USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1626 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 73 GLN : amide:sc= -0.516 K(o=-2.2,f=-1.4!) USER MOD Set 1.2: B 97 GLN : amide:sc= -1.68 K(o=-2.2,f=-0.093) USER MOD Set 2.1: B 81 CYS SG : rot -56:sc= -3.46! USER MOD Set 2.2: B 85 MET CE :methyl 163:sc= 0 (180deg=-0.0453) USER MOD Set 3.1: A 76 CYS SG : rot -51:sc= 0.455! USER MOD Set 3.2: B 80 SER OG : rot 151:sc= 1 USER MOD Set 4.1: A 80 SER OG : rot 153:sc= 1.16 USER MOD Set 4.2: B 76 CYS SG : rot -53:sc= 0.403! USER MOD Set 5.1: A 97 GLN : amide:sc= -1.64 K(o=-2.2,f=-0.077) USER MOD Set 5.2: B 73 GLN : amide:sc= -0.528 K(o=-2.2,f=-1.4!) USER MOD Set 6.1: A 81 CYS SG : rot -48:sc= -3.34 USER MOD Set 6.2: A 85 MET CE :methyl -160:sc= 0 (180deg=-0.0355) USER MOD Single : A 1 MET CE :methyl -152:sc= -0.29 (180deg=-1.37!) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.0195 (180deg=-0.239) USER MOD Single : A 3 CYS SG : rot 102:sc= 0.0101 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -157:sc= -0.128 (180deg=-1.2) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -160:sc= 0.0769 USER MOD Single : A 17 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-0.68) USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0177) USER MOD Single : A 19 TYR OH : rot 165:sc= -0.135 USER MOD Single : A 20 SER OG : rot 87:sc= 0.0812 USER MOD Single : A 22 LYS NZ :NH3+ -133:sc= -1.71 (180deg=-4.42!) USER MOD Single : A 26 LYS NZ :NH3+ -164:sc= -0.11 (180deg=-0.625) USER MOD Single : A 28 LYS NZ :NH3+ -159:sc= 0.0104 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -1.1 K(o=-1.1,f=-2.3!) USER MOD Single : A 31 LYS NZ :NH3+ -156:sc= 1.48 (180deg=1.09) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -142:sc= -2.22 (180deg=-3.87!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.054! USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl -105:sc= -0.224 (180deg=-1.68) USER MOD Single : A 60 SER OG : rot 58:sc= 0.595! USER MOD Single : A 61 ASN : amide:sc= -0.0615 K(o=-0.062,f=-2!) USER MOD Single : A 64 SER OG : rot 180:sc= 0.0437 USER MOD Single : A 65 ASN : amide:sc= -0.773 K(o=-0.77,f=-8.1!) USER MOD Single : A 68 ASN : amide:sc= -0.0956 K(o=-0.096,f=-0.71) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -154:sc= -0.36 (180deg=-1.53) USER MOD Single : A 86 CYS SG : rot -34:sc= 0.00342 USER MOD Single : A 87 ASN : amide:sc= -4.92! C(o=-4.9!,f=-9.3!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -141:sc= -0.235 (180deg=-1.4) USER MOD Single : B 1 MET N :NH3+ -165:sc=-0.00453 (180deg=-0.21) USER MOD Single : B 3 CYS SG : rot 106:sc= 0.0613 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl -156:sc= -0.138 (180deg=-1.15) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot -160:sc= 0.0726 USER MOD Single : B 17 HIS : no HD1:sc= -1.31 K(o=-1.3,f=-0.71) USER MOD Single : B 18 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0566) USER MOD Single : B 19 TYR OH : rot 165:sc= -0.243 USER MOD Single : B 20 SER OG : rot 90:sc= 0.0653 USER MOD Single : B 22 LYS NZ :NH3+ -133:sc= -1.77 (180deg=-4.49!) USER MOD Single : B 26 LYS NZ :NH3+ -162:sc= -0.0532 (180deg=-0.529) USER MOD Single : B 28 LYS NZ :NH3+ -160:sc= 0.0387 (180deg=0.0042) USER MOD Single : B 30 ASN : amide:sc= -1.07 K(o=-1.1,f=-2.3!) USER MOD Single : B 31 LYS NZ :NH3+ -160:sc= 1.46 (180deg=1.04) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -77:sc= 0.00438 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ -143:sc= -2.1 (180deg=-3.72!) USER MOD Single : B 50 THR OG1 : rot -144:sc= 0.356! USER MOD Single : B 56 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl -102:sc= -0.0373 (180deg=-1.63) USER MOD Single : B 60 SER OG : rot 66:sc= 0.778 USER MOD Single : B 61 ASN : amide:sc= -0.0555 K(o=-0.055,f=-2!) USER MOD Single : B 64 SER OG : rot 180:sc= 0.0431 USER MOD Single : B 65 ASN : amide:sc= -0.756 K(o=-0.76,f=-8.8!) USER MOD Single : B 68 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.71) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 84 MET CE :methyl -153:sc= -0.323 (180deg=-1.57) USER MOD Single : B 86 CYS SG : rot -34:sc= 0.00948 USER MOD Single : B 87 ASN : amide:sc= -3.34! C(o=-3.3!,f=-7.5!) USER MOD Single : B 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 77.890 0.600 -19.784 1.00 0.00 N ATOM 2 CA MET A 1 78.670 1.833 -20.089 1.00 0.00 C ATOM 3 C MET A 1 78.064 3.011 -19.323 1.00 0.00 C ATOM 4 O MET A 1 78.757 3.756 -18.659 1.00 0.00 O ATOM 5 CB MET A 1 78.608 2.117 -21.591 1.00 0.00 C ATOM 6 CG MET A 1 79.404 1.050 -22.345 1.00 0.00 C ATOM 7 SD MET A 1 79.355 1.398 -24.122 1.00 0.00 S ATOM 8 CE MET A 1 77.575 1.166 -24.362 1.00 0.00 C ATOM 0 H1 MET A 1 78.437 -0.237 -20.070 1.00 0.00 H new ATOM 0 H2 MET A 1 77.697 0.555 -18.763 1.00 0.00 H new ATOM 0 H3 MET A 1 76.991 0.620 -20.306 1.00 0.00 H new ATOM 0 HA MET A 1 79.709 1.694 -19.790 1.00 0.00 H new ATOM 0 HB2 MET A 1 77.572 2.119 -21.929 1.00 0.00 H new ATOM 0 HB3 MET A 1 79.014 3.106 -21.802 1.00 0.00 H new ATOM 0 HG2 MET A 1 80.436 1.037 -21.995 1.00 0.00 H new ATOM 0 HG3 MET A 1 78.987 0.063 -22.146 1.00 0.00 H new ATOM 0 HE1 MET A 1 77.385 0.843 -25.386 1.00 0.00 H new ATOM 0 HE2 MET A 1 77.210 0.408 -23.669 1.00 0.00 H new ATOM 0 HE3 MET A 1 77.057 2.107 -24.176 1.00 0.00 H new ATOM 20 N ALA A 2 76.774 3.182 -19.411 1.00 0.00 N ATOM 21 CA ALA A 2 76.120 4.309 -18.692 1.00 0.00 C ATOM 22 C ALA A 2 76.129 4.031 -17.186 1.00 0.00 C ATOM 23 O ALA A 2 75.851 4.903 -16.387 1.00 0.00 O ATOM 24 CB ALA A 2 74.675 4.456 -19.176 1.00 0.00 C ATOM 0 H ALA A 2 76.144 2.588 -19.951 1.00 0.00 H new ATOM 0 HA ALA A 2 76.665 5.231 -18.893 1.00 0.00 H new ATOM 0 HB1 ALA A 2 74.197 5.282 -18.649 1.00 0.00 H new ATOM 0 HB2 ALA A 2 74.669 4.657 -20.247 1.00 0.00 H new ATOM 0 HB3 ALA A 2 74.129 3.534 -18.977 1.00 0.00 H new ATOM 30 N CYS A 3 76.443 2.819 -16.792 1.00 0.00 N ATOM 31 CA CYS A 3 76.467 2.475 -15.333 1.00 0.00 C ATOM 32 C CYS A 3 77.730 1.658 -15.006 1.00 0.00 C ATOM 33 O CYS A 3 77.659 0.465 -14.790 1.00 0.00 O ATOM 34 CB CYS A 3 75.221 1.650 -14.992 1.00 0.00 C ATOM 35 SG CYS A 3 74.886 0.476 -16.328 1.00 0.00 S ATOM 0 H CYS A 3 76.684 2.051 -17.419 1.00 0.00 H new ATOM 0 HA CYS A 3 76.476 3.393 -14.745 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.372 1.116 -14.054 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.364 2.309 -14.850 1.00 0.00 H new ATOM 0 HG CYS A 3 75.296 -0.707 -15.979 1.00 0.00 H new ATOM 41 N PRO A 4 78.879 2.294 -14.955 1.00 0.00 N ATOM 42 CA PRO A 4 80.145 1.580 -14.631 1.00 0.00 C ATOM 43 C PRO A 4 80.185 1.141 -13.158 1.00 0.00 C ATOM 44 O PRO A 4 81.130 0.522 -12.709 1.00 0.00 O ATOM 45 CB PRO A 4 81.224 2.639 -14.945 1.00 0.00 C ATOM 46 CG PRO A 4 80.520 3.969 -15.297 1.00 0.00 C ATOM 47 CD PRO A 4 78.996 3.756 -15.215 1.00 0.00 C ATOM 0 HA PRO A 4 80.277 0.656 -15.195 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.882 2.775 -14.087 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.848 2.309 -15.776 1.00 0.00 H new ATOM 0 HG2 PRO A 4 80.830 4.755 -14.608 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.803 4.293 -16.298 1.00 0.00 H new ATOM 0 HD2 PRO A 4 78.548 4.346 -14.415 1.00 0.00 H new ATOM 0 HD3 PRO A 4 78.497 4.043 -16.141 1.00 0.00 H new ATOM 55 N LEU A 5 79.171 1.473 -12.407 1.00 0.00 N ATOM 56 CA LEU A 5 79.149 1.096 -10.965 1.00 0.00 C ATOM 57 C LEU A 5 79.221 -0.430 -10.845 1.00 0.00 C ATOM 58 O LEU A 5 79.825 -0.962 -9.935 1.00 0.00 O ATOM 59 CB LEU A 5 77.857 1.612 -10.314 1.00 0.00 C ATOM 60 CG LEU A 5 77.819 1.248 -8.816 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.920 2.008 -8.056 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.449 1.630 -8.237 1.00 0.00 C ATOM 0 H LEU A 5 78.354 1.991 -12.731 1.00 0.00 H new ATOM 0 HA LEU A 5 80.003 1.542 -10.455 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.791 2.694 -10.432 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.992 1.183 -10.820 1.00 0.00 H new ATOM 0 HG LEU A 5 77.985 0.176 -8.706 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.883 1.742 -7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.895 1.740 -8.463 1.00 0.00 H new ATOM 0 HD13 LEU A 5 78.764 3.081 -8.166 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.418 1.374 -7.178 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.289 2.702 -8.357 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.666 1.085 -8.765 1.00 0.00 H new ATOM 74 N GLU A 6 78.595 -1.140 -11.746 1.00 0.00 N ATOM 75 CA GLU A 6 78.617 -2.629 -11.666 1.00 0.00 C ATOM 76 C GLU A 6 80.062 -3.130 -11.744 1.00 0.00 C ATOM 77 O GLU A 6 80.468 -3.997 -10.994 1.00 0.00 O ATOM 78 CB GLU A 6 77.834 -3.204 -12.852 1.00 0.00 C ATOM 79 CG GLU A 6 76.344 -2.872 -12.702 1.00 0.00 C ATOM 80 CD GLU A 6 76.096 -1.421 -13.119 1.00 0.00 C ATOM 81 OE1 GLU A 6 76.019 -1.172 -14.311 1.00 0.00 O ATOM 82 OE2 GLU A 6 75.997 -0.582 -12.239 1.00 0.00 O ATOM 0 H GLU A 6 78.071 -0.754 -12.531 1.00 0.00 H new ATOM 0 HA GLU A 6 78.169 -2.947 -10.725 1.00 0.00 H new ATOM 0 HB2 GLU A 6 78.216 -2.791 -13.786 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.972 -4.284 -12.901 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.748 -3.545 -13.318 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.030 -3.023 -11.669 1.00 0.00 H new ATOM 89 N LYS A 7 80.843 -2.590 -12.637 1.00 0.00 N ATOM 90 CA LYS A 7 82.260 -3.034 -12.749 1.00 0.00 C ATOM 91 C LYS A 7 83.022 -2.486 -11.560 1.00 0.00 C ATOM 92 O LYS A 7 83.752 -3.186 -10.891 1.00 0.00 O ATOM 93 CB LYS A 7 82.882 -2.471 -14.031 1.00 0.00 C ATOM 94 CG LYS A 7 81.920 -2.670 -15.199 1.00 0.00 C ATOM 95 CD LYS A 7 82.534 -2.078 -16.477 1.00 0.00 C ATOM 96 CE LYS A 7 81.426 -1.768 -17.480 1.00 0.00 C ATOM 97 NZ LYS A 7 82.021 -1.180 -18.713 1.00 0.00 N ATOM 0 H LYS A 7 80.562 -1.861 -13.293 1.00 0.00 H new ATOM 0 HA LYS A 7 82.305 -4.123 -12.774 1.00 0.00 H new ATOM 0 HB2 LYS A 7 83.102 -1.411 -13.905 1.00 0.00 H new ATOM 0 HB3 LYS A 7 83.828 -2.971 -14.237 1.00 0.00 H new ATOM 0 HG2 LYS A 7 81.716 -3.732 -15.339 1.00 0.00 H new ATOM 0 HG3 LYS A 7 80.966 -2.188 -14.984 1.00 0.00 H new ATOM 0 HD2 LYS A 7 83.088 -1.170 -16.240 1.00 0.00 H new ATOM 0 HD3 LYS A 7 83.245 -2.781 -16.911 1.00 0.00 H new ATOM 0 HE2 LYS A 7 80.879 -2.678 -17.726 1.00 0.00 H new ATOM 0 HE3 LYS A 7 80.709 -1.073 -17.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 81.266 -0.969 -19.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 82.524 -0.303 -18.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 82.689 -1.858 -19.133 1.00 0.00 H new ATOM 111 N ALA A 8 82.841 -1.230 -11.288 1.00 0.00 N ATOM 112 CA ALA A 8 83.546 -0.629 -10.135 1.00 0.00 C ATOM 113 C ALA A 8 83.107 -1.392 -8.898 1.00 0.00 C ATOM 114 O ALA A 8 83.900 -1.739 -8.048 1.00 0.00 O ATOM 115 CB ALA A 8 83.183 0.845 -10.015 1.00 0.00 C ATOM 0 H ALA A 8 82.238 -0.597 -11.813 1.00 0.00 H new ATOM 0 HA ALA A 8 84.627 -0.693 -10.258 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.706 1.280 -9.164 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.475 1.367 -10.926 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.107 0.944 -9.869 1.00 0.00 H new ATOM 121 N LEU A 9 81.854 -1.724 -8.823 1.00 0.00 N ATOM 122 CA LEU A 9 81.395 -2.541 -7.681 1.00 0.00 C ATOM 123 C LEU A 9 82.179 -3.845 -7.747 1.00 0.00 C ATOM 124 O LEU A 9 82.629 -4.372 -6.749 1.00 0.00 O ATOM 125 CB LEU A 9 79.891 -2.811 -7.796 1.00 0.00 C ATOM 126 CG LEU A 9 79.414 -3.685 -6.625 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.676 -2.979 -5.284 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.913 -3.954 -6.785 1.00 0.00 C ATOM 0 H LEU A 9 81.135 -1.466 -9.499 1.00 0.00 H new ATOM 0 HA LEU A 9 81.561 -2.031 -6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.345 -1.868 -7.801 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.675 -3.309 -8.741 1.00 0.00 H new ATOM 0 HG LEU A 9 79.964 -4.626 -6.631 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.332 -3.612 -4.466 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.744 -2.792 -5.174 1.00 0.00 H new ATOM 0 HD13 LEU A 9 79.138 -2.032 -5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.564 -4.574 -5.959 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.372 -3.008 -6.783 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.735 -4.472 -7.727 1.00 0.00 H new ATOM 140 N ASP A 10 82.366 -4.354 -8.940 1.00 0.00 N ATOM 141 CA ASP A 10 83.145 -5.607 -9.101 1.00 0.00 C ATOM 142 C ASP A 10 84.611 -5.326 -8.762 1.00 0.00 C ATOM 143 O ASP A 10 85.307 -6.170 -8.235 1.00 0.00 O ATOM 144 CB ASP A 10 83.026 -6.109 -10.544 1.00 0.00 C ATOM 145 CG ASP A 10 83.470 -7.571 -10.623 1.00 0.00 C ATOM 146 OD1 ASP A 10 84.634 -7.830 -10.367 1.00 0.00 O ATOM 147 OD2 ASP A 10 82.640 -8.405 -10.941 1.00 0.00 O ATOM 0 H ASP A 10 82.010 -3.951 -9.807 1.00 0.00 H new ATOM 0 HA ASP A 10 82.756 -6.374 -8.431 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.996 -6.013 -10.888 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.641 -5.497 -11.204 1.00 0.00 H new ATOM 152 N VAL A 11 85.088 -4.143 -9.056 1.00 0.00 N ATOM 153 CA VAL A 11 86.513 -3.822 -8.741 1.00 0.00 C ATOM 154 C VAL A 11 86.746 -3.954 -7.234 1.00 0.00 C ATOM 155 O VAL A 11 87.758 -4.468 -6.801 1.00 0.00 O ATOM 156 CB VAL A 11 86.828 -2.386 -9.188 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.195 -1.953 -8.650 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.845 -2.318 -10.722 1.00 0.00 C ATOM 0 H VAL A 11 84.558 -3.391 -9.497 1.00 0.00 H new ATOM 0 HA VAL A 11 87.166 -4.516 -9.270 1.00 0.00 H new ATOM 0 HB VAL A 11 86.061 -1.719 -8.796 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.407 -0.934 -8.973 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.187 -1.994 -7.561 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.965 -2.623 -9.032 1.00 0.00 H new ATOM 0 HG21 VAL A 11 87.068 -1.299 -11.039 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.609 -2.994 -11.108 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.870 -2.613 -11.110 1.00 0.00 H new ATOM 168 N MET A 12 85.820 -3.507 -6.427 1.00 0.00 N ATOM 169 CA MET A 12 86.016 -3.633 -4.954 1.00 0.00 C ATOM 170 C MET A 12 86.041 -5.116 -4.592 1.00 0.00 C ATOM 171 O MET A 12 86.807 -5.557 -3.759 1.00 0.00 O ATOM 172 CB MET A 12 84.865 -2.948 -4.204 1.00 0.00 C ATOM 173 CG MET A 12 84.910 -1.427 -4.426 1.00 0.00 C ATOM 174 SD MET A 12 84.164 -0.585 -3.005 1.00 0.00 S ATOM 175 CE MET A 12 82.655 -1.578 -2.891 1.00 0.00 C ATOM 0 H MET A 12 84.948 -3.066 -6.719 1.00 0.00 H new ATOM 0 HA MET A 12 86.954 -3.155 -4.670 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.910 -3.344 -4.550 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.934 -3.169 -3.139 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.941 -1.098 -4.556 1.00 0.00 H new ATOM 0 HG3 MET A 12 84.374 -1.166 -5.339 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.882 -1.007 -2.376 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.311 -1.833 -3.893 1.00 0.00 H new ATOM 0 HE3 MET A 12 82.862 -2.492 -2.335 1.00 0.00 H new ATOM 185 N VAL A 13 85.193 -5.887 -5.209 1.00 0.00 N ATOM 186 CA VAL A 13 85.147 -7.345 -4.911 1.00 0.00 C ATOM 187 C VAL A 13 86.298 -8.074 -5.607 1.00 0.00 C ATOM 188 O VAL A 13 86.940 -8.930 -5.029 1.00 0.00 O ATOM 189 CB VAL A 13 83.816 -7.902 -5.405 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.777 -9.414 -5.170 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.677 -7.223 -4.640 1.00 0.00 C ATOM 0 H VAL A 13 84.525 -5.569 -5.911 1.00 0.00 H new ATOM 0 HA VAL A 13 85.245 -7.496 -3.836 1.00 0.00 H new ATOM 0 HB VAL A 13 83.703 -7.707 -6.471 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.826 -9.813 -5.523 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.594 -9.888 -5.715 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.884 -9.620 -4.105 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.721 -7.615 -4.987 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.785 -7.422 -3.574 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.712 -6.148 -4.814 1.00 0.00 H new ATOM 201 N SER A 14 86.557 -7.758 -6.846 1.00 0.00 N ATOM 202 CA SER A 14 87.656 -8.456 -7.571 1.00 0.00 C ATOM 203 C SER A 14 88.980 -8.222 -6.846 1.00 0.00 C ATOM 204 O SER A 14 89.714 -9.148 -6.565 1.00 0.00 O ATOM 205 CB SER A 14 87.757 -7.911 -8.996 1.00 0.00 C ATOM 206 OG SER A 14 88.712 -8.673 -9.721 1.00 0.00 O ATOM 0 H SER A 14 86.058 -7.050 -7.385 1.00 0.00 H new ATOM 0 HA SER A 14 87.443 -9.524 -7.603 1.00 0.00 H new ATOM 0 HB2 SER A 14 86.785 -7.961 -9.487 1.00 0.00 H new ATOM 0 HB3 SER A 14 88.050 -6.861 -8.977 1.00 0.00 H new ATOM 0 HG SER A 14 88.779 -8.328 -10.636 1.00 0.00 H new ATOM 212 N THR A 15 89.292 -6.995 -6.536 1.00 0.00 N ATOM 213 CA THR A 15 90.571 -6.723 -5.825 1.00 0.00 C ATOM 214 C THR A 15 90.546 -7.414 -4.462 1.00 0.00 C ATOM 215 O THR A 15 91.523 -7.982 -4.018 1.00 0.00 O ATOM 216 CB THR A 15 90.745 -5.203 -5.661 1.00 0.00 C ATOM 217 OG1 THR A 15 92.122 -4.903 -5.494 1.00 0.00 O ATOM 218 CG2 THR A 15 89.959 -4.685 -4.448 1.00 0.00 C ATOM 0 H THR A 15 88.722 -6.175 -6.742 1.00 0.00 H new ATOM 0 HA THR A 15 91.412 -7.112 -6.399 1.00 0.00 H new ATOM 0 HB THR A 15 90.360 -4.713 -6.555 1.00 0.00 H new ATOM 0 HG1 