USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 821 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 75 LYS NZ :NH3+ 156:sc= 2.4 (180deg=0.955) USER MOD Set 1.2: A 78 ASN : amide:sc= 0.219! K(o=2.6!,f=-6.1) USER MOD Set 2.1: A 72 ASN : amide:sc= 0.748 K(o=2,f=-8.2!) USER MOD Set 2.2: A 91 LYS NZ :NH3+ 174:sc= 1.29 (180deg=0.0539) USER MOD Set 3.1: A 23 ASN : amide:sc= -0.0428 K(o=-0.044,f=-1.3!) USER MOD Set 3.2: A 66 MET CE :methyl -167:sc=-0.00138 (180deg=-0.194) USER MOD Set 4.1: A 38 HIS : no HE2:sc= -2.6! C(o=-2.9!,f=-13!) USER MOD Set 4.2: A 89 THR OG1 : rot -54:sc= -0.281 USER MOD Set 5.1: A 35 GLN : amide:sc= 1.05 K(o=2.3,f=-9.9!) USER MOD Set 5.2: A 37 LYS NZ :NH3+ 138:sc= 1.24 (180deg=-0.0298) USER MOD Set 6.1: A 24 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 28 HIS : no HD1:sc= -0.193 X(o=-0.19,f=0.021) USER MOD Set 7.1: A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc=-0.000913 USER MOD Single : A 16 LYS NZ :NH3+ 149:sc= 1.09 (180deg=0.442) USER MOD Single : A 19 GLN : amide:sc= -0.301 K(o=-0.3,f=-6.1!) USER MOD Single : A 20 ASN : amide:sc= -0.22 K(o=-0.22,f=-1.5!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= -0.0193 (180deg=-0.255) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -160:sc= 0 (180deg=-0.575) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 172:sc=-0.00209 (180deg=-0.0712) USER MOD Single : A 65 THR OG1 : rot 65:sc= 0.348 USER MOD Single : A 69 ASN :FLIP amide:sc= -0.275 F(o=-1.6!,f=-0.28) USER MOD Single : A 85 ASN : amide:sc= -0.437 X(o=-0.44,f=-0.12) USER MOD Single : A 86 MET CE :methyl -176:sc= -2.34! (180deg=-2.6!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.0928 X(o=-0.093,f=-0.0039) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -14.272 -48.920 13.368 1.00 0.00 N ATOM 2 CA LYS A 4 -14.738 -48.410 14.638 1.00 0.00 C ATOM 3 C LYS A 4 -13.710 -47.471 15.237 1.00 0.00 C ATOM 4 O LYS A 4 -12.554 -47.435 14.800 1.00 0.00 O ATOM 5 CB LYS A 4 -15.050 -49.552 15.615 1.00 0.00 C ATOM 6 CG LYS A 4 -13.835 -50.367 16.031 1.00 0.00 C ATOM 7 CD LYS A 4 -14.219 -51.470 17.003 1.00 0.00 C ATOM 8 CE LYS A 4 -13.005 -52.286 17.427 1.00 0.00 C ATOM 9 NZ LYS A 4 -13.371 -53.364 18.378 1.00 0.00 N ATOM 0 HA LYS A 4 -15.661 -47.858 14.461 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -15.516 -49.134 16.507 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -15.780 -50.218 15.156 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -13.367 -50.803 15.148 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -13.096 -49.713 16.493 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -14.691 -51.033 17.883 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -14.956 -52.126 16.539 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -12.535 -52.723 16.546 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -12.268 -51.629 17.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -12.518 -53.897 18.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -13.797 -52.946 19.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -14.055 -54.006 17.929 1.00 0.00 H new ATOM 23 N VAL A 5 -14.129 -46.715 16.224 1.00 0.00 N ATOM 24 CA VAL A 5 -13.249 -45.804 16.917 1.00 0.00 C ATOM 25 C VAL A 5 -12.872 -46.409 18.256 1.00 0.00 C ATOM 26 O VAL A 5 -13.728 -46.936 18.965 1.00 0.00 O ATOM 27 CB VAL A 5 -13.921 -44.427 17.141 1.00 0.00 C ATOM 28 CG1 VAL A 5 -12.983 -43.471 17.868 1.00 0.00 C ATOM 29 CG2 VAL A 5 -14.371 -43.833 15.815 1.00 0.00 C ATOM 0 H VAL A 5 -15.089 -46.714 16.569 1.00 0.00 H new ATOM 0 HA VAL A 5 -12.361 -45.647 16.305 1.00 0.00 H new ATOM 0 HB VAL A 5 -14.799 -44.577 17.769 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.481 -42.512 18.012 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -12.716 -43.890 18.838 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -12.080 -43.326 17.275 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.841 -42.865 15.991 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -13.508 -43.704 15.162 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -15.087 -44.504 15.340 1.00 0.00 H new ATOM 39 N ILE A 6 -11.595 -46.367 18.591 1.00 0.00 N ATOM 40 CA ILE A 6 -11.125 -46.949 19.836 1.00 0.00 C ATOM 41 C ILE A 6 -11.542 -46.079 21.017 1.00 0.00 C ATOM 42 O ILE A 6 -11.266 -44.874 21.048 1.00 0.00 O ATOM 43 CB ILE A 6 -9.580 -47.115 19.837 1.00 0.00 C ATOM 44 CG1 ILE A 6 -9.127 -47.993 18.660 1.00 0.00 C ATOM 45 CG2 ILE A 6 -9.098 -47.704 21.162 1.00 0.00 C ATOM 46 CD1 ILE A 6 -9.692 -49.403 18.682 1.00 0.00 C ATOM 0 H ILE A 6 -10.867 -45.937 18.021 1.00 0.00 H new ATOM 0 HA ILE A 6 -11.578 -47.936 19.930 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.134 -46.127 19.720 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.420 -47.511 17.728 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -8.038 -48.050 18.661 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.014 -47.811 21.139 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -9.380 -47.040 21.979 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -9.556 -48.681 21.314 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -9.324 -49.956 17.818 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.378 -49.907 19.596 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.781 -49.359 18.648 1.00 0.00 H new ATOM 58 N ASP A 7 -12.222 -46.688 21.969 1.00 0.00 N ATOM 59 CA ASP A 7 -12.675 -45.986 23.159 1.00 0.00 C ATOM 60 C ASP A 7 -11.587 -45.939 24.208 1.00 0.00 C ATOM 61 O ASP A 7 -10.887 -46.923 24.441 1.00 0.00 O ATOM 62 CB ASP A 7 -13.917 -46.652 23.761 1.00 0.00 C ATOM 63 CG ASP A 7 -15.159 -46.493 22.920 1.00 0.00 C ATOM 64 OD1 ASP A 7 -15.739 -45.385 22.912 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.582 -47.485 22.280 1.00 0.00 O ATOM 0 H ASP A 7 -12.476 -47.676 21.942 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.928 -44.971 22.852 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -13.717 -47.714 23.900 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -14.102 -46.230 24.749 1.00 0.00 H new ATOM 70 N ILE A 8 -11.442 -44.794 24.824 1.00 0.00 N ATOM 71 CA ILE A 8 -10.501 -44.613 25.895 1.00 0.00 C ATOM 72 C ILE A 8 -11.218 -43.987 27.061 1.00 0.00 C ATOM 73 O ILE A 8 -11.919 -42.993 26.899 1.00 0.00 O ATOM 74 CB ILE A 8 -9.306 -43.745 25.456 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.562 -44.452 24.327 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.369 -43.468 26.634 1.00 0.00 C ATOM 77 CD1 ILE A 8 -7.455 -43.642 23.722 1.00 0.00 C ATOM 0 H ILE A 8 -11.978 -43.957 24.594 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.097 -45.583 26.185 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.675 -42.784 25.098 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.148 -45.386 24.708 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.275 -44.715 23.545 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.534 -42.854 26.298 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.915 -42.942 27.417 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.990 -44.411 27.027 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.977 -44.215 22.928 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.863 -42.720 23.309 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.719 -43.401 24.489 1.00 0.00 H new ATOM 89 N LYS A 9 -11.069 -44.564 28.223 1.00 0.00 N ATOM 90 CA LYS A 9 -11.804 -44.095 29.370 1.00 0.00 C ATOM 91 C LYS A 9 -10.947 -43.240 30.274 1.00 0.00 C ATOM 92 O LYS A 9 -9.798 -43.570 30.560 1.00 0.00 O ATOM 93 CB LYS A 9 -12.387 -45.271 30.147 1.00 0.00 C ATOM 94 CG LYS A 9 -13.358 -46.117 29.334 1.00 0.00 C ATOM 95 CD LYS A 9 -14.575 -45.308 28.907 1.00 0.00 C ATOM 96 CE LYS A 9 -15.554 -46.147 28.096 1.00 0.00 C ATOM 97 NZ LYS A 9 -16.764 -45.373 27.718 1.00 0.00 N ATOM 0 H LYS A 9 -10.450 -45.355 28.402 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.620 -43.472 29.004 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.572 -45.904 30.497 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.900 -44.893 31.031 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -12.852 -46.509 28.452 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -13.678 -46.975 29.925 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -15.078 -44.914 29.790 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -14.253 -44.451 28.315 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -15.060 -46.512 27.195 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -15.849 -47.022 28.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -17.406 -45.979 27.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -17.249 -45.046 28.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -16.485 -44.552 27.144 1.00 0.00 H new ATOM 111 N GLU A 10 -11.512 -42.141 30.716 1.00 0.00 N ATOM 112 CA GLU A 10 -10.843 -41.255 31.623 1.00 0.00 C ATOM 113 C GLU A 10 -11.407 -41.422 33.015 1.00 0.00 C ATOM 114 O GLU A 10 -12.572 -41.091 33.274 1.00 0.00 O ATOM 115 CB GLU A 10 -10.985 -39.794 31.176 1.00 0.00 C ATOM 116 CG GLU A 10 -10.247 -39.454 29.890 1.00 0.00 C ATOM 117 CD GLU A 10 -10.413 -38.004 29.495 1.00 0.00 C ATOM 118 OE1 GLU A 10 -11.567 -37.560 29.292 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.391 -37.292 29.403 1.00 0.00 O ATOM 0 H GLU A 10 -12.451 -41.841 30.453 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.783 -41.509 31.626 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.043 -39.569 31.043 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.619 -39.146 31.972 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.187 -39.675 30.014 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.613 -40.091 29.085 1.00 0.00 H new ATOM 126 N ILE A 11 -10.597 -41.946 33.901 1.00 0.00 N ATOM 127 CA ILE A 11 -10.989 -42.110 35.269 1.00 0.00 C ATOM 128 C ILE A 11 -10.444 -40.948 36.088 1.00 0.00 C ATOM 129 O ILE A 11 -9.234 -40.797 36.260 1.00 0.00 O ATOM 130 CB ILE A 11 -10.539 -43.487 35.847 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.300 -44.617 35.138 1.00 0.00 C ATOM 132 CG2 ILE A 11 -10.771 -43.546 37.352 1.00 0.00 C ATOM 133 CD1 ILE A 11 -10.884 -46.009 35.573 1.00 0.00 C ATOM 0 H ILE A 11 -9.652 -42.268 33.691 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.078 -42.104 35.324 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.471 -43.611 35.670 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.367 -44.494 35.322 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.149 -44.523 34.063 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.450 -44.516 37.732 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.198 -42.757 37.840 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -11.831 -43.407 37.562 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.467 -46.750 35.027 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -9.824 -46.154 35.363 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.061 -46.124 36.642 1.00 0.00 H new ATOM 145 N LYS A 12 -11.352 -40.117 36.557 1.00 0.00 N ATOM 146 CA LYS A 12 -11.000 -38.908 37.269 1.00 0.00 C ATOM 147 C LYS A 12 -11.080 -39.104 38.779 1.00 0.00 C ATOM 148 O LYS A 12 -12.031 -39.703 39.288 1.00 0.00 O ATOM 149 CB LYS A 12 -11.929 -37.775 36.834 1.00 0.00 C ATOM 150 CG LYS A 12 -11.628 -36.436 37.474 1.00 0.00 C ATOM 151 CD LYS A 12 -12.603 -35.371 36.995 1.00 0.00 C ATOM 152 CE LYS A 12 -12.294 -34.028 37.618 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.235 -32.974 37.166 1.00 0.00 N ATOM 0 H LYS A 12 -12.356 -40.262 36.454 1.00 0.00 H new ATOM 0 HA LYS A 12 -9.969 -38.653 37.025 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -11.868 -37.668 35.751 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.956 -38.053 37.070 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.686 -36.526 38.559 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.608 -36.135 37.234 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -12.554 -35.291 35.909 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.621 -35.666 37.247 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -12.340 -34.113 38.704 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.275 -33.737 37.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -12.987 -32.070 37.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -13.173 -32.874 36.