOM 534 N TYR A 34 15.684 -8.167 1.292 1.00 64.11 N ATOM 535 CA TYR A 34 16.165 -7.629 0.025 1.00 11.00 C ATOM 536 C TYR A 34 15.020 -7.021 -0.779 1.00 1.02 C ATOM 537 O TYR A 34 14.746 -7.415 -1.912 1.00 65.43 O ATOM 538 CB TYR A 34 16.852 -8.725 -0.792 1.00 63.41 C ATOM 539 CG TYR A 34 15.932 -9.867 -1.164 1.00 11.14 C ATOM 540 CD1 TYR A 34 15.433 -10.727 -0.194 1.00 0.11 C ATOM 541 CD2 TYR A 34 15.564 -10.085 -2.485 1.00 41.43 C ATOM 542 CE1 TYR A 34 14.594 -11.772 -0.530 1.00 71.52 C ATOM 543 CE2 TYR A 34 14.724 -11.126 -2.831 1.00 40.12 C ATOM 544 CZ TYR A 34 14.242 -11.967 -1.849 1.00 3.35 C ATOM 545 OH TYR A 34 13.406 -13.006 -2.188 1.00 41.21 O ATOM 0 H TYR A 34 14.846 -8.743 1.214 1.00 64.11 H new ATOM 0 HA TYR A 34 16.888 -6.843 0.245 1.00 11.00 H new ATOM 0 HB2 TYR A 34 17.260 -8.286 -1.703 1.00 63.41 H new ATOM 0 HB3 TYR A 34 17.694 -9.118 -0.222 1.00 63.41 H new ATOM 0 HD1 TYR A 34 15.705 -10.576 0.840 1.00 0.11 H new ATOM 0 HD2 TYR A 34 15.941 -9.429 -3.256 1.00 41.43 H new ATOM 0 HE1 TYR A 34 14.216 -12.433 0.236 1.00 71.52 H new ATOM 0 HE2 TYR A 34 14.446 -11.280 -3.863 1.00 40.12 H new ATOM 0 HH TYR A 34 13.256 -13.003 -3.157 1.00 41.21 H new ATOM 554 N PRO A 35 14.335 -6.035 -0.180 1.00 23.24 N ATOM 555 CA PRO A 35 13.210 -5.350 -0.820 1.00 44.23 C ATOM 556 C PRO A 35 13.654 -4.468 -1.982 1.00 65.45 C ATOM 557 O PRO A 35 14.780 -4.579 -2.464 1.00 2.24 O ATOM 558 CB PRO A 35 12.625 -4.496 0.307 1.00 4.23 C ATOM 559 CG PRO A 35 13.764 -4.272 1.242 1.00 43.54 C ATOM 560 CD PRO A 35 14.608 -5.514 1.170 1.00 22.22 C ATOM 0 HA PRO A 35 12.498 -6.053 -1.253 1.00 44.23 H new ATOM 0 HB2 PRO A 35 12.234 -3.553 -0.073 1.00 4.23 H new ATOM 0 HB3 PRO A 35 11.800 -5.007 0.803 1.00 4.23 H new ATOM 0 HG2 PRO A 35 14.339 -3.392 0.953 1.00 43.54 H new ATOM 0 HG3 PRO A 35 13.407 -4.101 2.258 1.00 43.54 H new ATOM 0 HD2 PRO A 35 15.666 -5.289 1.308 1.00 22.22 H new ATOM 0 HD3 PRO A 35 14.332 -6.233 1.941 1.00 22.22 H new ATOM 565 N HIS A 36 12.760 -3.590 -2.428 1.00 72.14 N ATOM 566 CA HIS A 36 13.061 -2.687 -3.533 1.00 72.12 C ATOM 567 C HIS A 36 13.206 -3.459 -4.841 1.00 21.45 C ATOM 568 O HIS A 36 14.208 -3.323 -5.545 1.00 44.52 O ATOM 569 CB HIS A 36 14.341 -1.903 -3.244 1.00 53.52 C ATOM 570 CG HIS A 36 14.412 -1.366 -1.848 1.00 53.43 C ATOM 571 ND1 HIS A 36 15.327 -1.809 -0.917 1.00 12.40 N ATOM 572 CD2 HIS A 36 13.676 -0.414 -1.226 1.00 44.11 C ATOM 573 CE1 HIS A 36 15.151 -1.155 0.217 1.00 64.30 C ATOM 574 NE2 HIS A 36 14.154 -0.303 0.056 1.00 14.33 N ATOM 0 H HIS A 36 11.822 -3.485 -2.041 1.00 72.14 H new ATOM 0 HA HIS A 36 12.231 -1.987 -3.635 1.00 72.12 H new ATOM 0 HB2 HIS A 36 15.201 -2.549 -3.420 1.00 53.52 H new ATOM 0 HB3 HIS A 36 14.416 -1.074 -3.948 1.00 53.52 H new ATOM 0 HD2 HIS A 36 12.864 0.152 -1.658 1.00 44.11 H new ATOM 0 HE1 HIS A 36 15.724 -1.293 1.122 1.00 64.30 H new ATOM 0 HE2 HIS A 36 13.797 0.334 0.769 1.00 14.33 H new ATOM 581 N LEU A 37 12.203 -4.270 -5.159 1.00 52.41 N ATOM 582 CA LEU A 37 12.221 -5.065 -6.382 1.00 52.32 C ATOM 583 C LEU A 37 11.120 -4.616 -7.338 1.00 65.41 C ATOM 584 O LEU A 37 11.178 -4.883 -8.537 1.00 1.11 O ATOM 585 CB LEU A 37 12.052 -6.548 -6.052 1.00 4.34 C ATOM 586 CG LEU A 37 12.895 -7.078 -4.891 1.00 52.40 C ATOM 587 CD1 LEU A 37 12.139 -8.157 -4.131 1.00 1.41 C ATOM 588 CD2 LEU A 37 14.226 -7.613 -5.399 1.00 43.23 C ATOM 0 H LEU A 37 11.367 -4.394 -4.587 1.00 52.41 H new ATOM 0 HA LEU A 37 13.184 -4.916 -6.870 1.00 52.32 H new ATOM 0 HB2 LEU A 37 11.002 -6.732 -5.826 1.00 4.34 H new ATOM 0 HB3 LEU A 37 12.292 -7.128 -6.943 1.00 4.34 H new ATOM 0 HG LEU A 37 13.095 -6.254 -4.207 1.00 52.40 H new ATOM 0 HD11 LEU A 37 12.755 -8.522 -3.309 1.00 1.41 H new ATOM 0 HD12 LEU A 37 11.213 -7.741 -3.734 1.00 1.41 H new ATOM 0 HD13 LEU A 37 11.907 -8.982 -4.805 1.00 1.41 H new ATOM 0 HD21 LEU A 37 14.813 -7.986 -4.559 1.00 43.23 H new ATOM 0 HD22 LEU A 37 14.047 -8.424 -6.105 1.00 43.23 H new ATOM 0 HD23 LEU A 37 14.773 -6.813 -5.897 1.00 43.23 H new ATOM 599 N GLY A 38 10.116 -3.931 -6.797 1.00 43.33 N ATOM 600 CA GLY A 38 9.017 -3.455 -7.617 1.00 1.31 C ATOM 601 C GLY A 38 9.491 -2.672 -8.825 1.00 11.14 C ATOM 602 O GLY A 38 8.831 -2.659 -9.864 1.00 33.42 O ATOM 0 H GLY A 38 10.045 -3.698 -5.807 1.00 43.33 H new ATOM 0 HA2 GLY A 38 8.422 -4.305 -7.950 1.00 1.31 H new ATOM 0 HA3 GLY A 38 8.364 -2.825 -7.013 1.00 1.31 H new ATOM 606 N ARG A 39 10.639 -2.014 -8.689 1.00 31.42 N ATOM 607 CA ARG A 39 11.199 -1.222 -9.777 1.00 72.40 C ATOM 608 C ARG A 39 11.260 -2.036 -11.066 1.00 11.32 C ATOM 609 O ARG A 39 11.522 -3.239 -11.042 1.00 10.42 O ATOM 610 CB ARG A 39 12.599 -0.727 -9.407 1.00 53.53 C ATOM 611 CG ARG A 39 13.628 -1.839 -9.295 1.00 14.23 C ATOM 612 CD ARG A 39 15.045 -1.287 -9.297 1.00 1.14 C ATOM 613 NE ARG A 39 15.494 -0.927 -7.954 1.00 2.12 N ATOM 614 CZ ARG A 39 16.768 -0.727 -7.634 1.00 4.13 C ATOM 615 NH1 ARG A 39 17.714 -0.852 -8.555 1.00 74.43 N ATOM 616 NH2 ARG A 39 17.098 -0.403 -6.391 1.00 55.14 N ATOM 0 H ARG A 39 11.198 -2.014 -7.836 1.00 31.42 H new ATOM 0 HA ARG A 39 10.548 -0.363 -9.940 1.00 72.40 H new ATOM 0 HB2 ARG A 39 12.932 -0.010 -10.157 1.00 53.53 H new ATOM 0 HB3 ARG A 39 12.548 -0.194 -8.458 1.00 53.53 H new ATOM 0 HG2 ARG A 39 13.457 -2.404 -8.378 1.00 14.23 H new ATOM 0 HG3 ARG A 39 13.506 -2.535 -10.125 1.00 14.23 H new ATOM 0 HD2 ARG A 39 15.723 -2.029 -9.719 1.00 1.14 H new ATOM 0 HD3 ARG A 39 15.091 -0.410 -9.942 1.00 1.14 H new ATOM 0 HE ARG A 39 14.791 -0.824 -7.222 1.00 2.12 H new ATOM 0 HH11 ARG A 39 17.464 -1.102 -9.512 1.00 74.43 H new ATOM 0 HH12 ARG A 39 18.691 -0.698 -8.307 1.00 74.43 H new ATOM 0 HH21 ARG A 39 16.373 -0.307 -5.679 1.00 55.14 H new ATOM 0 HH22 ARG A 39 18.076 -0.250 -6.147 1.00 55.14 H new ATOM 627 N LEU A 40 11.016 -1.372 -12.190 1.00 41.52 N ATOM 628 CA LEU A 40 11.043 -2.033 -13.491 1.00 21.31 C ATOM 629 C LEU A 40 12.468 -2.411 -13.881 1.00 75.23 C ATOM 630 O LEU A 40 13.420 -2.110 -13.160 1.00 72.41 O ATOM 631 CB LEU A 40 10.432 -1.124 -14.559 1.00 11.14 C ATOM 632 CG LEU A 40 9.499 -1.801 -15.562 1.00 45.34 C ATOM 633 CD1 LEU A 40 8.071 -1.816 -15.039 1.00 32.32 C ATOM 634 CD2 LEU A 40 9.566 -1.100 -16.912 1.00 55.22 C ATOM 0 H LEU A 40 10.797 -0.376 -12.227 1.00 41.52 H new ATOM 0 HA LEU A 40 10.453 -2.946 -13.420 1.00 21.31 H new ATOM 0 HB2 LEU A 40 9.879 -0.329 -14.058 1.00 11.14 H new ATOM 0 HB3 LEU A 40 11.243 -0.649 -15.111 1.00 11.14 H new ATOM 0 HG LEU A 40 9.827 -2.832 -15.693 1.00 45.34 H new ATOM 0 HD11 LEU A 40 7.422 -2.302 -15.767 1.00 32.32 H new ATOM 0 HD12 LEU A 40 8.034 -2.364 -14.097 1.00 32.32 H new ATOM 0 HD13 LEU A 40 7.732 -0.793 -14.877 1.00 32.32 H new ATOM 0 HD21 LEU A 40 8.895 -1.596 -17.613 1.00 55.22 H new ATOM 0 HD22 LEU A 40 9.265 -0.059 -16.797 1.00 55.22 H new ATOM 0 HD23 LEU A 40 10.586 -1.143 -17.294 1.00 55.22 H new ATOM 645 N ASP A 41 12.608 -3.067 -15.026 1.00 64.32 N ATOM 646 CA ASP A 41 13.918 -3.483 -15.515 1.00 75.55 C ATOM 647 C ASP A 41 14.677 -4.256 -14.441 1.00 14.13 C ATOM 648 O ASP A 41 15.897 -4.140 -14.326 1.00 71.20 O ATOM 649 CB ASP A 41 14.731 -2.265 -15.956 1.00 10.34 C ATOM 650 CG ASP A 41 15.750 -2.606 -17.026 1.00 20.14 C ATOM 651 OD1 ASP A 41 15.337 -2.891 -18.170 1.00 13.15 O ATOM 652 OD2 ASP A 41 16.961 -2.587 -16.718 1.00 44.44 O ATOM 0 H ASP A 41 11.830 -3.323 -15.634 1.00 64.32 H new ATOM 0 HA ASP A 41 13.768 -4.139 -16.372 1.00 75.55 H new ATOM 0 HB2 ASP A 41 14.055 -1.498 -16.333 1.00 10.34 H new ATOM 0 HB3 ASP A 41 15.243 -1.842 -15.092 1.00 10.34 H new ATOM 656 N ASN A 42 13.948 -5.044 -13.658 1.00 73.15 N ATOM 657 CA ASN A 42 14.553 -5.835 -12.593 1.00 75.15 C ATOM 658 C ASN A 42 15.719 -6.661 -13.124 1.00 62.31 C ATOM 659 O ASN A 42 15.573 -7.406 -14.093 1.00 61.03 O ATOM 660 CB ASN A 42 13.509 -6.753 -11.955 1.00 2.22 C ATOM 661 CG ASN A 42 13.109 -7.896 -12.870 1.00 13.44 C ATOM 662 OD1 ASN A 42 13.653 -8.996 -12.780 1.00 63.32 O ATOM 663 ND2 ASN A 42 12.156 -7.637 -13.757 1.00 75.35 N ATOM 0 H ASN A 42 12.937 -5.152 -13.741 1.00 73.15 H new ATOM 0 HA ASN A 42 14.933 -5.149 -11.836 1.00 75.15 H new ATOM 0 HB2 ASN A 42 13.905 -7.158 -11.024 1.00 2.22 H new ATOM 0 HB3 ASN A 42 12.625 -6.170 -11.698 1.00 2.22 H new ATOM 0 HD21 ASN A 42 11.846 -8.365 -14.400 1.00 75.35 H new ATOM 0 HD22 ASN A 42 11.733 -6.710 -13.795 1.00 75.35 H new ATOM 669 N GLN A 43 16.876 -6.526 -12.483 1.00 62.22 N ATOM 670 CA GLN A 43 18.066 -7.261 -12.892 1.00 42.41 C ATOM 671 C GLN A 43 17.945 -8.738 -12.532 1.00 75.22 C ATOM 672 O GLN A 43 18.502 -9.600 -13.209 1.00 64.52 O ATOM 673 CB GLN A 43 19.311 -6.664 -12.234 1.00 53.43 C ATOM 674 CG GLN A 43 19.223 -6.593 -10.718 1.00 4.43 C ATOM 675 CD GLN A 43 19.681 -5.257 -10.169 1.00 14.05 C ATOM 676 OE1 GLN A 43 20.851 -4.892 -10.290 1.00 34.32 O ATOM 677 NE2 GLN A 43 18.761 -4.519 -9.560 1.00 62.32 N ATOM 0 H GLN A 43 17.014 -5.914 -11.678 1.00 62.22 H new ATOM 0 HA GLN A 43 18.160 -7.177 -13.975 1.00 42.41 H new ATOM 0 HB2 GLN A 43 20.180 -7.261 -12.512 1.00 53.43 H new ATOM 0 HB3 GLN A 43 19.474 -5.661 -12.628 1.00 53.43 H new ATOM 0 HG2 GLN A 43 18.194 -6.775 -10.409 1.00 4.43 H new ATOM 0 HG3 GLN A 43 19.831 -7.387 -10.285 1.00 4.43 H new ATOM 0 HE21 GLN A 43 17.803 -4.860 -9.482 1.00 62.32 H new ATOM 0 HE22 GLN A 43 19.012 -3.611 -9.170 1.00 62.32 H new ATOM 684 N GLY A 44 17.212 -9.022 -11.459 1.00 63.30 N ATOM 685 CA GLY A 44 17.031 -10.396 -11.027 1.00 75.02 C ATOM 686 C GLY A 44 15.936 -11.106 -11.797 1.00 44.33 C ATOM 687 O GLY A 44 16.168 -11.618 -12.892 1.00 3.41 O ATOM 0 H GLY A 44 16.741 -8.326 -10.882 1.00 63.30 H new ATOM 0 HA2 GLY A 44 17.968 -10.939 -11.150 1.00 75.02 H new ATOM 0 HA3 GLY A 44 16.791 -10.411 -9.964 1.00 75.02 H new ATOM 691 N LYS A 45 14.738 -11.141 -11.224 1.00 50.04 N ATOM 692 CA LYS A 45 13.602 -11.794 -11.863 1.00 24.01 C ATOM 693 C LYS A 45 12.343 -11.650 -11.014 1.00 73.14 C ATOM 694 O LYS A 45 11.232 -11.579 -11.541 1.00 53.04 O ATOM 695 CB LYS A 45 13.904 -13.276 -12.097 1.00 31.44 C ATOM 696 CG LYS A 45 14.130 -14.060 -10.815 1.00 72.21 C ATOM 697 CD LYS A 45 15.474 -13.728 -10.188 1.00 65.32 C ATOM 698 CE LYS A 45 16.046 -14.920 -9.434 1.00 31.21 C ATOM 699 NZ LYS A 45 16.895 -15.775 -10.309 1.00 43.54 N ATOM 0 H LYS A 45 14.529 -10.724 -10.317 1.00 50.04 H new ATOM 0 HA LYS A 45 13.430 -11.308 -12.823 1.00 24.01 H new ATOM 0 HB2 LYS A 45 13.076 -13.725 -12.646 1.00 31.44 H new ATOM 0 HB3 LYS A 45 14.789 -13.363 -12.727 1.00 31.44 H new ATOM 0 HG2 LYS A 45 13.332 -13.838 -10.106 1.00 72.21 H new ATOM 0 HG3 LYS A 45 14.080 -15.128 -11.027 1.00 72.21 H new ATOM 0 HD2 LYS A 45 16.173 -13.418 -10.965 1.00 65.32 H new ATOM 0 HD3 LYS A 45 15.361 -12.885 -9.506 1.00 65.32 H new ATOM 0 HE2 LYS A 45 16.637 -14.566 -8.589 1.00 31.21 H new ATOM 0 HE3 LYS A 45 15.230 -15.516 -9.025 1.00 31.21 H new ATOM 0 HZ1 LYS A 45 17.265 -16.576 -9.758 1.00 43.54 H new ATOM 0 HZ2 LYS A 45 16.325 -16.134 -11.102 1.00 43.54 H new ATOM 0 HZ3 LYS A 45 17.688 -15.213 -10.679 1.00 43.54 H new ATOM 709 N ILE A 46 12.523 -11.605 -9.698 1.00 12.45 N ATOM 710 CA ILE A 46 11.402 -11.466 -8.778 1.00 35.23 C ATOM 711 C ILE A 46 10.585 -10.217 -9.091 1.00 4.11 C ATOM 712 O ILE A 46 9.367 -10.284 -9.252 1.00 72.21 O ATOM 713 CB ILE A 46 11.879 -11.399 -7.315 1.00 2.41 C ATOM 714 CG1 ILE A 46 12.916 -12.491 -7.044 1.00 40.11 C ATOM 715 CG2 ILE A 46 10.698 -11.535 -6.366 1.00 12.21 C ATOM 716 CD1 ILE A 46 14.328 -11.966 -6.914 1.00 74.02 C ATOM 0 H ILE A 46 13.435 -11.663 -9.245 1.00 12.45 H new ATOM 0 HA ILE A 46 10.776 -12.349 -8.908 1.00 35.23 H new ATOM 0 HB ILE A 46 12.347 -10.429 -7.144 1.00 2.41 H new ATOM 0 HG12 ILE A 46 12.647 -13.017 -6.128 1.00 40.11 H new ATOM 0 HG13 ILE A 46 12.882 -13.221 -7.852 1.00 40.11 H new ATOM 0 HG21 ILE A 46 11.051 -11.486 -5.336 1.00 12.21 H new ATOM 0 HG22 ILE A 46 9.991 -10.725 -6.546 1.00 12.21 H new ATOM 0 HG23 ILE A 46 10.204 -12.492 -6.535 1.00 12.21 H new ATOM 0 HD11 ILE A 46 15.009 -12.796 -6.723 1.00 74.02 H new ATOM 0 HD12 ILE A 46 14.617 -11.466 -7.838 1.00 74.02 H new ATOM 0 HD13 ILE A 46 14.378 -11.258 -6.087 1.00 74.02 H new ATOM 727 N ASN A 47 11.265 -9.078 -9.180 1.00 31.42 N ATOM 728 CA ASN A 47 10.602 -7.814 -9.476 1.00 74.02 C ATOM 729 C ASN A 47 9.424 -7.582 -8.534 1.00 25.35 C ATOM 730 O ASN A 47 8.401 -7.025 -8.929 1.00 44.14 O ATOM 731 CB ASN A 47 10.121 -7.793 -10.928 1.00 64.41 C ATOM 732 CG ASN A 47 9.638 -6.422 -11.358 1.00 31.24 C ATOM 733 OD1 ASN A 47 10.095 -5.401 -10.843 1.00 65.24 O ATOM 734 ND2 ASN A 47 8.710 -6.392 -12.307 1.00 21.13 N ATOM 0 H ASN A 47 12.274 -9.005 -9.051 1.00 31.42 H new ATOM 0 HA ASN A 47 11.325 -7.011 -9.329 1.00 74.02 H new ATOM 0 HB2 ASN A 47 10.934 -8.110 -11.582 1.00 64.41 H new ATOM 0 HB3 ASN A 47 9.313 -8.515 -11.051 1.00 64.41 H new ATOM 0 HD21 ASN A 47 8.347 -5.498 -12.637 1.00 21.13 H new ATOM 0 HD22 ASN A 47 8.360 -7.263 -12.706 1.00 21.13 H new ATOM 740 N ALA A 48 9.576 -8.016 -7.287 1.00 14.12 N ATOM 741 CA ALA A 48 8.526 -7.855 -6.289 1.00 14.40 C ATOM 742 C ALA A 48 8.966 -8.404 -4.936 1.00 34.14 C ATOM 743 O ALA A 48 9.651 -9.424 -4.862 1.00 4.44 O ATOM 744 CB ALA A 48 7.250 -8.543 -6.750 1.00 70.13 C ATOM 0 H ALA A 48 10.416 -8.482 -6.944 1.00 14.12 H new ATOM 0 HA ALA A 48 8.330 -6.789 -6.173 1.00 14.40 H new ATOM 0 HB1 ALA A 48 6.474 -8.415 -5.995 1.00 70.13 H new ATOM 0 HB2 ALA A 48 6.918 -8.102 -7.690 1.00 70.13 H new ATOM 0 HB3 ALA A 48 7.442 -9.606 -6.896 1.00 70.13 H new ATOM 750 N TRP A 49 8.570 -7.720 -3.869 1.00 21.51 N ATOM 751 CA TRP A 49 8.925 -8.141 -2.518 1.00 72.33 C ATOM 752 C TRP A 49 7.986 -9.236 -2.023 1.00 73.12 C ATOM 753 O TRP A 49 6.772 -9.164 -2.222 1.00 12.25 O ATOM 754 CB TRP A 49 8.883 -6.946 -1.562 1.00 44.34 C ATOM 755 CG TRP A 49 8.391 -7.299 -0.191 1.00 14.41 C ATOM 756 CD1 TRP A 49 9.152 -7.651 0.887 1.00 12.31 C ATOM 757 CD2 TRP A 49 7.029 -7.335 0.248 1.00 12.41 C ATOM 758 NE1 TRP A 49 8.345 -7.904 1.969 1.00 63.20 N ATOM 759 CE2 TRP A 49 7.038 -7.717 1.604 1.00 10.20 C ATOM 760 CE3 TRP A 49 5.802 -7.081 -0.372 1.00 54.21 C ATOM 761 CZ2 TRP A 49 5.868 -7.850 2.347 1.00 1.04 C ATOM 762 CZ3 TRP A 49 4.642 -7.214 0.367 1.00 34.14 C ATOM 763 CH2 TRP A 49 4.682 -7.595 