THR A 15 92.216 -4.021 -5.077 1.00 0.00 H new ATOM 0 HG21 THR A 15 90.100 -3.608 -4.356 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.899 -4.902 -4.581 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.319 -5.177 -3.544 1.00 0.00 H new ATOM 226 N PHE A 16 89.429 -7.359 -3.798 1.00 0.00 N ATOM 227 CA PHE A 16 89.321 -7.997 -2.454 1.00 0.00 C ATOM 228 C PHE A 16 89.597 -9.497 -2.552 1.00 0.00 C ATOM 229 O PHE A 16 90.286 -10.062 -1.726 1.00 0.00 O ATOM 230 CB PHE A 16 87.914 -7.766 -1.895 1.00 0.00 C ATOM 231 CG PHE A 16 87.790 -8.413 -0.536 1.00 0.00 C ATOM 232 CD1 PHE A 16 88.109 -7.691 0.621 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.355 -9.739 -0.436 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.990 -8.297 1.878 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.236 -10.345 0.821 1.00 0.00 C ATOM 236 CZ PHE A 16 87.553 -9.624 1.977 1.00 0.00 C ATOM 0 H PHE A 16 88.581 -6.898 -4.127 1.00 0.00 H new ATOM 0 HA PHE A 16 90.059 -7.550 -1.788 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.714 -6.697 -1.818 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.170 -8.181 -2.575 1.00 0.00 H new ATOM 0 HD1 PHE A 16 88.446 -6.668 0.544 1.00 0.00 H new ATOM 0 HD2 PHE A 16 87.111 -10.296 -1.329 1.00 0.00 H new ATOM 0 HE1 PHE A 16 88.235 -7.741 2.771 1.00 0.00 H new ATOM 0 HE2 PHE A 16 86.900 -11.368 0.898 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.461 -10.091 2.946 1.00 0.00 H new ATOM 246 N HIS A 17 89.081 -10.147 -3.553 1.00 0.00 N ATOM 247 CA HIS A 17 89.336 -11.607 -3.692 1.00 0.00 C ATOM 248 C HIS A 17 90.838 -11.838 -3.839 1.00 0.00 C ATOM 249 O HIS A 17 91.391 -12.774 -3.298 1.00 0.00 O ATOM 250 CB HIS A 17 88.607 -12.155 -4.927 1.00 0.00 C ATOM 251 CG HIS A 17 87.151 -12.375 -4.613 1.00 0.00 C ATOM 252 ND1 HIS A 17 86.142 -12.009 -5.494 1.00 0.00 N ATOM 253 CD2 HIS A 17 86.516 -12.931 -3.527 1.00 0.00 C ATOM 254 CE1 HIS A 17 84.968 -12.347 -4.930 1.00 0.00 C ATOM 255 NE2 HIS A 17 85.143 -12.911 -3.733 1.00 0.00 N ATOM 0 H HIS A 17 88.496 -9.734 -4.279 1.00 0.00 H new ATOM 0 HA HIS A 17 88.966 -12.125 -2.807 1.00 0.00 H new ATOM 0 HB2 HIS A 17 88.706 -11.456 -5.757 1.00 0.00 H new ATOM 0 HB3 HIS A 17 89.065 -13.092 -5.243 1.00 0.00 H new ATOM 0 HD2 HIS A 17 87.009 -13.323 -2.650 1.00 0.00 H new ATOM 0 HE1 HIS A 17 84.004 -12.182 -5.389 1.00 0.00 H new ATOM 0 HE2 HIS A 17 84.420 -13.255 -3.102 1.00 0.00 H new ATOM 264 N LYS A 18 91.503 -10.995 -4.580 1.00 0.00 N ATOM 265 CA LYS A 18 92.967 -11.178 -4.769 1.00 0.00 C ATOM 266 C LYS A 18 93.666 -11.107 -3.410 1.00 0.00 C ATOM 267 O LYS A 18 94.519 -11.914 -3.098 1.00 0.00 O ATOM 268 CB LYS A 18 93.510 -10.073 -5.682 1.00 0.00 C ATOM 269 CG LYS A 18 92.892 -10.179 -7.088 1.00 0.00 C ATOM 270 CD LYS A 18 93.562 -11.307 -7.892 1.00 0.00 C ATOM 271 CE LYS A 18 93.146 -11.208 -9.364 1.00 0.00 C ATOM 272 NZ LYS A 18 91.710 -11.583 -9.510 1.00 0.00 N ATOM 0 H LYS A 18 91.097 -10.192 -5.060 1.00 0.00 H new ATOM 0 HA LYS A 18 93.156 -12.149 -5.227 1.00 0.00 H new ATOM 0 HB2 LYS A 18 93.286 -9.096 -5.253 1.00 0.00 H new ATOM 0 HB3 LYS A 18 94.595 -10.150 -5.749 1.00 0.00 H new ATOM 0 HG2 LYS A 18 91.822 -10.369 -7.007 1.00 0.00 H new ATOM 0 HG3 LYS A 18 93.008 -9.232 -7.614 1.00 0.00 H new ATOM 0 HD2 LYS A 18 94.646 -11.235 -7.805 1.00 0.00 H new ATOM 0 HD3 LYS A 18 93.273 -12.277 -7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 18 93.305 -10.193 -9.729 1.00 0.00 H new ATOM 0 HE3 LYS A 18 93.767 -11.866 -9.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 91.447 -11.563 -10.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 91.561 -12.540 -9.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 91.120 -10.907 -8.984 1.00 0.00 H new ATOM 286 N TYR A 19 93.305 -10.153 -2.591 1.00 0.00 N ATOM 287 CA TYR A 19 93.951 -10.046 -1.247 1.00 0.00 C ATOM 288 C TYR A 19 93.500 -11.208 -0.364 1.00 0.00 C ATOM 289 O TYR A 19 94.278 -11.778 0.374 1.00 0.00 O ATOM 290 CB TYR A 19 93.585 -8.714 -0.586 1.00 0.00 C ATOM 291 CG TYR A 19 94.378 -7.595 -1.224 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.731 -7.430 -0.902 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.763 -6.724 -2.131 1.00 0.00 C ATOM 294 CE1 TYR A 19 96.472 -6.396 -1.488 1.00 0.00 C ATOM 295 CE2 TYR A 19 94.500 -5.688 -2.717 1.00 0.00 C ATOM 296 CZ TYR A 19 95.856 -5.524 -2.397 1.00 0.00 C ATOM 297 OH TYR A 19 96.585 -4.505 -2.977 1.00 0.00 O ATOM 0 H TYR A 19 92.596 -9.448 -2.792 1.00 0.00 H new ATOM 0 HA TYR A 19 95.033 -10.088 -1.371 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.517 -8.524 -0.695 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.794 -8.758 0.483 1.00 0.00 H new ATOM 0 HD1 TYR A 19 96.204 -8.101 -0.201 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.720 -6.851 -2.379 1.00 0.00 H new ATOM 0 HE1 TYR A 19 97.516 -6.271 -1.240 1.00 0.00 H new ATOM 0 HE2 TYR A 19 94.025 -5.015 -3.415 1.00 0.00 H new ATOM 0 HH TYR A 19 96.094 -4.149 -3.747 1.00 0.00 H new ATOM 307 N SER A 20 92.252 -11.568 -0.434 1.00 0.00 N ATOM 308 CA SER A 20 91.757 -12.700 0.396 1.00 0.00 C ATOM 309 C SER A 20 92.120 -14.004 -0.309 1.00 0.00 C ATOM 310 O SER A 20 91.794 -15.085 0.141 1.00 0.00 O ATOM 311 CB SER A 20 90.239 -12.599 0.548 1.00 0.00 C ATOM 312 OG SER A 20 89.814 -13.459 1.598 1.00 0.00 O ATOM 0 H SER A 20 91.551 -11.128 -1.030 1.00 0.00 H new ATOM 0 HA SER A 20 92.212 -12.670 1.386 1.00 0.00 H new ATOM 0 HB2 SER A 20 89.951 -11.570 0.766 1.00 0.00 H new ATOM 0 HB3 SER A 20 89.749 -12.876 -0.385 1.00 0.00 H new ATOM 0 HG SER A 20 89.863 -12.981 2.452 1.00 0.00 H new ATOM 318 N GLY A 21 92.790 -13.903 -1.428 1.00 0.00 N ATOM 319 CA GLY A 21 93.179 -15.123 -2.197 1.00 0.00 C ATOM 320 C GLY A 21 94.597 -15.560 -1.819 1.00 0.00 C ATOM 321 O GLY A 21 95.382 -15.934 -2.668 1.00 0.00 O ATOM 0 H GLY A 21 93.087 -13.021 -1.845 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.476 -15.930 -1.992 1.00 0.00 H new ATOM 0 HA3 GLY A 21 93.127 -14.919 -3.266 1.00 0.00 H new ATOM 325 N LYS A 22 94.942 -15.521 -0.555 1.00 0.00 N ATOM 326 CA LYS A 22 96.315 -15.941 -0.140 1.00 0.00 C ATOM 327 C LYS A 22 96.259 -16.615 1.238 1.00 0.00 C ATOM 328 O LYS A 22 96.164 -17.823 1.339 1.00 0.00 O ATOM 329 CB LYS A 22 97.240 -14.706 -0.095 1.00 0.00 C ATOM 330 CG LYS A 22 96.415 -13.458 0.233 1.00 0.00 C ATOM 331 CD LYS A 22 97.345 -12.309 0.648 1.00 0.00 C ATOM 332 CE LYS A 22 98.179 -11.845 -0.552 1.00 0.00 C ATOM 333 NZ LYS A 22 99.324 -12.777 -0.753 1.00 0.00 N ATOM 0 H LYS A 22 94.333 -15.217 0.205 1.00 0.00 H new ATOM 0 HA LYS A 22 96.711 -16.655 -0.862 1.00 0.00 H new ATOM 0 HB2 LYS A 22 98.017 -14.848 0.656 1.00 0.00 H new ATOM 0 HB3 LYS A 22 97.743 -14.580 -1.054 1.00 0.00 H new ATOM 0 HG2 LYS A 22 95.824 -13.164 -0.635 1.00 0.00 H new ATOM 0 HG3 LYS A 22 95.713 -13.677 1.037 1.00 0.00 H new ATOM 0 HD2 LYS A 22 96.757 -11.477 1.035 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.003 -12.636 1.453 1.00 0.00 H new ATOM 0 HE2 LYS A 22 97.560 -11.814 -1.448 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.546 -10.833 -0.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 100.198 -12.229 -0.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 99.424 -13.389 0.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 99.151 -13.364 -1.594 1.00 0.00 H new ATOM 347 N GLU A 23 96.338 -15.846 2.296 1.00 0.00 N ATOM 348 CA GLU A 23 96.313 -16.430 3.678 1.00 0.00 C ATOM 349 C GLU A 23 95.001 -16.085 4.389 1.00 0.00 C ATOM 350 O GLU A 23 94.405 -15.051 4.155 1.00 0.00 O ATOM 351 CB GLU A 23 97.488 -15.862 4.480 1.00 0.00 C ATOM 352 CG GLU A 23 97.408 -14.334 4.497 1.00 0.00 C ATOM 353 CD GLU A 23 98.649 -13.769 5.191 1.00 0.00 C ATOM 354 OE1 GLU A 23 98.965 -14.241 6.271 1.00 0.00 O ATOM 355 OE2 GLU A 23 99.261 -12.873 4.632 1.00 0.00 O ATOM 0 H GLU A 23 96.419 -14.830 2.263 1.00 0.00 H new ATOM 0 HA GLU A 23 96.393 -17.515 3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 23 97.466 -16.249 5.499 1.00 0.00 H new ATOM 0 HB3 GLU A 23 98.432 -16.182 4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 23 97.341 -13.951 3.479 1.00 0.00 H new ATOM 0 HG3 GLU A 23 96.507 -14.012 5.019 1.00 0.00 H new ATOM 362 N GLY A 24 94.556 -16.947 5.268 1.00 0.00 N ATOM 363 CA GLY A 24 93.289 -16.687 6.018 1.00 0.00 C ATOM 364 C GLY A 24 92.100 -17.248 5.237 1.00 0.00 C ATOM 365 O GLY A 24 92.261 -17.901 4.225 1.00 0.00 O ATOM 0 H GLY A 24 95.019 -17.826 5.500 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.338 -17.148 7.004 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.161 -15.616 6.173 1.00 0.00 H new ATOM 369 N ASP A 25 90.904 -16.994 5.696 1.00 0.00 N ATOM 370 CA ASP A 25 89.705 -17.506 4.976 1.00 0.00 C ATOM 371 C ASP A 25 89.459 -16.647 3.741 1.00 0.00 C ATOM 372 O ASP A 25 89.556 -15.438 3.780 1.00 0.00 O ATOM 373 CB ASP A 25 88.486 -17.448 5.899 1.00 0.00 C ATOM 374 CG ASP A 25 88.612 -18.523 6.980 1.00 0.00 C ATOM 375 OD1 ASP A 25 89.289 -19.508 6.731 1.00 0.00 O ATOM 376 OD2 ASP A 25 88.030 -18.347 8.036 1.00 0.00 O ATOM 0 H ASP A 25 90.707 -16.454 6.539 1.00 0.00 H new ATOM 0 HA ASP A 25 89.872 -18.540 4.674 1.00 0.00 H new ATOM 0 HB2 ASP A 25 88.411 -16.462 6.358 1.00 0.00 H new ATOM 0 HB3 ASP A 25 87.573 -17.601 5.323 1.00 0.00 H new ATOM 381 N LYS A 26 89.144 -17.267 2.643 1.00 0.00 N ATOM 382 CA LYS A 26 88.894 -16.494 1.401 1.00 0.00 C ATOM 383 C LYS A 26 87.589 -15.729 1.563 1.00 0.00 C ATOM 384 O LYS A 26 87.299 -14.805 0.828 1.00 0.00 O ATOM 385 CB LYS A 26 88.794 -17.458 0.215 1.00 0.00 C ATOM 386 CG LYS A 26 90.164 -18.095 -0.036 1.00 0.00 C ATOM 387 CD LYS A 26 90.071 -19.059 -1.220 1.00 0.00 C ATOM 388 CE LYS A 26 91.439 -19.702 -1.467 1.00 0.00 C ATOM 389 NZ LYS A 26 92.444 -18.645 -1.767 1.00 0.00 N ATOM 0 H LYS A 26 89.049 -18.278 2.552 1.00 0.00 H new ATOM 0 HA LYS A 26 89.710 -15.794 1.218 1.00 0.00 H new ATOM 0 HB2 LYS A 26 88.053 -18.231 0.421 1.00 0.00 H new ATOM 0 HB3 LYS A 26 88.460 -16.925 -0.675 1.00 0.00 H new ATOM 0 HG2 LYS A 26 90.904 -17.321 -0.241 1.00 0.00 H new ATOM 0 HG3 LYS A 26 90.498 -18.628 0.855 1.00 0.00 H new ATOM 0 HD2 LYS A 26 89.327 -19.829 -1.017 1.00 0.00 H new ATOM 0 HD3 LYS A 26 89.742 -18.525 -2.112 1.00 0.00 H new ATOM 0 HE2 LYS A 26 91.747 -20.272 -0.590 1.00 0.00 H new ATOM 0 HE3 LYS A 26 91.377 -20.404 -2.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 93.287 -19.079 -2.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 92.036 -17.956 -2.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 92.712 -18.161 -0.886 1.00 0.00 H new ATOM 403 N PHE A 27 86.800 -16.101 2.532 1.00 0.00 N ATOM 404 CA PHE A 27 85.509 -15.391 2.760 1.00 0.00 C ATOM 405 C PHE A 27 85.736 -14.239 3.739 1.00 0.00 C ATOM 406 O PHE A 27 84.836 -13.476 4.032 1.00 0.00 O ATOM 407 CB PHE A 27 84.487 -16.363 3.353 1.00 0.00 C ATOM 408 CG PHE A 27 84.126 -17.408 2.325 1.00 0.00 C ATOM 409 CD1 PHE A 27 83.057 -17.188 1.450 1.00 0.00 C ATOM 410 CD2 PHE A 27 84.859 -18.598 2.250 1.00 0.00 C ATOM 411 CE1 PHE A 27 82.722 -18.157 0.497 1.00 0.00 C ATOM 412 CE2 PHE A 27 84.524 -19.568 1.298 1.00 0.00 C ATOM 413 CZ PHE A 27 83.456 -19.348 0.422 1.00 0.00 C ATOM 0 H PHE A 27 86.993 -16.867 3.177 1.00 0.00 H new ATOM 0 HA PHE A 27 85.134 -15.004 1.813 1.00 0.00 H new ATOM 0 HB2 PHE A 27 84.898 -16.840 4.243 1.00 0.00 H new ATOM 0 HB3 PHE A 27 83.594 -15.822 3.665 1.00 0.00 H new ATOM 0 HD1 PHE A 27 82.490 -16.271 1.510 1.00 0.00 H new ATOM 0 HD2 PHE A 27 85.683 -18.768 2.927 1.00 0.00 H new ATOM 0 HE1 PHE A 27 81.898 -17.987 -0.180 1.00 0.00 H new ATOM 0 HE2 PHE A 27 85.090 -20.486 1.240 1.00 0.00 H new ATOM 0 HZ PHE A 27 83.197 -20.096 -0.312 1.00 0.00 H new ATOM 423 N LYS A 28 86.932 -14.110 4.261 1.00 0.00 N ATOM 424 CA LYS A 28 87.217 -13.016 5.235 1.00 0.00 C ATOM 425 C LYS A 28 88.629 -12.473 5.009 1.00 0.00 C ATOM 426 O LYS A 28 89.473 -13.137 4.440 1.00 0.00 O ATOM 427 CB LYS A 28 87.132 -13.583 6.650 1.00 0.00 C ATOM 428 CG LYS A 28 85.858 -14.421 6.795 1.00 0.00 C ATOM 429 CD LYS A 28 85.550 -14.643 8.286 1.00 0.00 C ATOM 430 CE LYS A 28 84.801 -13.424 8.859 1.00 0.00 C ATOM 431 NZ LYS A 28 83.339 -13.712 8.883 1.00 0.00 N ATOM 0 H LYS A 28 87.724 -14.718 4.052 1.00 0.00 H new ATOM 0 HA LYS A 28 86.492 -12.213 5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 28 88.008 -14.197 6.859 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.130 -12.772 7.378 1.00 0.00 H new ATOM 0 HG2 LYS A 28 85.022 -13.915 6.312 1.00 0.00 H new ATOM 0 HG3 LYS A 28 85.983 -15.380 6.293 1.00 0.00 H new ATOM 0 HD2 LYS A 28 84.947 -15.542 8.411 1.00 0.00 H new ATOM 0 HD3 LYS A 28 86.477 -14.802 8.837 1.00 0.00 H new ATOM 0 HE2 LYS A 28 85.157 -13.204 9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 28 85.000 -12.542 8.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 82.810 -12.818 8.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 83.074 -14.236 8.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 83.112 -14.284 9.721 1.00 0.00 H new ATOM 445 N LEU A 29 88.899 -11.275 5.473 1.00 0.00 N ATOM 446 CA LEU A 29 90.265 -10.684 5.314 1.00 0.00 C ATOM 447 C LEU A 29 90.714 -10.117 6.659 1.00 0.00 C ATOM 448 O LEU A 29 89.932 -9.573 7.413 1.00 0.00 O ATOM 449 CB LEU A 29 90.243 -9.591 4.239 1.00 0.00 C ATOM 450 CG LEU A 29 91.676 -9.141 3.914 1.00 0.00 C ATOM 451 CD1 LEU A 29 92.357 -10.141 2.966 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.638 -7.760 3.248 1.00 0.00 C ATOM 0 H LEU A 29 88.228 -10.679 5.957 1.00 0.00 H new ATOM 0 HA LEU A 29 90.970 -11.452 4.996 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.758 -9.966 3.338 1.00 0.00 H new ATOM 0 HB3 LEU A 29 89.656 -8.740 4.586 1.00 0.00 H new ATOM 0 HG LEU A 29 92.245 -9.093 4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 29 93.370 -9.804 2.748 1.00 0.00 H new ATOM 0 HD12 LEU A 29 92.395 -11.123 3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 29 91.789 -10.207 2.038 1.00 0.00 H new ATOM 0 HD21 LEU A 29 92.654 -7.439 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 29 91.057 -7.816 2.328 1.00 0.00 H new ATOM 0 HD23 LEU A 29 91.176 -7.042 3.926 1.00 0.00 H new ATOM 464 N ASN A 30 91.970 -10.267 6.971 1.00 0.00 N ATOM 465 CA ASN A 30 92.488 -9.769 8.276 1.00 0.00 C ATOM 466 C ASN A 30 92.741 -8.261 8.204 1.00 0.00 C ATOM 467 O ASN A 30 93.201 -7.743 7.211 1.00 0.00 O ATOM 468 CB ASN A 30 93.794 -10.493 8.612 1.00 0.00 C ATOM 469 CG ASN A 30 93.501 -11.969 8.894 1.00 0.00 C ATOM 470 OD1 ASN A 30 92.676 -12.288 9.727 1.00 0.00 O ATOM 471 ND2 ASN A 30 94.143 -12.891 8.227 1.00 0.00 N ATOM 0 H ASN A 30 92.665 -10.716 6.375 1.00 0.00 H new ATOM 0 HA ASN A 30 91.748 -9.965 9.052 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.496 -10.402 7.783 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.265 -10.032 9.480 1.00 0.00 H new ATOM 0 HD21 ASN A 30 93.951 -13.877 8.406 1.00 0.00 H new ATOM 0 HD22 ASN A 30 94.836 -12.625 7.527 1.00 0.00 H new ATOM 478 N LYS A 31 92.442 -7.561 9.257 1.00 0.00 N ATOM 479 CA LYS A 31 92.652 -6.087 9.277 1.00 0.00 C ATOM 480 C LYS A 31 94.126 -5.786 9.030 1.00 0.00 C ATOM 481 O LYS A 31 94.482 -4.733 8.548 1.00 0.00 O ATOM 482 CB LYS A 31 92.238 -5.542 10.640 1.00 0.00 C ATOM 483 CG LYS A 31 90.771 -5.899 10.910 1.00 0.00 C ATOM 484 CD LYS A 31 90.335 -5.362 12.287 1.00 0.00 C ATOM 485 CE LYS A 31 89.847 -3.913 12.162 1.00 0.00 C ATOM 486 NZ LYS A 31 88.431 -3.909 11.695 1.00 0.00 N ATOM 0 H LYS A 31 92.056 -7.950 10.117 1.00 0.00 H new ATOM 0 HA LYS A 31 92.051 -5.616 8.499 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.875 -5.961 11.419 1.00 0.00 H new ATOM 0 HB3 LYS A 31 92.371 -4.460 10.667 1.00 0.00 H new ATOM 0 HG2 LYS A 31 90.137 -5.477 10.130 1.00 0.00 H new ATOM 0 HG3 LYS A 31 90.641 -6.981 10.876 1.00 0.00 H new ATOM 0 HD2 LYS A 31 89.540 -5.987 12.694 1.00 0.00 H new ATOM 0 HD3 LYS A 31 91.170 -5.413 12.986 1.00 0.00 H new ATOM 0 HE2 LYS A 31 89.926 -3.406 13.124 1.00 0.00 H new ATOM 0 HE3 LYS A 31 90.475 -3.365 11.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 88.222 -3.003 11.