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -14.205 -33.238 37.431 1.00 0.00 H new ATOM 167 N LEU A 13 -10.078 -38.603 39.479 1.00 0.00 N ATOM 168 CA LEU A 13 -10.020 -38.686 40.930 1.00 0.00 C ATOM 169 C LEU A 13 -9.683 -37.322 41.520 1.00 0.00 C ATOM 170 O LEU A 13 -9.511 -36.339 40.785 1.00 0.00 O ATOM 171 CB LEU A 13 -8.979 -39.724 41.387 1.00 0.00 C ATOM 172 CG LEU A 13 -9.225 -41.170 40.940 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.568 -41.443 39.595 1.00 0.00 C ATOM 174 CD2 LEU A 13 -8.731 -42.153 41.990 1.00 0.00 C ATOM 0 H LEU A 13 -9.280 -38.126 39.058 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.999 -39.003 41.288 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.001 -39.413 41.020 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.931 -39.705 42.476 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.300 -41.307 40.825 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.757 -42.475 39.300 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -8.982 -40.770 38.844 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.493 -41.280 39.675 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.916 -43.172 41.650 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.662 -42.012 42.146 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.260 -41.981 42.927 1.00 0.00 H new ATOM 186 N SER A 14 -9.601 -37.259 42.833 1.00 0.00 N ATOM 187 CA SER A 14 -9.246 -36.040 43.519 1.00 0.00 C ATOM 188 C SER A 14 -8.296 -36.361 44.669 1.00 0.00 C ATOM 189 O SER A 14 -8.271 -37.483 45.162 1.00 0.00 O ATOM 190 CB SER A 14 -10.508 -35.323 44.030 1.00 0.00 C ATOM 191 OG SER A 14 -11.322 -36.198 44.798 1.00 0.00 O ATOM 0 H SER A 14 -9.779 -38.051 43.451 1.00 0.00 H new ATOM 0 HA SER A 14 -8.741 -35.369 42.824 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.221 -34.464 44.636 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.079 -34.940 43.184 1.00 0.00 H new ATOM 0 HG SER A 14 -12.116 -35.716 45.111 1.00 0.00 H new ATOM 197 N VAL A 15 -7.517 -35.383 45.085 1.00 0.00 N ATOM 198 CA VAL A 15 -6.544 -35.568 46.162 1.00 0.00 C ATOM 199 C VAL A 15 -7.241 -35.897 47.492 1.00 0.00 C ATOM 200 O VAL A 15 -6.676 -36.557 48.369 1.00 0.00 O ATOM 201 CB VAL A 15 -5.644 -34.306 46.301 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.744 -34.373 47.519 1.00 0.00 C ATOM 203 CG2 VAL A 15 -4.807 -34.141 45.054 1.00 0.00 C ATOM 0 H VAL A 15 -7.534 -34.441 44.694 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.910 -36.417 45.906 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.301 -33.446 46.429 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.136 -33.470 47.572 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.354 -34.453 48.419 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.094 -35.244 47.443 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.177 -33.257 45.153 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.178 -35.021 44.919 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.461 -34.026 44.190 1.00 0.00 H new ATOM 213 N LYS A 16 -8.478 -35.474 47.603 1.00 0.00 N ATOM 214 CA LYS A 16 -9.269 -35.682 48.797 1.00 0.00 C ATOM 215 C LYS A 16 -10.315 -36.791 48.608 1.00 0.00 C ATOM 216 O LYS A 16 -11.316 -36.853 49.335 1.00 0.00 O ATOM 217 CB LYS A 16 -9.903 -34.358 49.202 1.00 0.00 C ATOM 218 CG LYS A 16 -8.877 -33.389 49.760 1.00 0.00 C ATOM 219 CD LYS A 16 -9.426 -31.988 49.956 1.00 0.00 C ATOM 220 CE LYS A 16 -9.536 -31.259 48.627 1.00 0.00 C ATOM 221 NZ LYS A 16 -9.626 -29.787 48.807 1.00 0.00 N ATOM 0 H LYS A 16 -8.969 -34.972 46.863 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.619 -36.026 49.602 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.393 -33.910 48.338 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.676 -34.539 49.949 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.511 -33.766 50.715 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.022 -33.347 49.086 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.407 -32.040 50.429 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -8.776 -31.429 50.629 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.669 -31.497 48.010 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.416 -31.613 48.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.189 -29.310 47.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -10.625 -29.506 48.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.127 -29.513 49.677 1.00 0.00 H new ATOM 235 N ILE A 17 -10.065 -37.675 47.639 1.00 0.00 N ATOM 236 CA ILE A 17 -10.955 -38.807 47.377 1.00 0.00 C ATOM 237 C ILE A 17 -10.782 -39.871 48.466 1.00 0.00 C ATOM 238 O ILE A 17 -9.689 -40.028 49.031 1.00 0.00 O ATOM 239 CB ILE A 17 -10.692 -39.429 45.968 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.858 -40.323 45.553 1.00 0.00 C ATOM 241 CG2 ILE A 17 -9.385 -40.221 45.945 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.782 -40.803 44.115 1.00 0.00 C ATOM 0 H ILE A 17 -9.253 -37.628 47.023 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.981 -38.439 47.391 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.603 -38.610 45.254 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.892 -41.189 46.214 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.791 -39.777 45.695 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -9.231 -40.641 44.951 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.554 -39.560 46.192 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.436 -41.028 46.676 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -12.645 -41.432 43.895 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.779 -39.944 43.444 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.867 -41.378 43.971 1.00 0.00 H new ATOM 254 N ALA A 18 -11.853 -40.571 48.777 1.00 0.00 N ATOM 255 CA ALA A 18 -11.831 -41.582 49.825 1.00 0.00 C ATOM 256 C ALA A 18 -11.120 -42.856 49.368 1.00 0.00 C ATOM 257 O ALA A 18 -11.065 -43.152 48.175 1.00 0.00 O ATOM 258 CB ALA A 18 -13.243 -41.889 50.287 1.00 0.00 C ATOM 0 H ALA A 18 -12.757 -40.461 48.318 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.265 -41.180 50.665 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.213 -42.646 51.070 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.704 -40.981 50.677 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.828 -42.260 49.446 1.00 0.00 H new ATOM 264 N GLN A 19 -10.595 -43.613 50.331 1.00 0.00 N ATOM 265 CA GLN A 19 -9.865 -44.847 50.043 1.00 0.00 C ATOM 266 C GLN A 19 -10.767 -45.876 49.369 1.00 0.00 C ATOM 267 O GLN A 19 -10.343 -46.588 48.455 1.00 0.00 O ATOM 268 CB GLN A 19 -9.267 -45.433 51.327 1.00 0.00 C ATOM 269 CG GLN A 19 -8.473 -46.708 51.098 1.00 0.00 C ATOM 270 CD GLN A 19 -7.254 -46.489 50.220 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.630 -45.435 50.255 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.929 -47.473 49.405 1.00 0.00 N ATOM 0 H GLN A 19 -10.663 -43.391 51.324 1.00 0.00 H new ATOM 0 HA GLN A 19 -9.055 -44.600 49.357 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.619 -44.689 51.789 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -10.072 -45.637 52.033 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.155 -47.111 52.060 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -9.119 -47.455 50.637 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.473 -48.336 49.405 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -6.134 -47.371 48.775 1.00 0.00 H new ATOM 281 N ASN A 20 -12.012 -45.942 49.815 1.00 0.00 N ATOM 282 CA ASN A 20 -12.986 -46.867 49.243 1.00 0.00 C ATOM 283 C ASN A 20 -13.180 -46.533 47.764 1.00 0.00 C ATOM 284 O ASN A 20 -13.240 -47.424 46.914 1.00 0.00 O ATOM 285 CB ASN A 20 -14.318 -46.760 50.017 1.00 0.00 C ATOM 286 CG ASN A 20 -15.351 -47.824 49.642 1.00 0.00 C ATOM 287 OD1 ASN A 20 -15.427 -48.273 48.500 1.00 0.00 O ATOM 288 ND2 ASN A 20 -16.146 -48.231 50.610 1.00 0.00 N ATOM 0 H ASN A 20 -12.375 -45.365 50.574 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.627 -47.893 49.326 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.111 -46.832 51.085 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.749 -45.774 49.841 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.854 -48.941 50.424 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -16.054 -47.836 51.546 1.00 0.00 H new ATOM 295 N ASP A 21 -13.238 -45.243 47.471 1.00 0.00 N ATOM 296 CA ASP A 21 -13.372 -44.760 46.103 1.00 0.00 C ATOM 297 C ASP A 21 -12.142 -45.117 45.261 1.00 0.00 C ATOM 298 O ASP A 21 -12.271 -45.477 44.097 1.00 0.00 O ATOM 299 CB ASP A 21 -13.624 -43.249 46.093 1.00 0.00 C ATOM 300 CG ASP A 21 -15.021 -42.888 46.537 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.980 -43.153 45.777 1.00 0.00 O ATOM 302 OD2 ASP A 21 -15.171 -42.341 47.645 1.00 0.00 O ATOM 0 H ASP A 21 -13.194 -44.503 48.171 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.231 -45.257 45.652 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -12.902 -42.760 46.747 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.456 -42.863 45.087 1.00 0.00 H new ATOM 307 N ILE A 22 -10.950 -45.027 45.864 1.00 0.00 N ATOM 308 CA ILE A 22 -9.700 -45.382 45.164 1.00 0.00 C ATOM 309 C ILE A 22 -9.708 -46.850 44.759 1.00 0.00 C ATOM 310 O ILE A 22 -9.381 -47.199 43.620 1.00 0.00 O ATOM 311 CB ILE A 22 -8.451 -45.133 46.045 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.400 -43.686 46.524 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.174 -45.506 45.295 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.288 -43.415 47.509 1.00 0.00 C ATOM 0 H ILE A 22 -10.820 -44.715 46.826 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.648 -44.744 44.282 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.525 -45.774 46.924 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.278 -43.031 45.662 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.354 -43.431 46.986 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.310 -45.323 45.934 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.207 -46.561 45.023 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.092 -44.901 44.392 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.313 -42.367 47.806 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.420 -44.045 48.389 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.328 -43.638 47.044 1.00 0.00 H new ATOM 326 N ASN A 23 -10.110 -47.698 45.696 1.00 0.00 N ATOM 327 CA ASN A 23 -10.187 -49.138 45.467 1.00 0.00 C ATOM 328 C ASN A 23 -11.140 -49.438 44.342 1.00 0.00 C ATOM 329 O ASN A 23 -10.890 -50.291 43.489 1.00 0.00 O ATOM 330 CB ASN A 23 -10.687 -49.833 46.726 1.00 0.00 C ATOM 331 CG ASN A 23 -9.607 -50.022 47.774 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.428 -50.137 47.456 1.00 0.00 O ATOM 333 ND2 ASN A 23 -10.006 -50.060 49.034 1.00 0.00 N ATOM 0 H ASN A 23 -10.391 -47.411 46.633 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.192 -49.500 45.209 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.502 -49.251 47.155 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.097 -50.806 46.457 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -9.324 -50.189 49.781 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.996 -49.961 49.259 1.00 0.00 H new ATOM 340 N TYR A 24 -12.228 -48.734 44.359 1.00 0.00 N ATOM 341 CA TYR A 24 -13.248 -48.853 43.363 1.00 0.00 C ATOM 342 C TYR A 24 -12.716 -48.476 41.966 1.00 0.00 C ATOM 343 O TYR A 24 -12.983 -49.172 40.987 1.00 0.00 O ATOM 344 CB TYR A 24 -14.414 -47.968 43.783 1.00 0.00 C ATOM 345 CG TYR A 24 -15.519 -47.839 42.779 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.508 -48.795 42.689 1.00 0.00 C ATOM 347 CD2 TYR A 24 -15.580 -46.754 41.925 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.532 -48.681 41.772 1.00 0.00 C ATOM 349 CE2 TYR A 24 -16.599 -46.627 41.003 1.00 0.00 C ATOM 350 CZ TYR A 24 -17.571 -47.596 40.932 1.00 0.00 C ATOM 351 OH TYR A 24 -18.585 -47.480 40.015 1.00 0.00 O ATOM 0 H TYR A 24 -12.437 -48.045 45.081 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.581 -49.888 43.288 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.832 -48.363 44.709 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.030 -46.972 44.005 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.481 -49.649 43.349 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -14.817 -45.992 41.980 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.298 -49.440 41.715 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -16.632 -45.773 40.343 1.00 0.00 H new ATOM 0 HH TYR A 24 -18.467 -46.655 39.499 1.00 0.00 H new ATOM 361 N LYS A 25 -11.958 -47.380 41.887 1.00 0.00 N ATOM 362 CA LYS A 25 -11.436 -46.900 40.605 1.00 0.00 C ATOM 363 C LYS A 25 -10.459 -47.895 39.964 1.00 0.00 C ATOM 364 O LYS A 25 -10.544 -48.162 38.762 1.00 0.00 O ATOM 365 CB LYS A 25 -10.765 -45.531 40.762 1.00 0.00 C ATOM 366 CG LYS A 25 -11.693 -44.442 41.278 1.00 0.00 C ATOM 367 CD LYS A 25 -12.872 -44.220 40.351 1.00 0.00 C ATOM 368 CE LYS A 25 -13.798 -43.137 40.884 1.00 0.00 C ATOM 369 NZ LYS A 25 -14.966 -42.925 40.000 1.00 0.00 N ATOM 0 H LYS A 25 -11.693 -46.811 42.691 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.292 -46.801 39.938 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.921 -45.628 41.445 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.361 -45.223 39.797 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.056 -44.714 42.269 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.136 -43.511 41.387 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.511 -43.939 39.362 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.427 -45.151 40.235 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.142 -43.412 41.881 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.245 -42.203 40.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.572 -42.180 40.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.639 -42.638 39.