1.715 1.00 71.11 C ATOM 0 H TRP A 49 8.004 -6.873 -3.912 1.00 21.51 H new ATOM 0 HA TRP A 49 9.938 -8.542 -2.544 1.00 72.33 H new ATOM 0 HB2 TRP A 49 9.882 -6.518 -1.483 1.00 44.34 H new ATOM 0 HB3 TRP A 49 8.239 -6.175 -1.984 1.00 44.34 H new ATOM 0 HD1 TRP A 49 10.230 -7.720 0.888 1.00 12.31 H new ATOM 0 HE1 TRP A 49 8.667 -8.186 2.895 1.00 63.20 H new ATOM 0 HE3 TRP A 49 5.761 -6.786 -1.410 1.00 54.21 H new ATOM 0 HZ2 TRP A 49 5.896 -8.144 3.386 1.00 1.04 H new ATOM 0 HZ3 TRP A 49 3.689 -7.021 -0.102 1.00 34.14 H new ATOM 0 HH2 TRP A 49 3.758 -7.689 2.266 1.00 71.11 H new ATOM 773 N THR A 50 8.553 -10.250 -1.378 1.00 11.11 N ATOM 774 CA THR A 50 7.766 -11.360 -0.856 1.00 10.13 C ATOM 775 C THR A 50 7.754 -11.356 0.668 1.00 64.14 C ATOM 776 O THR A 50 8.502 -10.613 1.303 1.00 30.22 O ATOM 777 CB THR A 50 8.309 -12.713 -1.350 1.00 24.35 C ATOM 778 OG1 THR A 50 9.020 -12.538 -2.581 1.00 35.52 O ATOM 779 CG2 THR A 50 7.177 -13.711 -1.551 1.00 54.42 C ATOM 0 H THR A 50 9.555 -10.326 -1.204 1.00 11.11 H new ATOM 0 HA THR A 50 6.749 -11.228 -1.225 1.00 10.13 H new ATOM 0 HB THR A 50 8.987 -13.104 -0.592 1.00 24.35 H new ATOM 0 HG1 THR A 50 9.363 -13.404 -2.887 1.00 35.52 H new ATOM 0 HG21 THR A 50 7.586 -14.659 -1.900 1.00 54.42 H new ATOM 0 HG22 THR A 50 6.657 -13.866 -0.606 1.00 54.42 H new ATOM 0 HG23 THR A 50 6.477 -13.323 -2.291 1.00 54.42 H new ATOM 787 N ALA A 51 6.899 -12.192 1.250 1.00 33.00 N ATOM 788 CA ALA A 51 6.791 -12.286 2.700 1.00 31.21 C ATOM 789 C ALA A 51 7.745 -13.339 3.254 1.00 30.30 C ATOM 790 O ALA A 51 8.317 -14.127 2.503 1.00 0.54 O ATOM 791 CB ALA A 51 5.359 -12.603 3.104 1.00 44.11 C ATOM 0 H ALA A 51 6.272 -12.813 0.739 1.00 33.00 H new ATOM 0 HA ALA A 51 7.070 -11.321 3.124 1.00 31.21 H new ATOM 0 HB1 ALA A 51 5.294 -12.670 4.190 1.00 44.11 H new ATOM 0 HB2 ALA A 51 4.697 -11.813 2.749 1.00 44.11 H new ATOM 0 HB3 ALA A 51 5.058 -13.553 2.663 1.00 44.11 H new ATOM 797 N GLN A 52 7.911 -13.346 4.573 1.00 71.03 N ATOM 798 CA GLN A 52 8.796 -14.302 5.227 1.00 45.22 C ATOM 799 C GLN A 52 8.011 -15.496 5.759 1.00 73.32 C ATOM 800 O GLN A 52 8.256 -16.637 5.368 1.00 50.44 O ATOM 801 CB GLN A 52 9.557 -13.626 6.369 1.00 10.21 C ATOM 802 CG GLN A 52 10.309 -14.602 7.260 1.00 71.32 C ATOM 803 CD GLN A 52 10.965 -15.722 6.476 1.00 73.44 C ATOM 804 OE1 GLN A 52 10.587 -16.957 6.780 1.00 35.25 O flip ATOM 805 NE2 GLN A 52 11.802 -15.478 5.606 1.00 32.45 N flip ATOM 0 H GLN A 52 7.444 -12.700 5.209 1.00 71.03 H new ATOM 0 HA GLN A 52 9.511 -14.662 4.487 1.00 45.22 H new ATOM 0 HB2 GLN A 52 10.264 -12.910 5.950 1.00 10.21 H new ATOM 0 HB3 GLN A 52 8.853 -13.059 6.978 1.00 10.21 H new ATOM 0 HG2 GLN A 52 11.071 -14.062 7.822 1.00 71.32 H new ATOM 0 HG3 GLN A 52 9.619 -15.029 7.988 1.00 71.32 H new ATOM 0 HE21 GLN A 52 12.063 -14.512 5.405 1.00 32.45 H new ATOM 0 HE22 GLN A 52 12.235 -16.241 5.086 1.00 32.45 H new ATOM 812 N SER A 53 7.066 -15.225 6.654 1.00 34.21 N ATOM 813 CA SER A 53 6.248 -16.278 7.244 1.00 43.13 C ATOM 814 C SER A 53 5.098 -16.656 6.314 1.00 74.55 C ATOM 815 O SER A 53 4.301 -17.541 6.624 1.00 12.30 O ATOM 816 CB SER A 53 5.697 -15.827 8.598 1.00 31.33 C ATOM 817 OG SER A 53 5.266 -16.936 9.367 1.00 71.24 O ATOM 0 H SER A 53 6.848 -14.286 6.986 1.00 34.21 H new ATOM 0 HA SER A 53 6.878 -17.155 7.391 1.00 43.13 H new ATOM 0 HB2 SER A 53 6.466 -15.279 9.143 1.00 31.33 H new ATOM 0 HB3 SER A 53 4.864 -15.141 8.445 1.00 31.33 H new ATOM 0 HG SER A 53 4.705 -17.519 8.814 1.00 71.24 H new ATOM 822 N ASN A 54 5.017 -15.976 5.176 1.00 50.51 N ATOM 823 CA ASN A 54 3.965 -16.239 4.201 1.00 51.12 C ATOM 824 C ASN A 54 2.591 -16.215 4.865 1.00 4.22 C ATOM 825 O ASN A 54 1.702 -16.987 4.502 1.00 35.30 O ATOM 826 CB ASN A 54 4.193 -17.592 3.524 1.00 1.04 C ATOM 827 CG ASN A 54 5.667 -17.924 3.379 1.00 62.45 C ATOM 828 OD1 ASN A 54 6.379 -17.305 2.588 1.00 64.54 O ATOM 829 ND2 ASN A 54 6.129 -18.905 4.144 1.00 10.35 N ATOM 0 H ASN A 54 5.667 -15.238 4.906 1.00 50.51 H new ATOM 0 HA ASN A 54 3.999 -15.453 3.446 1.00 51.12 H new ATOM 0 HB2 ASN A 54 3.703 -18.373 4.105 1.00 1.04 H new ATOM 0 HB3 ASN A 54 3.726 -17.586 2.539 1.00 1.04 H new ATOM 0 HD21 ASN A 54 7.112 -19.174 4.091 1.00 10.35 H new ATOM 0 HD22 ASN A 54 5.502 -19.390 4.785 1.00 10.35 H new ATOM 835 N SER A 55 2.424 -15.325 5.837 1.00 34.02 N ATOM 836 CA SER A 55 1.160 -15.202 6.553 1.00 35.44 C ATOM 837 C SER A 55 0.649 -13.765 6.512 1.00 2.32 C ATOM 838 O SER A 55 1.177 -12.929 5.780 1.00 70.23 O ATOM 839 CB SER A 55 1.328 -15.654 8.006 1.00 63.13 C ATOM 840 OG SER A 55 0.090 -16.076 8.554 1.00 15.12 O ATOM 0 H SER A 55 3.149 -14.678 6.147 1.00 34.02 H new ATOM 0 HA SER A 55 0.428 -15.843 6.061 1.00 35.44 H new ATOM 0 HB2 SER A 55 2.049 -16.470 8.056 1.00 63.13 H new ATOM 0 HB3 SER A 55 1.733 -14.835 8.601 1.00 63.13 H new ATOM 0 HG SER A 55 0.223 -16.362 9.482 1.00 15.12 H new ATOM 845 N ALA A 56 -0.382 -13.488 7.303 1.00 40.12 N ATOM 846 CA ALA A 56 -0.964 -12.153 7.358 1.00 74.13 C ATOM 847 C ALA A 56 -0.226 -11.273 8.362 1.00 34.43 C ATOM 848 O ALA A 56 -0.389 -10.053 8.373 1.00 3.11 O ATOM 849 CB ALA A 56 -2.442 -12.235 7.713 1.00 23.15 C ATOM 0 H ALA A 56 -0.831 -14.170 7.914 1.00 40.12 H new ATOM 0 HA ALA A 56 -0.863 -11.699 6.372 1.00 74.13 H new ATOM 0 HB1 ALA A 56 -2.863 -11.230 7.751 1.00 23.15 H new ATOM 0 HB2 ALA A 56 -2.966 -12.820 6.957 1.00 23.15 H new ATOM 0 HB3 ALA A 56 -2.557 -12.713 8.686 1.00 23.15 H new ATOM 855 N LYS A 57 0.586 -11.901 9.206 1.00 74.54 N ATOM 856 CA LYS A 57 1.350 -11.176 10.215 1.00 13.22 C ATOM 857 C LYS A 57 2.400 -10.283 9.564 1.00 12.55 C ATOM 858 O LYS A 57 2.937 -9.375 10.199 1.00 23.15 O ATOM 859 CB LYS A 57 2.024 -12.157 11.177 1.00 42.02 C ATOM 860 CG LYS A 57 1.072 -12.767 12.190 1.00 33.42 C ATOM 861 CD LYS A 57 1.384 -14.233 12.438 1.00 4.13 C ATOM 862 CE LYS A 57 2.395 -14.405 13.562 1.00 24.43 C ATOM 863 NZ LYS A 57 2.861 -15.815 13.678 1.00 71.43 N ATOM 0 H LYS A 57 0.732 -12.910 9.211 1.00 74.54 H new ATOM 0 HA LYS A 57 0.659 -10.546 10.775 1.00 13.22 H new ATOM 0 HB2 LYS A 57 2.489 -12.957 10.600 1.00 42.02 H new ATOM 0 HB3 LYS A 57 2.824 -11.641 11.708 1.00 42.02 H new ATOM 0 HG2 LYS A 57 1.137 -12.217 13.129 1.00 33.42 H new ATOM 0 HG3 LYS A 57 0.047 -12.668 11.833 1.00 33.42 H new ATOM 0 HD2 LYS A 57 0.466 -14.764 12.689 1.00 4.13 H new ATOM 0 HD3 LYS A 57 1.773 -14.683 11.525 1.00 4.13 H new ATOM 0 HE2 LYS A 57 3.250 -13.753 13.384 1.00 24.43 H new ATOM 0 HE3 LYS A 57 1.947 -14.092 14.505 1.00 24.43 H new ATOM 0 HZ1 LYS A 57 3.548 -15.891 14.455 1.00 71.43 H new ATOM 0 HZ2 LYS A 57 2.049 -16.434 13.873 1.00 71.43 H new ATOM 0 HZ3 LYS A 57 3.312 -16.106 12.787 1.00 71.43 H new ATOM 873 N GLU A 58 2.689 -10.546 8.293 1.00 51.55 N ATOM 874 CA GLU A 58 3.675 -9.765 7.556 1.00 14.04 C ATOM 875 C GLU A 58 3.075 -8.448 7.072 1.00 74.10 C ATOM 876 O GLU A 58 1.881 -8.367 6.783 1.00 0.45 O ATOM 877 CB GLU A 58 4.206 -10.564 6.364 1.00 31.32 C ATOM 878 CG GLU A 58 5.693 -10.863 6.447 1.00 5.53 C ATOM 879 CD GLU A 58 6.055 -11.701 7.658 1.00 63.51 C ATOM 880 OE1 GLU A 58 5.339 -12.686 7.933 1.00 23.52 O ATOM 881 OE2 GLU A 58 7.053 -11.371 8.331 1.00 53.44 O ATOM 0 H GLU A 58 2.254 -11.294 7.753 1.00 51.55 H new ATOM 0 HA GLU A 58 4.501 -9.542 8.231 1.00 14.04 H new ATOM 0 HB2 GLU A 58 3.658 -11.504 6.294 1.00 31.32 H new ATOM 0 HB3 GLU A 58 4.006 -10.009 5.447 1.00 31.32 H new ATOM 0 HG2 GLU A 58 6.005 -11.385 5.543 1.00 5.53 H new ATOM 0 HG3 GLU A 58 6.247 -9.925 6.481 1.00 5.53 H new ATOM 886 N TRP A 59 3.911 -7.419 6.987 1.00 44.11 N ATOM 887 CA TRP A 59 3.464 -6.106 6.539 1.00 40.10 C ATOM 888 C TRP A 59 4.586 -5.363 5.822 1.00 4.33 C ATOM 889 O TRP A 59 5.757 -5.486 6.187 1.00 44.53 O ATOM 890 CB TRP A 59 2.968 -5.281 7.727 1.00 53.35 C ATOM 891 CG TRP A 59 3.911 -5.290 8.892 1.00 70.54 C ATOM 892 CD1 TRP A 59 5.165 -4.752 8.937 1.00 70.21 C ATOM 893 CD2 TRP A 59 3.674 -5.869 10.180 1.00 30.12 C ATOM 894 NE1 TRP A 59 5.723 -4.961 10.176 1.00 45.34 N ATOM 895 CE2 TRP A 59 4.828 -5.644 10.956 1.00 54.02 C ATOM 896 CE3 TRP A 59 2.599 -6.554 10.755 1.00 53.53 C ATOM 897 CZ2 TRP A 59 4.935 -6.080 12.274 1.00 51.23 C ATOM 898 CZ3 TRP A 59 2.707 -6.986 12.063 1.00 11.40 C ATOM 899 CH2 TRP A 59 3.868 -6.748 12.811 1.00 34.20 C ATOM 0 H TRP A 59 4.902 -7.469 7.223 1.00 44.11 H new ATOM 0 HA TRP A 59 2.643 -6.250 5.837 1.00 40.10 H new ATOM 0 HB2 TRP A 59 2.810 -4.252 7.405 1.00 53.35 H new ATOM 0 HB3 TRP A 59 2.001 -5.666 8.049 1.00 53.35 H new ATOM 0 HD1 TRP A 59 5.648 -4.238 8.119 1.00 70.21 H new ATOM 0 HE1 TRP A 59 6.652 -4.657 10.467 1.00 45.34 H new ATOM 0 HE3 TRP A 59 1.700 -6.742 10.187 1.00 53.53 H new ATOM 0 HZ2 TRP A 59 5.829 -5.897 12.852 1.00 51.23 H new ATOM 0 HZ3 TRP A 59 1.883 -7.516 12.517 1.00 11.40 H new ATOM 0 HH2 TRP A 59 3.922 -7.099 13.831 1.00 34.20 H new ATOM 909 N LEU A 60 4.224 -4.594 4.802 1.00 72.32 N ATOM 910 CA LEU A 60 5.202 -3.831 4.034 1.00 63.23 C ATOM 911 C LEU A 60 4.966 -2.332 4.189 1.00 1.10 C ATOM 912 O LEU A 60 3.865 -1.839 3.944 1.00 20.50 O ATOM 913 CB LEU A 60 5.133 -4.219 2.555 1.00 14.11 C ATOM 914 CG LEU A 60 5.869 -3.296 1.585 1.00 41.41 C ATOM 915 CD1 LEU A 60 7.308 -3.087 2.033 1.00 74.45 C ATOM 916 CD2 LEU A 60 5.827 -3.863 0.173 1.00 23.31 C ATOM 0 H LEU A 60 3.260 -4.482 4.487 1.00 72.32 H new ATOM 0 HA LEU A 60 6.194 -4.066 4.420 1.00 63.23 H new ATOM 0 HB2 LEU A 60 5.537 -5.225 2.445 1.00 14.11 H new ATOM 0 HB3 LEU A 60 4.085 -4.262 2.260 1.00 14.11 H new ATOM 0 HG LEU A 60 5.366 -2.329 1.583 1.00 41.41 H new ATOM 0 HD11 LEU A 60 7.816 -2.427 1.330 1.00 74.45 H new ATOM 0 HD12 LEU A 60 7.318 -2.637 3.026 1.00 74.45 H new ATOM 0 HD13 LEU A 60 7.822 -4.048 2.065 1.00 74.45 H new ATOM 0 HD21 LEU A 60 6.356 -3.192 -0.504 1.00 23.31 H new ATOM 0 HD22 LEU A 60 6.304 -4.843 0.160 1.00 23.31 H new ATOM 0 HD23 LEU A 60 4.790 -3.960 -0.149 1.00 23.31 H new ATOM 927 N GLN A 61 6.008 -1.614 4.595 1.00 51.11 N ATOM 928 CA GLN A 61 5.914 -0.170 4.780 1.00 51.04 C ATOM 929 C GLN A 61 6.923 0.559 3.899 1.00 21.22 C ATOM 930 O GLN A 61 7.934 -0.013 3.491 1.00 22.34 O ATOM 931 CB GLN A 61 6.145 0.193 6.248 1.00 25.51 C ATOM 932 CG GLN A 61 7.539 -0.150 6.747 1.00 15.24 C ATOM 933 CD GLN A 61 7.615 -1.530 7.368 1.00 34.32 C ATOM 934 OE1 GLN A 61 6.635 -2.276 7.373 1.00 11.55 O ATOM 935 NE2 GLN A 61 8.782 -1.878 7.898 1.00 10.34 N ATOM 0 H GLN A 61 6.926 -2.007 4.802 1.00 51.11 H new ATOM 0 HA GLN A 61 4.912 0.144 4.488 1.00 51.04 H new ATOM 0 HB2 GLN A 61 5.973 1.261 6.381 1.00 25.51 H new ATOM 0 HB3 GLN A 61 5.410 -0.327 6.862 1.00 25.51 H new ATOM 0 HG2 GLN A 61 8.242 -0.091 5.917 1.00 15.24 H new ATOM 0 HG3 GLN A 61 7.850 0.592 7.482 1.00 15.24 H new ATOM 0 HE21 GLN A 61 9.568 -1.228 7.872 1.00 10.34 H new ATOM 0 HE22 GLN A 61 8.892 -2.795 8.331 1.00 10.34 H new ATOM 942 N VAL A 62 6.642 1.825 3.609 1.00 43.40 N ATOM 943 CA VAL A 62 7.525 2.633 2.777 1.00 43.53 C ATOM 944 C VAL A 62 7.879 3.946 3.464 1.00 53.25 C ATOM 945 O VAL A 62 7.011 4.787 3.704 1.00 63.24 O ATOM 946 CB VAL A 62 6.885 2.937 1.409 1.00 51.22 C ATOM 947 CG1 VAL A 62 7.926 3.477 0.440 1.00 64.41 C ATOM 948 CG2 VAL A 62 6.214 1.694 0.847 1.00 41.13 C ATOM 0 H VAL A 62 5.809 2.313 3.938 1.00 43.40 H new ATOM 0 HA VAL A 62 8.434 2.051 2.623 1.00 43.53 H new ATOM 0 HB VAL A 62 6.121 3.703 1.547 1.00 51.22 H new ATOM 0 HG11 VAL A 62 7.455 3.686 -0.521 1.00 64.41 H new ATOM 0 HG12 VAL A 62 8.355 4.395 0.841 1.00 64.41 H new ATOM 0 HG13 VAL A 62 8.715 2.737 0.304 1.00 64.41 H new ATOM 0 HG21 VAL A 62 5.767 1.927 -0.120 1.00 41.13 H new ATOM 0 HG22 VAL A 62 6.955 0.905 0.723 1.00 41.13 H new ATOM 0 HG23 VAL A 62 5.437 1.358 1.534 1.00 41.13 H new ATOM 958 N ASP A 63 9.158 4.118 3.779 1.00 42.33 N ATOM 959 CA ASP A 63 9.627 5.332 4.438 1.00 63.31 C ATOM 960 C ASP A 63 10.230 6.301 3.426 1.00 53.03 C ATOM 961 O ASP A 63 11.147 5.948 2.682 1.00 73.31 O ATOM 962 CB ASP A 63 10.660 4.987 5.511 1.00 22.44 C ATOM 963 CG ASP A 63 10.979 6.167 6.408 1.00 34.31 C ATOM 964 OD1 ASP A 63 11.149 7.285 5.879 1.00 35.23 O ATOM 965 OD2 ASP A 63 11.058 5.973 7.640 1.00 25.31 O ATOM 0 H ASP A 63 9.889 3.432 3.589 1.00 42.33 H new ATOM 0 HA ASP A 63 8.771 5.815 4.910 1.00 63.31 H new ATOM 0 HB2 ASP A 63 10.287 4.163 6.119 1.00 22.44 H new ATOM 0 HB3 ASP A 63 11.576 4.641 5.032 1.00 22.44 H new ATOM 969 N LEU A 64 9.710 7.523 3.403 1.00 53.22 N ATOM 970 CA LEU A 64 10.196 8.544 2.481 1.00 31.32 C ATOM 971 C LEU A 64 10.965 9.630 3.228 1.00 24.24 C ATOM 972 O LEU A 64 12.139 9.875 2.951 1.00 73.41 O ATOM 973 CB LEU A 64 9.027 9.167 1.716 1.00 43.03 C ATOM 974 CG LEU A 64 8.595 8.438 0.443 1.00 13.30 C ATOM 975 CD1 LEU A 64 8.071 7.049 0.774 1.00 60.14 C ATOM 976 CD2 LEU A 64 7.541 9.245 -0.301 1.00 65.25 C ATOM 0 H LEU A 64 8.952 7.831 4.012 1.00 53.22 H new ATOM 0 HA LEU A 64 10.873 8.066 1.773 1.00 31.32 H new ATOM 0 HB2 LEU A 64 8.170 9.225 2.386 1.00 43.03 H new ATOM 0 HB3 LEU A 64 9.295 10.190 1.452 1.00 43.03 H new ATOM 0 HG LEU A 64 9.465 8.330 -0.204 1.00 13.30 H new ATOM 0 HD11 LEU A 64 7.768 6.546 -0.144 1.00 60.14 H new ATOM 0 HD12 LEU A 64 8.855 6.471 1.263 1.00 60.14 H new ATOM 0 HD13 LEU A 64 7.213 7.133 1.441 1.00 60.14 H new ATOM 0 HD21 LEU A 64 7.245 8.712 -1.204 1.00 65.25 H new ATOM 0 HD22 LEU A 64 6.670 9.385 0.340 1.00 65.25 H new ATOM 0 HD23 LEU A 64 7.952 10.218 -0.572 1.00 65.25 H new ATOM 987 N GLY A 65 10.295 10.276 4.178 1.00 51.30 N ATOM 988 CA GLY A 65 10.932 11.326 4.951 1.00 63.12 C ATOM 989 C GLY A 65 11.234 12.557 4.120 1.00 45.21 C ATOM 990 O GLY A 65 11.915 13.475 4.578 1.00 25.53 O ATOM 0 H GLY A 65 9.323 10.091 4.426 1.00 51.30 H new ATOM 0 HA2 GLY A 65 10.285 11.603 5.783 1.00 63.12 H new ATOM 0 HA3 GLY A 65 11.859 10.945 5.381 1.00 63.12 H new ATOM 994 N THR A 66 10.728 12.577 2.890 1.00 51.34 N ATOM 995 CA THR A 66 10.950 13.703 1.991 1.00 72.03 C ATOM 996 C THR A 66 9.679 14.527 1.819 1.00 61.31 C ATOM 997 O THR A 66 9.712 15.625 1.265 1.00 53.05 O ATOM 998 CB THR A 66 11.433 13.230 0.607 1.00 62.44 C ATOM 999 OG1 THR A 66 11.791 14.357 -0.199 1.00 54.34 O ATOM 1000 CG2 THR A 66 10.352 12.421 -0.096 1.00 73.24 C ATOM 0 H THR A 66 10.162 11.826 2.494 1.00 51.34 H new ATOM 0 HA THR