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 88.286 -4.687 11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 87.796 -4.033 12.510 1.00 0.00 H new ATOM 500 N SER A 32 94.988 -6.708 9.323 1.00 0.00 N ATOM 501 CA SER A 32 96.426 -6.465 9.066 1.00 0.00 C ATOM 502 C SER A 32 96.557 -6.218 7.579 1.00 0.00 C ATOM 503 O SER A 32 97.282 -5.350 7.137 1.00 0.00 O ATOM 504 CB SER A 32 97.254 -7.682 9.449 1.00 0.00 C ATOM 505 OG SER A 32 97.163 -7.896 10.852 1.00 0.00 O ATOM 0 H SER A 32 94.761 -7.616 9.728 1.00 0.00 H new ATOM 0 HA SER A 32 96.785 -5.620 9.654 1.00 0.00 H new ATOM 0 HB2 SER A 32 96.897 -8.561 8.913 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.294 -7.533 9.160 1.00 0.00 H new ATOM 0 HG SER A 32 97.695 -8.681 11.098 1.00 0.00 H new ATOM 511 N GLU A 33 95.814 -6.955 6.799 1.00 0.00 N ATOM 512 CA GLU A 33 95.852 -6.733 5.340 1.00 0.00 C ATOM 513 C GLU A 33 95.462 -5.300 5.102 1.00 0.00 C ATOM 514 O GLU A 33 95.815 -4.728 4.110 1.00 0.00 O ATOM 515 CB GLU A 33 94.876 -7.663 4.628 1.00 0.00 C ATOM 516 CG GLU A 33 95.310 -9.113 4.843 1.00 0.00 C ATOM 517 CD GLU A 33 96.584 -9.385 4.041 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.782 -8.717 3.038 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.340 -10.253 4.441 1.00 0.00 O ATOM 0 H GLU A 33 95.188 -7.696 7.114 1.00 0.00 H new ATOM 0 HA GLU A 33 96.848 -6.940 4.949 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.867 -7.513 5.012 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.849 -7.434 3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.487 -9.298 5.902 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.517 -9.792 4.529 1.00 0.00 H new ATOM 526 N LEU A 34 94.767 -4.682 6.015 1.00 0.00 N ATOM 527 CA LEU A 34 94.443 -3.255 5.768 1.00 0.00 C ATOM 528 C LEU A 34 95.781 -2.545 5.643 1.00 0.00 C ATOM 529 O LEU A 34 95.970 -1.690 4.807 1.00 0.00 O ATOM 530 CB LEU A 34 93.655 -2.629 6.933 1.00 0.00 C ATOM 531 CG LEU A 34 93.210 -1.192 6.560 1.00 0.00 C ATOM 532 CD1 LEU A 34 91.873 -1.236 5.812 1.00 0.00 C ATOM 533 CD2 LEU A 34 93.060 -0.335 7.830 1.00 0.00 C ATOM 0 H LEU A 34 94.422 -5.084 6.887 1.00 0.00 H new ATOM 0 HA LEU A 34 93.822 -3.162 4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.783 -3.241 7.163 1.00 0.00 H new ATOM 0 HB3 LEU A 34 94.273 -2.606 7.830 1.00 0.00 H new ATOM 0 HG LEU A 34 93.970 -0.748 5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 34 91.567 -0.222 5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 34 91.985 -1.825 4.901 1.00 0.00 H new ATOM 0 HD13 LEU A 34 91.115 -1.692 6.448 1.00 0.00 H new ATOM 0 HD21 LEU A 34 92.747 0.672 7.554 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.311 -0.782 8.484 1.00 0.00 H new ATOM 0 HD23 LEU A 34 94.016 -0.288 8.352 1.00 0.00 H new ATOM 545 N LYS A 35 96.725 -2.913 6.464 1.00 0.00 N ATOM 546 CA LYS A 35 98.060 -2.264 6.368 1.00 0.00 C ATOM 547 C LYS A 35 98.731 -2.661 5.051 1.00 0.00 C ATOM 548 O LYS A 35 99.182 -1.824 4.298 1.00 0.00 O ATOM 549 CB LYS A 35 98.935 -2.706 7.549 1.00 0.00 C ATOM 550 CG LYS A 35 100.303 -2.008 7.485 1.00 0.00 C ATOM 551 CD LYS A 35 101.209 -2.526 8.609 1.00 0.00 C ATOM 552 CE LYS A 35 100.592 -2.213 9.978 1.00 0.00 C ATOM 553 NZ LYS A 35 101.664 -2.206 11.013 1.00 0.00 N ATOM 0 H LYS A 35 96.632 -3.626 7.188 1.00 0.00 H new ATOM 0 HA LYS A 35 97.938 -1.181 6.397 1.00 0.00 H new ATOM 0 HB2 LYS A 35 98.439 -2.465 8.489 1.00 0.00 H new ATOM 0 HB3 LYS A 35 99.069 -3.788 7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.769 -2.192 6.517 1.00 0.00 H new ATOM 0 HG3 LYS A 35 100.175 -0.930 7.578 1.00 0.00 H new ATOM 0 HD2 LYS A 35 101.351 -3.602 8.504 1.00 0.00 H new ATOM 0 HD3 LYS A 35 102.194 -2.065 8.533 1.00 0.00 H new ATOM 0 HE2 LYS A 35 100.091 -1.245 9.951 1.00 0.00 H new ATOM 0 HE3 LYS A 35 99.835 -2.957 10.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 101.248 -1.994 11.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 102.123 -3.139 11.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 102.370 -1.480 10.776 1.00 0.00 H new ATOM 567 N GLU A 36 98.811 -3.931 4.770 1.00 0.00 N ATOM 568 CA GLU A 36 99.468 -4.371 3.505 1.00 0.00 C ATOM 569 C GLU A 36 98.605 -3.991 2.305 1.00 0.00 C ATOM 570 O GLU A 36 99.100 -3.567 1.280 1.00 0.00 O ATOM 571 CB GLU A 36 99.656 -5.893 3.547 1.00 0.00 C ATOM 572 CG GLU A 36 100.330 -6.387 2.262 1.00 0.00 C ATOM 573 CD GLU A 36 101.775 -5.884 2.212 1.00 0.00 C ATOM 574 OE1 GLU A 36 102.237 -5.371 3.219 1.00 0.00 O ATOM 575 OE2 GLU A 36 102.399 -6.029 1.174 1.00 0.00 O ATOM 0 H GLU A 36 98.452 -4.683 5.358 1.00 0.00 H new ATOM 0 HA GLU A 36 100.436 -3.880 3.407 1.00 0.00 H new ATOM 0 HB2 GLU A 36 100.262 -6.167 4.411 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.689 -6.381 3.668 1.00 0.00 H new ATOM 0 HG2 GLU A 36 100.312 -7.476 2.226 1.00 0.00 H new ATOM 0 HG3 GLU A 36 99.780 -6.030 1.391 1.00 0.00 H new ATOM 582 N LEU A 37 97.323 -4.140 2.421 1.00 0.00 N ATOM 583 CA LEU A 37 96.428 -3.796 1.294 1.00 0.00 C ATOM 584 C LEU A 37 96.525 -2.310 1.042 1.00 0.00 C ATOM 585 O LEU A 37 96.471 -1.855 -0.084 1.00 0.00 O ATOM 586 CB LEU A 37 94.978 -4.170 1.652 1.00 0.00 C ATOM 587 CG LEU A 37 94.020 -3.895 0.457 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.879 -4.923 0.449 1.00 0.00 C ATOM 589 CD2 LEU A 37 93.399 -2.484 0.561 1.00 0.00 C ATOM 0 H LEU A 37 96.852 -4.489 3.256 1.00 0.00 H new ATOM 0 HA LEU A 37 96.723 -4.346 0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.928 -5.223 1.928 1.00 0.00 H new ATOM 0 HB3 LEU A 37 94.655 -3.597 2.521 1.00 0.00 H new ATOM 0 HG LEU A 37 94.605 -3.969 -0.460 1.00 0.00 H new ATOM 0 HD11 LEU A 37 92.214 -4.722 -0.391 1.00 0.00 H new ATOM 0 HD12 LEU A 37 93.294 -5.926 0.351 1.00 0.00 H new ATOM 0 HD13 LEU A 37 92.318 -4.851 1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 37 92.733 -2.316 -0.286 1.00 0.00 H new ATOM 0 HD22 LEU A 37 92.833 -2.403 1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 37 94.192 -1.736 0.553 1.00 0.00 H new ATOM 601 N LEU A 38 96.635 -1.537 2.081 1.00 0.00 N ATOM 602 CA LEU A 38 96.695 -0.057 1.860 1.00 0.00 C ATOM 603 C LEU A 38 98.024 0.364 1.242 1.00 0.00 C ATOM 604 O LEU A 38 98.056 1.140 0.308 1.00 0.00 O ATOM 605 CB LEU A 38 96.472 0.710 3.174 1.00 0.00 C ATOM 606 CG LEU A 38 94.976 0.771 3.523 1.00 0.00 C ATOM 607 CD1 LEU A 38 94.817 1.535 4.842 1.00 0.00 C ATOM 608 CD2 LEU A 38 94.187 1.489 2.401 1.00 0.00 C ATOM 0 H LEU A 38 96.685 -1.847 3.051 1.00 0.00 H new ATOM 0 HA LEU A 38 95.894 0.192 1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 38 97.019 0.224 3.982 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.870 1.721 3.083 1.00 0.00 H new ATOM 0 HG LEU A 38 94.582 -0.240 3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 38 93.761 1.589 5.106 1.00 0.00 H new ATOM 0 HD12 LEU A 38 95.363 1.017 5.631 1.00 0.00 H new ATOM 0 HD13 LEU A 38 95.214 2.544 4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 38 93.130 1.523 2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 38 94.565 2.505 2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 38 94.310 0.945 1.464 1.00 0.00 H new ATOM 620 N THR A 39 99.115 -0.110 1.745 1.00 0.00 N ATOM 621 CA THR A 39 100.411 0.308 1.162 1.00 0.00 C ATOM 622 C THR A 39 100.565 -0.314 -0.205 1.00 0.00 C ATOM 623 O THR A 39 101.314 0.164 -1.033 1.00 0.00 O ATOM 624 CB THR A 39 101.560 -0.180 2.034 1.00 0.00 C ATOM 625 OG1 THR A 39 101.580 -1.600 2.041 1.00 0.00 O ATOM 626 CG2 THR A 39 101.358 0.332 3.443 1.00 0.00 C ATOM 0 H THR A 39 99.171 -0.763 2.527 1.00 0.00 H new ATOM 0 HA THR A 39 100.431 1.396 1.097 1.00 0.00 H new ATOM 0 HB THR A 39 102.507 0.189 1.640 1.00 0.00 H new ATOM 0 HG1 THR A 39 102.320 -1.914 2.601 1.00 0.00 H new ATOM 0 HG21 THR A 39 102.176 -0.012 4.076 1.00 0.00 H new ATOM 0 HG22 THR A 39 101.339 1.422 3.435 1.00 0.00 H new ATOM 0 HG23 THR A 39 100.413 -0.044 3.835 1.00 0.00 H new ATOM 634 N ARG A 40 99.885 -1.403 -0.440 1.00 0.00 N ATOM 635 CA ARG A 40 100.026 -2.083 -1.748 1.00 0.00 C ATOM 636 C ARG A 40 98.922 -1.652 -2.698 1.00 0.00 C ATOM 637 O ARG A 40 99.059 -1.788 -3.898 1.00 0.00 O ATOM 638 CB ARG A 40 99.951 -3.601 -1.564 1.00 0.00 C ATOM 639 CG ARG A 40 101.145 -4.107 -0.744 1.00 0.00 C ATOM 640 CD ARG A 40 102.413 -4.163 -1.609 1.00 0.00 C ATOM 641 NE ARG A 40 103.488 -4.879 -0.868 1.00 0.00 N ATOM 642 CZ ARG A 40 104.529 -5.328 -1.512 1.00 0.00 C ATOM 643 NH1 ARG A 40 104.620 -5.156 -2.802 1.00 0.00 N ATOM 644 NH2 ARG A 40 105.478 -5.953 -0.870 1.00 0.00 N ATOM 0 H ARG A 40 99.242 -1.846 0.217 1.00 0.00 H new ATOM 0 HA ARG A 40 100.993 -1.807 -2.168 1.00 0.00 H new ATOM 0 HB2 ARG A 40 99.020 -3.866 -1.062 1.00 0.00 H new ATOM 0 HB3 ARG A 40 99.939 -4.090 -2.538 1.00 0.00 H new ATOM 0 HG2 ARG A 40 101.310 -3.450 0.110 1.00 0.00 H new ATOM 0 HG3 ARG A 40 100.926 -5.098 -0.347 1.00 0.00 H new ATOM 0 HD2 ARG A 40 102.203 -4.673 -2.549 1.00 0.00 H new ATOM 0 HD3 ARG A 40 102.740 -3.154 -1.860 1.00 0.00 H new ATOM 0 HE ARG A 40 103.410 -5.018 0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 40 103.877 -4.671 -3.305 1.00 0.00 H new ATOM 0 HH12 ARG A 40 105.434 -5.507 -3.307 1.00 0.00 H new ATOM 0 HH21 ARG A 40 105.406 -6.091 0.138 1.00 0.00 H new ATOM 0 HH22 ARG A 40 106.291 -6.303 -1.376 1.00 0.00 H new ATOM 658 N GLU A 41 97.819 -1.144 -2.192 1.00 0.00 N ATOM 659 CA GLU A 41 96.713 -0.729 -3.115 1.00 0.00 C ATOM 660 C GLU A 41 96.623 0.779 -3.153 1.00 0.00 C ATOM 661 O GLU A 41 96.142 1.347 -4.114 1.00 0.00 O ATOM 662 CB GLU A 41 95.385 -1.330 -2.643 1.00 0.00 C ATOM 663 CG GLU A 41 94.337 -1.188 -3.754 1.00 0.00 C ATOM 664 CD GLU A 41 93.093 -1.999 -3.395 1.00 0.00 C ATOM 665 OE1 GLU A 41 93.108 -2.643 -2.362 1.00 0.00 O ATOM 666 OE2 GLU A 41 92.149 -1.968 -4.166 1.00 0.00 O ATOM 0 H GLU A 41 97.640 -1.001 -1.198 1.00 0.00 H new ATOM 0 HA GLU A 41 96.924 -1.097 -4.119 1.00 0.00 H new ATOM 0 HB2 GLU A 41 95.520 -2.381 -2.387 1.00 0.00 H new ATOM 0 HB3 GLU A 41 95.045 -0.823 -1.740 1.00 0.00 H new ATOM 0 HG2 GLU A 41 94.073 -0.139 -3.886 1.00 0.00 H new ATOM 0 HG3 GLU A 41 94.748 -1.535 -4.702 1.00 0.00 H new ATOM 673 N LEU A 42 97.088 1.446 -2.132 1.00 0.00 N ATOM 674 CA LEU A 42 97.034 2.939 -2.146 1.00 0.00 C ATOM 675 C LEU A 42 98.323 3.508 -1.532 1.00 0.00 C ATOM 676 O LEU A 42 98.318 3.984 -0.415 1.00 0.00 O ATOM 677 CB LEU A 42 95.823 3.443 -1.339 1.00 0.00 C ATOM 678 CG LEU A 42 94.500 2.919 -1.927 1.00 0.00 C ATOM 679 CD1 LEU A 42 93.373 3.163 -0.924 1.00 0.00 C ATOM 680 CD2 LEU A 42 94.166 3.651 -3.234 1.00 0.00 C ATOM 0 H LEU A 42 97.499 1.029 -1.297 1.00 0.00 H new ATOM 0 HA LEU A 42 96.936 3.273 -3.179 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.915 3.121 -0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.815 4.533 -1.334 1.00 0.00 H new ATOM 0 HG LEU A 42 94.604 1.853 -2.131 1.00 0.00 H new ATOM 0 HD11 LEU A 42 92.434 2.794 -1.335 1.00 0.00 H new ATOM 0 HD12 LEU A 42 93.593 2.638 0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 42 93.287 4.231 -0.726 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.228 3.268 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A 42 94.068 4.719 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.965 3.487 -3.957 1.00 0.00 H new ATOM 692 N PRO A 43 99.423 3.468 -2.246 1.00 0.00 N ATOM 693 CA PRO A 43 100.704 4.009 -1.711 1.00 0.00 C ATOM 694 C PRO A 43 100.732 5.550 -1.717 1.00 0.00 C ATOM 695 O PRO A 43 100.691 6.186 -0.683 1.00 0.00 O ATOM 696 CB PRO A 43 101.739 3.417 -2.690 1.00 0.00 C ATOM 697 CG PRO A 43 100.986 2.850 -3.913 1.00 0.00 C ATOM 698 CD PRO A 43 99.474 2.882 -3.615 1.00 0.00 C ATOM 0 HA PRO A 43 100.882 3.745 -0.669 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.447 4.184 -3.003 1.00 0.00 H new ATOM 0 HB3 PRO A 43 102.316 2.631 -2.202 1.00 0.00 H new ATOM 0 HG2 PRO A 43 101.209 3.440 -4.802 1.00 0.00 H new ATOM 0 HG3 PRO A 43 101.310 1.830 -4.118 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.932 3.492 -4.337 1.00 0.00 H new ATOM 0 HD3 PRO A 43 99.034 1.885 -3.646 1.00 0.00 H new ATOM 706 N SER A 44 100.806 6.146 -2.878 1.00 0.00 N ATOM 707 CA SER A 44 100.841 7.638 -2.965 1.00 0.00 C ATOM 708 C SER A 44 99.426 8.209 -2.824 1.00 0.00 C ATOM 709 O SER A 44 99.243 9.372 -2.534 1.00 0.00 O ATOM 710 CB SER A 44 101.419 8.052 -4.317 1.00 0.00 C ATOM 711 OG SER A 44 101.426 9.471 -4.410 1.00 0.00 O ATOM 0 H SER A 44 100.844 5.662 -3.775 1.00 0.00 H new ATOM 0 HA SER A 44 101.464 8.026 -2.159 1.00 0.00 H new ATOM 0 HB2 SER A 44 102.432 7.664 -4.427 1.00 0.00 H new ATOM 0 HB3 SER A 44 100.825 7.626 -5.125 1.00 0.00 H new ATOM 0 HG SER A 44 101.798 9.740 -5.276 1.00 0.00 H new ATOM 717 N PHE A 45 98.429 7.404 -3.056 1.00 0.00 N ATOM 718 CA PHE A 45 97.021 7.894 -2.963 1.00 0.00 C ATOM 719 C PHE A 45 96.543 7.884 -1.511 1.00 0.00 C ATOM 720 O PHE A 45 95.487 8.391 -1.191 1.00 0.00 O ATOM 721 CB PHE A 45 96.132 6.950 -3.755 1.00 0.00 C ATOM 722 CG PHE A 45 96.414 7.104 -5.231 1.00 0.00 C ATOM 723 CD1 PHE A 45 95.937 8.225 -5.918 1.00 0.00 C ATOM 724 CD2 PHE A 45 97.152 6.126 -5.909 1.00 0.00 C ATOM 725 CE1 PHE A 45 96.198 8.370 -7.286 1.00 0.00 C ATOM 726 CE2 PHE A 45 97.413 6.271 -7.276 1.00 0.00 C ATOM 727 CZ PHE A 45 96.936 7.392 -7.965 1.00 0.00 C ATOM 0 H PHE A 45 98.527 6.420 -3.308 1.00 0.00 H new ATOM 0 HA PHE A 45 96.973 8.911 -3.353 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.312 5.920 -3.446 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.083 7.165 -3.551 1.00 0.00 H new ATOM 0 HD1 PHE A 45 95.368 8.978 -5.394 1.00 0.00 H new ATOM 0 HD2 PHE A 45 97.519 5.261 -5.377 1.00 0.00 H new ATOM 0 HE1 PHE A 45 95.831 9.235 -7.817 1.00 0.00 H new ATOM 0 HE2 PHE A 45 97.983 5.518 -7.800 1.00 0.00 H new ATOM 0 HZ PHE A 45 97.137 7.503 -9.020 1.00 0.00 H new ATOM 737 N LEU A 46 97.298 7.289 -0.640 1.00 0.00 N ATOM 738 CA LEU A 46 96.878 7.215 0.795 1.00 0.00 C ATOM 739 C LEU A 46 98.127 7.164 1.655 1.00 0.00 C ATOM 740 O LEU A 46 98.234 7.826 2.668 1.00 0.00 O ATOM 741 CB LEU A 46 96.037 5.945 0.997 1.00 0.00 C ATOM 742 CG LEU A 46 95.565 5.814 2.472 1.00 0.00 C ATOM 743 CD1 LEU A 46 94.157 5.194 2.513 1.00 0.00 C ATOM 744 CD2 LEU A 46 96.530 4.911 3.272 1.00 0.00 C ATOM 0 H LEU A 46 98.192 6.847 -0.853 1.00 0.00 H new ATOM 0 HA LEU A 46 96.282 8.084 1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 46 95.171 5.970 0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.624 5.069 0.721 1.00 0.00 H new ATOM 0 HG LEU A 46 95.550 6.809 2.918 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.829 5.104 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 46 93.462 5.832 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 46 94.181 4.206 2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 46 96.183 4.831 4.302 1.00 0.00 H new ATOM 0 HD22 LEU A 46 96.559 3.919 2.821 1.00 0.00 H new ATOM 0 HD23 LEU A 46 97.530 5.345 3.258 1.00 0.00 H new ATOM 756 N GLY A 47 99.098 6.415 1.224 1.00 0.00 N ATOM 757 CA GLY A 47 100.379 6.349 1.970 1.00 0.00 C ATOM 758 C GLY A 47 101.188 7.549 1.513 1.00 0.00 C ATOM 759 O GLY A 47 102.403 7.564 1.546 1.00 0.00 O ATOM 0 H GLY A 47 99.059 5.842 0.381 1.00 0.00 H new ATOM 0 HA2 GLY A 47 100.207 6.381 3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.907 5.419 1.759 1.00 0.00 H new ATOM 763 N LYS A 48 100.492 8.548 1.047 1.00 0.00 N ATOM 764 CA LYS A 48 101.151 9.764 0.531 1.00 0.00 C ATOM 765 C LYS A 48 102.036 10.388 1.620 1.00 0.00 C ATOM 766 O LYS A 48 102.658 11.411 1.413 1.00 0.00 O ATOM 767 CB LYS A 48 100.068 10.760 0.105 1.00 0.00 C ATOM 768 CG LYS A 48 100.652 11.800 -0.856 1.00 0.00 C ATOM 769 CD LYS A 48 99.507 12.580 -1.508 1.00 0.00 C ATOM 770 CE LYS A 48 98.773 13.426 -0.458 1.00 0.00 C ATOM 771 NZ LYS A 48 97.763 12.582 0.240 1.00 0.00 N ATOM 0 H LYS A 48 99.473 8.566 1.004 1.00 0.00 H new ATOM 0 HA LYS A 48 101.781 9.510 -0.321 1.00 0.00 H new ATOM 0 HB2 LYS A 48 99.246 10.230 -0.377 1.00 0.00 H new ATOM 0 HB3 LYS A 48 99.656 11.257 0.983 1.00 0.00 H new ATOM 0 HG2 LYS A 48 101.312 12.481 -0.318 1.00 0.00 H new ATOM 0 HG3 LYS A 48 101.255 11.309 -1.620 1.00 0.00 H new ATOM 0 HD2 LYS A 48 99.899 13.224 -2.295 1.00 0.00 H new ATOM 0 HD3 LYS A 48 98.809 11.888 -1.980 1.00 0.00 H new ATOM 0 HE2 LYS A 48 99.485 13.830 0.262 1.00 0.00 H new ATOM 0 HE3 LYS A 48 98.285 14.276 -0.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 96.907 13.144 0.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 97.520 11.766 -0.