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.509 -43.809 39.924 1.00 0.00 H new ATOM 383 N VAL A 26 -9.541 -48.443 40.758 1.00 0.00 N ATOM 384 CA VAL A 26 -8.569 -49.401 40.233 1.00 0.00 C ATOM 385 C VAL A 26 -9.234 -50.704 39.820 1.00 0.00 C ATOM 386 O VAL A 26 -8.804 -51.354 38.862 1.00 0.00 O ATOM 387 CB VAL A 26 -7.400 -49.686 41.210 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.416 -48.526 41.231 1.00 0.00 C ATOM 389 CG2 VAL A 26 -7.906 -49.981 42.614 1.00 0.00 C ATOM 0 H VAL A 26 -9.449 -48.244 41.754 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.141 -48.926 39.350 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.881 -50.574 40.849 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.605 -48.750 41.924 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.008 -48.376 40.231 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.929 -47.620 41.553 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.059 -50.176 43.272 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.465 -49.123 42.987 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.556 -50.856 42.590 1.00 0.00 H new ATOM 399 N LYS A 27 -10.284 -51.075 40.531 1.00 0.00 N ATOM 400 CA LYS A 27 -11.023 -52.289 40.226 1.00 0.00 C ATOM 401 C LYS A 27 -11.635 -52.186 38.827 1.00 0.00 C ATOM 402 O LYS A 27 -11.537 -53.114 38.018 1.00 0.00 O ATOM 403 CB LYS A 27 -12.122 -52.502 41.265 1.00 0.00 C ATOM 404 CG LYS A 27 -12.863 -53.815 41.128 1.00 0.00 C ATOM 405 CD LYS A 27 -13.930 -53.950 42.199 1.00 0.00 C ATOM 406 CE LYS A 27 -14.659 -55.275 42.090 1.00 0.00 C ATOM 407 NZ LYS A 27 -13.749 -56.418 42.343 1.00 0.00 N ATOM 0 H LYS A 27 -10.646 -50.551 41.327 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.342 -53.140 40.253 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.680 -52.450 42.260 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.839 -51.684 41.191 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.323 -53.876 40.142 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.159 -54.644 41.204 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.471 -53.865 43.184 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.644 -53.132 42.108 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -15.482 -55.299 42.804 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -15.097 -55.370 41.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.310 -57.277 42.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -13.135 -56.563 41.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.163 -56.217 43.178 1.00 0.00 H new ATOM 421 N HIS A 28 -12.238 -51.036 38.545 1.00 0.00 N ATOM 422 CA HIS A 28 -12.834 -50.778 37.242 1.00 0.00 C ATOM 423 C HIS A 28 -11.769 -50.599 36.178 1.00 0.00 C ATOM 424 O HIS A 28 -11.977 -50.951 35.017 1.00 0.00 O ATOM 425 CB HIS A 28 -13.757 -49.562 37.286 1.00 0.00 C ATOM 426 CG HIS A 28 -15.175 -49.906 37.608 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.690 -49.879 38.884 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.191 -50.293 36.804 1.00 0.00 C ATOM 429 CE1 HIS A 28 -16.961 -50.240 38.850 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.288 -50.492 37.602 1.00 0.00 N ATOM 0 H HIS A 28 -12.326 -50.265 39.207 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.434 -51.649 36.980 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.384 -48.858 38.030 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.724 -49.055 36.322 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.147 -50.421 35.733 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.619 -50.315 39.703 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.209 -50.788 37.279 1.00 0.00 H new ATOM 438 N ALA A 29 -10.630 -50.045 36.578 1.00 0.00 N ATOM 439 CA ALA A 29 -9.520 -49.842 35.671 1.00 0.00 C ATOM 440 C ALA A 29 -9.122 -51.157 35.024 1.00 0.00 C ATOM 441 O ALA A 29 -8.959 -51.234 33.810 1.00 0.00 O ATOM 442 CB ALA A 29 -8.337 -49.234 36.405 1.00 0.00 C ATOM 0 H ALA A 29 -10.456 -49.729 37.532 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.833 -49.149 34.890 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -7.512 -49.088 35.708 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.627 -48.273 36.830 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.022 -49.904 37.205 1.00 0.00 H new ATOM 448 N LEU A 30 -9.016 -52.203 35.845 1.00 0.00 N ATOM 449 CA LEU A 30 -8.656 -53.527 35.355 1.00 0.00 C ATOM 450 C LEU A 30 -9.705 -54.046 34.377 1.00 0.00 C ATOM 451 O LEU A 30 -9.364 -54.640 33.356 1.00 0.00 O ATOM 452 CB LEU A 30 -8.475 -54.515 36.516 1.00 0.00 C ATOM 453 CG LEU A 30 -7.268 -54.265 37.427 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.300 -55.204 38.619 1.00 0.00 C ATOM 455 CD2 LEU A 30 -5.965 -54.436 36.654 1.00 0.00 C ATOM 0 H LEU A 30 -9.175 -52.155 36.851 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.705 -53.440 34.830 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.377 -54.496 37.127 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.391 -55.520 36.102 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.321 -53.239 37.790 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.436 -55.013 39.256 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.214 -55.038 39.189 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.273 -56.236 38.270 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.121 -54.254 37.319 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.905 -55.451 36.261 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.936 -53.725 35.828 1.00 0.00 H new ATOM 467 N GLU A 31 -10.981 -53.805 34.688 1.00 0.00 N ATOM 468 CA GLU A 31 -12.077 -54.254 33.837 1.00 0.00 C ATOM 469 C GLU A 31 -11.935 -53.704 32.419 1.00 0.00 C ATOM 470 O GLU A 31 -12.032 -54.445 31.445 1.00 0.00 O ATOM 471 CB GLU A 31 -13.425 -53.810 34.415 1.00 0.00 C ATOM 472 CG GLU A 31 -13.796 -54.452 35.742 1.00 0.00 C ATOM 473 CD GLU A 31 -15.142 -53.967 36.248 1.00 0.00 C ATOM 474 OE1 GLU A 31 -16.154 -54.168 35.539 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.203 -53.392 37.352 1.00 0.00 O ATOM 0 H GLU A 31 -11.277 -53.301 35.524 1.00 0.00 H new ATOM 0 HA GLU A 31 -12.037 -55.343 33.800 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.410 -52.728 34.543 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.206 -54.034 33.689 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.820 -55.536 35.627 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -13.028 -54.227 36.482 1.00 0.00 H new ATOM 482 N PHE A 32 -11.692 -52.408 32.311 1.00 0.00 N ATOM 483 CA PHE A 32 -11.544 -51.771 31.008 1.00 0.00 C ATOM 484 C PHE A 32 -10.263 -52.215 30.294 1.00 0.00 C ATOM 485 O PHE A 32 -10.246 -52.360 29.067 1.00 0.00 O ATOM 486 CB PHE A 32 -11.604 -50.243 31.116 1.00 0.00 C ATOM 487 CG PHE A 32 -12.966 -49.718 31.492 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.974 -49.641 30.543 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.245 -49.321 32.789 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.230 -49.173 30.873 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.502 -48.852 33.130 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.496 -48.779 32.166 1.00 0.00 C ATOM 0 H PHE A 32 -11.593 -51.776 33.106 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.389 -52.099 30.403 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.878 -49.911 31.858 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.307 -49.808 30.162 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.773 -49.952 29.529 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.474 -49.378 33.543 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -16.002 -49.116 30.120 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.708 -48.544 34.144 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.478 -48.414 32.429 1.00 0.00 H new ATOM 502 N LEU A 33 -9.199 -52.420 31.062 1.00 0.00 N ATOM 503 CA LEU A 33 -7.912 -52.845 30.506 1.00 0.00 C ATOM 504 C LEU A 33 -8.041 -54.219 29.854 1.00 0.00 C ATOM 505 O LEU A 33 -7.563 -54.450 28.745 1.00 0.00 O ATOM 506 CB LEU A 33 -6.861 -52.886 31.605 1.00 0.00 C ATOM 507 CG LEU A 33 -6.498 -51.540 32.222 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.548 -51.733 33.375 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.898 -50.607 31.178 1.00 0.00 C ATOM 0 H LEU A 33 -9.199 -52.299 32.075 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.605 -52.127 29.745 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.216 -53.545 32.398 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.955 -53.335 31.199 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.410 -51.078 32.599 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.297 -50.764 33.806 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.019 -52.357 34.134 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.639 -52.218 33.020 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.648 -49.654 31.643 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.996 -51.057 30.764 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.621 -50.442 30.379 1.00 0.00 H new ATOM 521 N GLU A 34 -8.723 -55.111 30.548 1.00 0.00 N ATOM 522 CA GLU A 34 -9.008 -56.457 30.059 1.00 0.00 C ATOM 523 C GLU A 34 -9.769 -56.394 28.737 1.00 0.00 C ATOM 524 O GLU A 34 -9.607 -57.252 27.872 1.00 0.00 O ATOM 525 CB GLU A 34 -9.832 -57.211 31.104 1.00 0.00 C ATOM 526 CG GLU A 34 -9.066 -57.538 32.372 1.00 0.00 C ATOM 527 CD GLU A 34 -8.030 -58.615 32.167 1.00 0.00 C ATOM 528 OE1 GLU A 34 -8.414 -59.780 31.924 1.00 0.00 O ATOM 529 OE2 GLU A 34 -6.825 -58.311 32.245 1.00 0.00 O ATOM 0 H GLU A 34 -9.101 -54.925 31.477 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.068 -56.982 29.889 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.706 -56.614 31.363 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.199 -58.138 30.663 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.578 -56.635 32.739 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.767 -57.857 33.143 1.00 0.00 H new ATOM 536 N GLN A 35 -10.586 -55.362 28.589 1.00 0.00 N ATOM 537 CA GLN A 35 -11.375 -55.156 27.389 1.00 0.00 C ATOM 538 C GLN A 35 -10.503 -54.642 26.228 1.00 0.00 C ATOM 539 O GLN A 35 -10.972 -54.531 25.095 1.00 0.00 O ATOM 540 CB GLN A 35 -12.510 -54.173 27.682 1.00 0.00 C ATOM 541 CG GLN A 35 -13.519 -54.699 28.692 1.00 0.00 C ATOM 542 CD GLN A 35 -14.600 -53.688 29.034 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.898 -52.791 28.253 1.00 0.00 O ATOM 544 NE2 GLN A 35 -15.193 -53.832 30.203 1.00 0.00 N ATOM 0 H GLN A 35 -10.719 -54.644 29.301 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.797 -56.114 27.085 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.086 -53.241 28.055 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -13.027 -53.938 26.751 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.985 -55.601 28.295 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.996 -54.986 29.604 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.916 -54.592 30.825 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.928 -53.184 30.485 1.00 0.00 H new ATOM 553 N GLY A 36 -9.239 -54.323 26.517 1.00 0.00 N ATOM 554 CA GLY A 36 -8.336 -53.855 25.482 1.00 0.00 C ATOM 555 C GLY A 36 -8.345 -52.350 25.325 1.00 0.00 C ATOM 556 O GLY A 36 -7.869 -51.820 24.316 1.00 0.00 O ATOM 0 H GLY A 36 -8.829 -54.382 27.449 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.323 -54.184 25.715 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.610 -54.315 24.533 1.00 0.00 H new ATOM 560 N LYS A 37 -8.886 -51.658 26.314 1.00 0.00 N ATOM 561 CA LYS A 37 -8.942 -50.202 26.275 1.00 0.00 C ATOM 562 C LYS A 37 -7.894 -49.563 27.160 1.00 0.00 C ATOM 563 O LYS A 37 -7.246 -50.225 27.969 1.00 0.00 O ATOM 564 CB LYS A 37 -10.317 -49.670 26.663 1.00 0.00 C ATOM 565 CG LYS A 37 -11.388 -49.862 25.611 1.00 0.00 C ATOM 566 CD LYS A 37 -12.653 -49.113 25.990 1.00 0.00 C ATOM 567 CE LYS A 37 -13.472 -49.867 27.017 1.00 0.00 C ATOM 568 NZ LYS A 37 -14.203 -51.001 26.401 1.00 0.00 N ATOM 0 H LYS A 37 -9.292 -52.076 27.151 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.738 -49.930 25.240 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.636 -50.162 27.582 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.231 -48.606 26.885 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.025 -49.508 24.646 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.608 -50.924 25.498 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.389 -48.132 26.386 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.256 -48.945 25.098 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.817 -50.240 27.804 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.182 -49.187 27.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.145 -51.831 27.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.200 -50.739 26.