A 66 11.723 14.323 2.445 1.00 72.03 H new ATOM 0 HB THR A 66 12.307 12.594 0.750 1.00 62.44 H new ATOM 0 HG1 THR A 66 11.230 15.123 0.043 1.00 54.34 H new ATOM 0 HG21 THR A 66 10.716 12.098 -1.071 1.00 73.24 H new ATOM 0 HG22 THR A 66 10.102 11.547 0.506 1.00 73.24 H new ATOM 0 HG23 THR A 66 9.463 13.038 -0.227 1.00 73.24 H new ATOM 1008 N GLN A 67 8.561 13.991 2.299 1.00 32.24 N ATOM 1009 CA GLN A 67 7.280 14.679 2.198 1.00 24.52 C ATOM 1010 C GLN A 67 7.013 15.124 0.764 1.00 44.21 C ATOM 1011 O GLN A 67 7.241 16.281 0.410 1.00 61.23 O ATOM 1012 CB GLN A 67 7.251 15.888 3.134 1.00 42.32 C ATOM 1013 CG GLN A 67 5.857 16.245 3.624 1.00 2.41 C ATOM 1014 CD GLN A 67 5.858 16.790 5.039 1.00 63.34 C ATOM 1015 OE1 GLN A 67 5.868 18.003 5.249 1.00 64.13 O ATOM 1016 NE2 GLN A 67 5.846 15.894 6.018 1.00 23.40 N ATOM 0 H GLN A 67 8.517 13.083 2.761 1.00 32.24 H new ATOM 0 HA GLN A 67 6.497 13.981 2.494 1.00 24.52 H new ATOM 0 HB2 GLN A 67 7.889 15.686 3.995 1.00 42.32 H new ATOM 0 HB3 GLN A 67 7.676 16.748 2.617 1.00 42.32 H new ATOM 0 HG2 GLN A 67 5.419 16.985 2.954 1.00 2.41 H new ATOM 0 HG3 GLN A 67 5.223 15.360 3.580 1.00 2.41 H new ATOM 0 HE21 GLN A 67 5.838 14.898 5.798 1.00 23.40 H new ATOM 0 HE22 GLN A 67 5.845 16.201 6.991 1.00 23.40 H new ATOM 1023 N ARG A 68 6.528 14.198 -0.058 1.00 14.45 N ATOM 1024 CA ARG A 68 6.232 14.494 -1.454 1.00 74.14 C ATOM 1025 C ARG A 68 4.753 14.268 -1.756 1.00 1.23 C ATOM 1026 O ARG A 68 4.107 13.422 -1.137 1.00 72.25 O ATOM 1027 CB ARG A 68 7.090 13.626 -2.376 1.00 35.04 C ATOM 1028 CG ARG A 68 8.443 14.239 -2.702 1.00 62.11 C ATOM 1029 CD ARG A 68 8.303 15.442 -3.620 1.00 41.05 C ATOM 1030 NE ARG A 68 9.554 16.183 -3.749 1.00 31.33 N ATOM 1031 CZ ARG A 68 9.628 17.433 -4.191 1.00 42.11 C ATOM 1032 NH1 ARG A 68 8.526 18.079 -4.547 1.00 70.34 N ATOM 1033 NH2 ARG A 68 10.805 18.039 -4.280 1.00 62.13 N ATOM 0 H ARG A 68 6.332 13.236 0.220 1.00 14.45 H new ATOM 0 HA ARG A 68 6.466 15.543 -1.634 1.00 74.14 H new ATOM 0 HB2 ARG A 68 7.244 12.654 -1.907 1.00 35.04 H new ATOM 0 HB3 ARG A 68 6.547 13.449 -3.304 1.00 35.04 H new ATOM 0 HG2 ARG A 68 8.939 14.540 -1.779 1.00 62.11 H new ATOM 0 HG3 ARG A 68 9.078 13.490 -3.176 1.00 62.11 H new ATOM 0 HD2 ARG A 68 7.976 15.110 -4.605 1.00 41.05 H new ATOM 0 HD3 ARG A 68 7.528 16.104 -3.234 1.00 41.05 H new ATOM 0 HE ARG A 68 10.420 15.714 -3.485 1.00 31.33 H new ATOM 0 HH11 ARG A 68 7.620 17.616 -4.482 1.00 70.34 H new ATOM 0 HH12 ARG A 68 8.585 19.039 -4.886 1.00 70.34 H new ATOM 0 HH21 ARG A 68 11.655 17.545 -4.009 1.00 62.13 H new ATOM 0 HH22 ARG A 68 10.860 18.999 -4.620 1.00 62.13 H new ATOM 1044 N GLN A 69 4.225 15.029 -2.709 1.00 4.04 N ATOM 1045 CA GLN A 69 2.824 14.910 -3.092 1.00 72.44 C ATOM 1046 C GLN A 69 2.644 13.861 -4.183 1.00 42.44 C ATOM 1047 O GLN A 69 3.174 14.001 -5.287 1.00 30.35 O ATOM 1048 CB GLN A 69 2.289 16.261 -3.571 1.00 4.51 C ATOM 1049 CG GLN A 69 1.031 16.150 -4.418 1.00 55.14 C ATOM 1050 CD GLN A 69 0.355 17.491 -4.636 1.00 3.53 C ATOM 1051 OE1 GLN A 69 0.266 18.310 -3.721 1.00 41.35 O ATOM 1052 NE2 GLN A 69 -0.124 17.720 -5.853 1.00 14.12 N ATOM 0 H GLN A 69 4.746 15.734 -3.230 1.00 4.04 H new ATOM 0 HA GLN A 69 2.259 14.594 -2.215 1.00 72.44 H new ATOM 0 HB2 GLN A 69 2.080 16.888 -2.704 1.00 4.51 H new ATOM 0 HB3 GLN A 69 3.063 16.765 -4.149 1.00 4.51 H new ATOM 0 HG2 GLN A 69 1.285 15.714 -5.384 1.00 55.14 H new ATOM 0 HG3 GLN A 69 0.331 15.468 -3.935 1.00 55.14 H new ATOM 0 HE21 GLN A 69 -0.027 17.012 -6.581 1.00 14.12 H new ATOM 0 HE22 GLN A 69 -0.588 18.604 -6.060 1.00 14.12 H new ATOM 1059 N VAL A 70 1.892 12.811 -3.871 1.00 11.14 N ATOM 1060 CA VAL A 70 1.642 11.738 -4.825 1.00 42.35 C ATOM 1061 C VAL A 70 0.401 12.026 -5.663 1.00 72.23 C ATOM 1062 O VAL A 70 -0.569 12.610 -5.177 1.00 53.24 O ATOM 1063 CB VAL A 70 1.463 10.383 -4.114 1.00 13.32 C ATOM 1064 CG1 VAL A 70 2.706 10.036 -3.308 1.00 62.13 C ATOM 1065 CG2 VAL A 70 0.230 10.408 -3.224 1.00 64.31 C ATOM 0 H VAL A 70 1.445 12.681 -2.964 1.00 11.14 H new ATOM 0 HA VAL A 70 2.514 11.686 -5.477 1.00 42.35 H new ATOM 0 HB VAL A 70 1.321 9.610 -4.870 1.00 13.32 H new ATOM 0 HG11 VAL A 70 2.562 9.076 -2.812 1.00 62.13 H new ATOM 0 HG12 VAL A 70 3.566 9.975 -3.974 1.00 62.13 H new ATOM 0 HG13 VAL A 70 2.881 10.808 -2.559 1.00 62.13 H new ATOM 0 HG21 VAL A 70 0.119 9.443 -2.729 1.00 64.31 H new ATOM 0 HG22 VAL A 70 0.339 11.190 -2.473 1.00 64.31 H new ATOM 0 HG23 VAL A 70 -0.653 10.609 -3.831 1.00 64.31 H new ATOM 1075 N THR A 71 0.436 11.613 -6.925 1.00 44.41 N ATOM 1076 CA THR A 71 -0.685 11.828 -7.832 1.00 2.23 C ATOM 1077 C THR A 71 -1.102 10.527 -8.508 1.00 44.11 C ATOM 1078 O THR A 71 -1.821 10.536 -9.506 1.00 54.52 O ATOM 1079 CB THR A 71 -0.340 12.868 -8.916 1.00 72.34 C ATOM 1080 OG1 THR A 71 1.046 13.217 -8.836 1.00 54.11 O ATOM 1081 CG2 THR A 71 -1.194 14.117 -8.756 1.00 63.11 C ATOM 0 H THR A 71 1.229 11.127 -7.343 1.00 44.41 H new ATOM 0 HA THR A 71 -1.512 12.203 -7.229 1.00 2.23 H new ATOM 0 HB THR A 71 -0.547 12.428 -9.892 1.00 72.34 H new ATOM 0 HG1 THR A 71 1.451 13.154 -9.726 1.00 54.11 H new ATOM 0 HG21 THR A 71 -0.934 14.837 -9.531 1.00 63.11 H new ATOM 0 HG22 THR A 71 -2.247 13.852 -8.846 1.00 63.11 H new ATOM 0 HG23 THR A 71 -1.014 14.558 -7.776 1.00 63.11 H new ATOM 1089 N GLY A 72 -0.646 9.406 -7.957 1.00 24.12 N ATOM 1090 CA GLY A 72 -0.983 8.111 -8.519 1.00 42.52 C ATOM 1091 C GLY A 72 -0.246 6.975 -7.841 1.00 24.12 C ATOM 1092 O GLY A 72 0.608 7.203 -6.984 1.00 71.23 O ATOM 0 H GLY A 72 -0.049 9.372 -7.131 1.00 24.12 H new ATOM 0 HA2 GLY A 72 -2.057 7.948 -8.429 1.00 42.52 H new ATOM 0 HA3 GLY A 72 -0.748 8.108 -9.583 1.00 42.52 H new ATOM 1096 N ILE A 73 -0.575 5.745 -8.225 1.00 70.42 N ATOM 1097 CA ILE A 73 0.061 4.569 -7.647 1.00 24.15 C ATOM 1098 C ILE A 73 0.222 3.464 -8.686 1.00 2.44 C ATOM 1099 O ILE A 73 -0.238 3.594 -9.822 1.00 34.05 O ATOM 1100 CB ILE A 73 -0.743 4.021 -6.454 1.00 75.10 C ATOM 1101 CG1 ILE A 73 -1.985 3.277 -6.947 1.00 71.50 C ATOM 1102 CG2 ILE A 73 -1.135 5.154 -5.516 1.00 72.21 C ATOM 1103 CD1 ILE A 73 -1.816 1.774 -6.978 1.00 73.13 C ATOM 0 H ILE A 73 -1.279 5.538 -8.934 1.00 70.42 H new ATOM 0 HA ILE A 73 1.044 4.884 -7.298 1.00 24.15 H new ATOM 0 HB ILE A 73 -0.117 3.319 -5.904 1.00 75.10 H new ATOM 0 HG12 ILE A 73 -2.828 3.527 -6.303 1.00 71.50 H new ATOM 0 HG13 ILE A 73 -2.235 3.627 -7.949 1.00 71.50 H new ATOM 0 HG21 ILE A 73 -1.703 4.752 -4.677 1.00 72.21 H new ATOM 0 HG22 ILE A 73 -0.236 5.645 -5.143 1.00 72.21 H new ATOM 0 HG23 ILE A 73 -1.747 5.877 -6.055 1.00 72.21 H new ATOM 0 HD11 ILE A 73 -2.735 1.312 -7.337 1.00 73.13 H new ATOM 0 HD12 ILE A 73 -0.994 1.514 -7.645 1.00 73.13 H new ATOM 0 HD13 ILE A 73 -1.596 1.412 -5.974 1.00 73.13 H new ATOM 1114 N ILE A 74 0.875 2.377 -8.290 1.00 40.11 N ATOM 1115 CA ILE A 74 1.094 1.249 -9.186 1.00 62.31 C ATOM 1116 C ILE A 74 1.485 -0.003 -8.409 1.00 35.43 C ATOM 1117 O ILE A 74 2.308 0.052 -7.494 1.00 23.23 O ATOM 1118 CB ILE A 74 2.188 1.558 -10.225 1.00 72.41 C ATOM 1119 CG1 ILE A 74 2.495 0.314 -11.061 1.00 41.22 C ATOM 1120 CG2 ILE A 74 3.447 2.062 -9.534 1.00 22.01 C ATOM 1121 CD1 ILE A 74 1.282 -0.257 -11.763 1.00 53.24 C ATOM 0 H ILE A 74 1.262 2.254 -7.354 1.00 40.11 H new ATOM 0 HA ILE A 74 0.152 1.072 -9.705 1.00 62.31 H new ATOM 0 HB ILE A 74 1.824 2.340 -10.892 1.00 72.41 H new ATOM 0 HG12 ILE A 74 3.251 0.564 -11.805 1.00 41.22 H new ATOM 0 HG13 ILE A 74 2.924 -0.451 -10.415 1.00 41.22 H new ATOM 0 HG21 ILE A 74 4.211 2.276 -10.281 1.00 22.01 H new ATOM 0 HG22 ILE A 74 3.218 2.971 -8.978 1.00 22.01 H new ATOM 0 HG23 ILE A 74 3.815 1.300 -8.847 1.00 22.01 H new ATOM 0 HD11 ILE A 74 1.574 -1.137 -12.337 1.00 53.24 H new ATOM 0 HD12 ILE A 74 0.533 -0.539 -11.023 1.00 53.24 H new ATOM 0 HD13 ILE A 74 0.864 0.492 -12.435 1.00 53.24 H new ATOM 1132 N THR A 75 0.892 -1.134 -8.780 1.00 31.44 N ATOM 1133 CA THR A 75 1.180 -2.400 -8.117 1.00 43.55 C ATOM 1134 C THR A 75 1.512 -3.488 -9.133 1.00 31.23 C ATOM 1135 O THR A 75 1.044 -3.451 -10.271 1.00 71.12 O ATOM 1136 CB THR A 75 -0.008 -2.866 -7.255 1.00 74.24 C ATOM 1137 OG1 THR A 75 0.173 -4.231 -6.867 1.00 3.21 O ATOM 1138 CG2 THR A 75 -1.319 -2.719 -8.014 1.00 34.13 C ATOM 0 H THR A 75 0.210 -1.199 -9.536 1.00 31.44 H new ATOM 0 HA THR A 75 2.043 -2.231 -7.473 1.00 43.55 H new ATOM 0 HB THR A 75 -0.049 -2.238 -6.365 1.00 74.24 H new ATOM 0 HG1 THR A 75 -0.364 -4.810 -7.447 1.00 3.21 H new ATOM 0 HG21 THR A 75 -2.143 -3.054 -7.385 1.00 34.13 H new ATOM 0 HG22 THR A 75 -1.469 -1.673 -8.282 1.00 34.13 H new ATOM 0 HG23 THR A 75 -1.285 -3.324 -8.920 1.00 34.13 H new ATOM 1146 N GLN A 76 2.323 -4.454 -8.714 1.00 40.14 N ATOM 1147 CA GLN A 76 2.717 -5.553 -9.588 1.00 41.40 C ATOM 1148 C GLN A 76 3.040 -6.804 -8.778 1.00 41.22 C ATOM 1149 O GLN A 76 3.726 -6.737 -7.759 1.00 65.14 O ATOM 1150 CB GLN A 76 3.928 -5.151 -10.432 1.00 12.14 C ATOM 1151 CG GLN A 76 3.723 -5.350 -11.924 1.00 43.53 C ATOM 1152 CD GLN A 76 4.805 -4.690 -12.756 1.00 53.22 C ATOM 1153 OE1 GLN A 76 5.765 -5.338 -13.174 1.00 14.20 O ATOM 1154 NE2 GLN A 76 4.655 -3.393 -13.000 1.00 0.24 N ATOM 0 H GLN A 76 2.720 -4.498 -7.775 1.00 40.14 H new ATOM 0 HA GLN A 76 1.880 -5.777 -10.249 1.00 41.40 H new ATOM 0 HB2 GLN A 76 4.161 -4.103 -10.242 1.00 12.14 H new ATOM 0 HB3 GLN A 76 4.793 -5.732 -10.112 1.00 12.14 H new ATOM 0 HG2 GLN A 76 3.701 -6.417 -12.144 1.00 43.53 H new ATOM 0 HG3 GLN A 76 2.752 -4.945 -12.210 1.00 43.53 H new ATOM 0 HE21 GLN A 76 3.843 -2.896 -12.634 1.00 0.24 H new ATOM 0 HE22 GLN A 76 5.351 -2.894 -13.554 1.00 0.24 H new ATOM 1161 N GLY A 77 2.539 -7.946 -9.239 1.00 64.51 N ATOM 1162 CA GLY A 77 2.784 -9.197 -8.545 1.00 24.51 C ATOM 1163 C GLY A 77 4.008 -9.922 -9.071 1.00 74.44 C ATOM 1164 O GLY A 77 4.601 -9.509 -10.067 1.00 33.43 O ATOM 0 H GLY A 77 1.968 -8.027 -10.080 1.00 64.51 H new ATOM 0 HA2 GLY A 77 2.912 -9.000 -7.481 1.00 24.51 H new ATOM 0 HA3 GLY A 77 1.912 -9.842 -8.647 1.00 24.51 H new ATOM 1168 N ALA A 78 4.387 -11.004 -8.398 1.00 61.41 N ATOM 1169 CA ALA A 78 5.547 -11.787 -8.803 1.00 63.22 C ATOM 1170 C ALA A 78 5.242 -13.281 -8.765 1.00 70.22 C ATOM 1171 O ALA A 78 4.138 -13.689 -8.402 1.00 42.32 O ATOM 1172 CB ALA A 78 6.737 -11.467 -7.911 1.00 4.13 C ATOM 0 H ALA A 78 3.907 -11.358 -7.570 1.00 61.41 H new ATOM 0 HA ALA A 78 5.794 -11.519 -9.830 1.00 63.22 H new ATOM 0 HB1 ALA A 78 7.597 -12.059 -8.225 1.00 4.13 H new ATOM 0 HB2 ALA A 78 6.978 -10.407 -7.992 1.00 4.13 H new ATOM 0 HB3 ALA A 78 6.491 -11.705 -6.876 1.00 4.13 H new ATOM 1178 N ARG A 79 6.225 -14.091 -9.143 1.00 13.42 N ATOM 1179 CA ARG A 79 6.060 -15.540 -9.154 1.00 61.14 C ATOM 1180 C ARG A 79 7.286 -16.231 -8.563 1.00 71.04 C ATOM 1181 O ARG A 79 8.280 -15.582 -8.238 1.00 72.33 O ATOM 1182 CB ARG A 79 5.819 -16.036 -10.581 1.00 35.00 C ATOM 1183 CG ARG A 79 6.855 -15.545 -11.579 1.00 31.34 C ATOM 1184 CD ARG A 79 7.488 -16.701 -12.339 1.00 70.33 C ATOM 1185 NE ARG A 79 8.113 -16.261 -13.583 1.00 31.21 N ATOM 1186 CZ ARG A 79 7.434 -16.003 -14.695 1.00 41.34 C ATOM 1187 NH1 ARG A 79 6.115 -16.140 -14.718 1.00 24.52 N ATOM 1188 NH2 ARG A 79 8.074 -15.606 -15.788 1.00 64.13 N ATOM 0 H ARG A 79 7.144 -13.769 -9.446 1.00 13.42 H new ATOM 0 HA ARG A 79 5.194 -15.787 -8.540 1.00 61.14 H new ATOM 0 HB2 ARG A 79 5.814 -17.126 -10.582 1.00 35.00 H new ATOM 0 HB3 ARG A 79 4.831 -15.712 -10.907 1.00 35.00 H new ATOM 0 HG2 ARG A 79 6.386 -14.858 -12.284 1.00 31.34 H new ATOM 0 HG3 ARG A 79 7.630 -14.985 -11.055 1.00 31.34 H new ATOM 0 HD2 ARG A 79 8.235 -17.183 -11.709 1.00 70.33 H new ATOM 0 HD3 ARG A 79 6.727 -17.449 -12.561 1.00 70.33 H new ATOM 0 HE ARG A 79 9.126 -16.145 -13.599 1.00 31.21 H new ATOM 0 HH11 ARG A 79 5.619 -16.444 -13.880 1.00 24.52 H new ATOM 0 HH12 ARG A 79 5.596 -15.941 -15.574 1.00 24.52 H new ATOM 0 HH21 ARG A 79 9.088 -15.499 -15.775 1.00 64.13 H new ATOM 0 HH22 ARG A 79 7.552 -15.408 -16.641 1.00 64.13 H new ATOM 1199 N ASP A 80 7.206 -17.550 -8.426 1.00 53.25 N ATOM 1200 CA ASP A 80 8.307 -18.329 -7.876 1.00 13.14 C ATOM 1201 C ASP A 80 8.944 -19.207 -8.950 1.00 51.01 C ATOM 1202 O ASP A 80 8.804 -20.430 -8.930 1.00 71.32 O ATOM 1203 CB ASP A 80 7.817 -19.197 -6.716 1.00 30.22 C ATOM 1204 CG ASP A 80 8.910 -20.085 -6.154 1.00 44.04 C ATOM 1205 OD1 ASP A 80 9.810 -19.558 -5.469 1.00 32.44 O ATOM 1206 OD2 ASP A 80 8.864 -21.309 -6.401 1.00 1.13 O ATOM 0 H ASP A 80 6.389 -18.102 -8.689 1.00 53.25 H new ATOM 0 HA ASP A 80 9.061 -17.634 -7.507 1.00 13.14 H new ATOM 0 HB2 ASP A 80 7.431 -18.555 -5.924 1.00 30.22 H new ATOM 0 HB3 ASP A 80 6.988 -19.818 -7.056 1.00 30.22 H new ATOM 1210 N PHE A 81 9.641 -18.573 -9.887 1.00 24.13 N ATOM 1211 CA PHE A 81 10.296 -19.296 -10.971 1.00 33.22 C ATOM 1212 C PHE A 81 9.316 -20.229 -11.674 1.00 63.51 C ATOM 1213 O PHE A 81 9.701 -21.274 -12.197 1.00 30.52 O ATOM 1214 CB PHE A 81 11.484 -20.096 -10.434 1.00 31.21 C ATOM 1215 CG PHE A 81 12.371 -19.308 -9.513 1.00 14.01 C ATOM 1216 CD1 PHE A 81 12.074 -19.204 -8.164 1.00 53.01 C ATOM 1217 CD2 PHE A 81 13.502 -18.670 -9.998 1.00 32.10 C ATOM 1218 CE1 PHE A 81 12.889 -18.479 -7.314 1.00 62.23 C ATOM 1219 CE2 PHE A 81 14.320 -17.944 -9.153 1.00 22.44 C ATOM 1220 CZ PHE A 81 14.013 -17.848 -7.809 1.00 11.03 C ATOM 0 H PHE A 81 9.767 -17.561 -9.918 1.00 24.13 H new ATOM 0 HA PHE A 81 10.656 -18.565 -11.695 1.00 33.22 H new ATOM 0 HB2 PHE A 81 11.112 -20.973 -9.904 1.00 31.21 H new ATOM 0 HB3 PHE A 81 12.077 -20.459 -11.274 1.00 31.21 H new ATOM 0 HD1 PHE A 81 11.196 -19.695 -7.771 1.00 53.01 H new ATOM 0 HD2 PHE A 81 13.747 -18.741 -11.048 1.00 32.10 H new ATOM 0 HE1 PHE A 81 12.647 -18.406 -6.264 1.00 62.23 H new ATOM 0 HE2 PHE A 81 15.199 -17.452 -9.543 1.00 22.44 H new ATOM 0 HZ PHE A 81 14.651 -17.281 -7.147 1.00 11.03 H new ATOM 1229 N GLY A 82 8.042 -19.844 -11.681 1.00 21.22 N ATOM 1230 CA GLY A 82 7.025 -20.658 -12.320 1.00 12.52 C ATOM 1231 C GLY A 82 5.648 -20.436 -11.728 1.00 73.22 C ATOM 1232 O GLY A 82 4.714 -20.051 -12.433 1.00 12.55 O ATOM 0 H GLY A 82 7.697 -18.983 -11.256 1.00 21.22 H new ATOM 0 HA2 GLY A 82 7.000 -20.431 -13.386 1.00 12.52 H new ATOM 0 HA3 GLY A 82 7.293 -21.710 -12.224 1.00 12.52 H new ATOM 1236 N HIS A 