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 98.156 12.246 1.142 1.00 0.00 H new ATOM 785 N ARG A 49 102.084 9.777 2.778 1.00 0.00 N ATOM 786 CA ARG A 49 102.917 10.308 3.901 1.00 0.00 C ATOM 787 C ARG A 49 102.486 11.729 4.273 1.00 0.00 C ATOM 788 O ARG A 49 103.307 12.576 4.566 1.00 0.00 O ATOM 789 CB ARG A 49 104.399 10.305 3.520 1.00 0.00 C ATOM 790 CG ARG A 49 104.903 8.865 3.437 1.00 0.00 C ATOM 791 CD ARG A 49 106.400 8.876 3.144 1.00 0.00 C ATOM 792 NE ARG A 49 107.121 9.421 4.327 1.00 0.00 N ATOM 793 CZ ARG A 49 108.408 9.251 4.443 1.00 0.00 C ATOM 794 NH1 ARG A 49 109.070 8.629 3.508 1.00 0.00 N ATOM 795 NH2 ARG A 49 109.032 9.707 5.494 1.00 0.00 N ATOM 0 H ARG A 49 101.574 8.921 2.995 1.00 0.00 H new ATOM 0 HA ARG A 49 102.769 9.657 4.763 1.00 0.00 H new ATOM 0 HB2 ARG A 49 104.540 10.806 2.562 1.00 0.00 H new ATOM 0 HB3 ARG A 49 104.976 10.861 4.259 1.00 0.00 H new ATOM 0 HG2 ARG A 49 104.707 8.344 4.374 1.00 0.00 H new ATOM 0 HG3 ARG A 49 104.371 8.325 2.654 1.00 0.00 H new ATOM 0 HD2 ARG A 49 106.748 7.867 2.923 1.00 0.00 H new ATOM 0 HD3 ARG A 49 106.607 9.484 2.264 1.00 0.00 H new ATOM 0 HE ARG A 49 106.607 9.928 5.048 1.00 0.00 H new ATOM 0 HH11 ARG A 49 108.581 8.275 2.686 1.00 0.00 H new ATOM 0 HH12 ARG A 49 110.077 8.496 3.599 1.00 0.00 H new ATOM 0 HH21 ARG A 49 108.513 10.196 6.223 1.00 0.00 H new ATOM 0 HH22 ARG A 49 110.039 9.575 5.586 1.00 0.00 H new ATOM 809 N THR A 50 101.205 11.993 4.280 1.00 0.00 N ATOM 810 CA THR A 50 100.710 13.356 4.654 1.00 0.00 C ATOM 811 C THR A 50 100.201 13.308 6.097 1.00 0.00 C ATOM 812 O THR A 50 100.865 12.795 6.976 1.00 0.00 O ATOM 813 CB THR A 50 99.569 13.759 3.716 1.00 0.00 C ATOM 814 OG1 THR A 50 98.954 14.943 4.204 1.00 0.00 O ATOM 815 CG2 THR A 50 98.534 12.635 3.646 1.00 0.00 C ATOM 0 H THR A 50 100.475 11.321 4.042 1.00 0.00 H new ATOM 0 HA THR A 50 101.515 14.086 4.568 1.00 0.00 H new ATOM 0 HB THR A 50 99.968 13.939 2.718 1.00 0.00 H new ATOM 0 HG1 THR A 50 98.224 15.204 3.604 1.00 0.00 H new ATOM 0 HG21 THR A 50 97.724 12.927 2.977 1.00 0.00 H new ATOM 0 HG22 THR A 50 99.007 11.728 3.269 1.00 0.00 H new ATOM 0 HG23 THR A 50 98.132 12.448 4.642 1.00 0.00 H new ATOM 823 N ASP A 51 99.027 13.817 6.356 1.00 0.00 N ATOM 824 CA ASP A 51 98.502 13.763 7.748 1.00 0.00 C ATOM 825 C ASP A 51 98.059 12.329 8.040 1.00 0.00 C ATOM 826 O ASP A 51 97.069 11.856 7.516 1.00 0.00 O ATOM 827 CB ASP A 51 97.307 14.712 7.889 1.00 0.00 C ATOM 828 CG ASP A 51 96.236 14.346 6.861 1.00 0.00 C ATOM 829 OD1 ASP A 51 96.583 13.743 5.859 1.00 0.00 O ATOM 830 OD2 ASP A 51 95.085 14.681 7.090 1.00 0.00 O ATOM 0 H ASP A 51 98.416 14.263 5.672 1.00 0.00 H new ATOM 0 HA ASP A 51 99.276 14.068 8.452 1.00 0.00 H new ATOM 0 HB2 ASP A 51 96.896 14.647 8.896 1.00 0.00 H new ATOM 0 HB3 ASP A 51 97.629 15.743 7.742 1.00 0.00 H new ATOM 835 N GLU A 52 98.801 11.624 8.855 1.00 0.00 N ATOM 836 CA GLU A 52 98.447 10.205 9.168 1.00 0.00 C ATOM 837 C GLU A 52 97.681 10.118 10.490 1.00 0.00 C ATOM 838 O GLU A 52 97.368 9.044 10.958 1.00 0.00 O ATOM 839 CB GLU A 52 99.729 9.375 9.286 1.00 0.00 C ATOM 840 CG GLU A 52 100.373 9.224 7.907 1.00 0.00 C ATOM 841 CD GLU A 52 101.645 8.384 8.029 1.00 0.00 C ATOM 842 OE1 GLU A 52 102.672 8.944 8.376 1.00 0.00 O ATOM 843 OE2 GLU A 52 101.571 7.193 7.773 1.00 0.00 O ATOM 0 H GLU A 52 99.640 11.971 9.319 1.00 0.00 H new ATOM 0 HA GLU A 52 97.818 9.821 8.365 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.425 9.858 9.972 1.00 0.00 H new ATOM 0 HB3 GLU A 52 99.501 8.393 9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 52 99.675 8.749 7.218 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.610 10.205 7.495 1.00 0.00 H new ATOM 850 N ALA A 53 97.395 11.226 11.114 1.00 0.00 N ATOM 851 CA ALA A 53 96.678 11.166 12.421 1.00 0.00 C ATOM 852 C ALA A 53 95.339 10.437 12.270 1.00 0.00 C ATOM 853 O ALA A 53 95.059 9.499 12.991 1.00 0.00 O ATOM 854 CB ALA A 53 96.429 12.586 12.930 1.00 0.00 C ATOM 0 H ALA A 53 97.623 12.163 10.781 1.00 0.00 H new ATOM 0 HA ALA A 53 97.295 10.619 13.133 1.00 0.00 H new ATOM 0 HB1 ALA A 53 95.905 12.544 13.885 1.00 0.00 H new ATOM 0 HB2 ALA A 53 97.382 13.098 13.062 1.00 0.00 H new ATOM 0 HB3 ALA A 53 95.822 13.130 12.207 1.00 0.00 H new ATOM 860 N ALA A 54 94.506 10.842 11.351 1.00 0.00 N ATOM 861 CA ALA A 54 93.199 10.140 11.195 1.00 0.00 C ATOM 862 C ALA A 54 93.443 8.731 10.669 1.00 0.00 C ATOM 863 O ALA A 54 92.822 7.779 11.092 1.00 0.00 O ATOM 864 CB ALA A 54 92.323 10.883 10.200 1.00 0.00 C ATOM 0 H ALA A 54 94.669 11.618 10.709 1.00 0.00 H new ATOM 0 HA ALA A 54 92.701 10.102 12.164 1.00 0.00 H new ATOM 0 HB1 ALA A 54 91.371 10.362 10.093 1.00 0.00 H new ATOM 0 HB2 ALA A 54 92.144 11.897 10.559 1.00 0.00 H new ATOM 0 HB3 ALA A 54 92.825 10.924 9.233 1.00 0.00 H new ATOM 870 N PHE A 55 94.352 8.588 9.751 1.00 0.00 N ATOM 871 CA PHE A 55 94.641 7.239 9.212 1.00 0.00 C ATOM 872 C PHE A 55 95.234 6.408 10.337 1.00 0.00 C ATOM 873 O PHE A 55 94.928 5.247 10.502 1.00 0.00 O ATOM 874 CB PHE A 55 95.647 7.341 8.078 1.00 0.00 C ATOM 875 CG PHE A 55 94.993 8.004 6.889 1.00 0.00 C ATOM 876 CD1 PHE A 55 94.283 7.233 5.960 1.00 0.00 C ATOM 877 CD2 PHE A 55 95.092 9.390 6.718 1.00 0.00 C ATOM 878 CE1 PHE A 55 93.674 7.849 4.860 1.00 0.00 C ATOM 879 CE2 PHE A 55 94.483 10.005 5.619 1.00 0.00 C ATOM 880 CZ PHE A 55 93.773 9.235 4.689 1.00 0.00 C ATOM 0 H PHE A 55 94.906 9.346 9.352 1.00 0.00 H new ATOM 0 HA PHE A 55 93.729 6.780 8.831 1.00 0.00 H new ATOM 0 HB2 PHE A 55 96.516 7.917 8.398 1.00 0.00 H new ATOM 0 HB3 PHE A 55 96.005 6.349 7.804 1.00 0.00 H new ATOM 0 HD1 PHE A 55 94.205 6.164 6.092 1.00 0.00 H new ATOM 0 HD2 PHE A 55 95.639 9.985 7.435 1.00 0.00 H new ATOM 0 HE1 PHE A 55 93.127 7.255 4.143 1.00 0.00 H new ATOM 0 HE2 PHE A 55 94.560 11.074 5.488 1.00 0.00 H new ATOM 0 HZ PHE A 55 93.302 9.710 3.841 1.00 0.00 H new ATOM 890 N GLN A 56 96.065 7.014 11.136 1.00 0.00 N ATOM 891 CA GLN A 56 96.662 6.271 12.275 1.00 0.00 C ATOM 892 C GLN A 56 95.519 5.806 13.149 1.00 0.00 C ATOM 893 O GLN A 56 95.547 4.741 13.728 1.00 0.00 O ATOM 894 CB GLN A 56 97.594 7.192 13.073 1.00 0.00 C ATOM 895 CG GLN A 56 98.210 6.427 14.247 1.00 0.00 C ATOM 896 CD GLN A 56 99.137 7.359 15.031 1.00 0.00 C ATOM 897 OE1 GLN A 56 98.826 8.517 15.228 1.00 0.00 O ATOM 898 NE2 GLN A 56 100.266 6.899 15.496 1.00 0.00 N ATOM 0 H GLN A 56 96.355 7.988 11.049 1.00 0.00 H new ATOM 0 HA GLN A 56 97.250 5.424 11.921 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.382 7.575 12.425 1.00 0.00 H new ATOM 0 HB3 GLN A 56 97.038 8.054 13.442 1.00 0.00 H new ATOM 0 HG2 GLN A 56 97.424 6.045 14.899 1.00 0.00 H new ATOM 0 HG3 GLN A 56 98.768 5.565 13.881 1.00 0.00 H new ATOM 0 HE21 GLN A 56 100.527 5.927 15.331 1.00 0.00 H new ATOM 0 HE22 GLN A 56 100.887 7.511 16.025 1.00 0.00 H new ATOM 907 N LYS A 57 94.499 6.595 13.211 1.00 0.00 N ATOM 908 CA LYS A 57 93.308 6.223 14.009 1.00 0.00 C ATOM 909 C LYS A 57 92.580 5.108 13.266 1.00 0.00 C ATOM 910 O LYS A 57 92.098 4.162 13.857 1.00 0.00 O ATOM 911 CB LYS A 57 92.422 7.471 14.213 1.00 0.00 C ATOM 912 CG LYS A 57 90.942 7.086 14.361 1.00 0.00 C ATOM 913 CD LYS A 57 90.174 8.220 15.048 1.00 0.00 C ATOM 914 CE LYS A 57 90.255 9.485 14.193 1.00 0.00 C ATOM 915 NZ LYS A 57 89.287 10.494 14.707 1.00 0.00 N ATOM 0 H LYS A 57 94.435 7.496 12.737 1.00 0.00 H new ATOM 0 HA LYS A 57 93.582 5.859 14.999 1.00 0.00 H new ATOM 0 HB2 LYS A 57 92.750 8.011 15.101 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.541 8.147 13.366 1.00 0.00 H new ATOM 0 HG2 LYS A 57 90.510 6.884 13.381 1.00 0.00 H new ATOM 0 HG3 LYS A 57 90.852 6.169 14.944 1.00 0.00 H new ATOM 0 HD2 LYS A 57 89.133 7.932 15.192 1.00 0.00 H new ATOM 0 HD3 LYS A 57 90.592 8.410 16.037 1.00 0.00 H new ATOM 0 HE2 LYS A 57 91.267 9.890 14.218 1.00 0.00 H new ATOM 0 HE3 LYS A 57 90.032 9.249 13.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 89.341 11.355 14.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 88.323 10.106 14.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 89.519 10.727 15.694 1.00 0.00 H new ATOM 929 N LEU A 58 92.534 5.194 11.969 1.00 0.00 N ATOM 930 CA LEU A 58 91.879 4.116 11.192 1.00 0.00 C ATOM 931 C LEU A 58 92.760 2.891 11.322 1.00 0.00 C ATOM 932 O LEU A 58 92.298 1.783 11.498 1.00 0.00 O ATOM 933 CB LEU A 58 91.759 4.524 9.720 1.00 0.00 C ATOM 934 CG LEU A 58 91.089 3.405 8.907 1.00 0.00 C ATOM 935 CD1 LEU A 58 89.677 3.119 9.448 1.00 0.00 C ATOM 936 CD2 LEU A 58 91.003 3.842 7.439 1.00 0.00 C ATOM 0 H LEU A 58 92.920 5.960 11.418 1.00 0.00 H new ATOM 0 HA LEU A 58 90.874 3.919 11.565 1.00 0.00 H new ATOM 0 HB2 LEU A 58 91.177 5.442 9.637 1.00 0.00 H new ATOM 0 HB3 LEU A 58 92.748 4.736 9.313 1.00 0.00 H new ATOM 0 HG LEU A 58 91.681 2.494 8.991 1.00 0.00 H new ATOM 0 HD11 LEU A 58 89.217 2.324 8.861 1.00 0.00 H new ATOM 0 HD12 LEU A 58 89.743 2.809 10.491 1.00 0.00 H new ATOM 0 HD13 LEU A 58 89.070 4.021 9.376 1.00 0.00 H new ATOM 0 HD21 LEU A 58 90.529 3.055 6.852 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.413 4.755 7.365 1.00 0.00 H new ATOM 0 HD23 LEU A 58 92.006 4.027 7.055 1.00 0.00 H new ATOM 948 N MET A 59 94.044 3.098 11.271 1.00 0.00 N ATOM 949 CA MET A 59 94.976 1.960 11.432 1.00 0.00 C ATOM 950 C MET A 59 94.957 1.531 12.891 1.00 0.00 C ATOM 951 O MET A 59 95.082 0.364 13.204 1.00 0.00 O ATOM 952 CB MET A 59 96.393 2.364 11.010 1.00 0.00 C ATOM 953 CG MET A 59 96.401 2.765 9.530 1.00 0.00 C ATOM 954 SD MET A 59 96.389 1.278 8.492 1.00 0.00 S ATOM 955 CE MET A 59 98.143 0.827 8.632 1.00 0.00 C ATOM 0 H MET A 59 94.485 4.006 11.125 1.00 0.00 H new ATOM 0 HA MET A 59 94.664 1.131 10.797 1.00 0.00 H new ATOM 0 HB2 MET A 59 96.742 3.195 11.623 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.081 1.535 11.175 1.00 0.00 H new ATOM 0 HG2 MET A 59 95.531 3.383 9.306 1.00 0.00 H new ATOM 0 HG3 MET A 59 97.284 3.366 9.311 1.00 0.00 H new ATOM 0 HE1 MET A 59 98.659 1.081 7.706 1.00 0.00 H new ATOM 0 HE2 MET A 59 98.594 1.373 9.460 1.00 0.00 H new ATOM 0 HE3 MET A 59 98.230 -0.244 8.814 1.00 0.00 H new ATOM 965 N SER A 60 94.778 2.457 13.795 1.00 0.00 N ATOM 966 CA SER A 60 94.729 2.053 15.229 1.00 0.00 C ATOM 967 C SER A 60 93.609 1.037 15.378 1.00 0.00 C ATOM 968 O SER A 60 93.665 0.146 16.201 1.00 0.00 O ATOM 969 CB SER A 60 94.442 3.257 16.127 1.00 0.00 C ATOM 970 OG SER A 60 95.484 4.214 15.992 1.00 0.00 O ATOM 0 H SER A 60 94.666 3.454 13.609 1.00 0.00 H new ATOM 0 HA SER A 60 95.690 1.633 15.527 1.00 0.00 H new ATOM 0 HB2 SER A 60 93.486 3.705 15.856 1.00 0.00 H new ATOM 0 HB3 SER A 60 94.361 2.937 17.166 1.00 0.00 H new ATOM 0 HG SER A 60 95.565 4.479 15.052 1.00 0.00 H new ATOM 976 N ASN A 61 92.595 1.150 14.572 1.00 0.00 N ATOM 977 CA ASN A 61 91.490 0.161 14.662 1.00 0.00 C ATOM 978 C ASN A 61 92.023 -1.168 14.148 1.00 0.00 C ATOM 979 O ASN A 61 91.735 -2.215 14.687 1.00 0.00 O ATOM 980 CB ASN A 61 90.284 0.611 13.834 1.00 0.00 C ATOM 981 CG ASN A 61 89.631 1.821 14.503 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.853 2.077 15.669 1.00 0.00 O ATOM 983 ND2 ASN A 61 88.811 2.570 13.816 1.00 0.00 N ATOM 0 H ASN A 61 92.483 1.875 13.863 1.00 0.00 H new ATOM 0 HA ASN A 61 91.154 0.066 15.694 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.599 0.867 12.822 1.00 0.00 H new ATOM 0 HB3 ASN A 61 89.564 -0.203 13.748 1.00 0.00 H new ATOM 0 HD21 ASN A 61 88.358 3.369 14.259 1.00 0.00 H new ATOM 0 HD22 ASN A 61 88.624 2.356 12.836 1.00 0.00 H new ATOM 990 N LEU A 62 92.830 -1.140 13.123 1.00 0.00 N ATOM 991 CA LEU A 62 93.397 -2.414 12.625 1.00 0.00 C ATOM 992 C LEU A 62 94.173 -3.016 13.795 1.00 0.00 C ATOM 993 O LEU A 62 94.321 -4.215 13.924 1.00 0.00 O ATOM 994 CB LEU A 62 94.288 -2.139 11.379 1.00 0.00 C ATOM 995 CG LEU A 62 95.799 -2.261 11.691 1.00 0.00 C ATOM 996 CD1 LEU A 62 96.205 -3.745 11.904 1.00 0.00 C ATOM 997 CD2 LEU A 62 96.593 -1.656 10.523 1.00 0.00 C ATOM 0 H LEU A 62 93.115 -0.301 12.618 1.00 0.00 H new ATOM 0 HA LEU A 62 92.633 -3.118 12.295 1.00 0.00 H new ATOM 0 HB2 LEU A 62 94.026 -2.841 10.587 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.078 -1.139 11.000 1.00 0.00 H new ATOM 0 HG LEU A 62 96.020 -1.722 12.612 1.00 0.00 H new ATOM 0 HD11 LEU A 62 97.271 -3.803 12.122 1.00 0.00 H new ATOM 0 HD12 LEU A 62 95.641 -4.160 12.739 1.00 0.00 H new ATOM 0 HD13 LEU A 62 95.988 -4.315 11.001 1.00 0.00 H new ATOM 0 HD21 LEU A 62 97.660 -1.735 10.729 1.00 0.00 H new ATOM 0 HD22 LEU A 62 96.360 -2.197 9.606 1.00 0.00 H new ATOM 0 HD23 LEU A 62 96.323 -0.607 10.404 1.00 0.00 H new ATOM 1009 N ASP A 63 94.619 -2.161 14.675 1.00 0.00 N ATOM 1010 CA ASP A 63 95.340 -2.618 15.888 1.00 0.00 C ATOM 1011 C ASP A 63 94.299 -2.842 16.987 1.00 0.00 C ATOM 1012 O ASP A 63 94.624 -3.053 18.138 1.00 0.00 O ATOM 1013 CB ASP A 63 96.349 -1.554 16.331 1.00 0.00 C ATOM 1014 CG ASP A 63 97.498 -1.491 15.324 1.00 0.00 C ATOM 1015 OD1 ASP A 63 97.742 -2.491 14.669 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.120 -0.445 15.228 1.00 0.00 O ATOM 0 H ASP A 63 94.510 -1.150 14.599 1.00 0.00 H new ATOM 0 HA ASP A 63 95.886 -3.539 15.684 1.00 0.00 H new ATOM 0 HB2 ASP A 63 95.861 -0.582 16.403 1.00 0.00 H new ATOM 0 HB3 ASP A 63 96.733 -1.792 17.323 1.00 0.00 H new ATOM 1021 N SER A 64 93.036 -2.784 16.627 1.00 0.00 N ATOM 1022 CA SER A 64 91.957 -2.979 17.637 1.00 0.00 C ATOM 1023 C SER A 64 92.102 -4.366 18.270 1.00 0.00 C ATOM 1024 O SER A 64 92.387 -5.335 17.593 1.00 0.00 O ATOM 1025 CB SER A 64 90.585 -2.903 16.964 1.00 0.00 C ATOM 1026 OG SER A 64 89.579 -3.195 17.924 1.00 0.00 O ATOM 0 H SER A 64 92.711 -2.610 15.676 1.00 0.00 H new ATOM 0 HA SER A 64 92.041 -2.199 18.394 1.00 0.00 H new ATOM 0 HB2 SER A 64 90.427 -1.910 16.544 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.532 -3.611 16.137 1.00 0.00 H new ATOM 0 HG SER A 64 88.697 -3.146 17.499 1.00 0.00 H new ATOM 1032 N ASN A 65 91.899 -4.482 19.555 1.00 0.00 N ATOM 1033 CA ASN A 65 92.018 -5.820 20.210 1.00 0.00 C ATOM 1034 C ASN A 65 90.654 -6.516 20.211 1.00 0.00 C ATOM 1035 O ASN A 65 90.537 -7.669 20.576 1.00 0.00 O ATOM 1036 CB ASN A 65 92.511 -5.644 21.651 1.00 0.00 C ATOM 1037 CG ASN A 65 91.522 -4.784 22.439 1.00 0.00 C ATOM 1038 OD1 ASN A 65 90.613 -4.208 21.875 1.00 0.00 O ATOM 1039 ND2 ASN A 65 91.665 -4.670 23.732 1.00 0.00 N ATOM 0 H ASN A 65 91.657 -3.712 20.179 1.00 0.00 H new ATOM 0 HA ASN A 65 92.732 -6.431 19.658 1.00 0.00 H new ATOM 0 HB2 ASN A 65 92.620 -6.618 22.129 1.00 0.00 H new ATOM 0 HB3 ASN A 65 93.495 -5.176 21.653 1.00 0.00 H new ATOM 0 HD21 ASN A 65 91.013 -4.097 24.269 1.00 0.00 H new ATOM 0 HD22 ASN A 65 92.428 -5.154 24.205 1.00 0.00 H new ATOM 1046 N ARG A 66 89.618 -5.826 19.806 1.00 0.00 N ATOM 1047 CA ARG A 66 88.263 -6.454 19.786 1.00 0.00 C ATOM 1048 C ARG A 66 88.073 -7.268 18.496 1.00 0.00 C ATOM 1049 O ARG A 66 88.018 -8.481 18.524 1.00 0.00 O ATOM 1050 CB ARG A 66 87.192 -5.364 19.870 1.00 0.00 C ATOM 1051 CG ARG A 66 87.292 -4.658 21.226 1.00 0.00 C ATOM 1052 CD ARG A 66 86.222 -3.567 21.315 1.00 0.00 C ATOM 1053 NE ARG A 66 84.874 -4.194 21.213 1.00 0.00 N ATOM 1054 CZ ARG A 66 83.806 -3.509 21.523 1.00 0.00 C ATOM 1055 NH1 ARG A 66 83.916 -2.277 21.940 1.00 0.00 N ATOM 1056 NH2 ARG A 66 82.627 -4.060 21.420 1.00 0.00 N ATOM 0 H ARG A 66 89.652 -4.857 19.489 1.00 0.00 H new ATOM 0 HA ARG A 66 88.170 -7.123 20.641 1.00 0.00 H new ATOM 0 HB2 ARG A 66 87.325 -4.645 19.062 1.00 0.00 H new ATOM 0 HB3 ARG A 66 86.201 -5.802 19.747 1.00 0.00 H new ATOM 0 HG2 ARG A 66 87.160 -5.378 22.033 1.00 0.00 H new ATOM 0 HG3 ARG A 66 88.283 -4.221 21.348 1.00 0.00 H new ATOM 0 HD2 ARG A 66 86.314 -3.026 22.257 1.00 0.00 H new ATOM 0 HD3 ARG A 66 86.360 -2.840 20.515 1.00 0.00 H new ATOM 0 HE ARG A 66 84.785 -5.161 20.900 1.00 0.00 H new ATOM 0 HH11 ARG A 66 84.837 -1.847 22.024 1.00 0.00 H new ATOM 0 HH12 ARG A 66 83.081 -1.744 22.182 1.00 0.00 H new ATOM 0 HH21 ARG A 66 82.541 -5.024 21.098 1.00 0.00 H new ATOM 0 HH22 ARG A 66 81.792 -3.527 21.662 1.00 0.00 H new ATOM 1070 N ASP A 67 87.964 -6.606 17.367 1.00 0.00 N ATOM 1071 CA ASP A 67 87.766 -7.334 16.068 1.00 0.00 C ATOM 1072 C ASP A 67 89.087 -7.394 15.296 1.00 0.00 C ATOM 1073 O ASP A 67 89.708 -6.383 15.036 1.00 0.00 O ATOM 1074 CB ASP A 67 86.727 -6.593 15.223 1.00 0.00 C ATOM 1075 CG ASP A 67 85.345 -6.747 15.859 1.00 0.00 C ATOM 1076 OD1 ASP A 67 85.173 -7.666 16.643 1.00 0.00 O ATOM 1077 OD2 ASP A 67 84.481 -5.944 15.549 1.00 0.00 O ATOM 0 H ASP A 67 88.004 -5.590 17.288 1.00 0.00 H new ATOM 0 HA ASP A 67 87.422 -8.347 16.277 1.00 0.00 H new ATOM 0 HB2 ASP A 67 86.989 -5.538 15.149 1.00 0.00 H new ATOM 0 HB3 ASP A 67 86.718 -6.991 14.208 1.00 0.00 H new ATOM 1082 N ASN A 68 89.520 -8.577 14.931 1.00 0.00 N ATOM 1083 CA ASN A 68 90.806 -8.727 14.174 1.00 0.00 C ATOM 1084 C ASN A 68 90.525 -9.152 12.724 1.00 0.00 C ATOM 1085 O ASN A 68 91.418 -9.174 11.901 1.00 0.00 O ATOM 1086 CB ASN A 68 91.663 -9.796 14.855 1.00 0.00 C ATOM 1087 CG ASN A 68 93.069 -9.786 14.253 1.00 0.00 C ATOM 1088 OD1 ASN A 68 93.643 -8.736 14.035 1.00 0.00 O ATOM 1089 ND2 ASN A 68 93.655 -10.917 13.976 1.00 0.00 N ATOM 0 H ASN A 68 89.035 -9.453 15.126 1.00 0.00 H new ATOM 0 HA ASN A 68 91.330 -7.771 14.167 1.00 0.00 H new ATOM 0 HB2 ASN A 68 91.714 -9.607 15.927 1.00 0.00 H new ATOM 0 HB3 ASN A 68 91.208 -10.778 14.726 1.00 0.00 H new ATOM 0 HD21 ASN A 68 94.594 -10.921 13.577 1.00 0.00 H new ATOM 0 HD22 ASN A 68 93.175 -11.798 14.158 1.00 0.00 H new ATOM 1096 N GLU A 69 89.298 -9.506 12.406 1.00 0.00 N ATOM 1097 CA GLU A 69 88.969 -9.951 11.007 1.00 0.00 C ATOM 1098 C GLU A 69 88.147 -8.875 10.287 1.00 0.00 C ATOM 1099 O GLU A 69 87.490 -8.058 10.899 1.00 0.00 O ATOM 1100 CB GLU A 69 88.163 -11.256 11.060 1.00 0.00 C ATOM 1101 CG GLU A 69 88.181 -11.941 9.688 1.00 0.00 C ATOM 1102 CD GLU A 69 89.591 -12.460 9.390 1.00 0.00 C ATOM 1103 OE1 GLU A 69 90.322 -12.706 10.334 1.00 0.00 O ATOM 1104 OE2 GLU A 69 89.914 -12.600 8.222 1.00 0.00 O ATOM 0 H GLU A 69 88.510 -9.506 13.054 1.00 0.00 H new ATOM 0 HA GLU A 69 89.898 -10.113 10.461 1.00 0.00 H new ATOM 0 HB2 GLU A 69 88.583 -11.922 11.813 1.00 0.00 H new ATOM 0 HB3 GLU A 69 87.135 -11.046 11.357 1.00 0.00 H new ATOM 0 HG2 GLU A 69 87.468 -12.766 9.673 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.871 -11.238 8.915 1.00 0.00 H new ATOM 1111 N VAL A 70 88.201 -8.878 8.982 1.00 0.00 N ATOM 1112 CA VAL A 70 87.453 -7.871 8.169 1.00 0.00 C ATOM 1113 C VAL A 70 86.323 -8.572 7.435 1.00 0.00 C ATOM 1114 O VAL A 70 86.545 -9.343 6.523 1.00 0.00 O ATOM 1115 CB VAL A 70 88.399 -7.265 7.121 1.00 0.00 C ATOM 1116 CG1 VAL A 70 87.772 -5.998 6.546 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.786 -6.931 7.729 1.00 0.00 C ATOM 0 H VAL A 70 88.741 -9.547 8.434 1.00 0.00 H new ATOM 0 HA VAL A 70 87.061 -7.092 8.823 1.00 0.00 H new ATOM 0 HB VAL A 70 88.549 -8.002 6.332 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.441 -5.566 5.802 1.00 0.00 H new ATOM 0 HG12 VAL A 70 86.819 -6.244 6.077 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.607 -5.278 7.347 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.428 -6.504 6.958 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.665 -6.212 8.539 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.242 -7.842 8.118 1.00 0.00 H new ATOM 1127 N ASP A 71 85.119 -8.274 7.785 