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.777 -51.230 25.480 1.00 0.00 H new ATOM 582 N HIS A 38 -7.741 -48.268 26.987 1.00 0.00 N ATOM 583 CA HIS A 38 -6.826 -47.477 27.763 1.00 0.00 C ATOM 584 C HIS A 38 -7.549 -46.680 28.818 1.00 0.00 C ATOM 585 O HIS A 38 -8.685 -46.236 28.612 1.00 0.00 O ATOM 586 CB HIS A 38 -6.042 -46.525 26.863 1.00 0.00 C ATOM 587 CG HIS A 38 -4.732 -47.057 26.433 1.00 0.00 C ATOM 588 ND1 HIS A 38 -4.435 -47.451 25.145 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.621 -47.234 27.136 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.172 -47.845 25.104 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.670 -47.714 26.298 1.00 0.00 N ATOM 0 H HIS A 38 -8.259 -47.732 26.291 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.137 -48.165 28.254 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.640 -46.299 25.980 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.886 -45.585 27.392 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -5.081 -47.441 24.356 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.496 -47.031 28.189 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.649 -48.211 24.233 1.00 0.00 H new ATOM 599 N VAL A 39 -6.896 -46.505 29.945 1.00 0.00 N ATOM 600 CA VAL A 39 -7.419 -45.693 31.009 1.00 0.00 C ATOM 601 C VAL A 39 -6.521 -44.491 31.223 1.00 0.00 C ATOM 602 O VAL A 39 -5.297 -44.623 31.335 1.00 0.00 O ATOM 603 CB VAL A 39 -7.553 -46.478 32.347 1.00 0.00 C ATOM 604 CG1 VAL A 39 -7.784 -45.524 33.512 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.696 -47.467 32.279 1.00 0.00 C ATOM 0 H VAL A 39 -5.988 -46.924 30.145 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.418 -45.376 30.710 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.620 -47.020 32.505 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.875 -46.094 34.437 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.942 -44.836 33.591 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.700 -44.959 33.343 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.770 -48.003 33.225 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.628 -46.934 32.090 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.515 -48.177 31.472 1.00 0.00 H new ATOM 615 N ARG A 40 -7.123 -43.334 31.247 1.00 0.00 N ATOM 616 CA ARG A 40 -6.415 -42.112 31.511 1.00 0.00 C ATOM 617 C ARG A 40 -6.833 -41.609 32.877 1.00 0.00 C ATOM 618 O ARG A 40 -7.983 -41.233 33.073 1.00 0.00 O ATOM 619 CB ARG A 40 -6.758 -41.070 30.443 1.00 0.00 C ATOM 620 CG ARG A 40 -5.998 -39.757 30.577 1.00 0.00 C ATOM 621 CD ARG A 40 -6.469 -38.737 29.546 1.00 0.00 C ATOM 622 NE ARG A 40 -6.178 -39.156 28.172 1.00 0.00 N ATOM 623 CZ ARG A 40 -6.852 -38.730 27.094 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.897 -37.914 27.230 1.00 0.00 N ATOM 625 NH2 ARG A 40 -6.491 -39.133 25.885 1.00 0.00 N ATOM 0 H ARG A 40 -8.122 -43.212 31.083 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.339 -42.288 31.489 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.554 -41.495 29.460 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.827 -40.863 30.485 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.137 -39.354 31.580 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.930 -39.938 30.452 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -7.542 -38.582 29.656 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.987 -37.779 29.741 1.00 0.00 H new ATOM 0 HE ARG A 40 -5.413 -39.815 28.026 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.189 -37.609 28.159 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -8.405 -37.594 26.405 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -5.700 -39.768 25.774 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.004 -38.809 25.065 1.00 0.00 H new ATOM 639 N PHE A 41 -5.919 -41.614 33.815 1.00 0.00 N ATOM 640 CA PHE A 41 -6.226 -41.160 35.156 1.00 0.00 C ATOM 641 C PHE A 41 -5.958 -39.686 35.258 1.00 0.00 C ATOM 642 O PHE A 41 -4.862 -39.243 34.960 1.00 0.00 O ATOM 643 CB PHE A 41 -5.382 -41.893 36.198 1.00 0.00 C ATOM 644 CG PHE A 41 -5.728 -43.337 36.381 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.813 -43.711 37.158 1.00 0.00 C ATOM 646 CD2 PHE A 41 -4.965 -44.324 35.788 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.130 -45.043 37.335 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.275 -45.655 35.965 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.360 -46.016 36.740 1.00 0.00 C ATOM 0 H PHE A 41 -4.957 -41.926 33.679 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.277 -41.370 35.352 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.333 -41.818 35.913 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.489 -41.384 37.156 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.418 -42.951 37.631 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.116 -44.050 35.179 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -7.981 -45.321 37.939 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.669 -46.417 35.497 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.603 -47.059 36.879 1.00 0.00 H new ATOM 659 N ARG A 42 -6.955 -38.929 35.660 1.00 0.00 N ATOM 660 CA ARG A 42 -6.792 -37.498 35.811 1.00 0.00 C ATOM 661 C ARG A 42 -7.259 -37.087 37.184 1.00 0.00 C ATOM 662 O ARG A 42 -8.301 -37.536 37.648 1.00 0.00 O ATOM 663 CB ARG A 42 -7.573 -36.745 34.720 1.00 0.00 C ATOM 664 CG ARG A 42 -7.146 -37.146 33.307 1.00 0.00 C ATOM 665 CD ARG A 42 -7.953 -36.453 32.223 1.00 0.00 C ATOM 666 NE ARG A 42 -7.674 -35.023 32.142 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.182 -34.215 31.204 1.00 0.00 C ATOM 668 NH1 ARG A 42 -8.921 -34.717 30.214 1.00 0.00 N ATOM 669 NH2 ARG A 42 -7.918 -32.911 31.234 1.00 0.00 N ATOM 0 H ARG A 42 -7.886 -39.278 35.888 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.738 -37.242 35.701 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.639 -36.939 34.842 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.427 -35.673 34.849 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.090 -36.911 33.172 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.249 -38.225 33.195 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.735 -36.917 31.261 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.016 -36.602 32.415 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.055 -34.615 32.842 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.101 -35.720 30.170 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.307 -34.098 29.501 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.328 -32.527 31.972 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.305 -32.296 30.519 1.00 0.00 H new ATOM 683 N VAL A 43 -6.498 -36.252 37.838 1.00 0.00 N ATOM 684 CA VAL A 43 -6.847 -35.820 39.169 1.00 0.00 C ATOM 685 C VAL A 43 -7.052 -34.321 39.223 1.00 0.00 C ATOM 686 O VAL A 43 -6.245 -33.546 38.700 1.00 0.00 O ATOM 687 CB VAL A 43 -5.784 -36.258 40.220 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.392 -35.828 39.806 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.119 -35.703 41.596 1.00 0.00 C ATOM 0 H VAL A 43 -5.632 -35.856 37.473 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.788 -36.308 39.422 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.803 -37.347 40.271 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.673 -36.148 40.560 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.140 -36.283 38.848 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.359 -34.743 39.712 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.362 -36.023 42.312 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.141 -34.614 41.554 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.095 -36.074 41.910 1.00 0.00 H new ATOM 699 N PHE A 44 -8.149 -33.925 39.830 1.00 0.00 N ATOM 700 CA PHE A 44 -8.466 -32.532 39.991 1.00 0.00 C ATOM 701 C PHE A 44 -8.020 -32.066 41.357 1.00 0.00 C ATOM 702 O PHE A 44 -8.370 -32.672 42.377 1.00 0.00 O ATOM 703 CB PHE A 44 -9.969 -32.294 39.815 1.00 0.00 C ATOM 704 CG PHE A 44 -10.373 -30.854 39.959 1.00 0.00 C ATOM 705 CD1 PHE A 44 -10.193 -29.964 38.912 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.937 -30.389 41.141 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.565 -28.642 39.036 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.309 -29.063 41.267 1.00 0.00 C ATOM 709 CZ PHE A 44 -11.123 -28.188 40.211 1.00 0.00 C ATOM 0 H PHE A 44 -8.842 -34.562 40.223 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.940 -31.961 39.226 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.272 -32.650 38.830 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.511 -32.889 40.550 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.756 -30.310 37.987 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.086 -31.068 41.967 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.419 -27.961 38.210 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.745 -28.710 42.190 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.414 -27.153 40.308 1.00 0.00 H new ATOM 719 N LEU A 45 -7.240 -31.014 41.385 1.00 0.00 N ATOM 720 CA LEU A 45 -6.778 -30.475 42.642 1.00 0.00 C ATOM 721 C LEU A 45 -7.758 -29.391 43.093 1.00 0.00 C ATOM 722 O LEU A 45 -7.887 -28.352 42.445 1.00 0.00 O ATOM 723 CB LEU A 45 -5.367 -29.902 42.480 1.00 0.00 C ATOM 724 CG LEU A 45 -4.350 -30.824 41.774 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.983 -30.177 41.719 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.265 -32.170 42.454 1.00 0.00 C ATOM 0 H LEU A 45 -6.913 -30.516 40.558 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.734 -31.260 43.396 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.435 -28.969 41.920 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.980 -29.653 43.468 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.702 -30.980 40.754 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.284 -30.846 41.217 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.047 -29.239 41.168 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.633 -29.980 42.732 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.540 -32.796 41.933 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.950 -32.036 43.489 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.243 -32.651 42.432 1.00 0.00 H new ATOM 738 N LYS A 46 -8.447 -29.640 44.190 1.00 0.00 N ATOM 739 CA LYS A 46 -9.493 -28.736 44.654 1.00 0.00 C ATOM 740 C LYS A 46 -8.967 -27.761 45.684 1.00 0.00 C ATOM 741 O LYS A 46 -8.515 -28.159 46.757 1.00 0.00 O ATOM 742 CB LYS A 46 -10.658 -29.529 45.244 1.00 0.00 C ATOM 743 CG LYS A 46 -11.796 -28.657 45.757 1.00 0.00 C ATOM 744 CD LYS A 46 -12.908 -29.495 46.355 1.00 0.00 C ATOM 745 CE LYS A 46 -14.044 -28.623 46.865 1.00 0.00 C ATOM 746 NZ LYS A 46 -15.118 -29.425 47.500 1.00 0.00 N ATOM 0 H LYS A 46 -8.305 -30.460 44.780 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.841 -28.167 43.792 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -11.046 -30.207 44.484 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.288 -30.146 46.063 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.416 -27.965 46.508 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.192 -28.054 44.939 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -13.288 -30.188 45.604 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.513 -30.097 47.174 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -13.654 -27.904 47.586 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -14.461 -28.050 46.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.873 -28.792 47.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -15.509 -30.094 46.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -14.727 -29.953 48.306 1.00 0.00 H new ATOM 760 N GLY A 47 -9.062 -26.489 45.372 1.00 0.00 N ATOM 761 CA GLY A 47 -8.581 -25.476 46.264 1.00 0.00 C ATOM 762 C GLY A 47 -7.234 -24.972 45.840 1.00 0.00 C ATOM 763 O GLY A 47 -6.965 -24.828 44.647 1.00 0.00 O ATOM 0 H GLY A 47 -9.469 -26.138 44.505 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.289 -24.648 46.293 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.519 -25.878 47.275 1.00 0.00 H new ATOM 767 N ARG A 48 -6.371 -24.726 46.799 1.00 0.00 N ATOM 768 CA ARG A 48 -5.049 -24.216 46.506 1.00 0.00 C ATOM 769 C ARG A 48 -4.060 -25.364 46.343 1.00 0.00 C ATOM 770 O ARG A 48 -2.848 -25.163 46.317 1.00 0.00 O ATOM 771 CB ARG A 48 -4.589 -23.240 47.592 1.00 0.00 C ATOM 772 CG ARG A 48 -5.522 -22.045 47.757 1.00 0.00 C ATOM 773 CD ARG A 48 -5.005 -21.040 48.770 1.00 0.00 C ATOM 774 NE ARG A 48 -3.815 -20.338 48.282 1.00 0.00 N ATOM 775 CZ ARG A 48 -3.169 -19.385 48.952 1.00 0.00 C ATOM 776 NH1 ARG A 48 -3.584 -19.018 50.161 1.00 0.00 N ATOM 777 NH2 ARG A 48 -2.106 -18.803 48.411 1.00 0.00 N ATOM 0 H ARG A 48 -6.560 -24.871 47.791 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.091 -23.668 45.564 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.516 -23.770 48.542 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.589 -22.881 47.350 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.650 -21.552 46.793 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.506 -22.396 48.068 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.788 -20.315 48.995 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.768 -21.553 49.702 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.456 -20.598 47.363 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.399 -19.467 50.578 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.087 -18.288 50.671 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.786 -19.086 47.485 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -1.609 -18.073 48.921 1.00 0.00 H new ATOM 791 N GLU A 49 -4.597 -26.576 46.209 1.00 0.00 N ATOM 792 CA GLU A 49 -3.790 -27.775 46.024 1.00 0.00 C ATOM 793 C GLU A 49 -2.986 -27.690 44.721 1.00 0.00 C ATOM 794 O GLU