83 5.518 -20.681 -10.428 1.00 31.25 N ATOM 1237 CA HIS A 83 4.244 -20.507 -9.739 1.00 4.23 C ATOM 1238 C HIS A 83 3.888 -19.028 -9.622 1.00 30.53 C ATOM 1239 O HIS A 83 4.617 -18.253 -9.001 1.00 74.20 O ATOM 1240 CB HIS A 83 4.299 -21.143 -8.351 1.00 34.34 C ATOM 1241 CG HIS A 83 3.734 -22.529 -8.303 1.00 23.14 C ATOM 1242 ND1 HIS A 83 3.037 -23.022 -7.220 1.00 15.41 N ATOM 1243 CD2 HIS A 83 3.763 -23.529 -9.215 1.00 1.14 C ATOM 1244 CE1 HIS A 83 2.665 -24.264 -7.466 1.00 44.25 C ATOM 1245 NE2 HIS A 83 3.092 -24.596 -8.671 1.00 3.41 N ATOM 0 H HIS A 83 6.280 -21.001 -9.830 1.00 31.25 H new ATOM 0 HA HIS A 83 3.471 -21.003 -10.326 1.00 4.23 H new ATOM 0 HB2 HIS A 83 5.335 -21.170 -8.014 1.00 34.34 H new ATOM 0 HB3 HIS A 83 3.752 -20.512 -7.650 1.00 34.34 H new ATOM 0 HD2 HIS A 83 4.228 -23.494 -10.189 1.00 1.14 H new ATOM 0 HE1 HIS A 83 2.106 -24.901 -6.796 1.00 44.25 H new ATOM 0 HE2 HIS A 83 2.947 -25.498 -9.124 1.00 3.41 H new ATOM 1252 N ILE A 84 2.766 -18.645 -10.220 1.00 52.23 N ATOM 1253 CA ILE A 84 2.314 -17.259 -10.181 1.00 2.54 C ATOM 1254 C ILE A 84 1.684 -16.924 -8.834 1.00 30.10 C ATOM 1255 O ILE A 84 0.745 -17.588 -8.396 1.00 61.31 O ATOM 1256 CB ILE A 84 1.296 -16.967 -11.299 1.00 3.21 C ATOM 1257 CG1 ILE A 84 1.920 -17.236 -12.670 1.00 33.22 C ATOM 1258 CG2 ILE A 84 0.805 -15.530 -11.206 1.00 21.34 C ATOM 1259 CD1 ILE A 84 3.183 -16.445 -12.924 1.00 13.24 C ATOM 0 H ILE A 84 2.153 -19.274 -10.738 1.00 52.23 H new ATOM 0 HA ILE A 84 3.195 -16.635 -10.332 1.00 2.54 H new ATOM 0 HB ILE A 84 0.441 -17.631 -11.174 1.00 3.21 H new ATOM 0 HG12 ILE A 84 2.143 -18.299 -12.756 1.00 33.22 H new ATOM 0 HG13 ILE A 84 1.191 -17.000 -13.445 1.00 33.22 H new ATOM 0 HG21 ILE A 84 0.086 -15.339 -12.003 1.00 21.34 H new ATOM 0 HG22 ILE A 84 0.326 -15.371 -10.240 1.00 21.34 H new ATOM 0 HG23 ILE A 84 1.650 -14.849 -11.309 1.00 21.34 H new ATOM 0 HD11 ILE A 84 3.570 -16.686 -13.914 1.00 13.24 H new ATOM 0 HD12 ILE A 84 2.962 -15.379 -12.870 1.00 13.24 H new ATOM 0 HD13 ILE A 84 3.929 -16.699 -12.171 1.00 13.24 H new ATOM 1270 N GLN A 85 2.206 -15.890 -8.183 1.00 13.34 N ATOM 1271 CA GLN A 85 1.693 -15.466 -6.886 1.00 60.00 C ATOM 1272 C GLN A 85 1.267 -14.002 -6.921 1.00 32.51 C ATOM 1273 O GLN A 85 1.702 -13.239 -7.783 1.00 34.41 O ATOM 1274 CB GLN A 85 2.751 -15.675 -5.801 1.00 5.34 C ATOM 1275 CG GLN A 85 3.286 -17.098 -5.739 1.00 53.02 C ATOM 1276 CD GLN A 85 4.730 -17.158 -5.284 1.00 4.21 C ATOM 1277 OE1 GLN A 85 5.449 -16.160 -5.324 1.00 41.22 O ATOM 1278 NE2 GLN A 85 5.164 -18.335 -4.848 1.00 3.02 N ATOM 0 H GLN A 85 2.984 -15.330 -8.532 1.00 13.34 H new ATOM 0 HA GLN A 85 0.819 -16.075 -6.653 1.00 60.00 H new ATOM 0 HB2 GLN A 85 3.581 -14.991 -5.978 1.00 5.34 H new ATOM 0 HB3 GLN A 85 2.323 -15.414 -4.833 1.00 5.34 H new ATOM 0 HG2 GLN A 85 2.670 -17.685 -5.058 1.00 53.02 H new ATOM 0 HG3 GLN A 85 3.200 -17.558 -6.723 1.00 53.02 H new ATOM 0 HE21 GLN A 85 4.534 -19.137 -4.832 1.00 3.02 H new ATOM 0 HE22 GLN A 85 6.128 -18.437 -4.529 1.00 3.02 H new ATOM 1285 N TYR A 86 0.413 -13.617 -5.979 1.00 62.41 N ATOM 1286 CA TYR A 86 -0.075 -12.245 -5.904 1.00 50.32 C ATOM 1287 C TYR A 86 -1.041 -12.074 -4.736 1.00 73.13 C ATOM 1288 O TYR A 86 -1.802 -12.982 -4.405 1.00 64.25 O ATOM 1289 CB TYR A 86 -0.765 -11.854 -7.212 1.00 62.50 C ATOM 1290 CG TYR A 86 -1.696 -12.919 -7.747 1.00 32.24 C ATOM 1291 CD1 TYR A 86 -2.942 -13.134 -7.170 1.00 21.03 C ATOM 1292 CD2 TYR A 86 -1.330 -13.711 -8.829 1.00 73.20 C ATOM 1293 CE1 TYR A 86 -3.796 -14.106 -7.655 1.00 10.24 C ATOM 1294 CE2 TYR A 86 -2.177 -14.684 -9.321 1.00 42.45 C ATOM 1295 CZ TYR A 86 -3.409 -14.878 -8.730 1.00 42.42 C ATOM 1296 OH TYR A 86 -4.256 -15.847 -9.217 1.00 4.23 O ATOM 0 H TYR A 86 0.044 -14.236 -5.257 1.00 62.41 H new ATOM 0 HA TYR A 86 0.781 -11.590 -5.743 1.00 50.32 H new ATOM 0 HB2 TYR A 86 -1.330 -10.935 -7.055 1.00 62.50 H new ATOM 0 HB3 TYR A 86 -0.005 -11.637 -7.963 1.00 62.50 H new ATOM 0 HD1 TYR A 86 -3.248 -12.531 -6.328 1.00 21.03 H new ATOM 0 HD2 TYR A 86 -0.366 -13.563 -9.293 1.00 73.20 H new ATOM 0 HE1 TYR A 86 -4.761 -14.260 -7.195 1.00 10.24 H new ATOM 0 HE2 TYR A 86 -1.877 -15.290 -10.163 1.00 42.45 H new ATOM 0 HH TYR A 86 -3.833 -16.300 -9.976 1.00 4.23 H new ATOM 1305 N VAL A 87 -1.003 -10.899 -4.113 1.00 63.23 N ATOM 1306 CA VAL A 87 -1.875 -10.606 -2.982 1.00 61.05 C ATOM 1307 C VAL A 87 -3.215 -10.050 -3.451 1.00 42.14 C ATOM 1308 O VAL A 87 -3.291 -9.359 -4.466 1.00 43.43 O ATOM 1309 CB VAL A 87 -1.224 -9.598 -2.018 1.00 13.04 C ATOM 1310 CG1 VAL A 87 -2.007 -9.521 -0.716 1.00 52.12 C ATOM 1311 CG2 VAL A 87 0.227 -9.973 -1.755 1.00 65.21 C ATOM 0 H VAL A 87 -0.378 -10.136 -4.373 1.00 63.23 H new ATOM 0 HA VAL A 87 -2.038 -11.547 -2.457 1.00 61.05 H new ATOM 0 HB VAL A 87 -1.242 -8.613 -2.484 1.00 13.04 H new ATOM 0 HG11 VAL A 87 -1.532 -8.803 -0.047 1.00 52.12 H new ATOM 0 HG12 VAL A 87 -3.028 -9.202 -0.924 1.00 52.12 H new ATOM 0 HG13 VAL A 87 -2.023 -10.503 -0.242 1.00 52.12 H new ATOM 0 HG21 VAL A 87 0.672 -9.250 -1.072 1.00 65.21 H new ATOM 0 HG22 VAL A 87 0.271 -10.967 -1.310 1.00 65.21 H new ATOM 0 HG23 VAL A 87 0.779 -9.971 -2.695 1.00 65.21 H new ATOM 1321 N ALA A 88 -4.271 -10.357 -2.705 1.00 35.32 N ATOM 1322 CA ALA A 88 -5.609 -9.885 -3.042 1.00 4.12 C ATOM 1323 C ALA A 88 -6.052 -8.771 -2.101 1.00 51.05 C ATOM 1324 O ALA A 88 -6.047 -7.596 -2.468 1.00 13.14 O ATOM 1325 CB ALA A 88 -6.600 -11.039 -3.002 1.00 50.21 C ATOM 0 H ALA A 88 -4.226 -10.931 -1.863 1.00 35.32 H new ATOM 0 HA ALA A 88 -5.581 -9.479 -4.053 1.00 4.12 H new ATOM 0 HB1 ALA A 88 -7.595 -10.673 -3.255 1.00 50.21 H new ATOM 0 HB2 ALA A 88 -6.300 -11.801 -3.721 1.00 50.21 H new ATOM 0 HB3 ALA A 88 -6.616 -11.470 -2.001 1.00 50.21 H new ATOM 1331 N SER A 89 -6.438 -9.147 -0.885 1.00 11.34 N ATOM 1332 CA SER A 89 -6.889 -8.180 0.108 1.00 10.42 C ATOM 1333 C SER A 89 -5.717 -7.672 0.943 1.00 75.41 C ATOM 1334 O SER A 89 -4.996 -8.455 1.561 1.00 3.42 O ATOM 1335 CB SER A 89 -7.946 -8.806 1.018 1.00 23.31 C ATOM 1336 OG SER A 89 -9.025 -7.915 1.237 1.00 41.43 O ATOM 0 H SER A 89 -6.447 -10.115 -0.565 1.00 11.34 H new ATOM 0 HA SER A 89 -7.330 -7.334 -0.419 1.00 10.42 H new ATOM 0 HB2 SER A 89 -8.317 -9.727 0.569 1.00 23.31 H new ATOM 0 HB3 SER A 89 -7.494 -9.076 1.973 1.00 23.31 H new ATOM 0 HG SER A 89 -9.687 -8.341 1.821 1.00 41.43 H new ATOM 1341 N TYR A 90 -5.535 -6.356 0.957 1.00 20.23 N ATOM 1342 CA TYR A 90 -4.450 -5.743 1.714 1.00 33.32 C ATOM 1343 C TYR A 90 -4.801 -4.311 2.106 1.00 23.03 C ATOM 1344 O TYR A 90 -5.306 -3.538 1.292 1.00 55.13 O ATOM 1345 CB TYR A 90 -3.158 -5.758 0.897 1.00 25.22 C ATOM 1346 CG TYR A 90 -3.308 -5.165 -0.486 1.00 64.52 C ATOM 1347 CD1 TYR A 90 -3.691 -5.954 -1.563 1.00 51.21 C ATOM 1348 CD2 TYR A 90 -3.067 -3.816 -0.715 1.00 31.43 C ATOM 1349 CE1 TYR A 90 -3.829 -5.417 -2.829 1.00 11.12 C ATOM 1350 CE2 TYR A 90 -3.204 -3.270 -1.975 1.00 44.31 C ATOM 1351 CZ TYR A 90 -3.585 -4.074 -3.029 1.00 44.45 C ATOM 1352 OH TYR A 90 -3.722 -3.534 -4.288 1.00 22.33 O ATOM 0 H TYR A 90 -6.125 -5.694 0.453 1.00 20.23 H new ATOM 0 HA TYR A 90 -4.303 -6.324 2.624 1.00 33.32 H new ATOM 0 HB2 TYR A 90 -2.390 -5.206 1.438 1.00 25.22 H new ATOM 0 HB3 TYR A 90 -2.808 -6.786 0.806 1.00 25.22 H new ATOM 0 HD1 TYR A 90 -3.884 -7.005 -1.408 1.00 51.21 H new ATOM 0 HD2 TYR A 90 -2.767 -3.184 0.108 1.00 31.43 H new ATOM 0 HE1 TYR A 90 -4.126 -6.045 -3.656 1.00 11.12 H new ATOM 0 HE2 TYR A 90 -3.014 -2.219 -2.135 1.00 44.31 H new ATOM 0 HH TYR A 90 -3.515 -2.577 -4.258 1.00 22.33 H new ATOM 1361 N LYS A 91 -4.529 -3.964 3.359 1.00 51.23 N ATOM 1362 CA LYS A 91 -4.812 -2.624 3.861 1.00 64.15 C ATOM 1363 C LYS A 91 -3.592 -1.721 3.722 1.00 11.42 C ATOM 1364 O LYS A 91 -2.612 -1.868 4.452 1.00 35.13 O ATOM 1365 CB LYS A 91 -5.247 -2.689 5.327 1.00 42.11 C ATOM 1366 CG LYS A 91 -6.546 -1.953 5.609 1.00 53.53 C ATOM 1367 CD LYS A 91 -6.305 -0.682 6.406 1.00 14.35 C ATOM 1368 CE LYS A 91 -7.591 -0.159 7.026 1.00 32.13 C ATOM 1369 NZ LYS A 91 -7.426 0.144 8.474 1.00 62.31 N ATOM 0 H LYS A 91 -4.113 -4.592 4.046 1.00 51.23 H new ATOM 0 HA LYS A 91 -5.622 -2.204 3.265 1.00 64.15 H new ATOM 0 HB2 LYS A 91 -5.360 -3.733 5.618 1.00 42.11 H new ATOM 0 HB3 LYS A 91 -4.458 -2.268 5.950 1.00 42.11 H new ATOM 0 HG2 LYS A 91 -7.037 -1.706 4.668 1.00 53.53 H new ATOM 0 HG3 LYS A 91 -7.223 -2.606 6.160 1.00 53.53 H new ATOM 0 HD2 LYS A 91 -5.575 -0.877 7.191 1.00 14.35 H new ATOM 0 HD3 LYS A 91 -5.877 0.081 5.755 1.00 14.35 H new ATOM 0 HE2 LYS A 91 -7.907 0.742 6.500 1.00 32.13 H new ATOM 0 HE3 LYS A 91 -8.382 -0.897 6.897 1.00 32.13 H new ATOM 0 HZ1 LYS A 91 -7.976 0.993 8.716 1.00 62.31 H new ATOM 0 HZ2 LYS A 91 -7.766 -0.661 9.038 1.00 62.31 H new ATOM 0 HZ3 LYS A 91 -6.421 0.312 8.681 1.00 62.31 H new ATOM 1379 N VAL A 92 -3.657 -0.786 2.779 1.00 74.32 N ATOM 1380 CA VAL A 92 -2.559 0.144 2.546 1.00 2.40 C ATOM 1381 C VAL A 92 -2.962 1.571 2.894 1.00 73.24 C ATOM 1382 O VAL A 92 -3.896 2.123 2.313 1.00 61.35 O ATOM 1383 CB VAL A 92 -2.086 0.099 1.081 1.00 63.33 C ATOM 1384 CG1 VAL A 92 -3.256 0.331 0.136 1.00 24.31 C ATOM 1385 CG2 VAL A 92 -0.987 1.122 0.843 1.00 74.44 C ATOM 0 H VAL A 92 -4.460 -0.653 2.164 1.00 74.32 H new ATOM 0 HA VAL A 92 -1.740 -0.167 3.195 1.00 2.40 H new ATOM 0 HB VAL A 92 -1.677 -0.891 0.880 1.00 63.33 H new ATOM 0 HG11 VAL A 92 -2.904 0.296 -0.895 1.00 24.31 H new ATOM 0 HG12 VAL A 92 -4.007 -0.444 0.289 1.00 24.31 H new ATOM 0 HG13 VAL A 92 -3.697 1.308 0.336 1.00 24.31 H new ATOM 0 HG21 VAL A 92 -0.666 1.075 -0.197 1.00 74.44 H new ATOM 0 HG22 VAL A 92 -1.366 2.120 1.061 1.00 74.44 H new ATOM 0 HG23 VAL A 92 -0.140 0.905 1.494 1.00 74.44 H new ATOM 1395 N ALA A 93 -2.252 2.166 3.847 1.00 31.21 N ATOM 1396 CA ALA A 93 -2.535 3.532 4.272 1.00 60.40 C ATOM 1397 C ALA A 93 -1.300 4.416 4.135 1.00 72.10 C ATOM 1398 O ALA A 93 -0.173 3.961 4.331 1.00 70.22 O ATOM 1399 CB ALA A 93 -3.039 3.544 5.708 1.00 53.44 C ATOM 0 H ALA A 93 -1.476 1.723 4.340 1.00 31.21 H new ATOM 0 HA ALA A 93 -3.312 3.935 3.623 1.00 60.40 H new ATOM 0 HB1 ALA A 93 -3.246 4.570 6.012 1.00 53.44 H new ATOM 0 HB2 ALA A 93 -3.952 2.953 5.778 1.00 53.44 H new ATOM 0 HB3 ALA A 93 -2.280 3.117 6.364 1.00 53.44 H new ATOM 1405 N HIS A 94 -1.520 5.682 3.796 1.00 42.13 N ATOM 1406 CA HIS A 94 -0.424 6.632 3.632 1.00 22.34 C ATOM 1407 C HIS A 94 -0.445 7.682 4.738 1.00 64.05 C ATOM 1408 O HIS A 94 -1.511 8.146 5.147 1.00 43.40 O ATOM 1409 CB HIS A 94 -0.510 7.310 2.264 1.00 34.44 C ATOM 1410 CG HIS A 94 -0.287 6.375 1.117 1.00 2.44 C ATOM 1411 ND1 HIS A 94 0.447 6.715 0.000 1.00 12.42 N ATOM 1412 CD2 HIS A 94 -0.705 5.104 0.917 1.00 24.13 C ATOM 1413 CE1 HIS A 94 0.469 5.695 -0.838 1.00 2.11 C ATOM 1414 NE2 HIS A 94 -0.222 4.703 -0.305 1.00 61.23 N ATOM 0 H HIS A 94 -2.447 6.074 3.629 1.00 42.13 H new ATOM 0 HA HIS A 94 0.515 6.082 3.697 1.00 22.34 H new ATOM 0 HB2 HIS A 94 -1.491 7.774 2.159 1.00 34.44 H new ATOM 0 HB3 HIS A 94 0.228 8.111 2.218 1.00 34.44 H new ATOM 0 HD2 HIS A 94 -1.307 4.514 1.593 1.00 24.13 H new ATOM 0 HE1 HIS A 94 0.967 5.675 -1.796 1.00 2.11 H new ATOM 0 HE2 HIS A 94 -0.372 3.789 -0.731 1.00 61.23 H new ATOM 1421 N SER A 95 0.737 8.053 5.218 1.00 72.52 N ATOM 1422 CA SER A 95 0.853 9.046 6.280 1.00 11.32 C ATOM 1423 C SER A 95 1.803 10.168 5.872 1.00 72.22 C ATOM 1424 O SER A 95 2.923 9.918 5.429 1.00 11.13 O ATOM 1425 CB SER A 95 1.346 8.389 7.570 1.00 12.23 C ATOM 1426 OG SER A 95 0.960 9.141 8.706 1.00 73.31 O ATOM 0 H SER A 95 1.628 7.681 4.889 1.00 72.52 H new ATOM 0 HA SER A 95 -0.134 9.474 6.453 1.00 11.32 H new ATOM 0 HB2 SER A 95 0.942 7.379 7.644 1.00 12.23 H new ATOM 0 HB3 SER A 95 2.432 8.297 7.543 1.00 12.23 H new ATOM 0 HG SER A 95 0.165 9.673 8.492 1.00 73.31 H new ATOM 1431 N ASP A 96 1.345 11.406 6.025 1.00 13.03 N ATOM 1432 CA ASP A 96 2.153 12.569 5.674 1.00 71.14 C ATOM 1433 C ASP A 96 2.929 13.077 6.886 1.00 3.45 C ATOM 1434 O ASP A 96 4.093 13.462 6.772 1.00 43.11 O ATOM 1435 CB ASP A 96 1.266 13.683 5.117 1.00 35.31 C ATOM 1436 CG ASP A 96 0.338 14.264 6.167 1.00 22.32 C ATOM 1437 OD1 ASP A 96 -0.663 13.597 6.507 1.00 33.31 O ATOM 1438 OD2 ASP A 96 0.611 15.382 6.648 1.00 15.11 O ATOM 0 H ASP A 96 0.419 11.630 6.390 1.00 13.03 H new ATOM 0 HA ASP A 96 2.867 12.267 4.908 1.00 71.14 H new ATOM 0 HB2 ASP A 96 1.895 14.476 4.713 1.00 35.31 H new ATOM 0 HB3 ASP A 96 0.674 13.293 4.289 1.00 35.31 H new ATOM 1442 N ASP A 97 2.277 13.074 8.043 1.00 4.52 N ATOM 1443 CA ASP A 97 2.906 13.534 9.276 1.00 53.41 C ATOM 1444 C ASP A 97 3.489 12.362 10.059 1.00 53.31 C ATOM 1445 O ASP A 97 4.346 12.544 10.923 1.00 41.22 O ATOM 1446 CB ASP A 97 1.894 14.289 10.139 1.00 42.41 C ATOM 1447 CG ASP A 97 2.553 15.311 11.044 1.00 13.21 C ATOM 1448 OD1 ASP A 97 3.176 14.903 12.047 1.00 24.22 O ATOM 1449 OD2 ASP A 97 2.447 16.520 10.749 1.00 4.45 O ATOM 0 H ASP A 97 1.313 12.758 8.153 1.00 4.52 H new ATOM 0 HA ASP A 97 3.719 14.209 9.010 1.00 53.41 H new ATOM 0 HB2 ASP A 97 1.173 14.791 9.493 1.00 42.41 H new ATOM 0 HB3 ASP A 97 1.336 13.577 10.746 1.00 42.41 H new ATOM 1453 N GLY A 98 3.015 11.158 9.751 1.00 14.45 N ATOM 1454 CA GLY A 98 3.500 9.973 10.437 1.00 54.12 C ATOM 1455 C GLY A 98 2.491 9.422 11.423 1.00 20.53 C ATOM 1456 O GLY A 98 2.523 8.238 11.758 1.00 21.21 O ATOM 0 H GLY A 98 2.305 10.982 9.040 1.00 14.45 H new ATOM 0 HA2 GLY A 98 3.742 9.205 9.702 1.00 54.12 H new ATOM 0 HA3 GLY A 98 4.424 10.214 10.963 1.00 54.12 H new ATOM 1460 N VAL A 99 1.592 10.282 11.892 1.00 31.31 N ATOM 1461 CA VAL A 99 0.568 9.874 12.846 1.00 23.52 C ATOM 1462 C VAL A 99 -0.767 9.633 12.152 1.00 51.32 C ATOM 1463 O VAL A 99 -1.527 8.746 12.537 1.00 72.52 O ATOM 1464 CB VAL A 99 0.378 10.930 13.951 1.00 34.44 C ATOM 1465 CG1 VAL A 99 -0.046 12.260 13.350 1.00 54.43 C ATOM 1466 CG2 VAL A 99 -0.639 10.451 14.977 1.00 1.24 C ATOM 0 H VAL A 99 1.552 11.266 11.626 1.00 31.31 H new ATOM 0 HA VAL A 99 0.910 8.943 13.298 1.00 23.52 H new ATOM 0 HB VAL A 99 1.332 11.075 14.459 1.00 34.44 H new ATOM 0 HG11 VAL A 99 -0.176 12.994 14.145 1.00 54.43 H new ATOM 0 HG12 VAL A 99 0.721 12.607 12.657 1.00 54.43 H new ATOM 0 HG13 VAL A 99 -0.988 12.134 12.816 1.00 54.43 H new ATOM 0 HG21 VAL