1.00 0.00 N ATOM 1128 CA ASP A 71 83.982 -8.885 7.059 1.00 0.00 C ATOM 1129 C ASP A 71 83.837 -8.080 5.782 1.00 0.00 C ATOM 1130 O ASP A 71 84.400 -7.010 5.667 1.00 0.00 O ATOM 1131 CB ASP A 71 82.699 -8.775 7.890 1.00 0.00 C ATOM 1132 CG ASP A 71 82.789 -9.700 9.105 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.592 -10.617 9.069 1.00 0.00 O ATOM 1134 OD2 ASP A 71 82.050 -9.475 10.050 1.00 0.00 O ATOM 0 H ASP A 71 84.867 -7.636 8.540 1.00 0.00 H new ATOM 0 HA ASP A 71 84.154 -9.943 6.861 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.553 -7.745 8.215 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.836 -9.043 7.281 1.00 0.00 H new ATOM 1139 N PHE A 72 83.101 -8.540 4.817 1.00 0.00 N ATOM 1140 CA PHE A 72 82.971 -7.728 3.590 1.00 0.00 C ATOM 1141 C PHE A 72 82.474 -6.352 4.017 1.00 0.00 C ATOM 1142 O PHE A 72 82.872 -5.329 3.493 1.00 0.00 O ATOM 1143 CB PHE A 72 81.969 -8.378 2.641 1.00 0.00 C ATOM 1144 CG PHE A 72 81.975 -7.604 1.359 1.00 0.00 C ATOM 1145 CD1 PHE A 72 82.889 -7.939 0.360 1.00 0.00 C ATOM 1146 CD2 PHE A 72 81.093 -6.538 1.178 1.00 0.00 C ATOM 1147 CE1 PHE A 72 82.921 -7.210 -0.828 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.123 -5.804 -0.010 1.00 0.00 C ATOM 1149 CZ PHE A 72 82.038 -6.139 -1.017 1.00 0.00 C ATOM 0 H PHE A 72 82.594 -9.425 4.824 1.00 0.00 H new ATOM 0 HA PHE A 72 83.925 -7.650 3.069 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.237 -9.419 2.459 1.00 0.00 H new ATOM 0 HB3 PHE A 72 80.972 -8.378 3.081 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.572 -8.763 0.507 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.388 -6.281 1.955 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.627 -7.471 -1.603 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.441 -4.979 -0.152 1.00 0.00 H new ATOM 0 HZ PHE A 72 82.062 -5.573 -1.936 1.00 0.00 H new ATOM 1159 N GLN A 73 81.614 -6.340 4.991 1.00 0.00 N ATOM 1160 CA GLN A 73 81.069 -5.066 5.518 1.00 0.00 C ATOM 1161 C GLN A 73 82.171 -4.251 6.214 1.00 0.00 C ATOM 1162 O GLN A 73 82.218 -3.049 6.088 1.00 0.00 O ATOM 1163 CB GLN A 73 79.958 -5.393 6.521 1.00 0.00 C ATOM 1164 CG GLN A 73 79.363 -4.105 7.095 1.00 0.00 C ATOM 1165 CD GLN A 73 78.211 -4.462 8.036 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.783 -5.598 8.086 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.686 -3.535 8.789 1.00 0.00 N ATOM 0 H GLN A 73 81.259 -7.177 5.453 1.00 0.00 H new ATOM 0 HA GLN A 73 80.675 -4.471 4.694 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.177 -5.976 6.032 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.357 -6.008 7.328 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.128 -3.544 7.633 1.00 0.00 H new ATOM 0 HG3 GLN A 73 79.005 -3.464 6.289 1.00 0.00 H new ATOM 0 HE21 GLN A 73 78.044 -2.581 8.748 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.917 -3.764 9.419 1.00 0.00 H new ATOM 1176 N GLU A 74 83.057 -4.870 6.958 1.00 0.00 N ATOM 1177 CA GLU A 74 84.106 -4.069 7.641 1.00 0.00 C ATOM 1178 C GLU A 74 85.054 -3.475 6.611 1.00 0.00 C ATOM 1179 O GLU A 74 85.478 -2.344 6.730 1.00 0.00 O ATOM 1180 CB GLU A 74 84.879 -4.960 8.613 1.00 0.00 C ATOM 1181 CG GLU A 74 83.978 -5.333 9.794 1.00 0.00 C ATOM 1182 CD GLU A 74 83.698 -4.094 10.644 1.00 0.00 C ATOM 1183 OE1 GLU A 74 84.647 -3.516 11.146 1.00 0.00 O ATOM 1184 OE2 GLU A 74 82.537 -3.744 10.779 1.00 0.00 O ATOM 0 H GLU A 74 83.095 -5.877 7.117 1.00 0.00 H new ATOM 0 HA GLU A 74 83.636 -3.258 8.197 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.220 -5.861 8.104 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.768 -4.440 8.970 1.00 0.00 H new ATOM 0 HG2 GLU A 74 83.041 -5.754 9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 74 84.458 -6.101 10.401 1.00 0.00 H new ATOM 1191 N TYR A 75 85.399 -4.215 5.602 1.00 0.00 N ATOM 1192 CA TYR A 75 86.324 -3.650 4.592 1.00 0.00 C ATOM 1193 C TYR A 75 85.679 -2.406 3.977 1.00 0.00 C ATOM 1194 O TYR A 75 86.328 -1.410 3.731 1.00 0.00 O ATOM 1195 CB TYR A 75 86.592 -4.675 3.487 1.00 0.00 C ATOM 1196 CG TYR A 75 87.520 -4.071 2.454 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.865 -3.836 2.768 1.00 0.00 C ATOM 1198 CD2 TYR A 75 87.032 -3.742 1.181 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.720 -3.274 1.811 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.888 -3.180 0.225 1.00 0.00 C ATOM 1201 CZ TYR A 75 89.231 -2.948 0.539 1.00 0.00 C ATOM 1202 OH TYR A 75 90.073 -2.394 -0.403 1.00 0.00 O ATOM 0 H TYR A 75 85.087 -5.171 5.434 1.00 0.00 H new ATOM 0 HA TYR A 75 87.268 -3.392 5.071 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.038 -5.575 3.911 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.654 -4.975 3.019 1.00 0.00 H new ATOM 0 HD1 TYR A 75 89.243 -4.088 3.748 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.995 -3.922 0.937 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.756 -3.092 2.054 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.511 -2.926 -0.755 1.00 0.00 H new ATOM 0 HH TYR A 75 89.575 -2.230 -1.231 1.00 0.00 H new ATOM 1212 N CYS A 76 84.397 -2.464 3.732 1.00 0.00 N ATOM 1213 CA CYS A 76 83.689 -1.302 3.139 1.00 0.00 C ATOM 1214 C CYS A 76 83.589 -0.190 4.183 1.00 0.00 C ATOM 1215 O CYS A 76 83.770 0.971 3.875 1.00 0.00 O ATOM 1216 CB CYS A 76 82.288 -1.739 2.674 1.00 0.00 C ATOM 1217 SG CYS A 76 81.112 -1.701 4.053 1.00 0.00 S ATOM 0 H CYS A 76 83.809 -3.276 3.920 1.00 0.00 H new ATOM 0 HA CYS A 76 84.240 -0.927 2.276 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.942 -1.081 1.877 1.00 0.00 H new ATOM 0 HB3 CYS A 76 82.335 -2.745 2.258 1.00 0.00 H new ATOM 0 HG CYS A 76 81.601 -2.365 5.058 1.00 0.00 H new ATOM 1223 N VAL A 77 83.325 -0.524 5.425 1.00 0.00 N ATOM 1224 CA VAL A 77 83.252 0.549 6.449 1.00 0.00 C ATOM 1225 C VAL A 77 84.607 1.244 6.484 1.00 0.00 C ATOM 1226 O VAL A 77 84.701 2.451 6.579 1.00 0.00 O ATOM 1227 CB VAL A 77 82.930 -0.052 7.820 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.102 1.015 8.906 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.481 -0.543 7.822 1.00 0.00 C ATOM 0 H VAL A 77 83.161 -1.473 5.762 1.00 0.00 H new ATOM 0 HA VAL A 77 82.465 1.261 6.202 1.00 0.00 H new ATOM 0 HB VAL A 77 83.606 -0.883 8.021 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.872 0.583 9.880 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.131 1.375 8.903 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.426 1.847 8.709 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.244 -0.973 8.795 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.813 0.295 7.622 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.353 -1.301 7.050 1.00 0.00 H new ATOM 1239 N PHE A 78 85.660 0.483 6.385 1.00 0.00 N ATOM 1240 CA PHE A 78 87.012 1.090 6.388 1.00 0.00 C ATOM 1241 C PHE A 78 87.208 1.858 5.076 1.00 0.00 C ATOM 1242 O PHE A 78 87.768 2.933 5.058 1.00 0.00 O ATOM 1243 CB PHE A 78 88.073 -0.011 6.545 1.00 0.00 C ATOM 1244 CG PHE A 78 88.249 -0.347 8.018 1.00 0.00 C ATOM 1245 CD1 PHE A 78 87.143 -0.729 8.792 1.00 0.00 C ATOM 1246 CD2 PHE A 78 89.516 -0.265 8.611 1.00 0.00 C ATOM 1247 CE1 PHE A 78 87.307 -1.029 10.151 1.00 0.00 C ATOM 1248 CE2 PHE A 78 89.678 -0.565 9.969 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.573 -0.947 10.739 1.00 0.00 C ATOM 0 H PHE A 78 85.639 -0.533 6.302 1.00 0.00 H new ATOM 0 HA PHE A 78 87.116 1.781 7.224 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.772 -0.901 5.993 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.021 0.321 6.122 1.00 0.00 H new ATOM 0 HD1 PHE A 78 86.164 -0.792 8.340 1.00 0.00 H new ATOM 0 HD2 PHE A 78 90.370 0.030 8.019 1.00 0.00 H new ATOM 0 HE1 PHE A 78 86.455 -1.324 10.745 1.00 0.00 H new ATOM 0 HE2 PHE A 78 90.656 -0.502 10.423 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.698 -1.178 11.786 1.00 0.00 H new ATOM 1259 N LEU A 79 86.748 1.326 3.973 1.00 0.00 N ATOM 1260 CA LEU A 79 86.917 2.062 2.683 1.00 0.00 C ATOM 1261 C LEU A 79 86.029 3.310 2.697 1.00 0.00 C ATOM 1262 O LEU A 79 86.399 4.359 2.208 1.00 0.00 O ATOM 1263 CB LEU A 79 86.519 1.157 1.513 1.00 0.00 C ATOM 1264 CG LEU A 79 86.722 1.889 0.176 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.213 2.230 -0.020 1.00 0.00 C ATOM 1266 CD2 LEU A 79 86.235 0.983 -0.965 1.00 0.00 C ATOM 0 H LEU A 79 86.270 0.428 3.908 1.00 0.00 H new ATOM 0 HA LEU A 79 87.960 2.356 2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 79 87.117 0.246 1.530 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.476 0.856 1.616 1.00 0.00 H new ATOM 0 HG LEU A 79 86.152 2.818 0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.346 2.748 -0.970 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.549 2.872 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.799 1.311 -0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.374 1.492 -1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.807 0.055 -0.962 1.00 0.00 H new ATOM 0 HD23 LEU A 79 85.178 0.758 -0.825 1.00 0.00 H new ATOM 1278 N SER A 80 84.855 3.190 3.245 1.00 0.00 N ATOM 1279 CA SER A 80 83.916 4.346 3.291 1.00 0.00 C ATOM 1280 C SER A 80 84.488 5.415 4.205 1.00 0.00 C ATOM 1281 O SER A 80 84.441 6.593 3.908 1.00 0.00 O ATOM 1282 CB SER A 80 82.560 3.888 3.830 1.00 0.00 C ATOM 1283 OG SER A 80 81.584 4.881 3.547 1.00 0.00 O ATOM 0 H SER A 80 84.501 2.332 3.668 1.00 0.00 H new ATOM 0 HA SER A 80 83.785 4.750 2.287 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.275 2.940 3.373 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.621 3.718 4.905 1.00 0.00 H new ATOM 0 HG SER A 80 80.702 4.461 3.474 1.00 0.00 H new ATOM 1289 N CYS A 81 85.047 5.018 5.311 1.00 0.00 N ATOM 1290 CA CYS A 81 85.638 6.019 6.222 1.00 0.00 C ATOM 1291 C CYS A 81 86.733 6.739 5.455 1.00 0.00 C ATOM 1292 O CYS A 81 86.949 7.921 5.619 1.00 0.00 O ATOM 1293 CB CYS A 81 86.214 5.340 7.476 1.00 0.00 C ATOM 1294 SG CYS A 81 87.842 4.626 7.125 1.00 0.00 S ATOM 0 H CYS A 81 85.118 4.048 5.618 1.00 0.00 H new ATOM 0 HA CYS A 81 84.878 6.724 6.557 1.00 0.00 H new ATOM 0 HB2 CYS A 81 86.296 6.067 8.284 1.00 0.00 H new ATOM 0 HB3 CYS A 81 85.535 4.559 7.818 1.00 0.00 H new ATOM 0 HG CYS A 81 87.783 3.930 6.029 1.00 0.00 H new ATOM 1300 N ILE A 82 87.420 6.032 4.596 1.00 0.00 N ATOM 1301 CA ILE A 82 88.495 6.699 3.807 1.00 0.00 C ATOM 1302 C ILE A 82 87.849 7.650 2.804 1.00 0.00 C ATOM 1303 O ILE A 82 88.329 8.739 2.563 1.00 0.00 O ATOM 1304 CB ILE A 82 89.343 5.663 3.062 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.162 4.858 4.075 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.295 6.381 2.096 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.828 3.665 3.381 1.00 0.00 C ATOM 0 H ILE A 82 87.286 5.038 4.409 1.00 0.00 H new ATOM 0 HA ILE A 82 89.147 7.251 4.485 1.00 0.00 H new ATOM 0 HB ILE A 82 88.691 4.993 2.501 1.00 0.00 H new ATOM 0 HG12 ILE A 82 90.921 5.495 4.530 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.516 4.507 4.880 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.899 5.645 1.566 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.715 6.960 1.377 1.00 0.00 H new ATOM 0 HG23 ILE A 82 90.948 7.049 2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.408 3.098 4.109 1.00 0.00 H new ATOM 0 HD12 ILE A 82 90.062 3.022 2.948 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.488 4.025 2.592 1.00 0.00 H new ATOM 1319 N ALA A 83 86.769 7.243 2.207 1.00 0.00 N ATOM 1320 CA ALA A 83 86.104 8.128 1.215 1.00 0.00 C ATOM 1321 C ALA A 83 85.692 9.434 1.889 1.00 0.00 C ATOM 1322 O ALA A 83 85.943 10.505 1.381 1.00 0.00 O ATOM 1323 CB ALA A 83 84.866 7.434 0.661 1.00 0.00 C ATOM 0 H ALA A 83 86.319 6.341 2.361 1.00 0.00 H new ATOM 0 HA ALA A 83 86.797 8.341 0.401 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.379 8.084 -0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.157 6.502 0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.174 7.219 1.476 1.00 0.00 H new ATOM 1329 N MET A 84 85.073 9.364 3.036 1.00 0.00 N ATOM 1330 CA MET A 84 84.669 10.621 3.727 1.00 0.00 C ATOM 1331 C MET A 84 85.909 11.431 4.067 1.00 0.00 C ATOM 1332 O MET A 84 85.902 12.643 3.994 1.00 0.00 O ATOM 1333 CB MET A 84 83.857 10.304 4.983 1.00 0.00 C ATOM 1334 CG MET A 84 82.486 9.761 4.566 1.00 0.00 C ATOM 1335 SD MET A 84 81.497 9.375 6.033 1.00 0.00 S ATOM 1336 CE MET A 84 82.447 7.940 6.592 1.00 0.00 C ATOM 0 H MET A 84 84.831 8.500 3.521 1.00 0.00 H new ATOM 0 HA MET A 84 84.036 11.211 3.064 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.382 9.571 5.596 1.00 0.00 H new ATOM 0 HB3 MET A 84 83.738 11.201 5.591 1.00 0.00 H new ATOM 0 HG2 MET A 84 81.967 10.496 3.951 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.611 8.866 3.956 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.802 7.281 7.173 1.00 0.00 H new ATOM 0 HE2 MET A 84 82.833 7.400 5.727 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.279 8.274 7.213 1.00 0.00 H new ATOM 1346 N MET A 85 86.992 10.788 4.400 1.00 0.00 N ATOM 1347 CA MET A 85 88.218 11.569 4.688 1.00 0.00 C ATOM 1348 C MET A 85 88.530 12.369 3.428 1.00 0.00 C ATOM 1349 O MET A 85 89.127 13.426 3.480 1.00 0.00 O ATOM 1350 CB MET A 85 89.387 10.639 5.022 1.00 0.00 C ATOM 1351 CG MET A 85 89.190 10.051 6.420 1.00 0.00 C ATOM 1352 SD MET A 85 90.379 8.712 6.682 1.00 0.00 S ATOM 1353 CE MET A 85 89.625 8.034 8.179 1.00 0.00 C ATOM 0 H MET A 85 87.079 9.775 4.483 1.00 0.00 H new ATOM 0 HA MET A 85 88.067 12.222 5.547 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.450 9.838 4.285 1.00 0.00 H new ATOM 0 HB3 MET A 85 90.327 11.189 4.977 1.00 0.00 H new ATOM 0 HG2 MET A 85 89.326 10.826 7.175 1.00 0.00 H new ATOM 0 HG3 MET A 85 88.173 9.675 6.528 1.00 0.00 H new ATOM 0 HE1 MET A 85 90.360 7.437 8.718 1.00 0.00 H new ATOM 0 HE2 MET A 85 89.283 8.850 8.816 1.00 0.00 H new ATOM 0 HE3 MET A 85 88.777 7.406 7.907 1.00 0.00 H new ATOM 1363 N CYS A 86 88.100 11.879 2.287 1.00 0.00 N ATOM 1364 CA CYS A 86 88.345 12.634 1.023 1.00 0.00 C ATOM 1365 C CYS A 86 87.315 12.245 -0.042 1.00 0.00 C ATOM 1366 O CYS A 86 87.645 11.671 -1.060 1.00 0.00 O ATOM 1367 CB CYS A 86 89.756 12.340 0.512 1.00 0.00 C ATOM 1368 SG CYS A 86 89.968 10.553 0.318 1.00 0.00 S ATOM 0 H CYS A 86 87.596 10.999 2.180 1.00 0.00 H new ATOM 0 HA CYS A 86 88.249 13.700 1.227 1.00 0.00 H new ATOM 0 HB2 CYS A 86 89.921 12.842 -0.441 1.00 0.00 H new ATOM 0 HB3 CYS A 86 90.496 12.731 1.210 1.00 0.00 H new ATOM 0 HG CYS A 86 89.293 9.933 1.240 1.00 0.00 H new ATOM 1374 N ASN A 87 86.071 12.569 0.184 1.00 0.00 N ATOM 1375 CA ASN A 87 85.011 12.236 -0.814 1.00 0.00 C ATOM 1376 C ASN A 87 85.028 13.266 -1.951 1.00 0.00 C ATOM 1377 O ASN A 87 85.008 12.921 -3.115 1.00 0.00 O ATOM 1378 CB ASN A 87 83.645 12.255 -0.121 1.00 0.00 C ATOM 1379 CG ASN A 87 82.555 11.843 -1.112 1.00 0.00 C ATOM 1380 OD1 ASN A 87 82.841 11.523 -2.249 1.00 0.00 O ATOM 1381 ND2 ASN A 87 81.309 11.837 -0.725 1.00 0.00 N ATOM 0 H ASN A 87 85.741 13.052 1.020 1.00 0.00 H new ATOM 0 HA ASN A 87 85.198 11.245 -1.229 1.00 0.00 H new ATOM 0 HB2 ASN A 87 83.650 11.576 0.731 1.00 0.00 H new ATOM 0 HB3 ASN A 87 83.438 13.252 0.267 1.00 0.00 H new ATOM 0 HD21 ASN A 87 80.574 11.564 -1.377 1.00 0.00 H new ATOM 0 HD22 ASN A 87 81.070 12.106 0.230 1.00 0.00 H new ATOM 1388 N GLU A 88 85.064 14.530 -1.617 1.00 0.00 N ATOM 1389 CA GLU A 88 85.080 15.593 -2.669 1.00 0.00 C ATOM 1390 C GLU A 88 86.484 15.688 -3.281 1.00 0.00 C ATOM 1391 O GLU A 88 87.459 15.289 -2.677 1.00 0.00 O ATOM 1392 CB GLU A 88 84.699 16.935 -2.041 1.00 0.00 C ATOM 1393 CG GLU A 88 83.234 16.901 -1.591 1.00 0.00 C ATOM 1394 CD GLU A 88 83.104 16.080 -0.304 1.00 0.00 C ATOM 1395 OE1 GLU A 88 84.128 15.747 0.271 1.00 0.00 O ATOM 1396 OE2 GLU A 88 81.983 15.797 0.084 1.00 0.00 O ATOM 0 H GLU A 88 85.083 14.874 -0.657 1.00 0.00 H new ATOM 0 HA GLU A 88 84.363 15.343 -3.451 1.00 0.00 H new ATOM 0 HB2 GLU A 88 85.346 17.145 -1.189 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.849 17.739 -2.761 1.00 0.00 H new ATOM 0 HG2 GLU A 88 82.872 17.915 -1.424 1.00 0.00 H new ATOM 0 HG3 GLU A 88 82.614 16.466 -2.375 1.00 0.00 H new ATOM 1403 N PHE A 89 86.594 16.201 -4.482 1.00 0.00 N ATOM 1404 CA PHE A 89 87.939 16.299 -5.128 1.00 0.00 C ATOM 1405 C PHE A 89 88.877 17.158 -4.278 1.00 0.00 C ATOM 1406 O PHE A 89 89.871 16.683 -3.765 1.00 0.00 O ATOM 1407 CB PHE A 89 87.790 16.961 -6.501 1.00 0.00 C ATOM 1408 CG PHE A 89 87.064 16.038 -7.448 1.00 0.00 C ATOM 1409 CD1 PHE A 89 85.667 16.076 -7.529 1.00 0.00 C ATOM 1410 CD2 PHE A 89 87.787 15.153 -8.256 1.00 0.00 C ATOM 1411 CE1 PHE A 89 84.994 15.228 -8.416 1.00 0.00 C ATOM 1412 CE2 PHE A 89 87.114 14.304 -9.143 1.00 0.00 C ATOM 1413 CZ PHE A 89 85.717 14.342 -9.223 1.00 0.00 C ATOM 0 H PHE A 89 85.816 16.554 -5.039 1.00 0.00 H new ATOM 0 HA PHE A 89 88.354 15.296 -5.227 1.00 0.00 H new ATOM 0 HB2 PHE A 89 87.242 17.898 -6.403 1.00 0.00 H new ATOM 0 HB3 PHE A 89 88.773 17.207 -6.903 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.108 16.760 -6.907 1.00 0.00 H new ATOM 0 HD2 PHE A 89 88.865 15.125 -8.195 1.00 0.00 H new ATOM 0 HE1 PHE A 89 83.916 15.257 -8.478 1.00 0.00 H new ATOM 0 HE2 PHE A 89 87.672 13.620 -9.765 1.00 0.00 H new ATOM 0 HZ PHE A 89 85.197 13.688 -9.907 1.00 0.00 H new ATOM 1423 N PHE A 90 88.568 18.423 -4.132 1.00 0.00 