A 49 -1.955 -28.349 44.565 1.00 0.00 O ATOM 795 CB GLU A 49 -4.693 -29.014 46.001 1.00 0.00 C ATOM 796 CG GLU A 49 -5.458 -29.244 47.294 1.00 0.00 C ATOM 797 CD GLU A 49 -6.337 -30.489 47.257 1.00 0.00 C ATOM 798 OE1 GLU A 49 -7.012 -30.726 46.233 1.00 0.00 O ATOM 799 OE2 GLU A 49 -6.367 -31.218 48.270 1.00 0.00 O ATOM 0 H GLU A 49 -5.602 -26.751 46.226 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.092 -27.854 46.857 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.405 -28.917 45.182 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.083 -29.892 45.791 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.749 -29.332 48.117 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.080 -28.373 47.500 1.00 0.00 H new ATOM 806 N MET A 50 -3.460 -26.849 43.799 1.00 0.00 N ATOM 807 CA MET A 50 -2.815 -26.660 42.503 1.00 0.00 C ATOM 808 C MET A 50 -1.456 -25.988 42.636 1.00 0.00 C ATOM 809 O MET A 50 -0.692 -25.934 41.672 1.00 0.00 O ATOM 810 CB MET A 50 -3.707 -25.849 41.566 1.00 0.00 C ATOM 811 CG MET A 50 -4.967 -26.574 41.127 1.00 0.00 C ATOM 812 SD MET A 50 -5.974 -25.604 39.983 1.00 0.00 S ATOM 813 CE MET A 50 -7.285 -26.765 39.622 1.00 0.00 C ATOM 0 H MET A 50 -4.298 -26.283 43.931 1.00 0.00 H new ATOM 0 HA MET A 50 -2.659 -27.651 42.078 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.989 -24.921 42.063 1.00 0.00 H new ATOM 0 HB3 MET A 50 -3.132 -25.574 40.682 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.691 -27.516 40.652 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.562 -26.823 42.006 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.778 -26.479 38.693 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.866 -27.766 39.518 1.00 0.00 H new ATOM 0 HE3 MET A 50 -8.011 -26.758 40.435 1.00 0.00 H new ATOM 823 N ALA A 51 -1.161 -25.471 43.826 1.00 0.00 N ATOM 824 CA ALA A 51 0.124 -24.845 44.090 1.00 0.00 C ATOM 825 C ALA A 51 1.250 -25.866 43.972 1.00 0.00 C ATOM 826 O ALA A 51 2.389 -25.525 43.640 1.00 0.00 O ATOM 827 CB ALA A 51 0.133 -24.202 45.474 1.00 0.00 C ATOM 0 H ALA A 51 -1.799 -25.475 44.622 1.00 0.00 H new ATOM 0 HA ALA A 51 0.284 -24.065 43.346 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.103 -23.739 45.654 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.647 -23.443 45.528 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.050 -24.965 46.231 1.00 0.00 H new ATOM 833 N THR A 52 0.929 -27.120 44.241 1.00 0.00 N ATOM 834 CA THR A 52 1.904 -28.182 44.166 1.00 0.00 C ATOM 835 C THR A 52 1.365 -29.359 43.352 1.00 0.00 C ATOM 836 O THR A 52 0.590 -30.176 43.848 1.00 0.00 O ATOM 837 CB THR A 52 2.319 -28.659 45.573 1.00 0.00 C ATOM 838 OG1 THR A 52 2.702 -27.526 46.369 1.00 0.00 O ATOM 839 CG2 THR A 52 3.486 -29.634 45.496 1.00 0.00 C ATOM 0 H THR A 52 -0.006 -27.423 44.514 1.00 0.00 H new ATOM 0 HA THR A 52 2.786 -27.783 43.664 1.00 0.00 H new ATOM 0 HB THR A 52 1.469 -29.168 46.028 1.00 0.00 H new ATOM 0 HG1 THR A 52 2.964 -27.828 47.264 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.759 -29.955 46.501 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.196 -30.502 44.904 1.00 0.00 H new ATOM 0 HG23 THR A 52 4.339 -29.144 45.027 1.00 0.00 H new ATOM 847 N PRO A 53 1.770 -29.441 42.079 1.00 0.00 N ATOM 848 CA PRO A 53 1.350 -30.510 41.160 1.00 0.00 C ATOM 849 C PRO A 53 1.758 -31.908 41.644 1.00 0.00 C ATOM 850 O PRO A 53 1.148 -32.911 41.254 1.00 0.00 O ATOM 851 CB PRO A 53 2.075 -30.159 39.853 1.00 0.00 C ATOM 852 CG PRO A 53 2.364 -28.703 39.969 1.00 0.00 C ATOM 853 CD PRO A 53 2.649 -28.469 41.414 1.00 0.00 C ATOM 0 HA PRO A 53 0.265 -30.557 41.066 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.991 -30.738 39.739 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.453 -30.373 38.984 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.216 -28.421 39.350 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.515 -28.106 39.634 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.698 -28.642 41.653 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.419 -27.446 41.711 1.00 0.00 H new ATOM 861 N GLU A 54 2.784 -31.971 42.499 1.00 0.00 N ATOM 862 CA GLU A 54 3.254 -33.246 43.042 1.00 0.00 C ATOM 863 C GLU A 54 2.148 -33.933 43.859 1.00 0.00 C ATOM 864 O GLU A 54 2.160 -35.152 44.035 1.00 0.00 O ATOM 865 CB GLU A 54 4.513 -33.049 43.895 1.00 0.00 C ATOM 866 CG GLU A 54 5.136 -34.352 44.365 1.00 0.00 C ATOM 867 CD GLU A 54 6.418 -34.151 45.140 1.00 0.00 C ATOM 868 OE1 GLU A 54 6.353 -33.898 46.359 1.00 0.00 O ATOM 869 OE2 GLU A 54 7.501 -34.259 44.535 1.00 0.00 O ATOM 0 H GLU A 54 3.302 -31.156 42.828 1.00 0.00 H new ATOM 0 HA GLU A 54 3.511 -33.893 42.203 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.250 -32.491 43.318 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.262 -32.441 44.764 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.420 -34.885 44.991 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.337 -34.985 43.500 1.00 0.00 H new ATOM 876 N ALA A 55 1.181 -33.144 44.336 1.00 0.00 N ATOM 877 CA ALA A 55 0.056 -33.686 45.087 1.00 0.00 C ATOM 878 C ALA A 55 -0.737 -34.646 44.210 1.00 0.00 C ATOM 879 O ALA A 55 -1.173 -35.709 44.662 1.00 0.00 O ATOM 880 CB ALA A 55 -0.842 -32.561 45.584 1.00 0.00 C ATOM 0 H ALA A 55 1.159 -32.132 44.214 1.00 0.00 H new ATOM 0 HA ALA A 55 0.438 -34.229 45.951 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -1.678 -32.982 46.143 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.269 -31.898 46.232 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.223 -31.996 44.733 1.00 0.00 H new ATOM 886 N GLY A 56 -0.908 -34.264 42.946 1.00 0.00 N ATOM 887 CA GLY A 56 -1.596 -35.112 41.992 1.00 0.00 C ATOM 888 C GLY A 56 -0.811 -36.365 41.705 1.00 0.00 C ATOM 889 O GLY A 56 -1.374 -37.450 41.580 1.00 0.00 O ATOM 0 H GLY A 56 -0.579 -33.376 42.566 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.579 -35.378 42.381 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.758 -34.562 41.065 1.00 0.00 H new ATOM 893 N VAL A 57 0.499 -36.209 41.628 1.00 0.00 N ATOM 894 CA VAL A 57 1.396 -37.315 41.354 1.00 0.00 C ATOM 895 C VAL A 57 1.326 -38.349 42.472 1.00 0.00 C ATOM 896 O VAL A 57 1.240 -39.546 42.215 1.00 0.00 O ATOM 897 CB VAL A 57 2.855 -36.823 41.194 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.798 -37.988 40.962 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.960 -35.818 40.058 1.00 0.00 C ATOM 0 H VAL A 57 0.969 -35.313 41.754 1.00 0.00 H new ATOM 0 HA VAL A 57 1.078 -37.775 40.418 1.00 0.00 H new ATOM 0 HB VAL A 57 3.148 -36.329 42.120 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.817 -37.615 40.853 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.750 -38.670 41.811 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.506 -38.517 40.055 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.993 -35.484 39.962 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.642 -36.287 39.127 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.320 -34.961 40.270 1.00 0.00 H new ATOM 909 N ALA A 58 1.335 -37.872 43.712 1.00 0.00 N ATOM 910 CA ALA A 58 1.298 -38.749 44.878 1.00 0.00 C ATOM 911 C ALA A 58 0.042 -39.623 44.879 1.00 0.00 C ATOM 912 O ALA A 58 0.105 -40.809 45.219 1.00 0.00 O ATOM 913 CB ALA A 58 1.386 -37.932 46.156 1.00 0.00 C ATOM 0 H ALA A 58 1.368 -36.878 43.937 1.00 0.00 H new ATOM 0 HA ALA A 58 2.161 -39.413 44.828 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.357 -38.599 47.017 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.319 -37.369 46.164 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.545 -37.241 46.205 1.00 0.00 H new ATOM 919 N LEU A 59 -1.097 -39.042 44.516 1.00 0.00 N ATOM 920 CA LEU A 59 -2.339 -39.810 44.429 1.00 0.00 C ATOM 921 C LEU A 59 -2.228 -40.876 43.347 1.00 0.00 C ATOM 922 O LEU A 59 -2.586 -42.038 43.552 1.00 0.00 O ATOM 923 CB LEU A 59 -3.525 -38.897 44.102 1.00 0.00 C ATOM 924 CG LEU A 59 -4.866 -39.614 43.861 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.415 -40.215 45.142 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.876 -38.677 43.235 1.00 0.00 C ATOM 0 H LEU A 59 -1.189 -38.054 44.279 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.505 -40.282 45.398 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.653 -38.189 44.921 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.279 -38.315 43.214 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.678 -40.431 43.165 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.362 -40.713 44.934 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.704 -40.940 45.538 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.574 -39.425 45.876 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.814 -39.208 43.075 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.047 -37.830 43.899 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.495 -38.317 42.279 1.00 0.00 H new ATOM 938 N LEU A 60 -1.710 -40.468 42.203 1.00 0.00 N ATOM 939 CA LEU A 60 -1.586 -41.340 41.057 1.00 0.00 C ATOM 940 C LEU A 60 -0.628 -42.501 41.310 1.00 0.00 C ATOM 941 O LEU A 60 -0.903 -43.633 40.908 1.00 0.00 O ATOM 942 CB LEU A 60 -1.172 -40.543 39.827 1.00 0.00 C ATOM 943 CG LEU A 60 -2.202 -39.516 39.333 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.692 -38.797 38.108 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.541 -40.177 39.044 1.00 0.00 C ATOM 0 H LEU A 60 -1.364 -39.521 42.045 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.566 -41.781 40.875 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.241 -40.021 40.049 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.961 -41.241 39.016 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.352 -38.784 40.127 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.436 -38.074 37.774 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.765 -38.278 38.351 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.506 -39.519 37.313 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.250 -39.426 38.696 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.412 -40.938 38.275 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.922 -40.641 39.954 1.00 0.00 H new ATOM 957 N GLU A 61 0.490 -42.228 41.971 1.00 0.00 N ATOM 958 CA GLU A 61 1.451 -43.275 42.280 1.00 0.00 C ATOM 959 C GLU A 61 0.834 -44.308 43.214 1.00 0.00 C ATOM 960 O GLU A 61 1.131 -45.497 43.116 1.00 0.00 O ATOM 961 CB GLU A 61 2.724 -42.685 42.870 1.00 0.00 C ATOM 962 CG GLU A 61 3.442 -41.761 41.897 1.00 0.00 C ATOM 963 CD GLU A 61 3.877 -42.479 40.637 1.00 0.00 C ATOM 964 OE1 GLU A 61 3.076 -42.555 39.692 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.013 -42.998 40.597 1.00 0.00 O ATOM 0 H GLU A 61 0.751 -41.298 42.300 1.00 0.00 H new ATOM 0 HA GLU A 61 1.721 -43.780 41.353 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.478 -42.133 43.777 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.395 -43.493 43.161 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.784 -40.934 41.632 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.315 -41.329 42.386 1.00 0.00 H new ATOM 972 N LYS A 62 -0.038 -43.844 44.109 1.00 0.00 N ATOM 973 CA LYS A 62 -0.776 -44.735 45.002 1.00 0.00 C ATOM 974 C LYS A 62 -1.657 -45.669 44.170 1.00 0.00 C ATOM 975 O LYS A 62 -1.752 -46.870 44.443 1.00 0.00 O ATOM 976 CB LYS A 62 -1.641 -43.920 45.974 1.00 0.00 C ATOM 977 CG LYS A 62 -2.370 -44.765 47.006 1.00 0.00 C ATOM 978 CD LYS A 62 -3.222 -43.910 47.931 1.00 0.00 C ATOM 979 CE LYS A 62 -3.988 -44.763 48.934 1.00 0.00 C ATOM 980 NZ LYS A 62 -3.092 -45.495 49.863 1.00 0.00 N ATOM 0 H LYS A 62 -0.250 -42.854 44.234 1.00 0.00 H new ATOM 0 HA LYS A 62 -0.069 -45.326 45.584 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.008 -43.199 46.491 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.373 -43.350 45.403 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -3.002 -45.494 46.499 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.645 -45.327 47.595 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.585 -43.204 48.464 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.925 -43.323 47.340 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.659 -44.126 49.509 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.610 -45.478 48.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.660 -45.950 50.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -2.564 -46.221 49.