A 99 -0.761 11.210 15.750 1.00 1.24 H new ATOM 0 HG22 VAL A 99 -1.596 10.276 14.486 1.00 1.24 H new ATOM 0 HG23 VAL A 99 -0.289 9.524 15.430 1.00 1.24 H new ATOM 1476 N GLN A 100 -1.046 10.431 11.126 1.00 14.00 N ATOM 1477 CA GLN A 100 -2.291 10.306 10.377 1.00 1.00 C ATOM 1478 C GLN A 100 -2.151 9.280 9.256 1.00 34.13 C ATOM 1479 O GLN A 100 -1.593 9.574 8.200 1.00 14.51 O ATOM 1480 CB GLN A 100 -2.700 11.660 9.797 1.00 61.23 C ATOM 1481 CG GLN A 100 -2.943 12.726 10.854 1.00 2.43 C ATOM 1482 CD GLN A 100 -3.724 13.910 10.320 1.00 62.24 C ATOM 1483 OE1 GLN A 100 -4.955 13.929 10.367 1.00 31.04 O ATOM 1484 NE2 GLN A 100 -3.012 14.908 9.808 1.00 32.40 N ATOM 0 H GLN A 100 -0.427 11.171 10.795 1.00 14.00 H new ATOM 0 HA GLN A 100 -3.066 9.964 11.063 1.00 1.00 H new ATOM 0 HB2 GLN A 100 -1.921 12.005 9.117 1.00 61.23 H new ATOM 0 HB3 GLN A 100 -3.607 11.534 9.205 1.00 61.23 H new ATOM 0 HG2 GLN A 100 -3.485 12.286 11.691 1.00 2.43 H new ATOM 0 HG3 GLN A 100 -1.985 13.073 11.242 1.00 2.43 H new ATOM 0 HE21 GLN A 100 -1.994 14.851 9.789 1.00 32.40 H new ATOM 0 HE22 GLN A 100 -3.484 15.731 9.434 1.00 32.40 H new ATOM 1491 N TRP A 101 -2.661 8.078 9.495 1.00 23.02 N ATOM 1492 CA TRP A 101 -2.591 7.009 8.504 1.00 72.42 C ATOM 1493 C TRP A 101 -3.874 6.945 7.682 1.00 52.31 C ATOM 1494 O TRP A 101 -4.888 6.411 8.132 1.00 21.12 O ATOM 1495 CB TRP A 101 -2.345 5.665 9.192 1.00 61.41 C ATOM 1496 CG TRP A 101 -1.318 5.734 10.281 1.00 34.41 C ATOM 1497 CD1 TRP A 101 -0.187 6.499 10.293 1.00 60.30 C ATOM 1498 CD2 TRP A 101 -1.328 5.008 11.516 1.00 52.44 C ATOM 1499 NE1 TRP A 101 0.507 6.293 11.462 1.00 62.13 N ATOM 1500 CE2 TRP A 101 -0.173 5.383 12.228 1.00 13.21 C ATOM 1501 CE3 TRP A 101 -2.201 4.081 12.089 1.00 63.12 C ATOM 1502 CZ2 TRP A 101 0.130 4.861 13.483 1.00 1.00 C ATOM 1503 CZ3 TRP A 101 -1.899 3.562 13.334 1.00 71.25 C ATOM 1504 CH2 TRP A 101 -0.743 3.954 14.020 1.00 13.01 C ATOM 0 H TRP A 101 -3.127 7.818 10.364 1.00 23.02 H new ATOM 0 HA TRP A 101 -1.760 7.223 7.831 1.00 72.42 H new ATOM 0 HB2 TRP A 101 -3.284 5.302 9.610 1.00 61.41 H new ATOM 0 HB3 TRP A 101 -2.025 4.937 8.447 1.00 61.41 H new ATOM 0 HD1 TRP A 101 0.118 7.167 9.501 1.00 60.30 H new ATOM 0 HE1 TRP A 101 1.385 6.744 11.717 1.00 62.13 H new ATOM 0 HE3 TRP A 101 -3.096 3.775 11.569 1.00 63.12 H new ATOM 0 HZ2 TRP A 101 1.022 5.161 14.013 1.00 1.00 H new ATOM 0 HZ3 TRP A 101 -2.566 2.842 13.785 1.00 71.25 H new ATOM 0 HH2 TRP A 101 -0.536 3.532 14.992 1.00 13.01 H new ATOM 1514 N THR A 102 -3.823 7.494 6.473 1.00 50.44 N ATOM 1515 CA THR A 102 -4.981 7.501 5.587 1.00 21.11 C ATOM 1516 C THR A 102 -5.129 6.166 4.866 1.00 63.22 C ATOM 1517 O THR A 102 -4.447 5.904 3.876 1.00 53.20 O ATOM 1518 CB THR A 102 -4.881 8.628 4.541 1.00 64.24 C ATOM 1519 OG1 THR A 102 -4.752 9.895 5.196 1.00 31.54 O ATOM 1520 CG2 THR A 102 -6.108 8.640 3.641 1.00 21.32 C ATOM 0 H THR A 102 -2.992 7.940 6.084 1.00 50.44 H new ATOM 0 HA THR A 102 -5.857 7.672 6.213 1.00 21.11 H new ATOM 0 HB THR A 102 -3.999 8.446 3.926 1.00 64.24 H new ATOM 0 HG1 THR A 102 -4.687 10.606 4.524 1.00 31.54 H new ATOM 0 HG21 THR A 102 -6.016 9.444 2.910 1.00 21.32 H new ATOM 0 HG22 THR A 102 -6.188 7.685 3.122 1.00 21.32 H new ATOM 0 HG23 THR A 102 -7.001 8.800 4.245 1.00 21.32 H new ATOM 1528 N VAL A 103 -6.027 5.324 5.369 1.00 60.31 N ATOM 1529 CA VAL A 103 -6.267 4.016 4.772 1.00 23.03 C ATOM 1530 C VAL A 103 -7.186 4.125 3.561 1.00 5.45 C ATOM 1531 O VAL A 103 -7.402 3.149 2.842 1.00 63.51 O ATOM 1532 CB VAL A 103 -6.889 3.040 5.788 1.00 35.21 C ATOM 1533 CG1 VAL A 103 -5.890 2.703 6.884 1.00 31.24 C ATOM 1534 CG2 VAL A 103 -8.162 3.627 6.379 1.00 43.43 C ATOM 0 H VAL A 103 -6.600 5.525 6.189 1.00 60.31 H new ATOM 0 HA VAL A 103 -5.298 3.630 4.456 1.00 23.03 H new ATOM 0 HB VAL A 103 -7.148 2.117 5.268 1.00 35.21 H new ATOM 0 HG11 VAL A 103 -6.347 2.012 7.593 1.00 31.24 H new ATOM 0 HG12 VAL A 103 -5.008 2.239 6.442 1.00 31.24 H new ATOM 0 HG13 VAL A 103 -5.598 3.616 7.404 1.00 31.24 H new ATOM 0 HG21 VAL A 103 -8.588 2.924 7.095 1.00 43.43 H new ATOM 0 HG22 VAL A 103 -7.930 4.564 6.885 1.00 43.43 H new ATOM 0 HG23 VAL A 103 -8.881 3.814 5.581 1.00 43.43 H new ATOM 1544 N TYR A 104 -7.725 5.319 3.340 1.00 12.51 N ATOM 1545 CA TYR A 104 -8.622 5.556 2.215 1.00 24.51 C ATOM 1546 C TYR A 104 -9.857 4.665 2.308 1.00 61.51 C ATOM 1547 O TYR A 104 -9.987 3.687 1.572 1.00 34.14 O ATOM 1548 CB TYR A 104 -7.896 5.304 0.893 1.00 71.20 C ATOM 1549 CG TYR A 104 -6.666 6.163 0.704 1.00 65.25 C ATOM 1550 CD1 TYR A 104 -6.763 7.549 0.662 1.00 21.34 C ATOM 1551 CD2 TYR A 104 -5.408 5.589 0.568 1.00 71.02 C ATOM 1552 CE1 TYR A 104 -5.642 8.337 0.489 1.00 21.03 C ATOM 1553 CE2 TYR A 104 -4.282 6.371 0.396 1.00 24.11 C ATOM 1554 CZ TYR A 104 -4.404 7.743 0.356 1.00 34.31 C ATOM 1555 OH TYR A 104 -3.285 8.526 0.186 1.00 42.13 O ATOM 0 H TYR A 104 -7.556 6.138 3.925 1.00 12.51 H new ATOM 0 HA TYR A 104 -8.942 6.597 2.252 1.00 24.51 H new ATOM 0 HB2 TYR A 104 -7.607 4.254 0.841 1.00 71.20 H new ATOM 0 HB3 TYR A 104 -8.586 5.486 0.069 1.00 71.20 H new ATOM 0 HD1 TYR A 104 -7.731 8.017 0.766 1.00 21.34 H new ATOM 0 HD2 TYR A 104 -5.309 4.514 0.597 1.00 71.02 H new ATOM 0 HE1 TYR A 104 -5.734 9.413 0.458 1.00 21.03 H new ATOM 0 HE2 TYR A 104 -3.311 5.909 0.293 1.00 24.11 H new ATOM 0 HH TYR A 104 -2.494 7.953 0.109 1.00 42.13 H new ATOM 1564 N GLU A 105 -10.763 5.012 3.218 1.00 55.21 N ATOM 1565 CA GLU A 105 -11.988 4.245 3.408 1.00 43.34 C ATOM 1566 C GLU A 105 -12.897 4.361 2.188 1.00 44.21 C ATOM 1567 O GLU A 105 -12.604 5.103 1.251 1.00 44.53 O ATOM 1568 CB GLU A 105 -12.728 4.725 4.657 1.00 63.55 C ATOM 1569 CG GLU A 105 -11.818 4.965 5.850 1.00 63.03 C ATOM 1570 CD GLU A 105 -11.424 6.422 5.998 1.00 11.12 C ATOM 1571 OE1 GLU A 105 -12.259 7.217 6.475 1.00 60.05 O ATOM 1572 OE2 GLU A 105 -10.279 6.765 5.638 1.00 14.41 O ATOM 0 H GLU A 105 -10.671 5.819 3.835 1.00 55.21 H new ATOM 0 HA GLU A 105 -11.714 3.198 3.537 1.00 43.34 H new ATOM 0 HB2 GLU A 105 -13.257 5.649 4.423 1.00 63.55 H new ATOM 0 HB3 GLU A 105 -13.482 3.986 4.929 1.00 63.55 H new ATOM 0 HG2 GLU A 105 -12.321 4.634 6.759 1.00 63.03 H new ATOM 0 HG3 GLU A 105 -10.919 4.358 5.745 1.00 63.03 H new ATOM 1577 N GLU A 106 -14.002 3.622 2.207 1.00 61.15 N ATOM 1578 CA GLU A 106 -14.953 3.641 1.102 1.00 74.42 C ATOM 1579 C GLU A 106 -16.290 3.038 1.524 1.00 54.41 C ATOM 1580 O GLU A 106 -17.331 3.687 1.433 1.00 55.44 O ATOM 1581 CB GLU A 106 -14.392 2.876 -0.097 1.00 24.43 C ATOM 1582 CG GLU A 106 -15.151 3.126 -1.390 1.00 15.31 C ATOM 1583 CD GLU A 106 -14.650 4.351 -2.131 1.00 63.13 C ATOM 1584 OE1 GLU A 106 -13.628 4.928 -1.704 1.00 63.22 O ATOM 1585 OE2 GLU A 106 -15.281 4.732 -3.139 1.00 73.22 O ATOM 0 H GLU A 106 -14.260 3.003 2.975 1.00 61.15 H new ATOM 0 HA GLU A 106 -15.117 4.680 0.816 1.00 74.42 H new ATOM 0 HB2 GLU A 106 -13.348 3.155 -0.239 1.00 24.43 H new ATOM 0 HB3 GLU A 106 -14.409 1.809 0.124 1.00 24.43 H new ATOM 0 HG2 GLU A 106 -15.060 2.252 -2.036 1.00 15.31 H new ATOM 0 HG3 GLU A 106 -16.211 3.248 -1.167 1.00 15.31 H new ATOM 1590 N GLN A 107 -16.251 1.792 1.986 1.00 43.15 N ATOM 1591 CA GLN A 107 -17.459 1.101 2.420 1.00 23.11 C ATOM 1592 C GLN A 107 -18.233 1.941 3.431 1.00 41.21 C ATOM 1593 O GLN A 107 -19.457 1.853 3.518 1.00 62.11 O ATOM 1594 CB GLN A 107 -17.103 -0.255 3.033 1.00 53.14 C ATOM 1595 CG GLN A 107 -16.486 -0.154 4.418 1.00 53.04 C ATOM 1596 CD GLN A 107 -16.068 -1.503 4.971 1.00 50.55 C ATOM 1597 OE1 GLN A 107 -14.912 -1.701 5.343 1.00 24.13 O ATOM 1598 NE2 GLN A 107 -17.009 -2.437 5.027 1.00 72.35 N ATOM 0 H GLN A 107 -15.397 1.241 2.069 1.00 43.15 H new ATOM 0 HA GLN A 107 -18.091 0.943 1.546 1.00 23.11 H new ATOM 0 HB2 GLN A 107 -18.004 -0.866 3.089 1.00 53.14 H new ATOM 0 HB3 GLN A 107 -16.408 -0.772 2.372 1.00 53.14 H new ATOM 0 HG2 GLN A 107 -15.617 0.503 4.377 1.00 53.04 H new ATOM 0 HG3 GLN A 107 -17.202 0.307 5.098 1.00 53.04 H new ATOM 0 HE21 GLN A 107 -17.955 -2.228 4.707 1.00 72.35 H new ATOM 0 HE22 GLN A 107 -16.787 -3.364 5.390 1.00 72.35 H new ATOM 1605 N GLY A 108 -17.510 2.757 4.193 1.00 1.20 N ATOM 1606 CA GLY A 108 -18.146 3.600 5.188 1.00 51.35 C ATOM 1607 C GLY A 108 -17.409 3.592 6.512 1.00 52.54 C ATOM 1608 O GLY A 108 -17.585 4.492 7.334 1.00 25.12 O ATOM 0 H GLY A 108 -16.496 2.849 4.139 1.00 1.20 H new ATOM 0 HA2 GLY A 108 -18.201 4.622 4.812 1.00 51.35 H new ATOM 0 HA3 GLY A 108 -19.171 3.263 5.344 1.00 51.35 H new ATOM 1612 N SER A 109 -16.583 2.573 6.721 1.00 5.02 N ATOM 1613 CA SER A 109 -15.820 2.448 7.958 1.00 63.02 C ATOM 1614 C SER A 109 -14.320 2.467 7.675 1.00 75.25 C ATOM 1615 O SER A 109 -13.601 3.349 8.143 1.00 75.14 O ATOM 1616 CB SER A 109 -16.197 1.156 8.686 1.00 73.23 C ATOM 1617 OG SER A 109 -17.084 0.372 7.907 1.00 74.12 O ATOM 0 H SER A 109 -16.424 1.821 6.050 1.00 5.02 H new ATOM 0 HA SER A 109 -16.063 3.299 8.594 1.00 63.02 H new ATOM 0 HB2 SER A 109 -15.296 0.582 8.905 1.00 73.23 H new ATOM 0 HB3 SER A 109 -16.663 1.396 9.642 1.00 73.23 H new ATOM 0 HG SER A 109 -17.308 -0.449 8.393 1.00 74.12 H new ATOM 1622 N SER A 110 -13.857 1.486 6.907 1.00 50.22 N ATOM 1623 CA SER A 110 -12.443 1.387 6.566 1.00 43.51 C ATOM 1624 C SER A 110 -12.183 0.174 5.677 1.00 3.34 C ATOM 1625 O SER A 110 -11.510 -0.775 6.083 1.00 62.14 O ATOM 1626 CB SER A 110 -11.594 1.295 7.835 1.00 74.34 C ATOM 1627 OG SER A 110 -12.247 0.524 8.829 1.00 32.35 O ATOM 0 H SER A 110 -14.440 0.749 6.510 1.00 50.22 H new ATOM 0 HA SER A 110 -12.164 2.286 6.017 1.00 43.51 H new ATOM 0 HB2 SER A 110 -10.628 0.848 7.599 1.00 74.34 H new ATOM 0 HB3 SER A 110 -11.396 2.296 8.218 1.00 74.34 H new ATOM 0 HG SER A 110 -11.684 0.478 9.630 1.00 32.35 H new ATOM 1632 N LYS A 111 -12.720 0.212 4.463 1.00 51.30 N ATOM 1633 CA LYS A 111 -12.547 -0.882 3.514 1.00 12.21 C ATOM 1634 C LYS A 111 -11.089 -1.001 3.082 1.00 31.24 C ATOM 1635 O LYS A 111 -10.436 -0.002 2.780 1.00 22.02 O ATOM 1636 CB LYS A 111 -13.436 -0.667 2.288 1.00 62.44 C ATOM 1637 CG LYS A 111 -13.585 -1.905 1.420 1.00 13.11 C ATOM 1638 CD LYS A 111 -14.223 -3.050 2.186 1.00 65.00 C ATOM 1639 CE LYS A 111 -15.280 -3.758 1.352 1.00 63.34 C ATOM 1640 NZ LYS A 111 -16.382 -4.298 2.196 1.00 3.01 N ATOM 0 H LYS A 111 -13.279 0.989 4.112 1.00 51.30 H new ATOM 0 HA LYS A 111 -12.839 -1.808 4.009 1.00 12.21 H new ATOM 0 HB2 LYS A 111 -14.423 -0.344 2.618 1.00 62.44 H new ATOM 0 HB3 LYS A 111 -13.021 0.141 1.686 1.00 62.44 H new ATOM 0 HG2 LYS A 111 -14.193 -1.667 0.547 1.00 13.11 H new ATOM 0 HG3 LYS A 111 -12.606 -2.213 1.053 1.00 13.11 H new ATOM 0 HD2 LYS A 111 -13.454 -3.763 2.483 1.00 65.00 H new ATOM 0 HD3 LYS A 111 -14.675 -2.669 3.102 1.00 65.00 H new ATOM 0 HE2 LYS A 111 -15.691 -3.063 0.620 1.00 63.34 H new ATOM 0 HE3 LYS A 111 -14.817 -4.572 0.794 1.00 63.34 H new ATOM 0 HZ1 LYS A 111 -17.082 -4.773 1.591 1.00 3.01 H new ATOM 0 HZ2 LYS A 111 -15.994 -4.980 2.878 1.00 3.01 H new ATOM 0 HZ3 LYS A 111 -16.840 -3.518 2.709 1.00 3.01 H new ATOM 1650 N VAL A 112 -10.583 -2.231 3.055 1.00 51.41 N ATOM 1651 CA VAL A 112 -9.203 -2.481 2.657 1.00 61.15 C ATOM 1652 C VAL A 112 -9.057 -2.467 1.139 1.00 61.51 C ATOM 1653 O VAL A 112 -10.049 -2.419 0.410 1.00 15.11 O ATOM 1654 CB VAL A 112 -8.699 -3.833 3.197 1.00 75.34 C ATOM 1655 CG1 VAL A 112 -8.899 -3.913 4.704 1.00 41.34 C ATOM 1656 CG2 VAL A 112 -9.405 -4.983 2.495 1.00 3.04 C ATOM 0 H VAL A 112 -11.109 -3.069 3.304 1.00 51.41 H new ATOM 0 HA VAL A 112 -8.601 -1.680 3.085 1.00 61.15 H new ATOM 0 HB VAL A 112 -7.632 -3.913 2.991 1.00 75.34 H new ATOM 0 HG11 VAL A 112 -8.538 -4.875 5.068 1.00 41.34 H new ATOM 0 HG12 VAL A 112 -8.344 -3.109 5.188 1.00 41.34 H new ATOM 0 HG13 VAL A 112 -9.959 -3.812 4.936 1.00 41.34 H new ATOM 0 HG21 VAL A 112 -9.037 -5.930 2.889 1.00 3.04 H new ATOM 0 HG22 VAL A 112 -10.479 -4.911 2.668 1.00 3.04 H new ATOM 0 HG23 VAL A 112 -9.206 -4.933 1.425 1.00 3.04 H new ATOM 1666 N PHE A 113 -7.816 -2.511 0.669 1.00 21.24 N ATOM 1667 CA PHE A 113 -7.540 -2.504 -0.763 1.00 11.44 C ATOM 1668 C PHE A 113 -7.466 -3.926 -1.311 1.00 71.22 C ATOM 1669 O PHE A 113 -6.452 -4.608 -1.160 1.00 44.02 O ATOM 1670 CB PHE A 113 -6.228 -1.768 -1.046 1.00 4.31 C ATOM 1671 CG PHE A 113 -6.420 -0.335 -1.452 1.00 41.34 C ATOM 1672 CD1 PHE A 113 -7.301 0.483 -0.762 1.00 24.23 C ATOM 1673 CD2 PHE A 113 -5.720 0.195 -2.525 1.00 34.41 C ATOM 1674 CE1 PHE A 113 -7.480 1.801 -1.134 1.00 73.12 C ATOM 1675 CE2 PHE A 113 -5.896 1.514 -2.901 1.00 14.04 C ATOM 1676 CZ PHE A 113 -6.776 2.319 -2.204 1.00 23.53 C ATOM 0 H PHE A 113 -6.985 -2.552 1.258 1.00 21.24 H new ATOM 0 HA PHE A 113 -8.357 -1.984 -1.263 1.00 11.44 H new ATOM 0 HB2 PHE A 113 -5.601 -1.804 -0.155 1.00 4.31 H new ATOM 0 HB3 PHE A 113 -5.690 -2.292 -1.836 1.00 4.31 H new ATOM 0 HD1 PHE A 113 -7.854 0.085 0.076 1.00 24.23 H new ATOM 0 HD2 PHE A 113 -5.030 -0.429 -3.073 1.00 34.41 H new ATOM 0 HE1 PHE A 113 -8.171 2.427 -0.588 1.00 73.12 H new ATOM 0 HE2 PHE A 113 -5.346 1.915 -3.739 1.00 14.04 H new ATOM 0 HZ PHE A 113 -6.913 3.350 -2.495 1.00 23.53 H new ATOM 1685 N GLN A 114 -8.548 -4.366 -1.945 1.00 73.42 N ATOM 1686 CA GLN A 114 -8.608 -5.708 -2.513 1.00 12.52 C ATOM 1687 C GLN A 114 -8.297 -5.679 -4.006 1.00 5.24 C ATOM 1688 O GLN A 114 -8.579 -4.698 -4.691 1.00 14.44 O ATOM 1689 CB GLN A 114 -9.988 -6.323 -2.279 1.00 33.10 C ATOM 1690 CG GLN A 114 -11.116 -5.563 -2.958 1.00 30.32 C ATOM 1691 CD GLN A 114 -11.304 -5.970 -4.407 1.00 75.33 C ATOM 1692 OE1 GLN A 114 -11.507 -7.145 -4.712 1.00 63.33 O ATOM 1693 NE2 GLN A 114 -11.237 -4.997 -5.307 1.00 2.41 N ATOM 0 H GLN A 114 -9.395 -3.813 -2.078 1.00 73.42 H new ATOM 0 HA GLN A 114 -7.857 -6.321 -2.015 1.00 12.52 H new ATOM 0 HB2 GLN A 114 -9.984 -7.351 -2.641 1.00 33.10 H new ATOM 0 HB3 GLN A 114 -10.182 -6.363 -1.207 1.00 33.10 H new ATOM 0 HG2 GLN A 114 -12.044 -5.734 -2.413 1.00 30.32 H new ATOM 0 HG3 GLN A 114 -10.910 -4.494 -2.909 1.00 30.32 H new ATOM 0 HE21 GLN A 114 -11.067 -4.037 -5.008 1.00 2.41 H new ATOM 0 HE22 GLN A 114 -11.356 -5.209 -6.298 1.00 2.41 H new ATOM 1700 N GLY A 115 -7.714 -6.766 -4.505 1.00 52.21 N ATOM 1701 CA GLY A 115 -7.375 -6.845 -5.914 1.00 30.41 C ATOM 1702 C GLY A 115 -6.108 -7.640 -6.161 1.00 22.41 C ATOM 1703 O GLY A 115 -5.058 -7.337 -5.597 1.00 14.44 O ATOM 0 H GLY A 115 -7.471 -7.592 -3.959 1.00 52.21 H new ATOM 0 HA2 GLY A 115 -8.200 -7.304 -6.458 1.00 30.41 H new ATOM 0 HA3 GLY A 115 -7.252 -5.838 -6.312 1.00 30.41 H new ATOM 1707 N ASN A 116 -6.207 -8.662 -7.005 1.00 32.45 N ATOM 1708 CA ASN A 116 -5.060 -9.505 -7.323 1.00 13.24 C ATOM 1709 C ASN A 116 -4.229 -8.891 -8.447 1.00 32.42 C ATOM 1710 O ASN A 116 -3.038 -8.627 -8.279 1.00 1.21 O ATOM 1711 CB ASN A 116 -5.526 -10.905 -7.725 1.00 43.51 C ATOM 1712 CG ASN A 116 -5.775 -11.798 -6.525 1.00 64.12 C ATOM 1713 OD1 ASN A 116 -5.168 -11.622 -5.470 1.00 13.02 O ATOM 1714 ND2 ASN A 116 -6.672 -12.765 -6.684 1.00 21.35 N ATOM 0 H ASN A 116 -7.070 -8.926 -7.481 1.00 32.45 H new ATOM 0 HA ASN A 116 -4.436 -9.579 -6.432 1.00 13.24 H new ATOM 0 HB2 ASN A 116 -6.441 -10.826 -8.312 1.00 43.51 H new ATOM 0 HB3 ASN A 116 -4.775 -11.365 -8.367 1.00 43.51 H new ATOM 0 HD21 ASN A 116 -6.881 -13.399 -5.912 1.00 21.35 H new ATOM 0 HD22 ASN A 116 -7.152 -12.874 -7.578 1.00 21.35 H new ATOM 1720 N LEU A 117 -4.866 -8.665 -9.590 1.00 52.25 N ATOM 1721 CA LEU A 117 -4.187 -8.081 -10.741 1.00 45.44 C ATOM 1722 C LEU A 117 -3.090 -9.008 -11.254 1.00 44.50 C ATOM 1723 O LEU A 117 -2.217 -8.591 -12.016 1.00 2.01 O ATOM 1724 CB LEU A 117 -3.590 -6.722 -10.371 1.00 55.24 C ATOM 1725 CG LEU A 117 -4.481 -5.803 -9.534 1.00 23.21 C ATOM 1726 CD1 LEU A 117 -3.644 -4.756 -8.816 1.00 40.33 C ATOM 1727 CD2 LEU A 117 -5.534 -5.138 -10.410 1.00 14.54 C ATOM 0 H LEU A 117 -5.852 -8.877 -9.745 1.00 52.25 H new ATOM 0 HA LEU A 117 -4.922 -7.944 -11.534 1.00 45.44 H new ATOM 0 HB2 LEU A 117 -2.662 -6.892 -9.825 1.00 55.24 H new ATOM 0 HB3 LEU A 117 -3.327 -6.200 -11.291 1.00 55.24 H new ATOM 0 HG LEU A 117 -4.990 -6.408 -8.784 1.00 23.21 H new ATOM 0 HD11 LEU A 117 -4.295 -4.112 -8.226 1.00 40.33 H new ATOM 0 HD12 LEU A 117 -2.929 -5.250 -8.158 1.00 40.33 H new ATOM 0 HD13 LEU A 117 -3.106 -4.155 -9.549 1.00 40.33 H new ATOM 0 HD21 LEU A 117 -6.159 -4.488 -9.798 1.00 14.54 H new ATOM 0 HD22 LEU A 117 -5.043 -4.547 -11.183 1.00 14.54 H new ATOM 0 HD23 LEU A 117 -6.155 -5.903 -10.877 1.00 14.54 H new ATOM 1738 N ASP A 118 -3.142 -10.266 -10.833 1.00 61.10 N ATOM 1739 CA ASP A 118 -2.154 -11.255 -11.252 1.00 72.03 C ATOM 1740 C ASP A 118 -0.737 -10.738 -11.022 1.00 50.23 C ATOM 1741 O ASP A 118 -0.537 -9.718 -10.362 1.00 44.14 O ATOM 1742 CB ASP A 118 -2.348 -11.606 -12.728 1.00 44.21 C ATOM 1743 CG ASP A 118 -3.809 -11.785 -13.094 1.00 20.43 C ATOM 1744 OD1 ASP A 118 -4.509 -12.541 -12.387 1.00 2.52 O ATOM 1745 OD2 ASP A 118 -4.251 -11.168 -14.085 1.00 61.42 O ATOM 0 H ASP A 118 -3.858 -10.626 -10.202 1.00 61.10 H new ATOM 0 HA ASP A 118 -2.296 -12.153 -10.651 1.00 72.03 H new ATOM 0 HB2 ASP A 118 -1.916 -10.819 -13.345 1.00 44.21 H new ATOM 0 HB3 ASP A 118 -1.805 -12.523 -12.955 1.00 44.21 H new ATOM 1749 N ASN A 119 0.243 -11.450 -11.569 1.00 13.10 N ATOM 1750 CA ASN A 119 1.641 -11.064 -11.421 1.00 10.33 C ATOM 1751 C ASN A 119 2.181 -10.467 -12.718 1.00 33.11 C ATOM 1752 O ASN A 119 3.118 -9.670 -12.703 1.00 70.15 O ATOM 1753 CB ASN A 119 2.486 -12.273 -11.014 1.00 71.21 C ATOM 1754 CG ASN A 119 3.073 -12.997 -12.210 1.00 2.05 C ATOM 1755 OD1 ASN A 119 2.207 -13.561 -13.044 1.00 41.04 O flip ATOM 1756 ND2 ASN A 119 4.292 -13.049 -12.381 1.00 13.00 N flip ATOM 0 H ASN A 119 0.095 -12.297 -12.118 1.00 13.10 H new ATOM 0 HA ASN A 119 1.701 -10.307 -10.639 1.00 10.33 H new ATOM 0 HB2 ASN A 119 3.293 -11.945 -10.359 1.00 71.21 H new ATOM 0 HB3 ASN A 119 1.871 -12.966 -10.439 1.00 71.21 H new ATOM 0 HD21 ASN A 119 4.920 -12.601 -11.714 1.00 13.00 H new ATOM 0 HD22 ASN A 119 4.673 -13.540 -13.190 1.00 13.00 H new ATOM 1762 N ASN A 120 1.581 -10.859 -13.838 1.00 15.05 N ATOM 1763 CA ASN A 120 2.002 -10.362 -15.143 1.00 72.31 C ATOM 1764 C ASN A 120 1.104 -9.218 -15.604 1.00 52.33 C ATOM 1765 O ASN A 120 1.047 -8.900 -16.792 1.00 61.21 O ATOM 1766 CB ASN A 120 1.976 -11.492 -16.173 1.00 43.42 C ATOM 1767 CG ASN A 120 3.215 -11.505 -17.048 1.00 2.41 C ATOM 1768 OD1 ASN A 120 3.147 -11.223 -18.245 1.00 21.11 O ATOM 1769 ND2 ASN A 120 4.356 -11.834 -16.453 1.00 52.32 N ATOM 0 H ASN A 120 0.803 -11.518 -13.868 1.00 15.05 H new ATOM 0 HA ASN A 120 3.021 -9.986 -15.051 1.00 72.31 H new ATOM 0 HB2 ASN A 120 1.889 -12.448 -15.657 1.00 43.42 H new ATOM 0 HB3 ASN A 120 1.092 -11.387 -16.801 1.00 43.42 H new ATOM 0 HD21 ASN A 120 5.222 -11.860 -16.991 1.00 52.32 H new ATOM 0 HD22 ASN A 120 4.366 -12.060 -15.458 1.00 52.32 H new ATOM 1775 N SER A 121 0.405 -8.602 -14.656 1.00 31.01 N ATOM 1776 CA SER A 121 -0.493 -7.495 -14.964 1.00 1.41 C ATOM 1777 C SER A 121 -0.375 -6.392 -13.917 1.00 74.01 C ATOM 1778 O SER A 121 -0.775 -6.568 -12.766 1.00 63.13 O ATOM 1779 CB SER A 121 -1.938 -7.990 -15.041 1.00 72.14 C ATOM 1780 OG SER A 121 -2.797 -7.179 -14.257 1.00 52.31 O ATOM 0 H SER A 121 0.443 -8.851 -13.668 1.00 31.01 H new ATOM 0 HA SER A 121 -0.205 -7.084 -15.932 1.00 1.41 H new ATOM 0 HB2 SER A 121 -2.273 -7.984 -16.078 1.00 72.14 H new ATOM 0 HB3 SER A 121 -1.991 -9.022 -14.695 1.00 72.14 H new ATOM 0 HG SER A 121 -2.663 -7.383 -13.308 1.00 52.31 H new ATOM 1785 N HIS A 122 0.177 -5.254 -14.325 1.00 51.51 N ATOM 1786 CA HIS A 122 0.348 -4.120 -13.423 1.00 22.53 C ATOM 1787 C HIS A 122 -0.934 -3.296 -13.338 1.00 2.35 C ATOM 1788 O HIS A 122 -1.718 -3.249 -14.285 1.00 45.33 O ATOM 1789 CB HIS A 122 1.506 -3.238 -13.892 1.00 71.43 C ATOM 1790 CG HIS A 122 1.152 -2.349 -15.044 1.00 21.44 C ATOM 1791 ND1 HIS A 122 0.346 -2.754 -16.087 1.00 54.12 N ATOM 1792 CD2 HIS A 122 1.500 -1.069 -15.314 1.00 33.45 C ATOM 1793 CE1 HIS A 122 0.215 -1.762 -16.949 1.00 74.24 C ATOM 1794 NE2 HIS A 122 0.905 -0.728 -16.503 1.00 52.11 N ATOM 0 H HIS A 122 0.514 -5.092 -15.274 1.00 51.51 H new ATOM 0 HA HIS A 122 0.576 -4.508 -12.430 1.00 22.53 H new ATOM 0 HB2 HIS A 122 1.844 -2.622 -13.059 1.00 71.43 H new ATOM 0 HB3 HIS A 122 2.344 -3.874 -14.178 1.00 71.43 H new ATOM 0 HD2 HIS A 122 2.129 -0.434 -14.707 1.00 33.45 H new ATOM 0 HE1 HIS A 122 -0.359 -1.791 -17.863 1.00 74.24 H new ATOM 0 HE2 HIS A 122 0.983 0.177 -16.967 1.00 52.11 H new ATOM 1801 N LYS A 123 -1.139 -2.648 -12.196 1.00 63.54 N ATOM 1802 CA LYS A 123 -2.325 -1.826 -11.987 1.00 34.03 C ATOM 1803 C LYS A 123 -1.957 -0.501 -11.325 1.00 71.42 C ATOM 1804 O LYS A 123 -1.451 -0.475 -10.203 1.00 55.33 O ATOM 1805 CB LYS A 123 -3.344 -2.573 -11.123 1.00 23.00 C ATOM 1806 CG LYS A 123 -4.724 -1.938 -11.124 1.00 44.31 C ATOM 1807 CD LYS A 123 -5.036 -1.281 -9.790 1.00 24.30 C ATOM 1808 CE LYS A 123 -6.504 -1.438 -9.422 1.00 23.10 C ATOM 1809 NZ LYS A 123 -6.687 -2.321 -8.237 1.00 75.22 N ATOM 0 H LYS A 123 -0.500 -2.676 -11.402 1.00 63.54 H new ATOM 0 HA LYS A 123 -2.768 -1.617 -12.961 1.00 34.03 H new ATOM 0 HB2 LYS A 123 -3.426 -3.600 -11.478 1.00 23.00 H new ATOM 0 HB3 LYS A 123 -2.975 -2.619 -10.098 1.00 23.00 H new ATOM 0 HG2 LYS A 123 -4.783 -1.195 -11.919 1.00 44.31 H new ATOM 0 HG3 LYS A 123 -5.475 -2.698 -11.341 1.00 44.31 H new ATOM 0 HD2 LYS A 123 -4.415 -1.723 -9.011 1.00 24.30 H new ATOM 0 HD3 LYS A 123 -4.783 -0.222 -9.837 1.00 24.30 H new ATOM 0 HE2 LYS A 123 -6.933 -0.458 -9.214 1.00 23.10 H new ATOM 0 HE3 LYS A 123 -7.049 -1.851 -10.271 1.00 23.10 H new ATOM 0 HZ1 LYS A 123 -7.228 -3.165 -8.513 1.00 75.22 H new ATOM 0 HZ2 LYS A 123 -5.757 -2.610 -7.872 1.00 75.22 H new ATOM 0 HZ3 LYS A 123 -7.204 -1.805 -7.496 1.00 75.22 H new ATOM 1819 N LYS A 124 -2.217 0.597 -12.027 1.00 13.25 N ATOM 1820 CA LYS A 124 -1.916 1.927 -11.507 1.00 4.14 C ATOM 1821 C LYS A 124 -3.196 2.722 -11.275 1.00 12.22 C ATOM 1822 O LYS A 124 -4.233 2.435 -11.871 1.00 50.32 O ATOM 1823 CB LYS A 124 -1.003 2.681 -12.477 1.00 4.13 C ATOM 1824 CG LYS A 124 -1.623 2.909 -13.844 1.00 61.34 C ATOM 1825 CD LYS A 124 -0.590 3.373 -14.856 1.00 3.31 C ATOM 1826 CE LYS A 124 -1.141 4.470 -15.754 1.00 44.20 C ATOM 1827 NZ LYS A 124 -1.598 3.934 -17.066 1.00 51.12 N ATOM 0 H LYS A 124 -2.635 0.593 -12.957 1.00 13.25 H new ATOM 0 HA LYS A 124 -1.404 1.810 -10.552 1.00 4.14 H new ATOM 0 HB2 LYS A 124 -0.741 3.645 -12.041 1.00 4.13 H new ATOM 0 HB3 LYS A 124 -0.075 2.123 -12.597 1.00 4.13 H new ATOM 0 HG2 LYS A 124 -2.086 1.986 -14.193 1.00 61.34 H new ATOM 0 HG3 LYS A 124 -2.416 3.653 -13.765 1.00 61.34 H new ATOM 0 HD2 LYS A 124 0.294 3.739 -14.333 1.00 3.31 H new ATOM 0 HD3 LYS A 124 -0.272 2.528 -15.466 1.00 3.31 H new ATOM 0 HE2 LYS A 124 -1.973 4.965 -15.254 1.00 44.20 H new ATOM 0 HE3 LYS A 124 -0.373 5.226 -15.918 1.00 44.20 H new ATOM 0 HZ1 LYS A 124 -1.967 4.712 -17.649 1.00 51.12 H new ATOM 0 HZ2 LYS A 124 -0.798 3.484 -17.555 1.00 51.12 H new ATOM 0 HZ3 LYS A 124 -2.349 3.231 -16.911 1.00 51.12 H new ATOM 1837 N ASN A 125 -3.115 3.725 -10.406 1.00 25.24 N ATOM 1838 CA ASN A 125 -4.268 4.562 -10.096 1.00 20.31 C ATOM 1839 C ASN A 125 -3.976 6.026 -10.409 1.00 13.15 C ATOM 1840 O ASN A 125 -2.923 6.551 -10.044 1.00 33.40 O ATOM 1841 CB ASN A 125 -4.653 4.410 -8.622 1.00 53.52 C ATOM 1842 CG ASN A 125 -4.980 2.976 -8.255 1.00 72.00 C ATOM 1843 OD1 ASN A 125 -4.219 2.057 -8.557 1.00 12.51 O ATOM 1844 ND2 ASN A 125 -6.118 2.778 -7.600 1.00 71.11 N ATOM 0 H ASN A 125 -2.263 3.977 -9.905 1.00 25.24 H new ATOM 0 HA ASN A 125 -5.102 4.235 -10.718 1.00 20.31 H new ATOM 0 HB2 ASN A 125 -3.833 4.764 -7.997 1.00 53.52 H new ATOM 0 HB3 ASN A 125 -5.514 5.043 -8.407 1.00 53.52 H new ATOM 0 HD21 ASN A 125 -6.392 1.834 -7.327 1.00 71.11 H new ATOM 0 HD22 ASN A 125 -6.719 3.570 -7.370 1.00 71.11 H new ATOM 1850 N ILE A 126 -4.914 6.680 -11.085 1.00 65.53 N ATOM 1851 CA ILE A 126 -4.758 8.084 -11.445 1.00 23.30 C ATOM 1852 C ILE A 126 -4.767 8.973 -10.207 1.00 25.31 C ATOM 1853 O ILE A 126 -4.894 8.488 -9.082 1.00 52.21 O ATOM 1854 CB ILE A 126 -5.871 8.546 -12.403 1.00 43.12 C ATOM 1855 CG1 ILE A 126 -5.340 9.615 -13.360 1.00 2.12 C ATOM 1856 CG2 ILE A 126 -7.062 9.075 -11.618 1.00 35.04 C ATOM 1857 CD1 ILE A 126 -5.590 9.299 -14.818 1.00 10.23 C ATOM 0 H ILE A 126 -5.790 6.260 -11.395 1.00 65.53 H new ATOM 0 HA ILE A 126 -3.795 8.176 -11.948 1.00 23.30 H new ATOM 0 HB ILE A 126 -6.201 7.690 -12.991 1.00 43.12 H new ATOM 0 HG12 ILE A 126 -5.806 10.571 -13.119 1.00 2.12 H new ATOM 0 HG13 ILE A 126 -4.268 9.733 -13.201 1.00 2.12 H new ATOM 0 HG21 ILE A 126 -7.840 9.397 -12.310 1.00 35.04 H new ATOM 0 HG22 ILE A 126 -7.453 8.287 -10.975 1.00 35.04 H new ATOM 0 HG23 ILE A 126 -6.748 9.920 -11.006 1.00 35.04 H new ATOM 0 HD11 ILE A 126 -5.187 10.100 -15.438 1.00 10.23 H new ATOM 0 HD12 ILE A 126 -5.101 8.359 -15.076 1.00 10.23 H new ATOM 0 HD13 ILE A 126 -6.662 9.210 -14.992 1.00 10.23 H new ATOM 1868 N PHE A 127 -4.633 10.277 -10.421 1.00 71.11 N ATOM 1869 CA PHE A 127 -4.627 11.236 -9.322 1.00 54.23 C ATOM 1870 C PHE A 127 -6.042 11.475 -8.800 1.00 11.42 C ATOM 1871 O PHE A 127 -6.497 12.614 -8.714 1.00 54.35 O ATOM 1872 CB PHE A 127 -4.008 12.560 -9.775 1.00 51.22 C ATOM 1873 CG PHE A 127 -4.499 13.023 -11.118 1.00 31.15 C ATOM 1874 CD1 PHE A 127 -5.655 13.779 -11.225 1.00 31.42 C ATOM 1875 CD2 PHE A 127 -3.804 12.701 -12.272 1.00 54.41 C ATOM 1876 CE1 PHE A 127 -6.109 14.205 -12.458 1.00 43.20 C ATOM 1877 CE2 PHE A 127 -4.253 13.126 -13.509 1.00 23.42 C ATOM 1878 CZ PHE A 127 -5.407 13.878 -13.602 1.00 13.11 C ATOM 0 H PHE A 127 -4.527 10.695 -11.346 1.00 71.11 H new ATOM 0 HA PHE A 127 -4.026 10.820 -8.514 1.00 54.23 H new ATOM 0 HB2 PHE A 127 -4.227 13.327 -9.033 1.00 51.22 H new ATOM 0 HB3 PHE A 127 -2.924 12.452 -9.811 1.00 51.22 H new ATOM 0 HD1 PHE A 127 -6.208 14.038 -10.334 1.00 31.42 H new ATOM 0 HD2 PHE A 127 -2.902 12.112 -12.205 1.00 54.41 H new ATOM 0 HE1 PHE A 127 -7.012 14.793 -12.528 1.00 43.20 H new ATOM 0 HE2 PHE A 127 -3.701 12.870 -14.401 1.00 23.42 H new ATOM 0 HZ PHE A 127 -5.760 14.210 -14.567 1.00 13.11 H new ATOM 1887 N GLU A 128 -6.729 10.391 -8.454 1.00 4.41 N ATOM 1888 CA GLU A 128 -8.092 10.483 -7.942 1.00 5.54 C ATOM 1889 C GLU A 128 -8.134 11.298 -6.654 1.00 71.35 C ATOM 1890 O GLU A 128 -9.174 11.849 -6.288 1.00 5.52 O ATOM 1891 CB GLU A 128 -8.661 9.085 -7.694 1.00 61.55 C ATOM 1892 CG GLU A 128 -10.174 9.012 -7.826 1.00 32.11 C ATOM 1893 CD GLU A 128 -10.743 7.711 -7.295 1.00 43.15 C ATOM 1894 OE1 GLU A 128 -10.057 6.674 -7.403 1.00 5.01 O ATOM 1895 OE2 GLU A 128 -11.876 7.731 -6.770 1.00 44.25 O ATOM 0 H GLU A 128 -6.365 9.440 -8.519 1.00 4.41 H new ATOM 0 HA GLU A 128 -8.702 10.988 -8.691 1.00 5.54 H new ATOM 0 HB2 GLU A 128 -8.209 8.387 -8.399 1.00 61.55 H new ATOM 0 HB3 GLU A 128 -8.376 8.758 -6.694 1.00 61.55 H new ATOM 0 HG2 GLU A 128 -10.623 9.847 -7.288 1.00 32.11 H new ATOM 0 HG3 GLU A 128 -10.449 9.124 -8.875 1.00 32.11 H new ATOM 1900 N LYS A 129 -6.999 11.371 -5.968 1.00 33.15 N ATOM 1901 CA LYS A 129 -6.905 12.119 -4.719 1.00 3.45 C ATOM 1902 C LYS A 129 -5.453 12.240 -4.267 1.00 0.14 C ATOM 1903 O LYS A 129 -4.998 11.534 -3.367 1.00 34.42 O ATOM 1904 CB LYS A 129 -7.735 11.438 -3.629 1.00 10.31 C ATOM 1905 CG LYS A 129 -9.097 12.076 -3.414 1.00 43.42 C ATOM 1906 CD LYS A 129 -9.559 11.934 -1.974 1.00 23.33 C ATOM 1907 CE LYS A 129 -10.602 12.982 -1.618 1.00 34.44 C ATOM 1908 NZ LYS A 129 -10.148 13.858 -0.502 1.00 0.02 N ATOM 0 H LYS A 129 -6.130 10.921 -6.256 1.00 33.15 H new ATOM 0 HA LYS A 129 -7.298 13.121 -4.893 1.00 3.45 H new ATOM 0 HB2 LYS A 129 -7.872 10.389 -3.890 1.00 10.31 H new ATOM 0 HB3 LYS A 129 -7.179 11.463 -2.692 1.00 10.31 H new ATOM 0 HG2 LYS A 129 -9.051 13.132 -3.680 1.00 43.42 H new ATOM 0 HG3 LYS A 129 -9.826 11.612 -4.078 1.00 43.42 H new ATOM 0 HD2 LYS A 129 -9.975 10.938 -1.821 1.00 23.33 H new ATOM 0 HD3 LYS A 129 -8.704 12.029 -1.305 1.00 23.33 H new ATOM 0 HE2 LYS A 129 -10.818 13.593 -2.495 1.00 34.44 H new ATOM 0 HE3 LYS A 129 -11.532 12.488 -1.337 1.00 34.44 H new ATOM 0 HZ1 LYS A 129 -10.886 14.559 -0.289 1.00 0.02 H new ATOM 0 HZ2 LYS A 129 -9.966 13.279 0.342 1.00 0.02 H new ATOM 0 HZ3 LYS A 129 -9.274 14.349 -0.779 1.00 0.02 H new ATOM 1918 N PRO A 130 -4.708 13.157 -4.902 1.00 4.21 N ATOM 1919 CA PRO A 130 -3.298 13.393 -4.580 1.00 14.31 C ATOM 1920 C PRO A 130 -3.118 14.050 -3.215 1.00 0.34 C ATOM 1921 O PRO