N ATOM 1424 CA PHE A 90 89.434 19.344 -3.323 1.00 0.00 C ATOM 1425 C PHE A 90 88.604 20.064 -2.255 1.00 0.00 C ATOM 1426 O PHE A 90 89.136 20.564 -1.283 1.00 0.00 O ATOM 1427 CB PHE A 90 90.083 20.373 -4.252 1.00 0.00 C ATOM 1428 CG PHE A 90 89.038 20.957 -5.172 1.00 0.00 C ATOM 1429 CD1 PHE A 90 88.783 20.349 -6.408 1.00 0.00 C ATOM 1430 CD2 PHE A 90 88.328 22.101 -4.794 1.00 0.00 C ATOM 1431 CE1 PHE A 90 87.817 20.887 -7.266 1.00 0.00 C ATOM 1432 CE2 PHE A 90 87.361 22.639 -5.653 1.00 0.00 C ATOM 1433 CZ PHE A 90 87.106 22.031 -6.890 1.00 0.00 C ATOM 0 H PHE A 90 87.745 18.864 -4.542 1.00 0.00 H new ATOM 0 HA PHE A 90 90.205 18.757 -2.824 1.00 0.00 H new ATOM 0 HB2 PHE A 90 90.548 21.165 -3.665 1.00 0.00 H new ATOM 0 HB3 PHE A 90 90.874 19.902 -4.836 1.00 0.00 H new ATOM 0 HD1 PHE A 90 89.332 19.465 -6.699 1.00 0.00 H new ATOM 0 HD2 PHE A 90 88.525 22.569 -3.841 1.00 0.00 H new ATOM 0 HE1 PHE A 90 87.621 20.418 -8.219 1.00 0.00 H new ATOM 0 HE2 PHE A 90 86.812 23.522 -5.362 1.00 0.00 H new ATOM 0 HZ PHE A 90 86.361 22.446 -7.552 1.00 0.00 H new ATOM 1443 N GLU A 91 87.311 20.132 -2.421 1.00 0.00 N ATOM 1444 CA GLU A 91 86.474 20.833 -1.404 1.00 0.00 C ATOM 1445 C GLU A 91 86.501 20.053 -0.089 1.00 0.00 C ATOM 1446 O GLU A 91 86.468 18.840 -0.072 1.00 0.00 O ATOM 1447 CB GLU A 91 85.029 20.955 -1.904 1.00 0.00 C ATOM 1448 CG GLU A 91 84.959 21.964 -3.056 1.00 0.00 C ATOM 1449 CD GLU A 91 85.272 23.368 -2.531 1.00 0.00 C ATOM 1450 OE1 GLU A 91 84.683 23.751 -1.532 1.00 0.00 O ATOM 1451 OE2 GLU A 91 86.097 24.035 -3.133 1.00 0.00 O ATOM 0 H GLU A 91 86.800 19.736 -3.210 1.00 0.00 H new ATOM 0 HA GLU A 91 86.877 21.832 -1.240 1.00 0.00 H new ATOM 0 HB2 GLU A 91 84.667 19.983 -2.238 1.00 0.00 H new ATOM 0 HB3 GLU A 91 84.379 21.274 -1.089 1.00 0.00 H new ATOM 0 HG2 GLU A 91 85.669 21.690 -3.836 1.00 0.00 H new ATOM 0 HG3 GLU A 91 83.967 21.947 -3.508 1.00 0.00 H new ATOM 1458 N GLY A 92 86.567 20.745 1.017 1.00 0.00 N ATOM 1459 CA GLY A 92 86.600 20.046 2.333 1.00 0.00 C ATOM 1460 C GLY A 92 85.427 19.072 2.422 1.00 0.00 C ATOM 1461 O GLY A 92 84.341 19.348 1.950 1.00 0.00 O ATOM 0 H GLY A 92 86.599 21.763 1.065 1.00 0.00 H new ATOM 0 HA2 GLY A 92 87.542 19.509 2.448 1.00 0.00 H new ATOM 0 HA3 GLY A 92 86.546 20.772 3.144 1.00 0.00 H new ATOM 1465 N PHE A 93 85.636 17.928 3.020 1.00 0.00 N ATOM 1466 CA PHE A 93 84.534 16.928 3.136 1.00 0.00 C ATOM 1467 C PHE A 93 83.719 17.207 4.415 1.00 0.00 C ATOM 1468 O PHE A 93 84.261 17.691 5.390 1.00 0.00 O ATOM 1469 CB PHE A 93 85.141 15.522 3.209 1.00 0.00 C ATOM 1470 CG PHE A 93 86.255 15.499 4.231 1.00 0.00 C ATOM 1471 CD1 PHE A 93 87.517 16.009 3.903 1.00 0.00 C ATOM 1472 CD2 PHE A 93 86.027 14.964 5.505 1.00 0.00 C ATOM 1473 CE1 PHE A 93 88.550 15.985 4.847 1.00 0.00 C ATOM 1474 CE2 PHE A 93 87.061 14.938 6.449 1.00 0.00 C ATOM 1475 CZ PHE A 93 88.322 15.450 6.121 1.00 0.00 C ATOM 0 H PHE A 93 86.524 17.643 3.434 1.00 0.00 H new ATOM 0 HA PHE A 93 83.877 17.000 2.269 1.00 0.00 H new ATOM 0 HB2 PHE A 93 84.373 14.797 3.478 1.00 0.00 H new ATOM 0 HB3 PHE A 93 85.525 15.230 2.232 1.00 0.00 H new ATOM 0 HD1 PHE A 93 87.694 16.421 2.921 1.00 0.00 H new ATOM 0 HD2 PHE A 93 85.054 14.571 5.759 1.00 0.00 H new ATOM 0 HE1 PHE A 93 89.523 16.379 4.593 1.00 0.00 H new ATOM 0 HE2 PHE A 93 86.886 14.523 7.430 1.00 0.00 H new ATOM 0 HZ PHE A 93 89.119 15.432 6.850 1.00 0.00 H new ATOM 1485 N PRO A 94 82.432 16.907 4.435 1.00 0.00 N ATOM 1486 CA PRO A 94 81.606 17.152 5.656 1.00 0.00 C ATOM 1487 C PRO A 94 82.062 16.290 6.842 1.00 0.00 C ATOM 1488 O PRO A 94 83.106 15.670 6.810 1.00 0.00 O ATOM 1489 CB PRO A 94 80.192 16.751 5.187 1.00 0.00 C ATOM 1490 CG PRO A 94 80.334 15.982 3.862 1.00 0.00 C ATOM 1491 CD PRO A 94 81.710 16.315 3.268 1.00 0.00 C ATOM 0 HA PRO A 94 81.676 18.177 6.019 1.00 0.00 H new ATOM 0 HB2 PRO A 94 79.703 16.131 5.938 1.00 0.00 H new ATOM 0 HB3 PRO A 94 79.570 17.636 5.050 1.00 0.00 H new ATOM 0 HG2 PRO A 94 80.241 14.909 4.032 1.00 0.00 H new ATOM 0 HG3 PRO A 94 79.541 16.265 3.170 1.00 0.00 H new ATOM 0 HD2 PRO A 94 82.214 15.426 2.888 1.00 0.00 H new ATOM 0 HD3 PRO A 94 81.634 17.018 2.438 1.00 0.00 H new ATOM 1499 N ASP A 95 81.275 16.244 7.882 1.00 0.00 N ATOM 1500 CA ASP A 95 81.644 15.419 9.064 1.00 0.00 C ATOM 1501 C ASP A 95 81.448 13.940 8.723 1.00 0.00 C ATOM 1502 O ASP A 95 80.736 13.596 7.801 1.00 0.00 O ATOM 1503 CB ASP A 95 80.750 15.795 10.248 1.00 0.00 C ATOM 1504 CG ASP A 95 81.117 17.197 10.740 1.00 0.00 C ATOM 1505 OD1 ASP A 95 82.253 17.593 10.544 1.00 0.00 O ATOM 1506 OD2 ASP A 95 80.253 17.850 11.301 1.00 0.00 O ATOM 0 H ASP A 95 80.390 16.744 7.963 1.00 0.00 H new ATOM 0 HA ASP A 95 82.686 15.599 9.328 1.00 0.00 H new ATOM 0 HB2 ASP A 95 79.702 15.765 9.950 1.00 0.00 H new ATOM 0 HB3 ASP A 95 80.873 15.072 11.054 1.00 0.00 H new ATOM 1511 N LYS A 96 82.076 13.061 9.455 1.00 0.00 N ATOM 1512 CA LYS A 96 81.927 11.606 9.164 1.00 0.00 C ATOM 1513 C LYS A 96 80.607 11.101 9.758 1.00 0.00 C ATOM 1514 O LYS A 96 79.685 10.771 9.041 1.00 0.00 O ATOM 1515 CB LYS A 96 83.092 10.837 9.789 1.00 0.00 C ATOM 1516 CG LYS A 96 84.383 11.156 9.030 1.00 0.00 C ATOM 1517 CD LYS A 96 85.508 10.231 9.507 1.00 0.00 C ATOM 1518 CE LYS A 96 85.892 10.570 10.952 1.00 0.00 C ATOM 1519 NZ LYS A 96 87.214 9.961 11.267 1.00 0.00 N ATOM 0 H LYS A 96 82.685 13.287 10.241 1.00 0.00 H new ATOM 0 HA LYS A 96 81.926 11.450 8.085 1.00 0.00 H new ATOM 0 HB2 LYS A 96 83.199 11.109 10.839 1.00 0.00 H new ATOM 0 HB3 LYS A 96 82.894 9.766 9.756 1.00 0.00 H new ATOM 0 HG2 LYS A 96 84.226 11.030 7.959 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.663 12.197 9.191 1.00 0.00 H new ATOM 0 HD2 LYS A 96 85.187 9.191 9.442 1.00 0.00 H new ATOM 0 HD3 LYS A 96 86.377 10.337 8.857 1.00 0.00 H new ATOM 0 HE2 LYS A 96 85.936 11.651 11.084 1.00 0.00 H new ATOM 0 HE3 LYS A 96 85.133 10.195 11.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 87.477 10.190 12.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 87.156 8.929 11.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 87.934 10.339 10.618 1.00 0.00 H new ATOM 1533 N GLN A 97 80.517 11.031 11.063 1.00 0.00 N ATOM 1534 CA GLN A 97 79.262 10.543 11.722 1.00 0.00 C ATOM 1535 C GLN A 97 78.499 11.746 12.325 1.00 0.00 C ATOM 1536 O GLN A 97 78.896 12.256 13.354 1.00 0.00 O ATOM 1537 CB GLN A 97 79.652 9.590 12.858 1.00 0.00 C ATOM 1538 CG GLN A 97 78.402 8.923 13.445 1.00 0.00 C ATOM 1539 CD GLN A 97 77.886 7.849 12.486 1.00 0.00 C ATOM 1540 OE1 GLN A 97 76.692 7.674 12.339 1.00 0.00 O ATOM 1541 NE2 GLN A 97 78.737 7.112 11.824 1.00 0.00 N ATOM 0 H GLN A 97 81.264 11.293 11.706 1.00 0.00 H new ATOM 0 HA GLN A 97 78.631 10.035 10.993 1.00 0.00 H new ATOM 0 HB2 GLN A 97 80.337 8.829 12.485 1.00 0.00 H new ATOM 0 HB3 GLN A 97 80.180 10.139 13.638 1.00 0.00 H new ATOM 0 HG2 GLN A 97 78.637 8.477 14.412 1.00 0.00 H new ATOM 0 HG3 GLN A 97 77.628 9.670 13.618 1.00 0.00 H new ATOM 0 HE21 GLN A 97 79.739 7.257 11.945 1.00 0.00 H new ATOM 0 HE22 GLN A 97 78.399 6.392 11.186 1.00 0.00 H new ATOM 1550 N PRO A 98 77.415 12.208 11.722 1.00 0.00 N ATOM 1551 CA PRO A 98 76.665 13.362 12.297 1.00 0.00 C ATOM 1552 C PRO A 98 75.807 12.952 13.505 1.00 0.00 C ATOM 1553 O PRO A 98 75.027 13.733 14.014 1.00 0.00 O ATOM 1554 CB PRO A 98 75.788 13.804 11.111 1.00 0.00 C ATOM 1555 CG PRO A 98 75.757 12.654 10.085 1.00 0.00 C ATOM 1556 CD PRO A 98 76.865 11.647 10.452 1.00 0.00 C ATOM 0 HA PRO A 98 77.316 14.147 12.682 1.00 0.00 H new ATOM 0 HB2 PRO A 98 74.779 14.039 11.450 1.00 0.00 H new ATOM 0 HB3 PRO A 98 76.190 14.709 10.656 1.00 0.00 H new ATOM 0 HG2 PRO A 98 74.783 12.165 10.092 1.00 0.00 H new ATOM 0 HG3 PRO A 98 75.913 13.040 9.078 1.00 0.00 H new ATOM 0 HD2 PRO A 98 76.468 10.642 10.593 1.00 0.00 H new ATOM 0 HD3 PRO A 98 77.627 11.583 9.675 1.00 0.00 H new ATOM 1564 N ARG A 99 75.943 11.732 13.965 1.00 0.00 N ATOM 1565 CA ARG A 99 75.133 11.268 15.135 1.00 0.00 C ATOM 1566 C ARG A 99 75.981 11.332 16.408 1.00 0.00 C ATOM 1567 O ARG A 99 76.981 10.653 16.535 1.00 0.00 O ATOM 1568 CB ARG A 99 74.688 9.821 14.893 1.00 0.00 C ATOM 1569 CG ARG A 99 73.792 9.353 16.044 1.00 0.00 C ATOM 1570 CD ARG A 99 73.353 7.909 15.792 1.00 0.00 C ATOM 1571 NE ARG A 99 72.547 7.830 14.527 1.00 0.00 N ATOM 1572 CZ ARG A 99 71.441 8.509 14.368 1.00 0.00 C ATOM 1573 NH1 ARG A 99 70.908 9.154 15.370 1.00 0.00 N ATOM 1574 NH2 ARG A 99 70.837 8.504 13.211 1.00 0.00 N ATOM 0 H ARG A 99 76.581 11.036 13.580 1.00 0.00 H new ATOM 0 HA ARG A 99 74.260 11.910 15.252 1.00 0.00 H new ATOM 0 HB2 ARG A 99 74.149 9.750 13.948 1.00 0.00 H new ATOM 0 HB3 ARG A 99 75.560 9.172 14.812 1.00 0.00 H new ATOM 0 HG2 ARG A 99 74.330 9.421 16.989 1.00 0.00 H new ATOM 0 HG3 ARG A 99 72.919 10.001 16.127 1.00 0.00 H new ATOM 0 HD2 ARG A 99 74.227 7.262 15.717 1.00 0.00 H new ATOM 0 HD3 ARG A 99 72.761 7.548 16.633 1.00 0.00 H new ATOM 0 HE ARG A 99 72.872 7.229 13.770 1.00 0.00 H new ATOM 0 HH11 ARG A 99 71.355 9.131 16.287 1.00 0.00 H new ATOM 0 HH12 ARG A 99 70.045 9.681 15.236 1.00 0.00 H new ATOM 0 HH21 ARG A 99 71.228 7.971 12.434 1.00 0.00 H new ATOM 0 HH22 ARG A 99 69.974 9.033 13.084 1.00 0.00 H new ATOM 1588 N LYS A 100 75.580 12.134 17.357 1.00 0.00 N ATOM 1589 CA LYS A 100 76.355 12.236 18.625 1.00 0.00 C ATOM 1590 C LYS A 100 76.092 10.993 19.477 1.00 0.00 C ATOM 1591 O LYS A 100 75.034 10.399 19.415 1.00 0.00 O ATOM 1592 CB LYS A 100 75.915 13.489 19.390 1.00 0.00 C ATOM 1593 CG LYS A 100 76.254 14.732 18.565 1.00 0.00 C ATOM 1594 CD LYS A 100 75.819 15.992 19.319 1.00 0.00 C ATOM 1595 CE LYS A 100 76.162 17.228 18.486 1.00 0.00 C ATOM 1596 NZ LYS A 100 75.555 18.438 19.112 1.00 0.00 N ATOM 0 H LYS A 100 74.749 12.723 17.308 1.00 0.00 H new ATOM 0 HA LYS A 100 77.420 12.305 18.402 1.00 0.00 H new ATOM 0 HB2 LYS A 100 74.844 13.451 19.587 1.00 0.00 H new ATOM 0 HB3 LYS A 100 76.416 13.533 20.357 1.00 0.00 H new ATOM 0 HG2 LYS A 100 77.325 14.767 18.368 1.00 0.00 H new ATOM 0 HG3 LYS A 100 75.753 14.685 17.598 1.00 0.00 H new ATOM 0 HD2 LYS A 100 74.748 15.959 19.516 1.00 0.00 H new ATOM 0 HD3 LYS A 100 76.320 16.041 20.286 1.00 0.00 H new ATOM 0 HE2 LYS A 100 77.244 17.345 18.419 1.00 0.00 H new ATOM 0 HE3 LYS A 100 75.791 17.108 17.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 75.789 19.277 18.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 74.522 18.326 19.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 75.930 18.556 20.075 1.00 0.00 H new ATOM 1610 N LYS A 101 77.050 10.589 20.270 1.00 0.00 N ATOM 1611 CA LYS A 101 76.857 9.379 21.126 1.00 0.00 C ATOM 1612 C LYS A 101 76.206 9.783 22.450 1.00 0.00 C ATOM 1613 O LYS A 101 76.424 10.904 22.878 1.00 0.00 O ATOM 1614 CB LYS A 101 78.216 8.733 21.402 1.00 0.00 C ATOM 1615 CG LYS A 101 78.753 8.104 20.115 1.00 0.00 C ATOM 1616 CD LYS A 101 80.111 7.457 20.390 1.00 0.00 C ATOM 1617 CE LYS A 101 80.642 6.816 19.107 1.00 0.00 C ATOM 1618 NZ LYS A 101 81.949 6.157 19.385 1.00 0.00 N ATOM 1619 OXT LYS A 101 75.498 8.963 23.013 1.00 0.00 O ATOM 0 H LYS A 101 77.958 11.044 20.362 1.00 0.00 H new ATOM 0 HA LYS A 101 76.211 8.669 20.610 1.00 0.00 H new ATOM 0 HB2 LYS A 101 78.917 9.480 21.774 1.00 0.00 H new ATOM 0 HB3 LYS A 101 78.119 7.973 22.178 1.00 0.00 H new ATOM 0 HG2 LYS A 101 78.052 7.357 19.743 1.00 0.00 H new ATOM 0 HG3 LYS A 101 78.851 8.864 19.340 1.00 0.00 H new ATOM 0 HD2 LYS A 101 80.815 8.206 20.753 1.00 0.00 H new ATOM 0 HD3 LYS A 101 80.015 6.704 21.172 1.00 0.00 H new ATOM 0 HE2 LYS A 101 79.927 6.085 18.730 1.00 0.00 H new ATOM 0 HE3 LYS A 101 80.762 7.573 18.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 82.310 5.721 18.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 82.630 6.866 19.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 81.821 5.424 20.111 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 96.799 1.620 -12.766 1.00 0.00 N ATOM 1635 CA MET B 1 96.428 0.411 -13.553 1.00 0.00 C ATOM 1636 C MET B 1 96.401 -0.802 -12.623 1.00 0.00 C ATOM 1637 O MET B 1 95.448 -1.555 -12.594 1.00 0.00 O ATOM 1638 CB MET B 1 97.464 0.182 -14.654 1.00 0.00 C ATOM 1639 CG MET B 1 97.335 1.277 -15.716 1.00 0.00 C ATOM 1640 SD MET B 1 98.538 0.987 -17.039 1.00 0.00 S ATOM 1641 CE MET B 1 100.041 1.212 -16.055 1.00 0.00 C ATOM 0 H1 MET B 1 96.576 2.474 -13.316 1.00 0.00 H new ATOM 0 H2 MET B 1 96.263 1.632 -11.875 1.00 0.00 H new ATOM 0 H3 MET B 1 97.817 1.599 -12.557 1.00 0.00 H new ATOM 0 HA MET B 1 95.446 0.553 -14.003 1.00 0.00 H new ATOM 0 HB2 MET B 1 98.468 0.189 -14.230 1.00 0.00 H new ATOM 0 HB3 MET B 1 97.317 -0.798 -15.108 1.00 0.00 H new ATOM 0 HG2 MET B 1 96.325 1.284 -16.125 1.00 0.00 H new ATOM 0 HG3 MET B 1 97.503 2.255 -15.266 1.00 0.00 H new ATOM 0 HE1 MET B 1 100.786 1.746 -16.645 1.00 0.00 H new ATOM 0 HE2 MET B 1 99.807 1.788 -15.159 1.00 0.00 H new ATOM 0 HE3 MET B 1 100.437 0.238 -15.767 1.00 0.00 H new ATOM 1653 N ALA B 2 97.442 -0.996 -11.861 1.00 0.00 N ATOM 1654 CA ALA B 2 97.481 -2.157 -10.930 1.00 0.00 C ATOM 1655 C ALA B 2 96.493 -1.930 -9.783 1.00 0.00 C ATOM 1656 O ALA B 2 96.190 -2.834 -9.030 1.00 0.00 O ATOM 1657 CB ALA B 2 98.895 -2.316 -10.367 1.00 0.00 C ATOM 0 H ALA B 2 98.269 -0.399 -11.844 1.00 0.00 H new ATOM 0 HA ALA B 2 97.204 -3.062 -11.470 1.00 0.00 H new ATOM 0 HB1 ALA B 2 98.922 -3.166 -9.686 1.00 0.00 H new ATOM 0 HB2 ALA B 2 99.596 -2.484 -11.185 1.00 0.00 H new ATOM 0 HB3 ALA B 2 99.176 -1.411 -9.829 1.00 0.00 H new ATOM 1663 N CYS B 3 95.990 -0.724 -9.640 1.00 0.00 N ATOM 1664 CA CYS B 3 95.018 -0.428 -8.535 1.00 0.00 C ATOM 1665 C CYS B 3 93.840 0.400 -9.077 1.00 0.00 C ATOM 1666 O CYS B 3 93.744 1.584 -8.820 1.00 0.00 O ATOM 1667 CB CYS B 3 95.737 0.361 -7.433 1.00 0.00 C ATOM 1668 SG CYS B 3 96.860 1.564 -8.187 1.00 0.00 S ATOM 0 H CYS B 3 96.211 0.069 -10.242 1.00 0.00 H new ATOM 0 HA CYS B 3 94.634 -1.364 -8.130 1.00 0.00 H new ATOM 0 HB2 CYS B 3 95.009 0.872 -6.803 1.00 0.00 H new ATOM 0 HB3 CYS B 3 96.294 -0.319 -6.789 1.00 0.00 H new ATOM 0 HG CYS B 3 96.359 2.758 -8.070 1.00 0.00 H new ATOM 1674 N PRO B 4 92.939 -0.215 -9.810 1.00 0.00 N ATOM 1675 CA PRO B 4 91.757 0.510 -10.359 1.00 0.00 C ATOM 1676 C PRO B 4 90.770 0.903 -9.249 1.00 0.00 C ATOM 1677 O PRO B 4 89.756 1.525 -9.496 1.00 0.00 O ATOM 1678 CB PRO B 4 91.146 -0.523 -11.332 1.00 0.00 C ATOM 1679 CG PRO B 4 91.935 -1.844 -11.206 1.00 0.00 C ATOM 1680 CD PRO B 4 93.035 -1.663 -10.141 1.00 0.00 C ATOM 0 HA PRO B 4 92.014 1.453 -10.842 1.00 0.00 H new ATOM 0 HB2 PRO B 4 90.094 -0.687 -11.098 1.00 0.00 H new ATOM 0 HB3 PRO B 4 91.191 -0.151 -12.356 1.00 0.00 H new ATOM 0 HG2 PRO B 4 91.267 -2.658 -10.925 1.00 0.00 H new ATOM 0 HG3 PRO B 4 92.378 -2.112 -12.165 1.00 0.00 H new ATOM 0 HD2 PRO B 4 92.859 -2.290 -9.267 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.020 -1.925 -10.528 1.00 0.00 H new ATOM 1688 N LEU B 5 91.056 0.525 -8.032 1.00 0.00 N ATOM 1689 CA LEU B 5 90.136 0.852 -6.907 1.00 0.00 C ATOM 1690 C LEU B 5 89.995 2.374 -6.801 1.00 0.00 C ATOM 1691 O LEU B 5 88.940 2.887 -6.481 1.00 0.00 O ATOM 1692 CB LEU B 5 90.701 0.282 -5.597 1.00 0.00 C ATOM 1693 CG LEU B 5 89.761 0.601 -4.416 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.420 -0.135 -4.589 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.423 0.144 -3.110 1.00 0.00 C ATOM 0 H LEU B 5 91.891 0.002 -7.769 1.00 0.00 H new ATOM 0 HA LEU B 5 89.156 0.410 -7.090 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.826 -0.797 -5.688 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.688 0.703 -5.407 1.00 0.00 H new ATOM 0 HG LEU B 5 89.575 1.675 -4.387 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.766 0.099 -3.749 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.947 0.185 -5.517 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.597 -1.210 -4.623 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.764 0.366 -2.271 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.608 -0.929 -3.152 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.369 0.670 -2.978 1.00 0.00 H new ATOM 1707 N GLU B 6 91.049 3.101 -7.053 1.00 0.00 N ATOM 1708 CA GLU B 6 90.972 4.587 -6.950 1.00 0.00 C ATOM 1709 C GLU B 6 89.919 5.119 -7.926 1.00 0.00 C ATOM 1710 O GLU B 6 89.118 5.968 -7.587 1.00 0.00 O ATOM 1711 CB GLU B 6 92.331 5.185 -7.326 1.00 0.00 C ATOM 1712 CG GLU B 6 93.374 4.828 -6.262 1.00 0.00 C ATOM 1713 CD GLU B 6 93.837 3.383 -6.462 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.674 3.164 -7.323 1.00 0.00 O ATOM 1715 OE2 GLU B 6 93.343 2.518 -5.757 1.00 0.00 O ATOM 0 H GLU B 6 91.960 2.731 -7.326 1.00 0.00 H new ATOM 0 HA GLU B 6 90.703 4.864 -5.931 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.647 4.807 -8.298 1.00 0.00 H new ATOM 0 HB3 GLU B 6 92.248 6.268 -7.417 1.00 0.00 H new ATOM 0 HG2 GLU B 6 94.225 5.506 -6.330 1.00 0.00 H new ATOM 0 HG3 GLU B 6 92.949 4.950 -5.266 1.00 0.00 H new ATOM 1722 N LYS B 7 89.908 4.627 -9.134 1.00 0.00 N ATOM 1723 CA LYS B 7 88.902 5.104 -10.122 1.00 0.00 C ATOM 1724 C LYS B 7 87.553 4.533 -9.736 1.00 0.00 C ATOM 1725 O LYS B 7 86.563 5.228 -9.667 1.00 0.00 O ATOM 1726 CB LYS B 7 89.266 4.599 -11.520 1.00 0.00 C ATOM 1727 CG LYS B 7 90.753 4.825 -11.778 1.00 0.00 C ATOM 1728 CD LYS B 7 91.128 4.277 -13.164 1.00 0.00 C ATOM 1729 CE LYS B 7 92.626 3.978 -13.203 1.00 0.00 C ATOM 1730 NZ LYS B 7 92.999 3.470 -14.553 1.00 0.00 N ATOM 0 H LYS B 7 90.552 3.915 -9.479 1.00 0.00 H new ATOM 0 HA LYS B 7 88.877 6.194 -10.127 1.00 0.00 H new ATOM 0 HB2 LYS B 7 89.029 3.539 -11.607 1.00 0.00 H new ATOM 0 HB3 LYS B 7 88.673 5.121 -12.271 1.00 0.00 H new ATOM 0 HG2 LYS B 7 90.984 5.889 -11.722 1.00 0.00 H new ATOM 0 HG3 LYS B 7 91.345 4.330 -11.008 1.00 0.00 H new ATOM 0 HD2 LYS B 7 90.560 3.371 -13.375 1.00 0.00 H new ATOM 0 HD3 LYS B 7 90.870 5.002 -13.936 1.00 0.00 H new ATOM 0 HE2 LYS B 7 93.193 4.880 -12.973 1.00 0.00 H new ATOM 0 HE3 LYS B 7 92.880 3.239 -12.