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.423 -44.828 50.298 1.00 0.00 H new ATOM 994 N ILE A 63 -2.288 -45.096 43.144 1.00 0.00 N ATOM 995 CA ILE A 63 -3.146 -45.845 42.229 1.00 0.00 C ATOM 996 C ILE A 63 -2.327 -46.885 41.467 1.00 0.00 C ATOM 997 O ILE A 63 -2.734 -48.042 41.334 1.00 0.00 O ATOM 998 CB ILE A 63 -3.816 -44.893 41.204 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.786 -43.950 41.911 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.536 -45.677 40.110 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.324 -42.857 41.015 1.00 0.00 C ATOM 0 H ILE A 63 -2.218 -44.102 42.926 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.915 -46.340 42.822 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.032 -44.301 40.731 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.621 -44.529 42.306 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.282 -43.495 42.764 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -4.996 -44.982 39.407 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.820 -46.307 39.582 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.308 -46.303 40.559 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.007 -42.224 41.582 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.497 -42.254 40.640 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.857 -43.304 40.176 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.161 -46.462 40.993 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.271 -47.322 40.234 1.00 0.00 C ATOM 1015 C TRP A 64 0.159 -48.544 41.040 1.00 0.00 C ATOM 1016 O TRP A 64 0.277 -49.624 40.500 1.00 0.00 O ATOM 1017 CB TRP A 64 0.946 -46.549 39.715 1.00 0.00 C ATOM 1018 CG TRP A 64 1.895 -47.409 38.941 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.194 -47.670 39.242 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.606 -48.155 37.751 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.729 -48.518 38.301 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.779 -48.833 37.394 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.471 -48.317 36.958 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 2.856 -49.657 36.287 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.552 -49.135 35.852 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.734 -49.799 35.532 1.00 0.00 C ATOM 0 H TRP A 64 -0.809 -45.514 41.126 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.832 -47.680 39.371 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.607 -45.730 39.081 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.473 -46.103 40.558 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.726 -47.271 40.093 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.691 -48.856 38.290 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.451 -47.813 37.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.772 -50.169 36.031 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.316 -49.264 35.222 1.00 0.00 H new ATOM 0 HH2 TRP A 64 1.760 -50.441 34.664 1.00 0.00 H new ATOM 1037 N THR A 65 0.370 -48.367 42.333 1.00 0.00 N ATOM 1038 CA THR A 65 0.766 -49.476 43.199 1.00 0.00 C ATOM 1039 C THR A 65 -0.283 -50.604 43.138 1.00 0.00 C ATOM 1040 O THR A 65 0.044 -51.788 43.232 1.00 0.00 O ATOM 1041 CB THR A 65 0.920 -48.993 44.661 1.00 0.00 C ATOM 1042 OG1 THR A 65 1.743 -47.822 44.697 1.00 0.00 O ATOM 1043 CG2 THR A 65 1.544 -50.070 45.534 1.00 0.00 C ATOM 0 H THR A 65 0.275 -47.470 42.810 1.00 0.00 H new ATOM 0 HA THR A 65 1.724 -49.858 42.847 1.00 0.00 H new ATOM 0 HB THR A 65 -0.073 -48.766 45.048 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.294 -47.092 44.223 1.00 0.00 H new ATOM 0 HG21 THR A 65 1.639 -49.701 46.555 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.910 -50.957 45.526 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.530 -50.326 45.147 1.00 0.00 H new ATOM 1051 N MET A 66 -1.533 -50.209 42.980 1.00 0.00 N ATOM 1052 CA MET A 66 -2.654 -51.134 42.923 1.00 0.00 C ATOM 1053 C MET A 66 -2.762 -51.850 41.564 1.00 0.00 C ATOM 1054 O MET A 66 -3.197 -52.997 41.497 1.00 0.00 O ATOM 1055 CB MET A 66 -3.952 -50.386 43.213 1.00 0.00 C ATOM 1056 CG MET A 66 -4.055 -49.852 44.634 1.00 0.00 C ATOM 1057 SD MET A 66 -4.103 -51.156 45.878 1.00 0.00 S ATOM 1058 CE MET A 66 -5.749 -51.809 45.610 1.00 0.00 C ATOM 0 H MET A 66 -1.803 -49.230 42.887 1.00 0.00 H new ATOM 0 HA MET A 66 -2.480 -51.899 43.679 1.00 0.00 H new ATOM 0 HB2 MET A 66 -4.043 -49.553 42.516 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.793 -51.053 43.025 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.205 -49.199 44.833 1.00 0.00 H new ATOM 0 HG3 MET A 66 -4.953 -49.241 44.722 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.022 -52.460 46.441 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.461 -50.986 45.545 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.767 -52.379 44.681 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.378 -51.167 40.488 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.550 -51.716 39.128 1.00 0.00 C ATOM 1070 C ILE A 67 -1.235 -51.922 38.379 1.00 0.00 C ATOM 1071 O ILE A 67 -1.244 -52.097 37.169 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.463 -50.808 38.267 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.883 -49.385 38.187 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.884 -50.790 38.821 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.644 -48.469 37.259 1.00 0.00 C ATOM 0 H ILE A 67 -1.949 -50.242 40.521 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.010 -52.693 39.277 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.503 -51.216 37.257 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.874 -48.949 39.186 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.846 -49.443 37.856 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.508 -50.146 38.201 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.289 -51.802 38.816 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.872 -50.409 39.842 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.176 -47.485 37.255 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.631 -48.881 36.250 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.675 -48.379 37.601 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.116 -51.912 39.078 1.00 0.00 N ATOM 1088 CA GLU A 68 1.175 -52.158 38.417 1.00 0.00 C ATOM 1089 C GLU A 68 1.205 -53.559 37.822 1.00 0.00 C ATOM 1090 O GLU A 68 1.984 -53.863 36.909 1.00 0.00 O ATOM 1091 CB GLU A 68 2.344 -51.963 39.369 1.00 0.00 C ATOM 1092 CG GLU A 68 2.316 -52.878 40.572 1.00 0.00 C ATOM 1093 CD GLU A 68 3.637 -52.908 41.295 1.00 0.00 C ATOM 1094 OE1 GLU A 68 3.901 -51.999 42.103 1.00 0.00 O ATOM 1095 OE2 GLU A 68 4.429 -53.844 41.049 1.00 0.00 O ATOM 0 H GLU A 68 -0.061 -51.741 40.082 1.00 0.00 H new ATOM 0 HA GLU A 68 1.279 -51.427 37.615 1.00 0.00 H new ATOM 0 HB2 GLU A 68 3.274 -52.125 38.824 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.351 -50.928 39.712 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.536 -52.549 41.258 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.055 -53.887 40.253 1.00 0.00 H new ATOM 1102 N ASN A 69 0.368 -54.412 38.358 1.00 0.00 N ATOM 1103 CA ASN A 69 0.178 -55.720 37.821 1.00 0.00 C ATOM 1104 C ASN A 69 -1.051 -55.681 36.947 1.00 0.00 C ATOM 1105 O ASN A 69 -2.011 -54.991 37.269 1.00 0.00 O ATOM 1106 CB ASN A 69 0.032 -56.767 38.936 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.114 -56.470 39.892 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -2.266 -57.064 39.646 1.00 0.00 O flip ATOM 1109 ND2 ASN A 69 -0.951 -55.726 40.857 1.00 0.00 N flip ATOM 0 H ASN A 69 -0.199 -54.210 39.182 1.00 0.00 H new ATOM 0 HA ASN A 69 1.049 -56.013 37.235 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.124 -57.748 38.486 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.963 -56.819 39.500 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -0.045 -55.285 41.014 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.722 -55.550 41.501 1.00 0.00 H new ATOM 1116 N GLU A 70 -0.995 -56.389 35.826 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.079 -56.425 34.830 1.00 0.00 C ATOM 1118 C GLU A 70 -2.138 -55.130 34.001 1.00 0.00 C ATOM 1119 O GLU A 70 -2.793 -55.088 32.964 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.443 -56.707 35.477 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.456 -57.949 36.340 1.00 0.00 C ATOM 1122 CD GLU A 70 -4.826 -58.298 36.865 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -5.738 -58.521 36.051 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -4.986 -58.398 38.099 1.00 0.00 O ATOM 0 H GLU A 70 -0.191 -56.963 35.572 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.849 -57.249 34.155 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.733 -55.849 36.084 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.193 -56.811 34.693 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.072 -58.789 35.761 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -2.778 -57.805 37.181 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.448 -54.088 34.450 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.392 -52.847 33.708 1.00 0.00 C ATOM 1133 C ALA A 71 0.046 -52.391 33.548 1.00 0.00 C ATOM 1134 O ALA A 71 0.905 -52.718 34.371 1.00 0.00 O ATOM 1135 CB ALA A 71 -2.226 -51.768 34.384 1.00 0.00 C ATOM 0 H ALA A 71 -0.922 -54.084 35.324 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.812 -53.024 32.718 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.166 -50.846 33.806 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.265 -52.094 34.441 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.845 -51.591 35.390 1.00 0.00 H new ATOM 1141 N ASN A 72 0.311 -51.689 32.476 1.00 0.00 N ATOM 1142 CA ASN A 72 1.624 -51.149 32.211 1.00 0.00 C ATOM 1143 C ASN A 72 1.558 -49.650 32.198 1.00 0.00 C ATOM 1144 O ASN A 72 0.537 -49.065 31.821 1.00 0.00 O ATOM 1145 CB ASN A 72 2.155 -51.625 30.871 1.00 0.00 C ATOM 1146 CG ASN A 72 2.386 -53.114 30.815 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.724 -53.739 31.817 1.00 0.00 O ATOM 1148 ND2 ASN A 72 2.202 -53.699 29.647 1.00 0.00 N ATOM 0 H ASN A 72 -0.380 -51.474 31.757 1.00 0.00 H new ATOM 0 HA ASN A 72 2.294 -51.495 32.998 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.450 -51.344 30.088 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.092 -51.111 30.656 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.341 -54.705 29.553 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.921 -53.145 28.838 1.00 0.00 H new ATOM 1155 N ARG A 73 2.629 -49.026 32.586 1.00 0.00 N ATOM 1156 CA ARG A 73 2.686 -47.616 32.623 1.00 0.00 C ATOM 1157 C ARG A 73 3.128 -47.060 31.274 1.00 0.00 C ATOM 1158 O ARG A 73 4.292 -47.187 30.884 1.00 0.00 O ATOM 1159 CB ARG A 73 3.597 -47.151 33.752 1.00 0.00 C ATOM 1160 CG ARG A 73 4.050 -45.729 33.602 1.00 0.00 C ATOM 1161 CD ARG A 73 4.555 -45.149 34.907 1.00 0.00 C ATOM 1162 NE ARG A 73 3.453 -44.944 35.851 1.00 0.00 N ATOM 1163 CZ ARG A 73 3.567 -44.367 37.045 1.00 0.00 C ATOM 1164 NH1 ARG A 73 4.749 -43.964 37.500 1.00 0.00 N ATOM 1165 NH2 ARG A 73 2.498 -44.195 37.794 1.00 0.00 N ATOM 0 H ARG A 73 3.486 -49.492 32.885 1.00 0.00 H new ATOM 0 HA ARG A 73 1.687 -47.228 32.823 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.072 -47.259 34.701 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.471 -47.801 33.795 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.841 -45.678 32.854 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.223 -45.123 33.233 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.294 -45.819 35.345 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.058 -44.201 34.717 1.00 0.00 H new ATOM 0 HE ARG A 73 2.527 -45.269 35.571 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.586 -44.095 36.932 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.819 -43.523 38.417 1.00 0.00 H new ATOM 0 HH21 ARG A 73 1.585 -44.504 37.459 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.582 -43.753 38.709 1.00 0.00 H new ATOM 1179 N ASP A 74 2.181 -46.487 30.552 1.00 0.00 N ATOM 1180 CA ASP A 74 2.459 -45.899 29.250 1.00 0.00 C ATOM 1181 C ASP A 74 3.054 -44.518 29.422 1.00 0.00 C ATOM 1182 O ASP A 74 3.988 -44.133 28.725 1.00 0.00 O ATOM 1183 CB ASP A 74 1.181 -45.815 28.417 1.00 0.00 C ATOM 1184 CG ASP A 74 1.449 -45.457 26.972 1.00 0.00 C ATOM 1185 OD1 ASP A 74 1.879 -46.346 26.207 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.210 -44.299 26.584 1.00 0.00 O ATOM 0 H ASP A 74 1.207 -46.415 30.846 1.00 0.00 H new ATOM 0 HA ASP A 74 3.174 -46.534 28.728 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.661 -46.772 28.460 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.515 -45.071 28.854 1.00 0.00 H new ATOM 1191 N LYS A 75 2.503 -43.780 30.364 1.00 0.00 N ATOM 1192 CA LYS A 75 2.936 -42.431 30.640 1.00 0.00 C ATOM 1193 C LYS A 75 3.009 -42.229 32.145 1.00 0.00 C ATOM 1194 O LYS A 75 2.119 -42.675 32.875 1.00 0.00 O ATOM 1195 CB LYS A 75 1.940 -41.436 30.022 1.00 0.00 C ATOM 1196 CG LYS A 75 2.340 -39.971 30.154 1.00 0.00 C ATOM 1197 CD LYS A 75 3.573 -39.656 29.326 1.00 0.00 C ATOM 1198 CE LYS A 75 3.988 -38.201 29.477 1.00 0.00 C ATOM 1199 NZ LYS A 75 4.367 -37.877 30.877 1.00 0.00 N ATOM 0 H LYS A 75 1.740 -44.102 30.960 1.00 0.00 H new ATOM 0 HA LYS A 75 3.921 -42.262 30.205 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.820 -41.672 28.965 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.967 -41.577 30.493 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.513 -39.336 29.834 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.534 -39.738 31.201 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.394 -40.304 29.633 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.373 -39.871 28.276 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.829 -37.992 28.815 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.168 -37.555 29.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.005 -37.056 30.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.512 -37.655 31.