A 130 -4.059 14.618 -2.660 1.00 3.15 O ATOM 1922 CB PRO A 130 -2.832 14.335 -5.692 1.00 44.33 C ATOM 1923 CG PRO A 130 -4.071 15.030 -6.144 1.00 21.02 C ATOM 1924 CD PRO A 130 -5.186 14.033 -5.985 1.00 5.45 C ATOM 0 HA PRO A 130 -2.731 12.463 -4.526 1.00 14.31 H new ATOM 0 HB2 PRO A 130 -2.091 15.045 -5.325 1.00 44.33 H new ATOM 0 HB3 PRO A 130 -2.367 13.783 -6.509 1.00 44.33 H new ATOM 0 HG2 PRO A 130 -4.258 15.923 -5.547 1.00 21.02 H new ATOM 0 HG3 PRO A 130 -3.981 15.353 -7.181 1.00 21.02 H new ATOM 0 HD2 PRO A 130 -6.126 14.519 -5.723 1.00 5.45 H new ATOM 0 HD3 PRO A 130 -5.361 13.476 -6.905 1.00 5.45 H new ATOM 1929 N PHE A 131 -1.904 13.970 -2.681 1.00 54.01 N ATOM 1930 CA PHE A 131 -1.601 14.556 -1.381 1.00 53.32 C ATOM 1931 C PHE A 131 -0.166 14.245 -0.965 1.00 31.00 C ATOM 1932 O PHE A 131 0.457 13.323 -1.490 1.00 13.04 O ATOM 1933 CB PHE A 131 -2.575 14.036 -0.323 1.00 61.23 C ATOM 1934 CG PHE A 131 -3.529 15.082 0.180 1.00 33.45 C ATOM 1935 CD1 PHE A 131 -3.057 16.285 0.679 1.00 72.31 C ATOM 1936 CD2 PHE A 131 -4.896 14.861 0.156 1.00 53.43 C ATOM 1937 CE1 PHE A 131 -3.931 17.249 1.144 1.00 72.34 C ATOM 1938 CE2 PHE A 131 -5.776 15.822 0.619 1.00 5.30 C ATOM 1939 CZ PHE A 131 -5.293 17.018 1.113 1.00 31.13 C ATOM 0 H PHE A 131 -1.114 13.505 -3.129 1.00 54.01 H new ATOM 0 HA PHE A 131 -1.710 15.637 -1.464 1.00 53.32 H new ATOM 0 HB2 PHE A 131 -3.145 13.207 -0.742 1.00 61.23 H new ATOM 0 HB3 PHE A 131 -2.007 13.639 0.518 1.00 61.23 H new ATOM 0 HD1 PHE A 131 -1.994 16.472 0.705 1.00 72.31 H new ATOM 0 HD2 PHE A 131 -5.279 13.927 -0.229 1.00 53.43 H new ATOM 0 HE1 PHE A 131 -3.550 18.182 1.531 1.00 72.34 H new ATOM 0 HE2 PHE A 131 -6.840 15.638 0.594 1.00 5.30 H new ATOM 0 HZ PHE A 131 -5.978 17.771 1.474 1.00 31.13 H new ATOM 1948 N MET A 132 0.351 15.022 -0.018 1.00 60.53 N ATOM 1949 CA MET A 132 1.712 14.829 0.469 1.00 61.21 C ATOM 1950 C MET A 132 1.808 13.572 1.327 1.00 20.53 C ATOM 1951 O MET A 132 0.859 13.208 2.021 1.00 62.34 O ATOM 1952 CB MET A 132 2.164 16.047 1.276 1.00 13.44 C ATOM 1953 CG MET A 132 1.289 16.336 2.485 1.00 12.43 C ATOM 1954 SD MET A 132 1.012 18.100 2.736 1.00 45.32 S ATOM 1955 CE MET A 132 -0.066 18.472 1.353 1.00 31.33 C ATOM 0 H MET A 132 -0.152 15.790 0.427 1.00 60.53 H new ATOM 0 HA MET A 132 2.368 14.710 -0.394 1.00 61.21 H new ATOM 0 HB2 MET A 132 3.190 15.891 1.610 1.00 13.44 H new ATOM 0 HB3 MET A 132 2.170 16.921 0.625 1.00 13.44 H new ATOM 0 HG2 MET A 132 0.329 15.835 2.362 1.00 12.43 H new ATOM 0 HG3 MET A 132 1.756 15.915 3.376 1.00 12.43 H new ATOM 0 HE1 MET A 132 0.023 19.527 1.096 1.00 31.33 H new ATOM 0 HE2 MET A 132 0.220 17.864 0.495 1.00 31.33 H new ATOM 0 HE3 MET A 132 -1.098 18.251 1.626 1.00 31.33 H new ATOM 1963 N ALA A 133 2.961 12.913 1.277 1.00 2.54 N ATOM 1964 CA ALA A 133 3.182 11.697 2.050 1.00 35.40 C ATOM 1965 C ALA A 133 4.627 11.605 2.527 1.00 4.32 C ATOM 1966 O ALA A 133 5.547 12.047 1.838 1.00 74.35 O ATOM 1967 CB ALA A 133 2.816 10.472 1.227 1.00 43.14 C ATOM 0 H ALA A 133 3.757 13.201 0.709 1.00 2.54 H new ATOM 0 HA ALA A 133 2.538 11.734 2.929 1.00 35.40 H new ATOM 0 HB1 ALA A 133 2.987 9.572 1.818 1.00 43.14 H new ATOM 0 HB2 ALA A 133 1.765 10.525 0.943 1.00 43.14 H new ATOM 0 HB3 ALA A 133 3.434 10.439 0.329 1.00 43.14 H new ATOM 1973 N ARG A 134 4.821 11.026 3.708 1.00 44.02 N ATOM 1974 CA ARG A 134 6.155 10.878 4.275 1.00 21.55 C ATOM 1975 C ARG A 134 6.451 9.414 4.591 1.00 40.21 C ATOM 1976 O ARG A 134 7.606 8.986 4.573 1.00 64.41 O ATOM 1977 CB ARG A 134 6.289 11.721 5.545 1.00 20.13 C ATOM 1978 CG ARG A 134 7.726 12.072 5.893 1.00 21.34 C ATOM 1979 CD ARG A 134 8.141 11.465 7.225 1.00 65.21 C ATOM 1980 NE ARG A 134 8.478 10.049 7.099 1.00 33.23 N ATOM 1981 CZ ARG A 134 8.877 9.295 8.117 1.00 70.32 C ATOM 1982 NH1 ARG A 134 8.987 9.818 9.331 1.00 40.24 N ATOM 1983 NH2 ARG A 134 9.165 8.015 7.924 1.00 5.44 N ATOM 0 H ARG A 134 4.071 10.652 4.290 1.00 44.02 H new ATOM 0 HA ARG A 134 6.877 11.227 3.537 1.00 21.55 H new ATOM 0 HB2 ARG A 134 5.718 12.642 5.422 1.00 20.13 H new ATOM 0 HB3 ARG A 134 5.844 11.179 6.379 1.00 20.13 H new ATOM 0 HG2 ARG A 134 8.390 11.714 5.106 1.00 21.34 H new ATOM 0 HG3 ARG A 134 7.837 13.156 5.935 1.00 21.34 H new ATOM 0 HD2 ARG A 134 9.000 12.008 7.619 1.00 65.21 H new ATOM 0 HD3 ARG A 134 7.331 11.582 7.945 1.00 65.21 H new ATOM 0 HE ARG A 134 8.403 9.616 6.179 1.00 33.23 H new ATOM 0 HH11 ARG A 134 8.765 10.802 9.485 1.00 40.24 H new ATOM 0 HH12 ARG A 134 9.294 9.237 10.111 1.00 40.24 H new ATOM 0 HH21 ARG A 134 9.080 7.608 6.993 1.00 5.44 H new ATOM 0 HH22 ARG A 134 9.471 7.437 8.707 1.00 5.44 H new ATOM 1994 N TYR A 135 5.402 8.653 4.880 1.00 3.21 N ATOM 1995 CA TYR A 135 5.550 7.237 5.202 1.00 73.05 C ATOM 1996 C TYR A 135 4.216 6.508 5.075 1.00 72.13 C ATOM 1997 O TYR A 135 3.201 6.945 5.619 1.00 0.44 O ATOM 1998 CB TYR A 135 6.102 7.071 6.618 1.00 73.52 C ATOM 1999 CG TYR A 135 5.947 5.671 7.168 1.00 3.13 C ATOM 2000 CD1 TYR A 135 4.798 5.295 7.851 1.00 62.43 C ATOM 2001 CD2 TYR A 135 6.951 4.725 7.004 1.00 24.45 C ATOM 2002 CE1 TYR A 135 4.653 4.017 8.356 1.00 64.02 C ATOM 2003 CE2 TYR A 135 6.813 3.444 7.504 1.00 5.43 C ATOM 2004 CZ TYR A 135 5.663 3.094 8.178 1.00 73.20 C ATOM 2005 OH TYR A 135 5.523 1.820 8.678 1.00 13.11 O ATOM 0 H TYR A 135 4.440 8.992 4.898 1.00 3.21 H new ATOM 0 HA TYR A 135 6.252 6.799 4.492 1.00 73.05 H new ATOM 0 HB2 TYR A 135 7.159 7.338 6.621 1.00 73.52 H new ATOM 0 HB3 TYR A 135 5.594 7.771 7.281 1.00 73.52 H new ATOM 0 HD1 TYR A 135 4.004 6.014 7.990 1.00 62.43 H new ATOM 0 HD2 TYR A 135 7.854 4.995 6.477 1.00 24.45 H new ATOM 0 HE1 TYR A 135 3.754 3.742 8.887 1.00 64.02 H new ATOM 0 HE2 TYR A 135 7.603 2.720 7.367 1.00 5.43 H new ATOM 0 HH TYR A 135 4.656 1.738 9.127 1.00 13.11 H new ATOM 2014 N VAL A 136 4.226 5.392 4.352 1.00 53.42 N ATOM 2015 CA VAL A 136 3.019 4.599 4.153 1.00 75.52 C ATOM 2016 C VAL A 136 3.178 3.201 4.739 1.00 3.33 C ATOM 2017 O VAL A 136 4.282 2.656 4.783 1.00 43.45 O ATOM 2018 CB VAL A 136 2.665 4.481 2.660 1.00 41.02 C ATOM 2019 CG1 VAL A 136 2.745 5.841 1.983 1.00 24.12 C ATOM 2020 CG2 VAL A 136 3.580 3.479 1.973 1.00 1.41 C ATOM 0 H VAL A 136 5.057 5.017 3.895 1.00 53.42 H new ATOM 0 HA VAL A 136 2.211 5.117 4.670 1.00 75.52 H new ATOM 0 HB VAL A 136 1.640 4.120 2.575 1.00 41.02 H new ATOM 0 HG11 VAL A 136 2.491 5.738 0.928 1.00 24.12 H new ATOM 0 HG12 VAL A 136 2.044 6.526 2.459 1.00 24.12 H new ATOM 0 HG13 VAL A 136 3.757 6.235 2.076 1.00 24.12 H new ATOM 0 HG21 VAL A 136 3.315 3.408 0.918 1.00 1.41 H new ATOM 0 HG22 VAL A 136 4.615 3.808 2.066 1.00 1.41 H new ATOM 0 HG23 VAL A 136 3.466 2.502 2.442 1.00 1.41 H new ATOM 2030 N ARG A 137 2.069 2.623 5.188 1.00 44.14 N ATOM 2031 CA ARG A 137 2.085 1.287 5.771 1.00 64.31 C ATOM 2032 C ARG A 137 1.079 0.377 5.072 1.00 24.43 C ATOM 2033 O ARG A 137 -0.035 0.793 4.754 1.00 43.51 O ATOM 2034 CB ARG A 137 1.771 1.357 7.268 1.00 45.42 C ATOM 2035 CG ARG A 137 2.389 0.225 8.073 1.00 53.53 C ATOM 2036 CD ARG A 137 2.102 0.378 9.557 1.00 33.23 C ATOM 2037 NE ARG A 137 2.244 -0.887 10.275 1.00 53.12 N ATOM 2038 CZ ARG A 137 1.976 -1.032 11.568 1.00 30.32 C ATOM 2039 NH1 ARG A 137 1.554 0.003 12.282 1.00 24.20 N ATOM 2040 NH2 ARG A 137 2.130 -2.215 12.150 1.00 11.32 N ATOM 0 H ARG A 137 1.147 3.059 5.159 1.00 44.14 H new ATOM 0 HA ARG A 137 3.083 0.870 5.635 1.00 64.31 H new ATOM 0 HB2 ARG A 137 2.128 2.309 7.662 1.00 45.42 H new ATOM 0 HB3 ARG A 137 0.690 1.341 7.405 1.00 45.42 H new ATOM 0 HG2 ARG A 137 1.997 -0.729 7.722 1.00 53.53 H new ATOM 0 HG3 ARG A 137 3.466 0.206 7.909 1.00 53.53 H new ATOM 0 HD2 ARG A 137 2.782 1.115 9.984 1.00 33.23 H new ATOM 0 HD3 ARG A 137 1.091 0.761 9.693 1.00 33.23 H new ATOM 0 HE ARG A 137 2.566 -1.703 9.755 1.00 53.12 H new ATOM 0 HH11 ARG A 137 1.434 0.914 11.838 1.00 24.20 H new ATOM 0 HH12 ARG A 137 1.349 -0.112 13.275 1.00 24.20 H new ATOM 0 HH21 ARG A 137 2.454 -3.013 11.604 1.00 11.32 H new ATOM 0 HH22 ARG A 137 1.924 -2.326 13.143 1.00 11.32 H new ATOM 2051 N VAL A 138 1.480 -0.869 4.837 1.00 21.22 N ATOM 2052 CA VAL A 138 0.615 -1.839 4.177 1.00 5.12 C ATOM 2053 C VAL A 138 0.575 -3.154 4.948 1.00 44.35 C ATOM 2054 O VAL A 138 1.608 -3.659 5.389 1.00 3.21 O ATOM 2055 CB VAL A 138 1.081 -2.116 2.735 1.00 63.35 C ATOM 2056 CG1 VAL A 138 0.078 -3.003 2.011 1.00 54.31 C ATOM 2057 CG2 VAL A 138 1.290 -0.810 1.983 1.00 50.44 C ATOM 0 H VAL A 138 2.399 -1.230 5.094 1.00 21.22 H new ATOM 0 HA VAL A 138 -0.385 -1.406 4.151 1.00 5.12 H new ATOM 0 HB VAL A 138 2.034 -2.643 2.774 1.00 63.35 H new ATOM 0 HG11 VAL A 138 0.424 -3.188 0.994 1.00 54.31 H new ATOM 0 HG12 VAL A 138 -0.017 -3.951 2.540 1.00 54.31 H new ATOM 0 HG13 VAL A 138 -0.891 -2.506 1.980 1.00 54.31 H new ATOM 0 HG21 VAL A 138 1.619 -1.024 0.966 1.00 50.44 H new ATOM 0 HG22 VAL A 138 0.353 -0.254 1.952 1.00 50.44 H new ATOM 0 HG23 VAL A 138 2.048 -0.215 2.492 1.00 50.44 H new ATOM 2067 N LEU A 139 -0.624 -3.704 5.106 1.00 23.02 N ATOM 2068 CA LEU A 139 -0.799 -4.963 5.823 1.00 54.54 C ATOM 2069 C LEU A 139 -1.741 -5.893 5.067 1.00 70.34 C ATOM 2070 O LEU A 139 -2.965 -5.780 5.151 1.00 22.41 O ATOM 2071 CB LEU A 139 -1.344 -4.699 7.228 1.00 14.15 C ATOM 2072 CG LEU A 139 -1.324 -5.888 8.189 1.00 2.00 C ATOM 2073 CD1 LEU A 139 -0.731 -5.483 9.529 1.00 14.33 C ATOM 2074 CD2 LEU A 139 -2.728 -6.447 8.373 1.00 2.34 C ATOM 0 H LEU A 139 -1.489 -3.299 4.748 1.00 23.02 H new ATOM 0 HA LEU A 139 0.174 -5.447 5.902 1.00 54.54 H new ATOM 0 HB2 LEU A 139 -0.768 -3.888 7.673 1.00 14.15 H new ATOM 0 HB3 LEU A 139 -2.372 -4.348 7.137 1.00 14.15 H new ATOM 0 HG LEU A 139 -0.696 -6.668 7.758 1.00 2.00 H new ATOM 0 HD11 LEU A 139 -0.725 -6.343 10.199 1.00 14.33 H new ATOM 0 HD12 LEU A 139 0.290 -5.130 9.383 1.00 14.33 H new ATOM 0 HD13 LEU A 139 -1.332 -4.686 9.967 1.00 14.33 H new ATOM 0 HD21 LEU A 139 -2.696 -7.293 9.060 1.00 2.34 H new ATOM 0 HD22 LEU A 139 -3.377 -5.673 8.781 1.00 2.34 H new ATOM 0 HD23 LEU A 139 -3.118 -6.777 7.410 1.00 2.34 H new ATOM 2085 N PRO A 140 -1.162 -6.837 4.311 1.00 15.24 N ATOM 2086 CA PRO A 140 -1.931 -7.808 3.528 1.00 22.00 C ATOM 2087 C PRO A 140 -2.656 -8.820 4.409 1.00 10.23 C ATOM 2088 O PRO A 140 -2.134 -9.247 5.439 1.00 35.25 O ATOM 2089 CB PRO A 140 -0.864 -8.504 2.679 1.00 62.54 C ATOM 2090 CG PRO A 140 0.397 -8.353 3.458 1.00 1.53 C ATOM 2091 CD PRO A 140 0.291 -7.029 4.165 1.00 44.41 C ATOM 0 HA PRO A 140 -2.716 -7.329 2.942 1.00 22.00 H new ATOM 0 HB2 PRO A 140 -1.108 -9.554 2.520 1.00 62.54 H new ATOM 0 HB3 PRO A 140 -0.779 -8.044 1.695 1.00 62.54 H new ATOM 0 HG2 PRO A 140 0.515 -9.168 4.172 1.00 1.53 H new ATOM 0 HG3 PRO A 140 1.267 -8.376 2.801 1.00 1.53 H new ATOM 0 HD2 PRO A 140 0.793 -7.048 5.132 1.00 44.41 H new ATOM 0 HD3 PRO A 140 0.746 -6.226 3.585 1.00 44.41 H new ATOM 2096 N VAL A 141 -3.861 -9.201 3.998 1.00 13.24 N ATOM 2097 CA VAL A 141 -4.656 -10.164 4.749 1.00 42.14 C ATOM 2098 C VAL A 141 -4.975 -11.391 3.903 1.00 64.43 C ATOM 2099 O VAL A 141 -4.770 -12.526 4.335 1.00 25.01 O ATOM 2100 CB VAL A 141 -5.973 -9.539 5.245 1.00 40.12 C ATOM 2101 CG1 VAL A 141 -6.746 -10.531 6.101 1.00 60.24 C ATOM 2102 CG2 VAL A 141 -5.697 -8.258 6.017 1.00 34.02 C ATOM 0 H VAL A 141 -4.308 -8.857 3.148 1.00 13.24 H new ATOM 0 HA VAL A 141 -4.059 -10.465 5.610 1.00 42.14 H new ATOM 0 HB VAL A 141 -6.585 -9.289 4.378 1.00 40.12 H new ATOM 0 HG11 VAL A 141 -7.674 -10.072 6.442 1.00 60.24 H new ATOM 0 HG12 VAL A 141 -6.976 -11.418 5.511 1.00 60.24 H new ATOM 0 HG13 VAL A 141 -6.143 -10.815 6.963 1.00 60.24 H new ATOM 0 HG21 VAL A 141 -6.639 -7.830 6.360 1.00 34.02 H new ATOM 0 HG22 VAL A 141 -5.065 -8.480 6.877 1.00 34.02 H new ATOM 0 HG23 VAL A 141 -5.189 -7.544 5.368 1.00 34.02 H new ATOM 2112 N SER A 142 -5.479 -11.156 2.696 1.00 45.31 N ATOM 2113 CA SER A 142 -5.831 -12.244 1.789 1.00 33.12 C ATOM 2114 C SER A 142 -4.916 -12.250 0.569 1.00 31.44 C ATOM 2115 O SER A 142 -4.971 -11.348 -0.267 1.00 4.34 O ATOM 2116 CB SER A 142 -7.290 -12.114 1.347 1.00 4.53 C ATOM 2117 OG SER A 142 -8.089 -11.559 2.376 1.00 12.10 O ATOM 0 H SER A 142 -5.653 -10.223 2.323 1.00 45.31 H new ATOM 0 HA SER A 142 -5.703 -13.186 2.322 1.00 33.12 H new ATOM 0 HB2 SER A 142 -7.349 -11.486 0.458 1.00 4.53 H new ATOM 0 HB3 SER A 142 -7.678 -13.094 1.071 1.00 4.53 H new ATOM 0 HG SER A 142 -9.016 -11.485 2.067 1.00 12.10 H new ATOM 2122 N TRP A 143 -4.075 -13.275 0.475 1.00 50.32 N ATOM 2123 CA TRP A 143 -3.146 -13.400 -0.643 1.00 43.02 C ATOM 2124 C TRP A 143 -3.454 -14.643 -1.470 1.00 63.42 C ATOM 2125 O TRP A 143 -4.292 -15.462 -1.089 1.00 31.31 O ATOM 2126 CB TRP A 143 -1.706 -13.457 -0.132 1.00 13.50 C ATOM 2127 CG TRP A 143 -1.471 -14.550 0.865 1.00 3.33 C ATOM 2128 CD1 TRP A 143 -1.051 -15.822 0.602 1.00 5.24 C ATOM 2129 CD2 TRP A 143 -1.646 -14.469 2.284 1.00 43.25 C ATOM 2130 NE1 TRP A 143 -0.953 -16.537 1.771 1.00 44.01 N ATOM 2131 CE2 TRP A 143 -1.312 -15.730 2.817 1.00 54.34 C ATOM 2132 CE3 TRP A 143 -2.050 -13.454 3.155 1.00 63.42 C ATOM 2133 CZ2 TRP A 143 -1.372 -15.999 4.181 1.00 73.34 C ATOM 2134 CZ3 TRP A 143 -2.110 -13.724 4.508 1.00 35.03 C ATOM 2135 CH2 TRP A 143 -1.771 -14.986 5.012 1.00 65.41 C ATOM 0 H TRP A 143 -4.017 -14.030 1.158 1.00 50.32 H new ATOM 0 HA TRP A 143 -3.264 -12.524 -1.280 1.00 43.02 H new ATOM 0 HB2 TRP A 143 -1.033 -13.597 -0.978 1.00 13.50 H new ATOM 0 HB3 TRP A 143 -1.452 -12.500 0.323 1.00 13.50 H new ATOM 0 HD1 TRP A 143 -0.828 -16.210 -0.381 1.00 5.24 H new ATOM 0 HE1 TRP A 143 -0.660 -17.511 1.847 1.00 44.01 H new ATOM 0 HE3 TRP A 143 -2.311 -12.476 2.777 1.00 63.42 H new ATOM 0 HZ2 TRP A 143 -1.113 -16.972 4.571 1.00 73.34 H new ATOM 0 HZ3 TRP A 143 -2.424 -12.948 5.190 1.00 35.03 H new ATOM 0 HH2 TRP A 143 -1.825 -15.164 6.076 1.00 65.41 H new ATOM 2145 N HIS A 144 -2.773 -14.780 -2.603 1.00 51.43 N ATOM 2146 CA HIS A 144 -2.974 -15.926 -3.483 1.00 40.12 C ATOM 2147 C HIS A 144 -1.645 -16.596 -3.815 1.00 61.11 C ATOM 2148 O HIS A 144 -0.732 -15.959 -4.340 1.00 25.51 O ATOM 2149 CB HIS A 144 -3.675 -15.489 -4.771 1.00 23.32 C ATOM 2150 CG HIS A 144 -4.942 -16.238 -5.046 1.00 51.14 C ATOM 2151 ND1 HIS A 144 -6.181 -15.801 -4.625 1.00 23.00 N ATOM 2152 CD2 HIS A 144 -5.159 -17.400 -5.705 1.00 60.31 C ATOM 2153 CE1 HIS A 144 -7.105 -16.662 -5.012 1.00 1.42 C ATOM 2154 NE2 HIS A 144 -6.511 -17.642 -5.670 1.00 11.44 N ATOM 0 H HIS A 144 -2.077 -14.112 -2.934 1.00 51.43 H new ATOM 0 HA HIS A 144 -3.603 -16.647 -2.962 1.00 40.12 H new ATOM 0 HB2 HIS A 144 -3.898 -14.424 -4.710 1.00 23.32 H new ATOM 0 HB3 HIS A 144 -2.993 -15.624 -5.610 1.00 23.32 H new ATOM 0 HD2 HIS A 144 -4.409 -18.021 -6.172 1.00 60.31 H new ATOM 0 HE1 HIS A 144 -8.165 -16.579 -4.823 1.00 1.42 H new ATOM 0 HE2 HIS A 144 -6.980 -18.447 -6.085 1.00 11.44 H new ATOM 2161 N ASN A 145 -1.543 -17.884 -3.505 1.00 63.40 N ATOM 2162 CA ASN A 145 -0.325 -18.640 -3.769 1.00 34.04 C ATOM 2163 C ASN A 145 0.774 -18.265 -2.778 1.00 1.12 C ATOM 2164 O ASN A 145 1.234 -19.102 -2.001 1.00 40.01 O ATOM 2165 CB ASN A 145 0.156 -18.389 -5.199 1.00 42.50 C ATOM 2166 CG ASN A 145 -0.992 -18.284 -6.185 1.00 14.43 C ATOM 2167 OD1 ASN A 145 -1.298 -17.202 -6.687 1.00 14.44 O ATOM 2168 ND2 ASN A 145 -1.633 -19.412 -6.467 1.00 44.33 N ATOM 0 H ASN A 145 -2.290 -18.426 -3.070 1.00 63.40 H new ATOM 0 HA ASN A 145 -0.552 -19.699 -3.650 1.00 34.04 H new ATOM 0 HB2 ASN A 145 0.740 -17.469 -5.227 1.00 42.50 H new ATOM 0 HB3 ASN A 145 0.820 -19.198 -5.503 1.00 42.50 H new ATOM 0 HD21 ASN A 145 -2.414 -19.405 -7.124 1.00 44.33 H new ATOM 0 HD22 ASN A 145 -1.345 -20.286 -6.027 1.00 44.33 H new ATOM 2174 N ARG A 146 1.188 -17.003 -2.813 1.00 24.34 N ATOM 2175 CA ARG A 146 2.232 -16.517 -1.919 1.00 30.35 C ATOM 2176 C ARG A 146 2.256 -14.992 -1.888 1.00 33.31 C ATOM 2177 O ARG A 146 1.962 -14.337 -2.888 1.00 35.43 O ATOM 2178 CB ARG A 146 3.597 -17.051 -2.358 1.00 34.14 C ATOM 2179 CG ARG A 146 4.328 -17.824 -1.272 1.00 70.41 C ATOM 2180 CD ARG A 146 5.409 -16.980 -0.617 1.00 24.22 C ATOM 2181 NE ARG A 146 6.729 -17.594 -0.736 1.00 71.21 N ATOM 2182 CZ ARG A 146 7.477 -17.521 -1.832 1.00 73.03 C ATOM 2183 NH1 ARG A 146 7.038 -16.864 -2.896 1.00 73.02 N ATOM 2184 NH2 ARG A 146 8.668 -18.105 -1.863 1.00 13.12 N ATOM 0 H ARG A 146 0.817 -16.299 -3.451 1.00 24.34 H new ATOM 0 HA ARG A 146 2.013 -16.879 -0.915 1.00 30.35 H new ATOM 0 HB2 ARG A 146 3.463 -17.698 -3.225 1.00 34.14 H new ATOM 0 HB3 ARG A 146 4.219 -16.215 -2.678 1.00 34.14 H new ATOM 0 HG2 ARG A 146 3.615 -18.154 -0.516 1.00 70.41 H new ATOM 0 HG3 ARG A 146 4.775 -18.721 -1.701 1.00 70.41 H new ATOM 0 HD2 ARG A 146 5.426 -15.992 -1.077 1.00 24.22 H new ATOM 0 HD3 ARG A 146 5.169 -16.837 0.437 1.00 24.22 H new ATOM 0 HE ARG A 146 7.097 -18.107 0.066 1.00 71.21 H new ATOM 0 HH11 ARG A 146 6.124 -16.413 -2.875 1.00 73.02 H new ATOM 0 HH12 ARG A 146 7.615 -16.810 -3.736 1.00 73.02 H new ATOM 0 HH21 ARG A 146 9.010 -18.610 -1.045 1.00 13.12 H new ATOM 0 HH22 ARG A 146 9.242 -18.049 -2.704 1.00 13.12 H new ATOM 2195 N ILE A 147 2.606 -14.434 -0.734 1.00 63.50 N ATOM 2196 CA ILE A 147 2.668 -12.987 -0.573 1.00 40.14 C ATOM 2197 C ILE A 147 3.845 -12.398 -1.345 1.00 70.33 C ATOM 2198 O ILE A 147 4.883 -12.076 -0.766 1.00 20.21 O ATOM 2199 CB ILE A 147 2.791 -12.590 0.909 1.00 35.30 C ATOM 2200 CG1 ILE A 147 1.592 -13.116 1.703 1.00 5.42 C ATOM 2201 CG2 ILE A 147 2.900 -11.078 1.046 1.00 33.31 C ATOM 2202 CD1 ILE A 147 1.815 -14.493 2.290 1.00 54.01 C ATOM 0 H ILE A 147 2.851 -14.962 0.103 1.00 63.50 H new ATOM 0 HA ILE A 147 1.737 -12.585 -0.972 1.00 40.14 H new ATOM 0 HB ILE A 147 3.698 -13.039 1.315 1.00 35.30 H new ATOM 0 HG12 ILE A 147 1.366 -12.418 2.509 1.00 5.42 H new ATOM 0 HG13 ILE A 147 0.719 -13.144 1.051 1.00 5.42 H new ATOM 0 HG21 ILE A 147 2.986 -10.813 2.100 1.00 33.31 H new ATOM 0 HG22 ILE A 147 3.782 -10.727 0.510 1.00 33.31 H new ATOM 0 HG23 ILE A 147 2.010 -10.610 0.626 1.00 33.31 H new ATOM 0 HD11 ILE A 147 0.926 -14.803 2.839 1.00 54.01 H new ATOM 0 HD12 ILE A 147 2.012 -15.203 1.487 1.00 54.01 H new ATOM 0 HD13 ILE A 147 2.668 -14.466 2.967 1.00 54.01 H new ATOM 2213 N THR A 148 3.674 -12.258 -2.655 1.00 11.41 N ATOM 2214 CA THR A 148 4.721 -11.707 -3.507 1.00 0.01 C ATOM 2215 C THR A 148 4.171 -10.618 -4.419 1.00 54.24 C ATOM 2216 O THR A 148 3.600 -10.904 -5.473 1.00 1.32 O ATOM 2217 CB THR A 148 5.376 -12.801 -4.371 1.00 32.13 C ATOM 2218 OG1 THR A 148 5.153 -14.089 -3.784 1.00 53.12 O ATOM 2219 CG2 THR A 148 6.870 -12.556 -4.514 1.00 0.13 C ATOM 0 H THR A 148 2.821 -12.518 -3.150 1.00 11.41 H new ATOM 0 HA THR A 148 5.473 -11.278 -2.845 1.00 0.01 H new ATOM 0 HB THR A 148 4.922 -12.770 -5.362 1.00 32.13 H new ATOM 0 HG1 THR A 148 5.308 -14.786 -4.455 1.00 53.12 H new ATOM 0 HG21 THR A 148 7.310 -13.341 -5.128 1.00 0.13 H new ATOM 0 HG22 THR A 148 7.036 -11.589 -4.988 1.00 0.13 H new ATOM 0 HG23 THR A 148 7.336 -12.562 -3.528 1.00 0.13 H new ATOM 2227 N LEU A 149 4.345 -9.365 -4.010 1.00 64.04 N ATOM 2228 CA LEU A 149 3.866 -8.231 -4.791 1.00 2.11 C ATOM 2229 C LEU A 149 4.783 -7.024 -4.618 1.00 43.24 C ATOM 2230 O LEU A 149 5.793 -7.095 -3.918 1.00 74.51 O ATOM 2231 CB LEU A 149 2.439 -7.866 -4.376 1.00 13.41 C ATOM 2232 CG LEU A 149 1.497 -7.451 -5.506 1.00 33.21 C ATOM 2233 CD1 LEU A 149 0.781 -8.664 -6.076 1.00 64.24 C ATOM 2234 CD2 LEU A 149 0.493 -6.420 -5.011 1.00 55.45 C ATOM 0 H LEU A 149 4.815 -9.110 -3.141 1.00 64.04 H new ATOM 0 HA LEU A 149 3.869 -8.519 -5.842 1.00 2.11 H new ATOM 0 HB2 LEU A 149 2.002 -8.721 -3.861 1.00 13.41 H new ATOM 0 HB3 LEU A 149 2.489 -7.051 -3.654 1.00 13.41 H new ATOM 0 HG LEU A 149 2.090 -6.999 -6.301 1.00 33.21 H new ATOM 0 HD11 LEU A 149 0.115 -8.349 -6.879 1.00 64.24 H new ATOM 0 HD12 LEU A 149 1.515 -9.368 -6.468 1.00 64.24 H new ATOM 0 HD13 LEU A 149 0.199 -9.146 -5.290 1.00 64.24 H new ATOM 0 HD21 LEU A 149 -0.170 -6.136 -5.828 1.00 55.45 H new ATOM 0 HD22 LEU A 149 -0.095 -6.846 -4.198 1.00 55.45 H new ATOM 0 HD23 LEU A 149 1.024 -5.539 -4.651 1.00 55.45 H new ATOM 2245 N ARG A 150 4.423 -5.917 -5.259 1.00 13.41 N ATOM 2246 CA ARG A 150 5.213 -4.695 -5.175 1.00 73.11 C ATOM 2247 C ARG A 150 4.315 -3.462 -5.234 1.00 40.25 C ATOM 2248 O ARG A 150 3.499 -3.318 -6.146 1.00 4.12 O ATOM 2249 CB ARG A 150 6.239 -4.647 -6.308 1.00 54.31 C ATOM 2250 CG ARG A 150 5.624 -4.415 -7.678 1.00 13.10 C ATOM 2251 CD ARG A 150 5.750 -2.961 -8.107 1.00 23.42 C ATOM 2252 NE ARG A 150 6.116 -2.835 -9.515 1.00 3.15 N ATOM 2253 CZ ARG A 150 6.130 -1.680 -10.171 1.00 21.54 C ATOM 2254 NH1 ARG A 150 5.799 -0.558 -9.549 1.00 35.34 N ATOM 2255 NH2 ARG A 150 6.475 -1.648 -11.452 1.00 53.00 N ATOM 0 H ARG A 150 3.589 -5.841 -5.842 1.00 13.41 H new ATOM 0 HA ARG A 150 5.737 -4.696 -4.219 1.00 73.11 H new ATOM 0 HB2 ARG A 150 6.957 -3.853 -6.103 1.00 54.31 H new ATOM 0 HB3 ARG A 150 6.795 -5.584 -6.323 1.00 54.31 H new ATOM 0 HG2 ARG A 150 6.114 -5.055 -8.411 1.00 13.10 H new ATOM 0 HG3 ARG A 150 4.572 -4.700 -7.659 1.00 13.10 H new ATOM 0 HD2 ARG A 150 4.804 -2.448 -7.931 1.00 23.42 H new ATOM 0 HD3 ARG A 150 6.501 -2.465 -7.492 1.00 23.42 H new ATOM 0 HE ARG A 150 6.375 -3.681 -10.023 1.00 3.15 H new ATOM 0 HH11 ARG A 150 5.533 -0.580 -8.565 1.00 35.34 H new ATOM 0 HH12 ARG A 150 5.810 0.328 -10.055 1.00 35.34 H new ATOM 0 HH21 ARG A 150 6.730 -2.511 -11.933 1.00 53.00 H new ATOM 0 HH22 ARG A 150 6.486 -0.761 -11.955 1.00 53.00 H new ATOM 2266 N LEU A 151 4.470 -2.576 -4.257 1.00 61.12 N ATOM 2267 CA LEU A 151 3.673 -1.354 -4.198 1.00 23.42 C ATOM 2268 C LEU A 151 4.540 -0.127 -4.451 1.00 54.34 C ATOM 2269 O LEU A 151 5.555 0.077 -3.785 1.00 61.12 O ATOM 2270 CB LEU A 151 2.986 -1.237 -2.836 1.00 53.34 C ATOM 2271 CG LEU A 151 3.904 -1.290 -1.614 1.00 42.42 C ATOM 2272 CD1 LEU A 151 4.278 0.115 -1.167 1.00 5.13 C ATOM 2273 CD2 LEU A 151 3.238 -2.053 -0.479 1.00 43.34 C ATOM 0 H LEU A 151 5.140 -2.680 -3.495 1.00 61.12 H new ATOM 0 HA LEU A 151 2.913 -1.405 -4.978 1.00 23.42 H new ATOM 0 HB2 LEU A 151 2.433 -0.298 -2.810 1.00 53.34 H new ATOM 0 HB3 LEU A 151 2.254 -2.040 -2.751 1.00 53.34 H new ATOM 0 HG LEU A 151 4.817 -1.816 -1.892 1.00 42.42 H new ATOM 0 HD11 LEU A 151 4.931 0.058 -0.296 1.00 5.13 H new ATOM 0 HD12 LEU A 151 4.796 0.629 -1.977 1.00 5.13 H new ATOM 0 HD13 LEU A 151 3.375 0.667 -0.907 1.00 5.13 H new ATOM 0 HD21 LEU A 151 3.906 -2.081 0.382 1.00 43.34 H new ATOM 0 HD22 LEU A 151 2.309 -1.555 -0.202 1.00 43.34 H new ATOM 0 HD23 LEU A 151 3.021 -3.071 -0.803 1.00 43.34 H new ATOM 2284 N GLU A 152 4.132 0.691 -5.417 1.00 10.12 N ATOM 2285 CA GLU A 152 4.872 1.901 -5.757 1.00 35.01 C ATOM 2286 C GLU A 152 3.934 3.101 -5.861 1.00 12.45 C ATOM 2287 O GLU A 152 2.800 2.978 -6.324 1.00 63.54 O ATOM 2288 CB GLU A 152 5.625 1.712 -7.076 1.00 62.33 C ATOM 2289 CG GLU A 152 6.988 1.062 -6.911 1.00 73.31 C ATOM 2290 CD GLU A 152 8.085 2.072 -6.634 1.00 4.43 C ATOM 2291 OE1 GLU A 152 8.219 2.500 -5.469 1.00 3.34 O ATOM 2292 OE2 GLU A 152 8.811 2.432 -7.586 1.00 35.42 O ATOM 0 H GLU A 152 3.294 0.538 -5.977 1.00 10.12 H new ATOM 0 HA GLU A 152 5.592 2.092 -4.961 1.00 35.01 H new ATOM 0 HB2 GLU A 152 5.020 1.102 -7.746 1.00 62.33 H new ATOM 0 HB3 GLU A 152 5.750 2.683 -7.555 1.00 62.33 H new ATOM 0 HG2 GLU A 152 6.947 0.342 -6.093 1.00 73.31 H new ATOM 0 HG3 GLU A 152 7.232 0.504 -7.815 1.00 73.31 H new ATOM 2297 N LEU A 153 4.416 4.260 -5.427 1.00 72.21 N ATOM 2298 CA LEU A 153 3.622 5.483 -5.470 1.00 52.30 C ATOM 2299 C LEU A 153 4.201 6.474 -6.475 1.00 23.14 C ATOM 2300 O LEU A 153 5.419 6.644 -6.564 1.00 74.35 O ATOM 2301 CB LEU A 153 3.562 6.125 -4.082 1.00 64.34 C ATOM 2302 CG LEU A 153 4.902 6.534 -3.474 1.00 34.42 C ATOM 2303 CD1 LEU A 153 5.230 7.977 -3.828 1.00 31.53 C ATOM 2304 CD2 LEU A 153 4.882 6.345 -1.964 1.00 2.14 C ATOM 0 H LEU A 153 5.353 4.379 -5.041 1.00 72.21 H new ATOM 0 HA LEU A 153 2.613 5.220 -5.787 1.00 52.30 H new ATOM 0 HB2 LEU A 153 2.927 7.009 -4.140 1.00 64.34 H new ATOM 0 HB3 LEU A 153 3.075 5.427 -3.401 1.00 64.34 H new ATOM 0 HG LEU A 153 5.679 5.893 -3.890 1.00 34.42 H new ATOM 0 HD11 LEU A 153 6.188 8.251 -3.386 1.00 31.53 H new ATOM 0 HD12 LEU A 153 5.286 8.082 -4.911 1.00 31.53 H new ATOM 0 HD13 LEU A 153 4.451 8.633 -3.440 1.00 31.53 H new ATOM 0 HD21 LEU A 153 5.845 6.641 -1.547 1.00 2.14 H new ATOM 0 HD22 LEU A 153 4.094 6.961 -1.531 1.00 2.14 H new ATOM 0 HD23 LEU A 153 4.693 5.297 -1.731 1.00 2.14 H new ATOM 2315 N LEU A 154 3.323 7.124 -7.230 1.00 42.21 N ATOM 2316 CA LEU A 154 3.747 8.100 -8.228 1.00 11.14 C ATOM 2317 C LEU A 154 3.396 9.517 -7.788 1.00 21.32 C ATOM 2318 O LEU A 154 2.399 9.736 -7.101 1.00 64.14 O ATOM 2319 CB LEU A 154 3.092 7.796 -9.577 1.00 1.34 C ATOM 2320 CG LEU A 154 2.932 6.316 -9.927 1.00 51.21 C ATOM 2321 CD1 LEU A 154 2.006 6.148 -11.121 1.00 45.02 C ATOM 2322 CD2 LEU A 154 4.288 5.685 -10.207 1.00 44.52 C ATOM 0 H LEU A 154 2.313 6.993 -7.170 1.00 42.21 H new ATOM 0 HA LEU A 154 4.830 8.030 -8.332 1.00 11.14 H new ATOM 0 HB2 LEU A 154 2.106 8.261 -9.593 1.00 1.34 H new ATOM 0 HB3 LEU A 154 3.682 8.272 -10.360 1.00 1.34 H new ATOM 0 HG LEU A 154 2.486 5.806 -9.073 1.00 51.21 H new ATOM 0 HD11 LEU A 154 1.904 5.089 -11.356 1.00 45.02 H new ATOM 0 HD12 LEU A 154 1.027 6.563 -10.883 1.00 45.02 H new ATOM 0 HD13 LEU A 154 2.423 6.672 -11.981 1.00 45.02 H new ATOM 0 HD21 LEU A 154 4.155 4.632 -10.454 1.00 44.52 H new ATOM 0 HD22 LEU A 154 4.762 6.197 -11.044 1.00 44.52 H new ATOM 0 HD23 LEU A 154 4.920 5.773 -9.323 1.00 44.52 H new ATOM 2333 N GLY A 155 4.222 10.478 -8.190 1.00 14.13 N ATOM 2334 CA GLY A 155 3.980 11.863 -7.829 1.00 13.13 C ATOM 2335 C GLY A 155 4.064 12.796 -9.021 1.00 70.44 C ATOM 2336 O GLY A 155 4.358 12.366 -10.136 1.00 4.14 O ATOM 0 H GLY A 155 5.054 10.322 -8.759 1.00 14.13 H new ATOM 0 HA2 GLY A 155 2.994 11.949 -7.373 1.00 13.13 H new ATOM 0 HA3 GLY A 155 4.707 12.172 -7.078 1.00 13.13 H new ATOM 2340 N CYS A 156 3.802 14.078 -8.786 1.00 25.34 N ATOM 2341 CA CYS A 156 3.847 15.074 -9.850 1.00 74.33 C ATOM 2342 C CYS A 156 5.107 15.928 -9.741 1.00 71.12 C ATOM 2343 O CYS A 156 5.510 16.584 -10.703 1.00 34.22 O ATOM 2344 CB CYS A 156 2.605 15.967 -9.792 1.00 13.43 C ATOM 2345 SG CYS A 156 1.993 16.493 -11.424 1.00 40.31 S ATOM 0 H CYS A 156 3.557 14.451 -7.869 1.00 25.34 H new ATOM 0 HA CYS A 156 3.866 14.550 -10.806 1.00 74.33 H new ATOM 0 HB2 CYS A 156 1.810 15.432 -9.272 1.00 13.43 H new ATOM 0 HB3 CYS A 156 2.834 16.852 -9.199 1.00 13.43 H new ATOM 2349 N LEU A 157 5.725 15.915 -8.565 1.00 53.55 N ATOM 2350 CA LEU A 157 6.940 16.689 -8.331 1.00 61.33 C ATOM 2351 C LEU A 157 6.668 18.184 -8.463 1.00 62.14 C ATOM 2352 O LEU A 157 7.583 18.972 -8.699 1.00 34.53 O ATOM 2353 CB LEU A 157 8.033 16.269 -9.315 1.00 20.41 C ATOM 2354 CG LEU A 157 9.278 15.627 -8.700 1.00 43.12 C ATOM 2355 CD1 LEU A 157 9.851 16.514 -7.606 1.00 51.04 C ATOM 2356 CD2 LEU A 157 8.951 14.245 -8.153 1.00 43.31 C ATOM 0 H LEU A 157 5.405 15.378 -7.759 1.00 53.55 H new ATOM 0 HA LEU A 157 7.278 16.489 -7.314 1.00 61.33 H new ATOM 0 HB2 LEU A 157 7.602 15.567 -10.029 1.00 20.41 H new ATOM 0 HB3 LEU A 157 8.343 17.148 -9.880 1.00 20.41 H new ATOM 0 HG LEU A 157 10.030 15.517 -9.481 1.00 43.12 H new ATOM 0 HD11 LEU A 157 10.736 16.041 -7.180 1.00 51.04 H new ATOM 0 HD12 LEU A 157 10.124 17.481 -8.028 1.00 51.04 H new ATOM 0 HD13 LEU A 157 9.104 16.656 -6.825 1.00 51.04 H new ATOM 0 HD21 LEU A 157 9.848 13.804 -7.719 1.00 43.31 H new ATOM 0 HD22 LEU A 157 8.181 14.330 -7.386 1.00 43.31 H new ATOM 0 HD23 LEU A 157 8.589 13.610 -8.961 1.00 43.31 H new ATOM 2367 N GLU A 158 5.404 18.567 -8.307 1.00 10.23 N ATOM 2368 CA GLU A 158 5.013 19.967 -8.408 1.00 52.34 C ATOM 2369 C GLU A 158 4.152 20.379 -7.218 1.00 52.10 C ATOM 2370 O GLU A 158 4.440 21.368 -6.544 1.00 41.21 O ATOM 2371 CB GLU A 158 4.251 20.215 -9.713 1.00 31.33 C ATOM 2372 CG GLU A 158 3.974 21.683 -9.986 1.00 54.12 C ATOM 2373 CD GLU A 158 2.495 22.013 -9.958 1.00 60.34 C ATOM 2374 OE1 GLU A 158 1.722 21.330 -10.661 1.00 43.32 O ATOM 2375 OE2 GLU A 158 2.110 22.954 -9.233 1.00 61.21 O ATOM 0 H GLU A 158 4.634 17.927 -8.110 1.00 10.23 H new ATOM 0 HA GLU A 158 5.920 20.571 -8.405 1.00 52.34 H new ATOM 0 HB2 GLU A 158 4.824 19.802 -10.543 1.00 31.33 H new ATOM 0 HB3 GLU A 158 3.305 19.675 -9.679 1.00 31.33 H new ATOM 0 HG2 GLU A 158 4.492 22.291 -9.244 1.00 54.12 H new ATOM 0 HG3 GLU A 158 4.384 21.951 -10.960 1.00 54.12 H new TER 2380 GLU A 158