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 94.019 3.267 -14.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 92.468 2.599 -14.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 92.771 4.189 -15.269 1.00 0.00 H new ATOM 1744 N ALA B 8 87.516 3.264 -9.465 1.00 0.00 N ATOM 1745 CA ALA B 8 86.231 2.643 -9.072 1.00 0.00 C ATOM 1746 C ALA B 8 85.761 3.357 -7.816 1.00 0.00 C ATOM 1747 O ALA B 8 84.605 3.694 -7.671 1.00 0.00 O ATOM 1748 CB ALA B 8 86.438 1.156 -8.804 1.00 0.00 C ATOM 0 H ALA B 8 88.317 2.633 -9.499 1.00 0.00 H new ATOM 0 HA ALA B 8 85.486 2.735 -9.862 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.490 0.703 -8.515 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.811 0.672 -9.707 1.00 0.00 H new ATOM 0 HB3 ALA B 8 87.161 1.029 -7.999 1.00 0.00 H new ATOM 1754 N LEU B 9 86.665 3.656 -6.933 1.00 0.00 N ATOM 1755 CA LEU B 9 86.268 4.425 -5.733 1.00 0.00 C ATOM 1756 C LEU B 9 85.707 5.746 -6.243 1.00 0.00 C ATOM 1757 O LEU B 9 84.713 6.248 -5.758 1.00 0.00 O ATOM 1758 CB LEU B 9 87.484 4.673 -4.836 1.00 0.00 C ATOM 1759 CG LEU B 9 87.074 5.485 -3.597 1.00 0.00 C ATOM 1760 CD1 LEU B 9 86.013 4.726 -2.780 1.00 0.00 C ATOM 1761 CD2 LEU B 9 88.314 5.734 -2.732 1.00 0.00 C ATOM 0 H LEU B 9 87.652 3.404 -6.990 1.00 0.00 H new ATOM 0 HA LEU B 9 85.531 3.884 -5.139 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.918 3.722 -4.529 1.00 0.00 H new ATOM 0 HB3 LEU B 9 88.252 5.209 -5.393 1.00 0.00 H new ATOM 0 HG LEU B 9 86.646 6.435 -3.917 1.00 0.00 H new ATOM 0 HD11 LEU B 9 85.735 5.316 -1.907 1.00 0.00 H new ATOM 0 HD12 LEU B 9 85.132 4.555 -3.398 1.00 0.00 H new ATOM 0 HD13 LEU B 9 86.420 3.768 -2.456 1.00 0.00 H new ATOM 0 HD21 LEU B 9 88.033 6.310 -1.850 1.00 0.00 H new ATOM 0 HD22 LEU B 9 88.739 4.779 -2.422 1.00 0.00 H new ATOM 0 HD23 LEU B 9 89.054 6.290 -3.308 1.00 0.00 H new ATOM 1773 N ASP B 10 86.337 6.296 -7.251 1.00 0.00 N ATOM 1774 CA ASP B 10 85.841 7.570 -7.831 1.00 0.00 C ATOM 1775 C ASP B 10 84.509 7.306 -8.536 1.00 0.00 C ATOM 1776 O ASP B 10 83.634 8.148 -8.558 1.00 0.00 O ATOM 1777 CB ASP B 10 86.865 8.114 -8.837 1.00 0.00 C ATOM 1778 CG ASP B 10 86.574 9.588 -9.122 1.00 0.00 C ATOM 1779 OD1 ASP B 10 85.521 9.867 -9.671 1.00 0.00 O ATOM 1780 OD2 ASP B 10 87.410 10.412 -8.790 1.00 0.00 O ATOM 0 H ASP B 10 87.173 5.914 -7.694 1.00 0.00 H new ATOM 0 HA ASP B 10 85.699 8.307 -7.040 1.00 0.00 H new ATOM 0 HB2 ASP B 10 87.874 8.003 -8.440 1.00 0.00 H new ATOM 0 HB3 ASP B 10 86.821 7.539 -9.762 1.00 0.00 H new ATOM 1785 N VAL B 11 84.344 6.141 -9.114 1.00 0.00 N ATOM 1786 CA VAL B 11 83.060 5.839 -9.815 1.00 0.00 C ATOM 1787 C VAL B 11 81.903 5.931 -8.815 1.00 0.00 C ATOM 1788 O VAL B 11 80.850 6.449 -9.124 1.00 0.00 O ATOM 1789 CB VAL B 11 83.113 4.423 -10.411 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.733 3.997 -10.915 1.00 0.00 C ATOM 1791 CG2 VAL B 11 84.098 4.396 -11.582 1.00 0.00 C ATOM 0 H VAL B 11 85.037 5.393 -9.130 1.00 0.00 H new ATOM 0 HA VAL B 11 82.908 6.560 -10.618 1.00 0.00 H new ATOM 0 HB VAL B 11 83.436 3.734 -9.631 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.793 2.992 -11.333 1.00 0.00 H new ATOM 0 HG12 VAL B 11 81.025 4.004 -10.086 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.397 4.691 -11.685 1.00 0.00 H new ATOM 0 HG21 VAL B 11 84.135 3.391 -12.004 1.00 0.00 H new ATOM 0 HG22 VAL B 11 83.772 5.099 -12.348 1.00 0.00 H new ATOM 0 HG23 VAL B 11 85.090 4.678 -11.229 1.00 0.00 H new ATOM 1801 N MET B 12 82.085 5.438 -7.618 1.00 0.00 N ATOM 1802 CA MET B 12 80.976 5.519 -6.623 1.00 0.00 C ATOM 1803 C MET B 12 80.714 6.991 -6.307 1.00 0.00 C ATOM 1804 O MET B 12 79.589 7.421 -6.159 1.00 0.00 O ATOM 1805 CB MET B 12 81.358 4.787 -5.330 1.00 0.00 C ATOM 1806 CG MET B 12 81.499 3.278 -5.590 1.00 0.00 C ATOM 1807 SD MET B 12 81.140 2.367 -4.065 1.00 0.00 S ATOM 1808 CE MET B 12 82.185 3.334 -2.948 1.00 0.00 C ATOM 0 H MET B 12 82.940 4.989 -7.290 1.00 0.00 H new ATOM 0 HA MET B 12 80.084 5.050 -7.039 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.296 5.185 -4.943 1.00 0.00 H new ATOM 0 HB3 MET B 12 80.599 4.962 -4.568 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.815 2.969 -6.381 1.00 0.00 H new ATOM 0 HG3 MET B 12 82.508 3.050 -5.934 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.453 2.726 -2.084 1.00 0.00 H new ATOM 0 HE2 MET B 12 83.091 3.641 -3.471 1.00 0.00 H new ATOM 0 HE3 MET B 12 81.641 4.218 -2.615 1.00 0.00 H new ATOM 1818 N VAL B 13 81.757 7.762 -6.193 1.00 0.00 N ATOM 1819 CA VAL B 13 81.594 9.210 -5.883 1.00 0.00 C ATOM 1820 C VAL B 13 81.159 9.981 -7.130 1.00 0.00 C ATOM 1821 O VAL B 13 80.290 10.828 -7.074 1.00 0.00 O ATOM 1822 CB VAL B 13 82.927 9.760 -5.384 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.803 11.263 -5.114 1.00 0.00 C ATOM 1824 CG2 VAL B 13 83.309 9.037 -4.096 1.00 0.00 C ATOM 0 H VAL B 13 82.722 7.450 -6.302 1.00 0.00 H new ATOM 0 HA VAL B 13 80.827 9.328 -5.118 1.00 0.00 H new ATOM 0 HB VAL B 13 83.695 9.600 -6.141 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.758 11.649 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL B 13 82.525 11.776 -6.034 1.00 0.00 H new ATOM 0 HG13 VAL B 13 82.038 11.435 -4.357 1.00 0.00 H new ATOM 0 HG21 VAL B 13 84.261 9.423 -3.731 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.538 9.202 -3.344 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.402 7.969 -4.292 1.00 0.00 H new ATOM 1834 N SER B 14 81.770 9.713 -8.254 1.00 0.00 N ATOM 1835 CA SER B 14 81.399 10.455 -9.491 1.00 0.00 C ATOM 1836 C SER B 14 79.924 10.223 -9.809 1.00 0.00 C ATOM 1837 O SER B 14 79.176 11.153 -10.037 1.00 0.00 O ATOM 1838 CB SER B 14 82.252 9.962 -10.659 1.00 0.00 C ATOM 1839 OG SER B 14 81.991 10.767 -11.801 1.00 0.00 O ATOM 0 H SER B 14 82.506 9.016 -8.367 1.00 0.00 H new ATOM 0 HA SER B 14 81.573 11.520 -9.335 1.00 0.00 H new ATOM 0 HB2 SER B 14 83.309 10.011 -10.399 1.00 0.00 H new ATOM 0 HB3 SER B 14 82.025 8.918 -10.876 1.00 0.00 H new ATOM 0 HG SER B 14 82.537 10.455 -12.553 1.00 0.00 H new ATOM 1845 N THR B 15 79.492 8.994 -9.824 1.00 0.00 N ATOM 1846 CA THR B 15 78.061 8.723 -10.124 1.00 0.00 C ATOM 1847 C THR B 15 77.188 9.368 -9.046 1.00 0.00 C ATOM 1848 O THR B 15 76.155 9.940 -9.322 1.00 0.00 O ATOM 1849 CB THR B 15 77.833 7.203 -10.169 1.00 0.00 C ATOM 1850 OG1 THR B 15 76.681 6.921 -10.951 1.00 0.00 O ATOM 1851 CG2 THR B 15 77.646 6.630 -8.758 1.00 0.00 C ATOM 0 H THR B 15 80.065 8.170 -9.642 1.00 0.00 H new ATOM 0 HA THR B 15 77.793 9.147 -11.091 1.00 0.00 H new ATOM 0 HB THR B 15 78.711 6.737 -10.615 1.00 0.00 H new ATOM 0 HG1 THR B 15 76.345 6.028 -10.728 1.00 0.00 H new ATOM 0 HG21 THR B 15 77.487 5.554 -8.821 1.00 0.00 H new ATOM 0 HG22 THR B 15 78.537 6.831 -8.163 1.00 0.00 H new ATOM 0 HG23 THR B 15 76.782 7.098 -8.287 1.00 0.00 H new ATOM 1859 N PHE B 16 77.607 9.270 -7.818 1.00 0.00 N ATOM 1860 CA PHE B 16 76.811 9.861 -6.703 1.00 0.00 C ATOM 1861 C PHE B 16 76.657 11.368 -6.900 1.00 0.00 C ATOM 1862 O PHE B 16 75.594 11.920 -6.698 1.00 0.00 O ATOM 1863 CB PHE B 16 77.520 9.584 -5.374 1.00 0.00 C ATOM 1864 CG PHE B 16 76.726 10.181 -4.238 1.00 0.00 C ATOM 1865 CD1 PHE B 16 75.738 9.424 -3.593 1.00 0.00 C ATOM 1866 CD2 PHE B 16 76.982 11.493 -3.825 1.00 0.00 C ATOM 1867 CE1 PHE B 16 75.008 9.984 -2.537 1.00 0.00 C ATOM 1868 CE2 PHE B 16 76.253 12.052 -2.771 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.265 11.298 -2.126 1.00 0.00 C ATOM 0 H PHE B 16 78.469 8.805 -7.534 1.00 0.00 H new ATOM 0 HA PHE B 16 75.820 9.408 -6.694 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.631 8.510 -5.227 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.524 10.009 -5.391 1.00 0.00 H new ATOM 0 HD1 PHE B 16 75.540 8.411 -3.910 1.00 0.00 H new ATOM 0 HD2 PHE B 16 77.744 12.075 -4.321 1.00 0.00 H new ATOM 0 HE1 PHE B 16 74.246 9.402 -2.039 1.00 0.00 H new ATOM 0 HE2 PHE B 16 76.452 13.065 -2.454 1.00 0.00 H new ATOM 0 HZ PHE B 16 74.701 11.729 -1.312 1.00 0.00 H new ATOM 1879 N HIS B 17 77.696 12.040 -7.300 1.00 0.00 N ATOM 1880 CA HIS B 17 77.585 13.508 -7.515 1.00 0.00 C ATOM 1881 C HIS B 17 76.539 13.774 -8.595 1.00 0.00 C ATOM 1882 O HIS B 17 75.762 14.704 -8.508 1.00 0.00 O ATOM 1883 CB HIS B 17 78.940 14.078 -7.959 1.00 0.00 C ATOM 1884 CG HIS B 17 79.840 14.262 -6.765 1.00 0.00 C ATOM 1885 ND1 HIS B 17 81.181 13.904 -6.788 1.00 0.00 N ATOM 1886 CD2 HIS B 17 79.611 14.777 -5.510 1.00 0.00 C ATOM 1887 CE1 HIS B 17 81.702 14.205 -5.584 1.00 0.00 C ATOM 1888 NE2 HIS B 17 80.787 14.738 -4.772 1.00 0.00 N ATOM 0 H HIS B 17 78.615 11.639 -7.487 1.00 0.00 H new ATOM 0 HA HIS B 17 77.288 13.990 -6.584 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.409 13.405 -8.677 1.00 0.00 H new ATOM 0 HB3 HIS B 17 78.794 15.032 -8.465 1.00 0.00 H new ATOM 0 HD2 HIS B 17 78.663 15.153 -5.154 1.00 0.00 H new ATOM 0 HE1 HIS B 17 82.733 14.036 -5.309 1.00 0.00 H new ATOM 0 HE2 HIS B 17 80.923 15.051 -3.811 1.00 0.00 H new ATOM 1897 N LYS B 18 76.519 12.969 -9.619 1.00 0.00 N ATOM 1898 CA LYS B 18 75.529 13.188 -10.708 1.00 0.00 C ATOM 1899 C LYS B 18 74.115 13.086 -10.133 1.00 0.00 C ATOM 1900 O LYS B 18 73.259 13.899 -10.421 1.00 0.00 O ATOM 1901 CB LYS B 18 75.721 12.126 -11.797 1.00 0.00 C ATOM 1902 CG LYS B 18 77.101 12.282 -12.462 1.00 0.00 C ATOM 1903 CD LYS B 18 77.089 13.432 -13.482 1.00 0.00 C ATOM 1904 CE LYS B 18 78.372 13.388 -14.319 1.00 0.00 C ATOM 1905 NZ LYS B 18 79.545 13.735 -13.465 1.00 0.00 N ATOM 0 H LYS B 18 77.142 12.172 -9.749 1.00 0.00 H new ATOM 0 HA LYS B 18 75.675 14.177 -11.142 1.00 0.00 H new ATOM 0 HB2 LYS B 18 75.630 11.130 -11.363 1.00 0.00 H new ATOM 0 HB3 LYS B 18 74.936 12.220 -12.547 1.00 0.00 H new ATOM 0 HG2 LYS B 18 77.857 12.473 -11.700 1.00 0.00 H new ATOM 0 HG3 LYS B 18 77.377 11.352 -12.959 1.00 0.00 H new ATOM 0 HD2 LYS B 18 76.217 13.348 -14.130 1.00 0.00 H new ATOM 0 HD3 LYS B 18 77.012 14.389 -12.966 1.00 0.00 H new ATOM 0 HE2 LYS B 18 78.504 12.394 -14.747 1.00 0.00 H new ATOM 0 HE3 LYS B 18 78.298 14.087 -15.152 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 80.397 13.803 -14.057 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 79.375 14.648 -12.996 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 79.681 12.996 -12.746 1.00 0.00 H new ATOM 1919 N TYR B 19 73.860 12.098 -9.315 1.00 0.00 N ATOM 1920 CA TYR B 19 72.497 11.962 -8.720 1.00 0.00 C ATOM 1921 C TYR B 19 72.257 13.084 -7.711 1.00 0.00 C ATOM 1922 O TYR B 19 71.183 13.644 -7.635 1.00 0.00 O ATOM 1923 CB TYR B 19 72.351 10.602 -8.032 1.00 0.00 C ATOM 1924 CG TYR B 19 72.173 9.522 -9.076 1.00 0.00 C ATOM 1925 CD1 TYR B 19 70.938 9.376 -9.721 1.00 0.00 C ATOM 1926 CD2 TYR B 19 73.234 8.666 -9.393 1.00 0.00 C ATOM 1927 CE1 TYR B 19 70.764 8.377 -10.685 1.00 0.00 C ATOM 1928 CE2 TYR B 19 73.064 7.666 -10.357 1.00 0.00 C ATOM 1929 CZ TYR B 19 71.827 7.521 -11.005 1.00 0.00 C ATOM 1930 OH TYR B 19 71.658 6.536 -11.957 1.00 0.00 O ATOM 0 H TYR B 19 74.532 11.384 -9.035 1.00 0.00 H new ATOM 0 HA TYR B 19 71.757 12.032 -9.517 1.00 0.00 H new ATOM 0 HB2 TYR B 19 73.232 10.394 -7.425 1.00 0.00 H new ATOM 0 HB3 TYR B 19 71.495 10.614 -7.357 1.00 0.00 H new ATOM 0 HD1 TYR B 19 70.119 10.035 -9.474 1.00 0.00 H new ATOM 0 HD2 TYR B 19 74.185 8.777 -8.893 1.00 0.00 H new ATOM 0 HE1 TYR B 19 69.812 8.265 -11.182 1.00 0.00 H new ATOM 0 HE2 TYR B 19 73.883 7.007 -10.602 1.00 0.00 H new ATOM 0 HH TYR B 19 72.534 6.194 -12.233 1.00 0.00 H new ATOM 1940 N SER B 20 73.249 13.420 -6.939 1.00 0.00 N ATOM 1941 CA SER B 20 73.078 14.512 -5.944 1.00 0.00 C ATOM 1942 C SER B 20 73.253 15.847 -6.661 1.00 0.00 C ATOM 1943 O SER B 20 73.202 16.904 -6.064 1.00 0.00 O ATOM 1944 CB SER B 20 74.133 14.373 -4.844 1.00 0.00 C ATOM 1945 OG SER B 20 73.769 15.190 -3.739 1.00 0.00 O ATOM 0 H SER B 20 74.172 12.986 -6.954 1.00 0.00 H new ATOM 0 HA SER B 20 72.088 14.458 -5.491 1.00 0.00 H new ATOM 0 HB2 SER B 20 74.214 13.332 -4.531 1.00 0.00 H new ATOM 0 HB3 SER B 20 75.111 14.668 -5.223 1.00 0.00 H new ATOM 0 HG SER B 20 73.206 14.676 -3.124 1.00 0.00 H new ATOM 1951 N GLY B 21 73.472 15.798 -7.950 1.00 0.00 N ATOM 1952 CA GLY B 21 73.670 17.053 -8.737 1.00 0.00 C ATOM 1953 C GLY B 21 72.343 17.503 -9.357 1.00 0.00 C ATOM 1954 O GLY B 21 72.297 17.918 -10.498 1.00 0.00 O ATOM 0 H GLY B 21 73.523 14.937 -8.495 1.00 0.00 H new ATOM 0 HA2 GLY B 21 74.063 17.838 -8.091 1.00 0.00 H new ATOM 0 HA3 GLY B 21 74.408 16.887 -9.521 1.00 0.00 H new ATOM 1958 N LYS B 22 71.261 17.430 -8.623 1.00 0.00 N ATOM 1959 CA LYS B 22 69.945 17.862 -9.186 1.00 0.00 C ATOM 1960 C LYS B 22 69.086 18.486 -8.078 1.00 0.00 C ATOM 1961 O LYS B 22 69.084 19.687 -7.893 1.00 0.00 O ATOM 1962 CB LYS B 22 69.224 16.646 -9.804 1.00 0.00 C ATOM 1963 CG LYS B 22 69.642 15.369 -9.069 1.00 0.00 C ATOM 1964 CD LYS B 22 68.665 14.231 -9.396 1.00 0.00 C ATOM 1965 CE LYS B 22 68.805 13.821 -10.867 1.00 0.00 C ATOM 1966 NZ LYS B 22 68.071 14.792 -11.728 1.00 0.00 N ATOM 0 H LYS B 22 71.232 17.091 -7.661 1.00 0.00 H new ATOM 0 HA LYS B 22 70.109 18.609 -9.963 1.00 0.00 H new ATOM 0 HB2 LYS B 22 68.144 16.779 -9.737 1.00 0.00 H new ATOM 0 HB3 LYS B 22 69.470 16.565 -10.863 1.00 0.00 H new ATOM 0 HG2 LYS B 22 70.653 15.086 -9.361 1.00 0.00 H new ATOM 0 HG3 LYS B 22 69.659 15.547 -7.994 1.00 0.00 H new ATOM 0 HD2 LYS B 22 68.864 13.375 -8.751 1.00 0.00 H new ATOM 0 HD3 LYS B 22 67.642 14.551 -9.195 1.00 0.00 H new ATOM 0 HE2 LYS B 22 69.858 13.793 -11.149 1.00 0.00 H new ATOM 0 HE3 LYS B 22 68.409 12.816 -11.015 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 67.489 14.274 -12.417 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 67.458 15.387 -11.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 68.753 15.393 -12.233 1.00 0.00 H new ATOM 1980 N GLU B 23 68.345 17.683 -7.355 1.00 0.00 N ATOM 1981 CA GLU B 23 67.462 18.221 -6.267 1.00 0.00 C ATOM 1982 C GLU B 23 67.998 17.824 -4.889 1.00 0.00 C ATOM 1983 O GLU B 23 68.610 16.788 -4.721 1.00 0.00 O ATOM 1984 CB GLU B 23 66.052 17.650 -6.443 1.00 0.00 C ATOM 1985 CG GLU B 23 66.112 16.121 -6.443 1.00 0.00 C ATOM 1986 CD GLU B 23 64.720 15.558 -6.743 1.00 0.00 C ATOM 1987 OE1 GLU B 23 63.776 16.001 -6.111 1.00 0.00 O ATOM 1988 OE2 GLU B 23 64.623 14.695 -7.600 1.00 0.00 O ATOM 0 H GLU B 23 68.312 16.670 -7.471 1.00 0.00 H new ATOM 0 HA GLU B 23 67.443 19.309 -6.333 1.00 0.00 H new ATOM 0 HB2 GLU B 23 65.405 17.998 -5.638 1.00 0.00 H new ATOM 0 HB3 GLU B 23 65.619 18.007 -7.377 1.00 0.00 H new ATOM 0 HG2 GLU B 23 66.826 15.774 -7.190 1.00 0.00 H new ATOM 0 HG3 GLU B 23 66.462 15.760 -5.476 1.00 0.00 H new ATOM 1995 N GLY B 24 67.760 18.646 -3.897 1.00 0.00 N ATOM 1996 CA GLY B 24 68.239 18.332 -2.516 1.00 0.00 C ATOM 1997 C GLY B 24 69.643 18.901 -2.314 1.00 0.00 C ATOM 1998 O GLY B 24 70.171 19.593 -3.161 1.00 0.00 O ATOM 0 H GLY B 24 67.252 19.526 -3.985 1.00 0.00 H new ATOM 0 HA2 GLY B 24 67.556 18.755 -1.779 1.00 0.00 H new ATOM 0 HA3 GLY B 24 68.248 17.253 -2.361 1.00 0.00 H new ATOM 2002 N ASP B 25 70.258 18.607 -1.199 1.00 0.00 N ATOM 2003 CA ASP B 25 71.632 19.125 -0.950 1.00 0.00 C ATOM 2004 C ASP B 25 72.628 18.303 -1.759 1.00 0.00 C ATOM 2005 O ASP B 25 72.536 17.093 -1.835 1.00 0.00 O ATOM 2006 CB ASP B 25 71.965 19.015 0.541 1.00 0.00 C ATOM 2007 CG ASP B 25 71.151 20.047 1.323 1.00 0.00 C ATOM 2008 OD1 ASP B 25 70.785 21.053 0.736 1.00 0.00 O ATOM 2009 OD2 ASP B 25 70.908 19.817 2.496 1.00 0.00 O ATOM 0 H ASP B 25 69.868 18.032 -0.452 1.00 0.00 H new ATOM 0 HA ASP B 25 71.688 20.171 -1.250 1.00 0.00 H new ATOM 0 HB2 ASP B 25 71.741 18.011 0.901 1.00 0.00 H new ATOM 0 HB3 ASP B 25 73.031 19.181 0.700 1.00 0.00 H new ATOM 2014 N LYS B 26 73.578 18.950 -2.367 1.00 0.00 N ATOM 2015 CA LYS B 26 74.578 18.208 -3.173 1.00 0.00 C ATOM 2016 C LYS B 26 75.468 17.412 -2.231 1.00 0.00 C ATOM 2017 O LYS B 26 76.175 16.509 -2.636 1.00 0.00 O ATOM 2018 CB LYS B 26 75.423 19.195 -3.984 1.00 0.00 C ATOM 2019 CG LYS B 26 74.538 19.884 -5.025 1.00 0.00 C ATOM 2020 CD LYS B 26 75.374 20.872 -5.840 1.00 0.00 C ATOM 2021 CE LYS B 26 74.480 21.570 -6.866 1.00 0.00 C ATOM 2022 NZ LYS B 26 73.922 20.564 -7.814 1.00 0.00 N ATOM 0 H LYS B 26 73.705 19.962 -2.340 1.00 0.00 H new ATOM 0 HA LYS B 26 74.074 17.531 -3.863 1.00 0.00 H new ATOM 0 HB2 LYS B 26 75.871 19.937 -3.323 1.00 0.00 H new ATOM 0 HB3 LYS B 26 76.242 18.671 -4.476 1.00 0.00 H new ATOM 0 HG2 LYS B 26 74.090 19.141 -5.685 1.00 0.00 H new ATOM 0 HG3 LYS B 26 73.719 20.407 -4.531 1.00 0.00 H new ATOM 0 HD2 LYS B 26 75.832 21.609 -5.180 1.00 0.00 H new ATOM 0 HD3 LYS B 26 76.186 20.348 -6.345 1.00 0.00 H new ATOM 0 HE2 LYS B 26 73.670 22.095 -6.359 1.00 0.00 H new ATOM 0 HE3 LYS B 26 75.053 22.319 -7.