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.849 -38.693 31.304 1.00 0.00 H new ATOM 1213 N GLU A 76 4.061 -41.587 32.612 1.00 0.00 N ATOM 1214 CA GLU A 76 4.203 -41.302 34.018 1.00 0.00 C ATOM 1215 C GLU A 76 3.379 -40.067 34.357 1.00 0.00 C ATOM 1216 O GLU A 76 3.156 -39.218 33.483 1.00 0.00 O ATOM 1217 CB GLU A 76 5.689 -41.111 34.411 1.00 0.00 C ATOM 1218 CG GLU A 76 6.398 -39.938 33.733 1.00 0.00 C ATOM 1219 CD GLU A 76 6.717 -40.197 32.277 1.00 0.00 C ATOM 1220 OE1 GLU A 76 5.839 -39.976 31.426 1.00 0.00 O ATOM 1221 OE2 GLU A 76 7.843 -40.628 31.976 1.00 0.00 O ATOM 0 H GLU A 76 4.831 -41.253 32.032 1.00 0.00 H new ATOM 0 HA GLU A 76 3.834 -42.151 34.593 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.748 -40.975 35.491 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.231 -42.027 34.175 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.771 -39.050 33.809 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.323 -39.722 34.268 1.00 0.00 H new ATOM 1228 N PRO A 77 2.897 -39.949 35.610 1.00 0.00 N ATOM 1229 CA PRO A 77 2.055 -38.827 36.025 1.00 0.00 C ATOM 1230 C PRO A 77 2.722 -37.482 35.780 1.00 0.00 C ATOM 1231 O PRO A 77 3.886 -37.263 36.146 1.00 0.00 O ATOM 1232 CB PRO A 77 1.850 -39.054 37.532 1.00 0.00 C ATOM 1233 CG PRO A 77 2.914 -40.021 37.922 1.00 0.00 C ATOM 1234 CD PRO A 77 3.134 -40.881 36.717 1.00 0.00 C ATOM 0 HA PRO A 77 1.124 -38.795 35.459 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.941 -38.121 38.088 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.857 -39.454 37.740 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.830 -39.503 38.207 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.606 -40.619 38.780 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.143 -41.292 36.691 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.445 -41.725 36.690 1.00 0.00 H new ATOM 1242 N ASN A 78 1.982 -36.589 35.163 1.00 0.00 N ATOM 1243 CA ASN A 78 2.471 -35.264 34.862 1.00 0.00 C ATOM 1244 C ASN A 78 1.341 -34.256 34.927 1.00 0.00 C ATOM 1245 O ASN A 78 0.168 -34.622 34.923 1.00 0.00 O ATOM 1246 CB ASN A 78 3.136 -35.223 33.482 1.00 0.00 C ATOM 1247 CG ASN A 78 2.205 -35.628 32.359 1.00 0.00 C ATOM 1248 OD1 ASN A 78 2.131 -36.792 31.990 1.00 0.00 O ATOM 1249 ND2 ASN A 78 1.509 -34.671 31.800 1.00 0.00 N ATOM 0 H ASN A 78 1.025 -36.761 34.856 1.00 0.00 H new ATOM 0 HA ASN A 78 3.220 -35.004 35.610 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.505 -34.215 33.294 1.00 0.00 H new ATOM 0 HB3 ASN A 78 4.002 -35.885 33.483 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.877 -34.884 31.028 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.598 -33.712 32.136 1.00 0.00 H new ATOM 1256 N PHE A 79 1.699 -32.993 34.966 1.00 0.00 N ATOM 1257 CA PHE A 79 0.729 -31.915 35.058 1.00 0.00 C ATOM 1258 C PHE A 79 0.370 -31.383 33.664 1.00 0.00 C ATOM 1259 O PHE A 79 1.250 -30.985 32.897 1.00 0.00 O ATOM 1260 CB PHE A 79 1.313 -30.798 35.930 1.00 0.00 C ATOM 1261 CG PHE A 79 0.411 -29.616 36.152 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.581 -29.659 37.118 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.569 -28.455 35.412 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.398 -28.569 37.342 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.250 -27.365 35.628 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.232 -27.420 36.595 1.00 0.00 C ATOM 0 H PHE A 79 2.669 -32.679 34.935 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.188 -32.291 35.511 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.578 -31.218 36.900 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.237 -30.447 35.471 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.717 -30.556 37.703 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.341 -28.402 34.658 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.166 -28.615 38.100 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.122 -26.469 35.039 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.870 -26.566 36.767 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.922 -31.410 33.343 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.439 -30.903 32.069 1.00 0.00 C ATOM 1278 C GLU A 80 -2.824 -30.305 32.230 1.00 0.00 C ATOM 1279 O GLU A 80 -3.760 -30.991 32.644 1.00 0.00 O ATOM 1280 CB GLU A 80 -1.503 -32.000 31.003 1.00 0.00 C ATOM 1281 CG GLU A 80 -0.178 -32.361 30.393 1.00 0.00 C ATOM 1282 CD GLU A 80 -0.312 -33.407 29.313 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -0.514 -33.033 28.145 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -0.210 -34.612 29.626 1.00 0.00 O ATOM 0 H GLU A 80 -1.643 -31.785 33.959 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.742 -30.129 31.746 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.939 -32.895 31.448 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -2.177 -31.678 30.209 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.283 -31.466 29.974 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.490 -32.729 31.172 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.944 -29.035 31.907 1.00 0.00 N ATOM 1292 CA GLY A 81 -4.231 -28.372 31.929 1.00 0.00 C ATOM 1293 C GLY A 81 -4.847 -28.267 33.314 1.00 0.00 C ATOM 1294 O GLY A 81 -6.050 -28.420 33.455 1.00 0.00 O ATOM 0 H GLY A 81 -2.165 -28.440 31.626 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.119 -27.370 31.515 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.918 -28.912 31.277 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.006 -28.004 34.335 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.449 -27.867 35.750 1.00 0.00 C ATOM 1300 C ARG A 82 -4.772 -29.229 36.363 1.00 0.00 C ATOM 1301 O ARG A 82 -5.165 -29.325 37.525 1.00 0.00 O ATOM 1302 CB ARG A 82 -5.664 -26.947 35.858 1.00 0.00 C ATOM 1303 CG ARG A 82 -5.431 -25.563 35.282 1.00 0.00 C ATOM 1304 CD ARG A 82 -6.697 -24.740 35.306 1.00 0.00 C ATOM 1305 NE ARG A 82 -6.546 -23.494 34.556 1.00 0.00 N ATOM 1306 CZ ARG A 82 -7.525 -22.918 33.854 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -8.752 -23.439 33.861 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -7.281 -21.828 33.152 1.00 0.00 N ATOM 0 H ARG A 82 -3.001 -27.880 34.209 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.624 -27.423 36.307 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.506 -27.409 35.342 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.945 -26.852 36.907 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.653 -25.055 35.853 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.070 -25.649 34.257 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -7.517 -25.321 34.885 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.964 -24.513 36.338 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.635 -23.036 34.570 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.946 -24.281 34.404 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.497 -22.996 33.323 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.344 -21.425 33.145 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -8.029 -21.388 32.616 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.594 -30.269 35.574 1.00 0.00 N ATOM 1323 CA TYR A 83 -4.837 -31.629 36.010 1.00 0.00 C ATOM 1324 C TYR A 83 -3.552 -32.421 35.963 1.00 0.00 C ATOM 1325 O TYR A 83 -2.686 -32.155 35.142 1.00 0.00 O ATOM 1326 CB TYR A 83 -5.865 -32.316 35.097 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.270 -31.767 35.183 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.639 -30.630 34.481 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.233 -32.401 35.949 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -8.926 -30.132 34.545 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.522 -31.912 36.016 1.00 0.00 C ATOM 1332 CZ TYR A 83 -9.862 -30.777 35.313 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.146 -30.286 35.381 1.00 0.00 O ATOM 0 H TYR A 83 -4.275 -30.194 34.608 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.222 -31.593 37.029 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.523 -32.234 34.065 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.891 -33.378 35.341 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -6.905 -30.123 33.872 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.972 -33.291 36.502 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.193 -29.242 33.995 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.262 -32.418 36.618 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.685 -30.859 35.966 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.425 -33.371 36.835 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.300 -34.273 36.797 1.00 0.00 C ATOM 1345 C VAL A 84 -2.824 -35.596 36.252 1.00 0.00 C ATOM 1346 O VAL A 84 -3.833 -36.104 36.739 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.683 -34.477 38.213 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.610 -35.544 38.197 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.115 -33.174 38.745 1.00 0.00 C ATOM 0 H VAL A 84 -4.088 -33.549 37.590 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.508 -33.866 36.168 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.483 -34.808 38.875 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.199 -35.662 39.200 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.042 -36.489 37.868 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.185 -35.250 37.512 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.689 -33.340 39.735 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.337 -32.814 38.071 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.910 -32.431 38.812 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.186 -36.138 35.236 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.725 -37.332 34.596 1.00 0.00 C ATOM 1361 C ASN A 85 -1.683 -38.415 34.368 1.00 0.00 C ATOM 1362 O ASN A 85 -0.478 -38.163 34.404 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.419 -36.969 33.272 1.00 0.00 C ATOM 1364 CG ASN A 85 -2.454 -36.561 32.173 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -1.972 -37.399 31.412 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -2.178 -35.274 32.072 1.00 0.00 N ATOM 0 H ASN A 85 -1.315 -35.786 34.839 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.457 -37.747 35.289 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.004 -37.823 32.932 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.120 -36.153 33.450 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.545 -34.944 31.344 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.598 -34.610 32.722 1.00 0.00 H new ATOM 1373 N MET A 86 -2.180 -39.633 34.156 1.00 0.00 N ATOM 1374 CA MET A 86 -1.357 -40.802 33.890 1.00 0.00 C ATOM 1375 C MET A 86 -2.071 -41.701 32.878 1.00 0.00 C ATOM 1376 O MET A 86 -3.303 -41.781 32.876 1.00 0.00 O ATOM 1377 CB MET A 86 -1.139 -41.603 35.176 1.00 0.00 C ATOM 1378 CG MET A 86 -0.119 -42.726 35.037 1.00 0.00 C ATOM 1379 SD MET A 86 -0.414 -44.110 36.166 1.00 0.00 S ATOM 1380 CE MET A 86 -0.664 -43.260 37.710 1.00 0.00 C ATOM 0 H MET A 86 -3.180 -39.833 34.165 1.00 0.00 H new ATOM 0 HA MET A 86 -0.395 -40.470 33.499 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.813 -40.925 35.964 1.00 0.00 H new ATOM 0 HB3 MET A 86 -2.091 -42.027 35.494 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.133 -43.094 34.011 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.878 -42.325 35.218 1.00 0.00 H new ATOM 0 HE1 MET A 86 -0.786 -43.989 38.511 1.00 0.00 H new ATOM 0 HE2 MET A 86 0.199 -42.629 37.922 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.559 -42.641 37.644 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.309 -42.364 32.024 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.869 -43.311 31.072 1.00 0.00 C ATOM 1392 C LEU A 87 -1.388 -44.720 31.352 1.00 0.00 C ATOM 1393 O LEU A 87 -0.182 -44.961 31.494 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.531 -42.920 29.638 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.469 -41.920 28.974 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.844 -41.378 27.699 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.800 -42.596 28.655 1.00 0.00 C ATOM 0 H LEU A 87 -0.295 -42.263 31.970 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.952 -43.284 31.191 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.523 -42.505 29.625 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.511 -43.826 29.032 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.642 -41.090 29.658 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.525 -40.665 27.235 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.904 -40.880 27.938 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.654 -42.200 27.009 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.468 -41.878 28.180 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.630 -43.434 27.980 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.254 -42.959 29.577 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.324 -45.647 31.432 1.00 0.00 N ATOM 1410 CA VAL A 88 -2.004 -47.038 31.669 1.00 0.00 C ATOM 1411 C VAL A 88 -2.508 -47.910 30.532 1.00 0.00 C ATOM 1412 O VAL A 88 -3.651 -47.771 30.077 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.577 -47.556 33.015 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.954 -46.809 34.184 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.095 -47.433 33.050 1.00 0.00 C ATOM 0 H VAL A 88 -3.321 -45.457 31.335 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.917 -47.101 31.722 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.323 -48.612 33.103 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.368 -47.186 35.119 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.874 -46.960 34.178 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.172 -45.745 34.094 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.468 -47.803 34.005 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.378 -46.387 32.931 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.526 -48.020 32.239 1.00 0.00 H new ATOM 1425 N THR A 89 -1.651 -48.778 30.057 1.00 0.00 N ATOM 1426 CA THR A 89 -1.991 -49.688 28.991 1.00 0.00 C ATOM 1427 C THR A 89 -2.193 -51.077 29.581 1.00 0.00 C ATOM 1428 O THR A 89 -1.475 -51.460 30.490 1.00 0.00 O ATOM 1429 CB THR A 89 -0.853 -49.737 27.939 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.459 -48.409 27.587 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.280 -50.467 26.684 1.00 0.00 C ATOM 0 H THR A 89 -0.695 -48.874 30.399 1.00 0.00 H new ATOM 0 HA THR A 89 -2.904 -49.347 28.502 1.00 0.00 H new ATOM 0 HB THR A 89 -0.018 -50.276 28.387 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.246 -47.899 27.302 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.455 -50.480 25.972 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.558 -51.491 26.935 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.135 -49.957 26.240 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.175 -51.837 29.098 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.416 -53.194 29.588 1.00 0.00 C ATOM 1441 C PRO A 90 -2.195 -54.085 29.330 1.00 0.00 C ATOM 1442 O PRO A 90 -1.474 -53.892 28.345 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.644 -53.653 28.784 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.643 -52.779 27.575 1.00 0.00 C ATOM 1445 CD PRO A 90 -4.123 -51.453 28.046 1.00 0.00 C ATOM 0 HA PRO A 90 -3.586 -53.244 30.663 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.571 -54.706 28.513 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.562 -53.535 29.359 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.010 -53.194 26.790 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.646 -52.683 27.158 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.635 -50.900 27.243 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.921 -50.818 28.431 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.961 -55.035 30.227 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.779 -55.893 30.161 1.00 0.00 C ATOM 1455 C LYS A 91 -0.706 -56.634 28.821 1.00 0.00 C ATOM 1456 O LYS A 91 -1.711 -57.170 28.333 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.793 -56.896 31.323 1.00 0.00 C ATOM 1458 CG LYS A 91 0.518 -57.637 31.540 1.00 0.00 C ATOM 1459 CD LYS A 91 1.614 -56.712 32.064 1.00 0.00 C ATOM 1460 CE LYS A 91 1.305 -56.173 33.461 1.00 0.00 C ATOM 1461 NZ LYS A 91 2.412 -55.324 33.989 1.00 0.00 N ATOM 0 H LYS A 91 -2.578 -55.233 31.015 1.00 0.00 H new ATOM 0 HA LYS A 91 0.105 -55.261 30.244 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.051 -56.366 32.240 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.582 -57.626 31.145 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.362 -58.452 32.247 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.841 -58.087 30.601 1.00 0.00 H new ATOM 0 HD2 LYS A 91 2.561 -57.252 32.087 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.740 -55.877 31.375 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.384 -55.590 33.429 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.131 -57.007 34.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.122 -54.897 34.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.258 -55.910 34.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.630 -54.572 33.304 1.00 0.00 H new ATOM 1475 N LYS A 92 0.485 -56.658 28.236 1.00 0.00 N ATOM 1476 CA LYS A 92 0.699 -57.286 26.942 1.00 0.00 C ATOM 1477 C LYS A 92 0.813 -58.802 27.084 1.00 0.00 C ATOM 1478 O LYS A 92 0.769 -59.337 28.196 1.00 0.00 O ATOM 1479 CB LYS A 92 1.964 -56.722 26.272 1.00 0.00 C ATOM 1480 CG LYS A 92 3.274 -57.159 26.925 1.00 0.00 C ATOM 1481 CD LYS A 92 4.480 -56.572 26.202 1.00 0.00 C ATOM 1482 CE LYS A 92 5.791 -57.167 26.714 1.00 0.00 C ATOM 1483 NZ LYS A 92 6.079 -56.794 28.124 1.00 0.00 N ATOM 0 H LYS A 92 1.324 -56.245 28.644 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.163 -57.063 26.313 1.00 0.00 H new ATOM 0 HB2 LYS A 92 1.974 -57.029 25.226 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.912 -55.633 26.284 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.285 -56.844 27.968 1.00 0.00 H new ATOM 0 HG3 LYS A 92 3.339 -58.247 26.920 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.389 -56.759 25.132 1.00 0.00 H new ATOM 0 HD3 LYS A 92 4.494 -55.490 26.337 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.749 -58.253 26.631 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.610 -56.830 26.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 6.979 -57.224 28.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 6.147 -55.759 28.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 5.313 -57.138 28.737 1.00 0.00 H new ATOM 1497 N ALA A 93 0.951 -59.484 25.960 1.00 0.00 N ATOM 1498 CA ALA A 93 1.073 -60.933 25.949 1.00 0.00 C ATOM 1499 C ALA A 93 2.415 -61.373 26.515 1.00 0.00 C ATOM 1500 O ALA A 93 3.409 -60.644 26.422 1.00 0.00 O ATOM 1501 CB ALA A 93 0.884 -61.474 24.543 1.00 0.00 C ATOM 0 H ALA A 93 0.982 -59.054 25.036 1.00 0.00 H new ATOM 0 HA ALA A 93 0.288 -61.342 26.586 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.979 -62.560 24.555 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.106 -61.200 24.178 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.643 -61.051 23.885 1.00 0.00 H new ATOM 1507 N GLU A 94 2.433 -62.556 27.103 1.00 0.00 N ATOM 1508 CA GLU A 94 3.633 -63.112 27.706 1.00 0.00 C ATOM 1509 C GLU A 94 4.683 -63.445 26.647 1.00 0.00 C ATOM 1510 O GLU A 94 4.352 -63.743 25.504 1.00 0.00 O ATOM 1511 CB GLU A 94 3.277 -64.373 28.484 1.00 0.00 C ATOM 1512 CG GLU A 94 2.409 -64.117 29.703 1.00 0.00 C ATOM 1513 CD GLU A 94 1.968 -65.397 30.367 1.00 0.00 C ATOM 1514 OE1 GLU A 94 1.322 -66.226 29.692 1.00 0.00 O ATOM 1515 OE2 GLU A 94 2.278 -65.596 31.561 1.00 0.00 O ATOM 0 H GLU A 94 1.614 -63.160 27.176 1.00 0.00 H new ATOM 0 HA GLU A 94 4.052 -62.365 28.379 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.759 -65.064 27.819 1.00 0.00 H new ATOM 0 HB3 GLU A 94 4.197 -64.865 28.801 1.00 0.00 H new ATOM 0 HG2 GLU A 94 2.962 -63.510 30.420 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.531 -63.542 29.408 1.00 0.00 H new ATOM 1522 N GLY A 95 5.947 -63.383 27.043 1.00 0.00 N ATOM 1523 CA GLY A 95 7.040 -63.702 26.137 1.00 0.00 C ATOM 1524 C GLY A 95 7.036 -65.160 25.711 1.00 0.00 C ATOM 1525 O GLY A 95 7.441 -65.484 24.589 1.00 0.00 O ATOM 0 H GLY A 95 6.240 -63.116 27.983 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.971 -63.068 25.253 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.989 -63.471 26.622 1.00 0.00 H new ATOM 1529 N HIS A 96 6.590 -66.036 26.625 1.00 0.00 N ATOM 1530 CA HIS A 96 6.516 -67.493 26.391 1.00 0.00 C ATOM 1531 C HIS A 96 7.911 -68.116 26.398 1.00 0.00 C ATOM 1532 O HIS A 96 8.253 -68.882 27.292 1.00 0.00 O ATOM 1533 CB HIS A 96 5.775 -67.811 25.075 1.00 0.00 C ATOM 1534 CG HIS A 96 5.471 -69.266 24.871 1.00 0.00 C ATOM 1535 ND1 HIS A 96 6.244 -70.096 24.092 1.00 0.00 N ATOM 1536 CD2 HIS A 96 4.460 -70.032 25.335 1.00 0.00 C ATOM 1537 CE1 HIS A 96 5.717 -71.309 24.085 1.00 0.00 C ATOM 1538 NE2 HIS A 96 4.638 -71.296 24.830 1.00 0.00 N ATOM 0 H HIS A 96 6.269 -65.756 27.552 1.00 0.00 H new ATOM 0 HA HIS A 96 5.944 -67.934 27.208 1.00 0.00 H new ATOM 0 HB2 HIS A 96 4.840 -67.251 25.054 1.00 0.00 H new ATOM 0 HB3 HIS A 96 6.378 -67.457 24.238 1.00 0.00 H new ATOM 0 HD2 HIS A 96 3.659 -69.709 25.984 1.00 0.00 H new ATOM 0 HE1 HIS A 96 6.109 -72.165 23.556 1.00 0.00 H new ATOM 0 HE2 HIS A 96 4.030 -72.096 25.006 1.00 0.00 H new ATOM 1546 N HIS A 97 8.706 -67.774 25.409 1.00 0.00 N ATOM 1547 CA HIS A 97 10.079 -68.243 25.314 1.00 0.00 C ATOM 1548 C HIS A 97 10.988 -67.068 25.067 1.00 0.00 C ATOM 1549 O HIS A 97 10.621 -66.140 24.346 1.00 0.00 O ATOM 1550 CB HIS A 97 10.246 -69.273 24.187 1.00 0.00 C ATOM 1551 CG HIS A 97 9.785 -70.651 24.543 1.00 0.00 C ATOM 1552 ND1 HIS A 97 9.252 -71.529 23.623 1.00 0.00 N ATOM 1553 CD2 HIS A 97 9.798 -71.311 25.721 1.00 0.00 C ATOM 1554 CE1 HIS A 97 8.959 -72.667 24.228 1.00 0.00 C ATOM 1555 NE2 HIS A 97 9.279 -72.558 25.497 1.00 0.00 N ATOM 0 H HIS A 97 8.422 -67.162 24.644 1.00 0.00 H new ATOM 0 HA HIS A 97 10.341 -68.731 26.253 1.00 0.00 H new ATOM 0 HB2 HIS A 97 9.692 -68.931 23.313 1.00 0.00 H new ATOM 0 HB3 HIS A 97 11.297 -69.316 23.902 1.00 0.00 H new ATOM 0 HD2 HIS A 97 10.152 -70.926 26.666 1.00 0.00 H new ATOM 0 HE1 HIS A 97 8.529 -73.539 23.758 1.00 0.00 H new ATOM 0 HE2 HIS A 97 9.160 -73.285 26.202 1.00 0.00 H new ATOM 1563 N HIS A 98 12.161 -67.080 25.664 1.00 0.00 N ATOM 1564 CA HIS A 98 13.104 -66.002 25.453 1.00 0.00 C ATOM 1565 C HIS A 98 13.813 -66.206 24.121 1.00 0.00 C ATOM 1566 O HIS A 98 14.835 -66.892 24.041 1.00 0.00 O ATOM 1567 CB HIS A 98 14.117 -65.926 26.600 1.00 0.00 C ATOM 1568 CG HIS A 98 14.976 -64.703 26.558 1.00 0.00 C ATOM 1569 ND1 HIS A 98 16.238 -64.683 26.003 1.00 0.00 N ATOM 1570 CD2 HIS A 98 14.751 -63.448 27.008 1.00 0.00 C ATOM 1571 CE1 HIS A 98 16.744 -63.469 26.114 1.00 0.00 C ATOM 1572 NE2 HIS A 98 15.863 -62.706 26.715 1.00 0.00 N ATOM 0 H HIS A 98 12.482 -67.816 26.293 1.00 0.00 H new ATOM 0 HA HIS A 98 12.562 -65.057 25.431 1.00 0.00 H new ATOM 0 HB2 HIS A 98 13.582 -65.952 27.549 1.00 0.00 H new ATOM 0 HB3 HIS A 98 14.755 -66.809 26.570 1.00 0.00 H new ATOM 0 HD2 HIS A 98 13.860 -63.096 27.506 1.00 0.00 H new ATOM 0 HE1 HIS A 98 17.718 -63.157 25.768 1.00 0.00 H new ATOM 0 HE2 HIS A 98 15.987 -61.717 26.930 1.00 0.00 H new ATOM 1580 N HIS A 99 13.244 -65.644 23.073 1.00 0.00 N ATOM 1581 CA HIS A 99 13.801 -65.795 21.741 1.00 0.00 C ATOM 1582 C HIS A 99 14.304 -64.453 21.225 1.00 0.00 C ATOM 1583 O HIS A 99 14.947 -64.378 20.179 1.00 0.00 O ATOM 1584 CB HIS A 99 12.737 -66.380 20.799 1.00 0.00 C ATOM 1585 CG HIS A 99 13.291 -66.952 19.526 1.00 0.00 C ATOM 1586 ND1 HIS A 99 13.123 -66.363 18.298 1.00 0.00 N ATOM 1587 CD2 HIS A 99 13.998 -68.087 19.303 1.00 0.00 C ATOM 1588 CE1 HIS A 99 13.702 -67.112 17.370 1.00 0.00 C ATOM 1589 NE2 HIS A 99 14.238 -68.160 17.957 1.00 0.00 N ATOM 0 H HIS A 99 12.396 -65.078 23.117 1.00 0.00 H new ATOM 0 HA HIS A 99 14.647 -66.481 21.780 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.190 -67.161 21.327 1.00 0.00 H new ATOM 0 HB3 HIS A 99 12.018 -65.599 20.551 1.00 0.00 H new ATOM 0 HD2 HIS A 99 14.314 -68.801 20.049 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.729 -66.898 16.312 1.00 0.00 H new ATOM 0 HE2 HIS A 99 14.750 -68.906 17.486 1.00 0.00 H new ATOM 1597 N HIS A 100 14.005 -63.397 21.964 1.00 0.00 N ATOM 1598 CA HIS A 100 14.423 -62.055 21.586 1.00 0.00 C ATOM 1599 C HIS A 100 15.523 -61.571 22.508 1.00 0.00 C ATOM 1600 O HIS A 100 15.322 -61.442 23.719 1.00 0.00 O ATOM 1601 CB HIS A 100 13.239 -61.082 21.616 1.00 0.00 C ATOM 1602 CG HIS A 100 12.143 -61.443 20.659 1.00 0.00 C ATOM 1603 ND1 HIS A 100 12.209 -61.195 19.300 1.00 0.00 N ATOM 1604 CD2 HIS A 100 10.957 -62.060 20.864 1.00 0.00 C ATOM 1605 CE1 HIS A 100 11.110 -61.650 18.718 1.00 0.00 C ATOM 1606 NE2 HIS A 100 10.339 -62.177 19.642 1.00 0.00 N ATOM 0 H HIS A 100 13.472 -63.443 22.833 1.00 0.00 H new ATOM 0 HA HIS A 100 14.806 -62.092 20.566 1.00 0.00 H new ATOM 0 HB2 HIS A 100 12.832 -61.049 22.627 1.00 0.00 H new ATOM 0 HB3 HIS A 100 13.597 -60.079 21.384 1.00 0.00 H new ATOM 0 HD2 HIS A 100 10.567 -62.398 21.813 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.886 -61.597 17.663 1.00 0.00 H new ATOM 0 HE2 HIS A 100 9.427 -62.605 19.479 1.00 0.00 H new ATOM 1614 N HIS A 101 16.679 -61.315 21.933 1.00 0.00 N ATOM 1615 CA HIS A 101 17.843 -60.879 22.686 1.00 0.00 C ATOM 1616 C HIS A 101 17.853 -59.354 22.826 1.00 0.00 C ATOM 1617 O HIS A 101 17.539 -58.855 23.924 1.00 0.00 O ATOM 1618 CB HIS A 101 19.120 -61.380 21.998 1.00 0.00 C ATOM 1619 CG HIS A 101 20.390 -61.039 22.721 1.00 0.00 C ATOM 1620 ND1 HIS A 101 20.779 -61.646 23.902 1.00 0.00 N ATOM 1621 CD2 HIS A 101 21.375 -60.163 22.416 1.00 0.00 C ATOM 1622 CE1 HIS A 101 21.947 -61.148 24.284 1.00 0.00 C ATOM 1623 NE2 HIS A 101 22.325 -60.252 23.402 1.00 0.00 N ATOM 1624 OXT HIS A 101 18.154 -58.659 21.830 1.00 0.00 O ATOM 0 H HIS A 101 16.842 -61.402 20.930 1.00 0.00 H new ATOM 0 HA HIS A 101 17.800 -61.303 23.689 1.00 0.00 H new ATOM 0 HB2 HIS A 101 19.058 -62.463 21.889 1.00 0.00 H new ATOM 0 HB3 HIS A 101 19.165 -60.960 20.993 1.00 0.00 H new ATOM 0 HD2 HIS A 101 21.408 -59.513 21.554 1.00 0.00 H new ATOM 0 HE1 HIS A 101 22.495 -61.431 25.171 1.00 0.00 H new ATOM 0 HE2 HIS A 101 23.187 -59.709 23.443 1.00 0.00 H new TER 1632 HIS A 101