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 73.577 21.046 -8.669 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 74.664 19.884 -8.075 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 73.134 20.059 -7.360 1.00 0.00 H new ATOM 2036 N PHE B 27 75.435 17.736 -0.970 1.00 0.00 N ATOM 2037 CA PHE B 27 76.274 16.996 0.016 1.00 0.00 C ATOM 2038 C PHE B 27 75.474 15.816 0.569 1.00 0.00 C ATOM 2039 O PHE B 27 75.974 15.027 1.346 1.00 0.00 O ATOM 2040 CB PHE B 27 76.651 17.932 1.165 1.00 0.00 C ATOM 2041 CG PHE B 27 77.593 19.000 0.661 1.00 0.00 C ATOM 2042 CD1 PHE B 27 78.976 18.787 0.692 1.00 0.00 C ATOM 2043 CD2 PHE B 27 77.080 20.204 0.162 1.00 0.00 C ATOM 2044 CE1 PHE B 27 79.847 19.779 0.225 1.00 0.00 C ATOM 2045 CE2 PHE B 27 77.951 21.194 -0.305 1.00 0.00 C ATOM 2046 CZ PHE B 27 79.335 20.983 -0.274 1.00 0.00 C ATOM 0 H PHE B 27 74.862 18.483 -0.577 1.00 0.00 H new ATOM 0 HA PHE B 27 77.179 16.633 -0.471 1.00 0.00 H new ATOM 0 HB2 PHE B 27 75.755 18.391 1.582 1.00 0.00 H new ATOM 0 HB3 PHE B 27 77.123 17.366 1.968 1.00 0.00 H new ATOM 0 HD1 PHE B 27 79.371 17.858 1.076 1.00 0.00 H new ATOM 0 HD2 PHE B 27 76.013 20.368 0.138 1.00 0.00 H new ATOM 0 HE1 PHE B 27 80.914 19.615 0.250 1.00 0.00 H new ATOM 0 HE2 PHE B 27 77.556 22.122 -0.690 1.00 0.00 H new ATOM 0 HZ PHE B 27 80.007 21.748 -0.635 1.00 0.00 H new ATOM 2056 N LYS B 28 74.226 15.695 0.183 1.00 0.00 N ATOM 2057 CA LYS B 28 73.383 14.576 0.697 1.00 0.00 C ATOM 2058 C LYS B 28 72.458 14.070 -0.413 1.00 0.00 C ATOM 2059 O LYS B 28 72.182 14.769 -1.368 1.00 0.00 O ATOM 2060 CB LYS B 28 72.527 15.100 1.847 1.00 0.00 C ATOM 2061 CG LYS B 28 73.407 15.893 2.821 1.00 0.00 C ATOM 2062 CD LYS B 28 72.674 16.067 4.160 1.00 0.00 C ATOM 2063 CE LYS B 28 72.854 14.808 5.027 1.00 0.00 C ATOM 2064 NZ LYS B 28 73.952 15.040 6.007 1.00 0.00 N ATOM 0 H LYS B 28 73.757 16.326 -0.467 1.00 0.00 H new ATOM 0 HA LYS B 28 74.024 13.762 1.035 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.730 15.735 1.461 1.00 0.00 H new ATOM 0 HB3 LYS B 28 72.049 14.269 2.366 1.00 0.00 H new ATOM 0 HG2 LYS B 28 74.352 15.373 2.978 1.00 0.00 H new ATOM 0 HG3 LYS B 28 73.647 16.868 2.398 1.00 0.00 H new ATOM 0 HD2 LYS B 28 73.063 16.939 4.686 1.00 0.00 H new ATOM 0 HD3 LYS B 28 71.614 16.248 3.983 1.00 0.00 H new ATOM 0 HE2 LYS B 28 71.926 14.577 5.550 1.00 0.00 H new ATOM 0 HE3 LYS B 28 73.088 13.949 4.398 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 74.307 14.126 6.353 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 74.725 15.560 5.545 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 73.591 15.596 6.808 1.00 0.00 H new ATOM 2078 N LEU B 29 71.960 12.862 -0.283 1.00 0.00 N ATOM 2079 CA LEU B 29 71.027 12.304 -1.314 1.00 0.00 C ATOM 2080 C LEU B 29 69.816 11.702 -0.606 1.00 0.00 C ATOM 2081 O LEU B 29 69.924 11.120 0.454 1.00 0.00 O ATOM 2082 CB LEU B 29 71.750 11.247 -2.158 1.00 0.00 C ATOM 2083 CG LEU B 29 70.877 10.841 -3.357 1.00 0.00 C ATOM 2084 CD1 LEU B 29 70.984 11.883 -4.482 1.00 0.00 C ATOM 2085 CD2 LEU B 29 71.341 9.478 -3.886 1.00 0.00 C ATOM 0 H LEU B 29 72.161 12.236 0.497 1.00 0.00 H new ATOM 0 HA LEU B 29 70.692 13.096 -1.984 1.00 0.00 H new ATOM 0 HB2 LEU B 29 72.704 11.641 -2.509 1.00 0.00 H new ATOM 0 HB3 LEU B 29 71.972 10.372 -1.547 1.00 0.00 H new ATOM 0 HG LEU B 29 69.839 10.782 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU B 29 70.359 11.578 -5.321 1.00 0.00 H new ATOM 0 HD12 LEU B 29 70.648 12.852 -4.113 1.00 0.00 H new ATOM 0 HD13 LEU B 29 72.021 11.959 -4.810 1.00 0.00 H new ATOM 0 HD21 LEU B 29 70.723 9.188 -4.736 1.00 0.00 H new ATOM 0 HD22 LEU B 29 72.383 9.545 -4.200 1.00 0.00 H new ATOM 0 HD23 LEU B 29 71.247 8.731 -3.098 1.00 0.00 H new ATOM 2097 N ASN B 30 68.659 11.865 -1.181 1.00 0.00 N ATOM 2098 CA ASN B 30 67.419 11.334 -0.549 1.00 0.00 C ATOM 2099 C ASN B 30 67.282 9.835 -0.827 1.00 0.00 C ATOM 2100 O ASN B 30 67.578 9.360 -1.900 1.00 0.00 O ATOM 2101 CB ASN B 30 66.208 12.075 -1.123 1.00 0.00 C ATOM 2102 CG ASN B 30 66.234 13.533 -0.657 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.316 13.803 0.526 1.00 0.00 O ATOM 2104 ND2 ASN B 30 66.174 14.490 -1.540 1.00 0.00 N ATOM 0 H ASN B 30 68.517 12.347 -2.069 1.00 0.00 H new ATOM 0 HA ASN B 30 67.472 11.487 0.529 1.00 0.00 H new ATOM 0 HB2 ASN B 30 66.223 12.030 -2.212 1.00 0.00 H new ATOM 0 HB3 ASN B 30 65.286 11.594 -0.797 1.00 0.00 H new ATOM 0 HD21 ASN B 30 66.196 15.464 -1.239 1.00 0.00 H new ATOM 0 HD22 ASN B 30 66.105 14.265 -2.532 1.00 0.00 H new ATOM 2111 N LYS B 31 66.835 9.092 0.142 1.00 0.00 N ATOM 2112 CA LYS B 31 66.672 7.623 -0.037 1.00 0.00 C ATOM 2113 C LYS B 31 65.714 7.360 -1.195 1.00 0.00 C ATOM 2114 O LYS B 31 65.765 6.331 -1.834 1.00 0.00 O ATOM 2115 CB LYS B 31 66.104 7.021 1.243 1.00 0.00 C ATOM 2116 CG LYS B 31 67.037 7.340 2.419 1.00 0.00 C ATOM 2117 CD LYS B 31 66.470 6.748 3.725 1.00 0.00 C ATOM 2118 CE LYS B 31 66.933 5.296 3.898 1.00 0.00 C ATOM 2119 NZ LYS B 31 68.308 5.283 4.468 1.00 0.00 N ATOM 0 H LYS B 31 66.572 9.443 1.063 1.00 0.00 H new ATOM 0 HA LYS B 31 67.638 7.168 -0.255 1.00 0.00 H new ATOM 0 HB2 LYS B 31 65.109 7.422 1.436 1.00 0.00 H new ATOM 0 HB3 LYS B 31 65.997 5.942 1.133 1.00 0.00 H new ATOM 0 HG2 LYS B 31 68.029 6.931 2.227 1.00 0.00 H new ATOM 0 HG3 LYS B 31 67.151 8.419 2.520 1.00 0.00 H new ATOM 0 HD2 LYS B 31 66.799 7.345 4.575 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.381 6.790 3.708 1.00 0.00 H new ATOM 0 HE2 LYS B 31 66.249 4.760 4.556 1.00 0.00 H new ATOM 0 HE3 LYS B 31 66.920 4.781 2.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 68.754 4.363 4.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 68.873 6.039 4.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 68.259 5.438 5.495 1.00 0.00 H new ATOM 2133 N SER B 32 64.861 8.289 -1.495 1.00 0.00 N ATOM 2134 CA SER B 32 63.937 8.082 -2.635 1.00 0.00 C ATOM 2135 C SER B 32 64.807 7.890 -3.859 1.00 0.00 C ATOM 2136 O SER B 32 64.550 7.052 -4.701 1.00 0.00 O ATOM 2137 CB SER B 32 63.049 9.302 -2.835 1.00 0.00 C ATOM 2138 OG SER B 32 62.208 9.466 -1.699 1.00 0.00 O ATOM 0 H SER B 32 64.763 9.178 -1.004 1.00 0.00 H new ATOM 0 HA SER B 32 63.289 7.224 -2.455 1.00 0.00 H new ATOM 0 HB2 SER B 32 63.662 10.192 -2.979 1.00 0.00 H new ATOM 0 HB3 SER B 32 62.445 9.182 -3.734 1.00 0.00 H new ATOM 0 HG SER B 32 61.637 10.252 -1.826 1.00 0.00 H new ATOM 2144 N GLU B 33 65.872 8.638 -3.938 1.00 0.00 N ATOM 2145 CA GLU B 33 66.796 8.467 -5.080 1.00 0.00 C ATOM 2146 C GLU B 33 67.255 7.035 -5.063 1.00 0.00 C ATOM 2147 O GLU B 33 67.636 6.502 -6.067 1.00 0.00 O ATOM 2148 CB GLU B 33 67.996 9.400 -4.948 1.00 0.00 C ATOM 2149 CG GLU B 33 67.521 10.852 -5.013 1.00 0.00 C ATOM 2150 CD GLU B 33 67.068 11.175 -6.439 1.00 0.00 C ATOM 2151 OE1 GLU B 33 67.573 10.546 -7.355 1.00 0.00 O ATOM 2152 OE2 GLU B 33 66.228 12.046 -6.590 1.00 0.00 O ATOM 0 H GLU B 33 66.137 9.355 -3.263 1.00 0.00 H new ATOM 0 HA GLU B 33 66.293 8.709 -6.016 1.00 0.00 H new ATOM 0 HB2 GLU B 33 68.511 9.216 -4.005 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.712 9.204 -5.746 1.00 0.00 H new ATOM 0 HG2 GLU B 33 66.699 11.009 -4.314 1.00 0.00 H new ATOM 0 HG3 GLU B 33 68.326 11.523 -4.714 1.00 0.00 H new ATOM 2159 N LEU B 34 67.190 6.371 -3.943 1.00 0.00 N ATOM 2160 CA LEU B 34 67.605 4.945 -3.973 1.00 0.00 C ATOM 2161 C LEU B 34 66.675 4.268 -4.966 1.00 0.00 C ATOM 2162 O LEU B 34 67.083 3.448 -5.756 1.00 0.00 O ATOM 2163 CB LEU B 34 67.445 4.264 -2.601 1.00 0.00 C ATOM 2164 CG LEU B 34 68.035 2.832 -2.649 1.00 0.00 C ATOM 2165 CD1 LEU B 34 69.539 2.876 -2.353 1.00 0.00 C ATOM 2166 CD2 LEU B 34 67.334 1.936 -1.613 1.00 0.00 C ATOM 0 H LEU B 34 66.880 6.736 -3.042 1.00 0.00 H new ATOM 0 HA LEU B 34 68.658 4.869 -4.245 1.00 0.00 H new ATOM 0 HB2 LEU B 34 67.952 4.850 -1.834 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.391 4.223 -2.327 1.00 0.00 H new ATOM 0 HG LEU B 34 67.875 2.421 -3.646 1.00 0.00 H new ATOM 0 HD11 LEU B 34 69.947 1.866 -2.389 1.00 0.00 H new ATOM 0 HD12 LEU B 34 70.039 3.495 -3.098 1.00 0.00 H new ATOM 0 HD13 LEU B 34 69.703 3.298 -1.362 1.00 0.00 H new ATOM 0 HD21 LEU B 34 67.756 0.932 -1.655 1.00 0.00 H new ATOM 0 HD22 LEU B 34 67.481 2.350 -0.615 1.00 0.00 H new ATOM 0 HD23 LEU B 34 66.268 1.891 -1.834 1.00 0.00 H new ATOM 2178 N LYS B 35 65.422 4.630 -4.945 1.00 0.00 N ATOM 2179 CA LYS B 35 64.473 4.015 -5.911 1.00 0.00 C ATOM 2180 C LYS B 35 64.821 4.465 -7.331 1.00 0.00 C ATOM 2181 O LYS B 35 64.973 3.661 -8.227 1.00 0.00 O ATOM 2182 CB LYS B 35 63.039 4.453 -5.578 1.00 0.00 C ATOM 2183 CG LYS B 35 62.044 3.762 -6.522 1.00 0.00 C ATOM 2184 CD LYS B 35 60.624 4.266 -6.244 1.00 0.00 C ATOM 2185 CE LYS B 35 60.194 3.889 -4.821 1.00 0.00 C ATOM 2186 NZ LYS B 35 58.705 3.861 -4.749 1.00 0.00 N ATOM 0 H LYS B 35 65.019 5.317 -4.308 1.00 0.00 H new ATOM 0 HA LYS B 35 64.547 2.930 -5.843 1.00 0.00 H new ATOM 0 HB2 LYS B 35 62.805 4.202 -4.543 1.00 0.00 H new ATOM 0 HB3 LYS B 35 62.950 5.535 -5.672 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.314 3.963 -7.559 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.089 2.682 -6.384 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.584 5.348 -6.368 1.00 0.00 H new ATOM 0 HD3 LYS B 35 59.930 3.836 -6.967 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.601 2.915 -4.552 1.00 0.00 H new ATOM 0 HE3 LYS B 35 60.591 4.609 -4.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 58.409 3.606 -3.785 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 58.328 4.800 -4.990 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 58.338 3.158 -5.422 1.00 0.00 H new ATOM 2200 N GLU B 36 64.932 5.744 -7.547 1.00 0.00 N ATOM 2201 CA GLU B 36 65.253 6.241 -8.915 1.00 0.00 C ATOM 2202 C GLU B 36 66.692 5.886 -9.279 1.00 0.00 C ATOM 2203 O GLU B 36 66.984 5.506 -10.394 1.00 0.00 O ATOM 2204 CB GLU B 36 65.074 7.764 -8.944 1.00 0.00 C ATOM 2205 CG GLU B 36 65.395 8.317 -10.336 1.00 0.00 C ATOM 2206 CD GLU B 36 64.332 7.848 -11.334 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.330 7.311 -10.893 1.00 0.00 O ATOM 2208 OE2 GLU B 36 64.533 8.041 -12.521 1.00 0.00 O ATOM 0 H GLU B 36 64.815 6.467 -6.838 1.00 0.00 H new ATOM 0 HA GLU B 36 64.584 5.774 -9.638 1.00 0.00 H new ATOM 0 HB2 GLU B 36 64.050 8.021 -8.672 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.726 8.227 -8.203 1.00 0.00 H new ATOM 0 HG2 GLU B 36 65.426 9.406 -10.307 1.00 0.00 H new ATOM 0 HG3 GLU B 36 66.381 7.979 -10.654 1.00 0.00 H new ATOM 2215 N LEU B 37 67.588 6.005 -8.351 1.00 0.00 N ATOM 2216 CA LEU B 37 69.004 5.679 -8.638 1.00 0.00 C ATOM 2217 C LEU B 37 69.102 4.205 -8.951 1.00 0.00 C ATOM 2218 O LEU B 37 69.878 3.787 -9.788 1.00 0.00 O ATOM 2219 CB LEU B 37 69.867 6.005 -7.405 1.00 0.00 C ATOM 2220 CG LEU B 37 71.375 5.763 -7.699 1.00 0.00 C ATOM 2221 CD1 LEU B 37 72.224 6.759 -6.898 1.00 0.00 C ATOM 2222 CD2 LEU B 37 71.795 4.334 -7.295 1.00 0.00 C ATOM 0 H LEU B 37 67.400 6.316 -7.398 1.00 0.00 H new ATOM 0 HA LEU B 37 69.360 6.265 -9.485 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.712 7.044 -7.113 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.553 5.387 -6.564 1.00 0.00 H new ATOM 0 HG LEU B 37 71.534 5.896 -8.769 1.00 0.00 H new ATOM 0 HD11 LEU B 37 73.280 6.587 -7.106 1.00 0.00 H new ATOM 0 HD12 LEU B 37 71.959 7.777 -7.185 1.00 0.00 H new ATOM 0 HD13 LEU B 37 72.037 6.622 -5.833 1.00 0.00 H new ATOM 0 HD21 LEU B 37 72.854 4.191 -7.511 1.00 0.00 H new ATOM 0 HD22 LEU B 37 71.620 4.191 -6.229 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.208 3.609 -7.859 1.00 0.00 H new ATOM 2234 N LEU B 38 68.347 3.400 -8.265 1.00 0.00 N ATOM 2235 CA LEU B 38 68.455 1.931 -8.529 1.00 0.00 C ATOM 2236 C LEU B 38 67.852 1.557 -9.878 1.00 0.00 C ATOM 2237 O LEU B 38 68.439 0.814 -10.637 1.00 0.00 O ATOM 2238 CB LEU B 38 67.777 1.118 -7.414 1.00 0.00 C ATOM 2239 CG LEU B 38 68.695 1.012 -6.184 1.00 0.00 C ATOM 2240 CD1 LEU B 38 67.967 0.212 -5.099 1.00 0.00 C ATOM 2241 CD2 LEU B 38 70.021 0.304 -6.560 1.00 0.00 C ATOM 0 H LEU B 38 67.675 3.678 -7.550 1.00 0.00 H new ATOM 0 HA LEU B 38 69.517 1.688 -8.548 1.00 0.00 H new ATOM 0 HB2 LEU B 38 66.836 1.591 -7.132 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.535 0.120 -7.780 1.00 0.00 H new ATOM 0 HG LEU B 38 68.932 2.011 -5.818 1.00 0.00 H new ATOM 0 HD11 LEU B 38 68.605 0.128 -4.219 1.00 0.00 H new ATOM 0 HD12 LEU B 38 67.043 0.722 -4.829 1.00 0.00 H new ATOM 0 HD13 LEU B 38 67.735 -0.784 -5.476 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.660 0.237 -5.679 1.00 0.00 H new ATOM 0 HD22 LEU B 38 69.806 -0.699 -6.930 1.00 0.00 H new ATOM 0 HD23 LEU B 38 70.531 0.875 -7.336 1.00 0.00 H new ATOM 2253 N THR B 39 66.693 2.036 -10.187 1.00 0.00 N ATOM 2254 CA THR B 39 66.092 1.663 -11.488 1.00 0.00 C ATOM 2255 C THR B 39 66.860 2.334 -12.600 1.00 0.00 C ATOM 2256 O THR B 39 66.834 1.899 -13.735 1.00 0.00 O ATOM 2257 CB THR B 39 64.648 2.140 -11.555 1.00 0.00 C ATOM 2258 OG1 THR B 39 64.616 3.560 -11.499 1.00 0.00 O ATOM 2259 CG2 THR B 39 63.889 1.566 -10.382 1.00 0.00 C ATOM 0 H THR B 39 66.138 2.663 -9.605 1.00 0.00 H new ATOM 0 HA THR B 39 66.128 0.579 -11.593 1.00 0.00 H new ATOM 0 HB THR B 39 64.189 1.809 -12.487 1.00 0.00 H new ATOM 0 HG1 THR B 39 64.757 3.854 -10.575 1.00 0.00 H new ATOM 0 HG21 THR B 39 62.853 1.901 -10.420 1.00 0.00 H new ATOM 0 HG22 THR B 39 63.920 0.477 -10.426 1.00 0.00 H new ATOM 0 HG23 THR B 39 64.346 1.904 -9.452 1.00 0.00 H new ATOM 2267 N ARG B 40 67.521 3.417 -12.295 1.00 0.00 N ATOM 2268 CA ARG B 40 68.260 4.144 -13.354 1.00 0.00 C ATOM 2269 C ARG B 40 69.718 3.721 -13.375 1.00 0.00 C ATOM 2270 O ARG B 40 70.392 3.900 -14.371 1.00 0.00 O ATOM 2271 CB ARG B 40 68.186 5.652 -13.106 1.00 0.00 C ATOM 2272 CG ARG B 40 66.739 6.145 -13.241 1.00 0.00 C ATOM 2273 CD ARG B 40 66.350 6.277 -14.720 1.00 0.00 C ATOM 2274 NE ARG B 40 65.041 6.980 -14.827 1.00 0.00 N ATOM 2275 CZ ARG B 40 64.662 7.471 -15.974 1.00 0.00 C ATOM 2276 NH1 ARG B 40 65.434 7.354 -17.019 1.00 0.00 N ATOM 2277 NH2 ARG B 40 63.514 8.082 -16.075 1.00 0.00 N ATOM 0 H ARG B 40 67.579 3.825 -11.362 1.00 0.00 H new ATOM 0 HA ARG B 40 67.801 3.904 -14.313 1.00 0.00 H new ATOM 0 HB2 ARG B 40 68.564 5.882 -12.110 1.00 0.00 H new ATOM 0 HB3 ARG B 40 68.824 6.176 -13.818 1.00 0.00 H new ATOM 0 HG2 ARG B 40 66.064 5.449 -12.742 1.00 0.00 H new ATOM 0 HG3 ARG B 40 66.629 7.108 -12.743 1.00 0.00 H new ATOM 0 HD2 ARG B 40 67.118 6.830 -15.261 1.00 0.00 H new ATOM 0 HD3 ARG B 40 66.284 5.291 -15.179 1.00 0.00 H new ATOM 0 HE ARG B 40 64.443 7.077 -14.006 1.00 0.00 H new ATOM 0 HH11 ARG B 40 66.333 6.879 -16.938 1.00 0.00 H new ATOM 0 HH12 ARG B 40 65.139 7.738 -17.917 1.00 0.00 H new ATOM 0 HH21 ARG B 40 62.912 8.176 -15.257 1.00 0.00 H new ATOM 0 HH22 ARG B 40 63.218 8.466 -16.972 1.00 0.00 H new ATOM 2291 N GLU B 41 70.232 3.177 -12.294 1.00 0.00 N ATOM 2292 CA GLU B 41 71.674 2.770 -12.293 1.00 0.00 C ATOM 2293 C GLU B 41 71.779 1.263 -12.317 1.00 0.00 C ATOM 2294 O GLU B 41 72.771 0.718 -12.757 1.00 0.00 O ATOM 2295 CB GLU B 41 72.371 3.344 -11.055 1.00 0.00 C ATOM 2296 CG GLU B 41 73.887 3.169 -11.194 1.00 0.00 C ATOM 2297 CD GLU B 41 74.597 3.961 -10.096 1.00 0.00 C ATOM 2298 OE1 GLU B 41 73.911 4.590 -9.311 1.00 0.00 O ATOM 2299 OE2 GLU B 41 75.816 3.936 -10.068 1.00 0.00 O ATOM 0 H GLU B 41 69.725 3.000 -11.427 1.00 0.00 H new ATOM 0 HA GLU B 41 72.166 3.165 -13.182 1.00 0.00 H new ATOM 0 HB2 GLU B 41 72.125 4.400 -10.943 1.00 0.00 H new ATOM 0 HB3 GLU B 41 72.017 2.837 -10.157 1.00 0.00 H new ATOM 0 HG2 GLU B 41 74.150 2.113 -11.123 1.00 0.00 H new ATOM 0 HG3 GLU B 41 74.215 3.514 -12.175 1.00 0.00 H new ATOM 2306 N LEU B 42 70.767 0.571 -11.869 1.00 0.00 N ATOM 2307 CA LEU B 42 70.826 -0.922 -11.901 1.00 0.00 C ATOM 2308 C LEU B 42 69.450 -1.485 -12.293 1.00 0.00 C ATOM 2309 O LEU B 42 68.730 -1.994 -11.461 1.00 0.00 O ATOM 2310 CB LEU B 42 71.227 -1.476 -10.522 1.00 0.00 C ATOM 2311 CG LEU B 42 72.612 -0.957 -10.092 1.00 0.00 C ATOM 2312 CD1 LEU B 42 72.828 -1.266 -8.610 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.719 -1.646 -10.907 1.00 0.00 C ATOM 0 H LEU B 42 69.909 0.968 -11.485 1.00 0.00 H new ATOM 0 HA LEU B 42 71.573 -1.224 -12.635 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.482 -1.187 -9.781 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.238 -2.565 -10.555 1.00 0.00 H new ATOM 0 HG LEU B 42 72.653 0.118 -10.266 1.00 0.00 H new ATOM 0 HD11 LEU B 42 73.807 -0.900 -8.301 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.055 -0.775 -8.019 1.00 0.00 H new ATOM 0 HD13 LEU B 42 72.776 -2.343 -8.452 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.692 -1.269 -10.591 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.676 -2.722 -10.741 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.575 -1.436 -11.967 1.00 0.00 H new ATOM 2325 N PRO B 43 69.078 -1.400 -13.548 1.00 0.00 N ATOM 2326 CA PRO B 43 67.760 -1.930 -13.994 1.00 0.00 C ATOM 2327 C PRO B 43 67.753 -3.468 -14.083 1.00 0.00 C ATOM 2328 O PRO B 43 67.112 -4.141 -13.300 1.00 0.00 O ATOM 2329 CB PRO B 43 67.600 -1.278 -15.382 1.00 0.00 C ATOM 2330 CG PRO B 43 68.968 -0.698 -15.806 1.00 0.00 C ATOM 2331 CD PRO B 43 69.926 -0.772 -14.600 1.00 0.00 C ATOM 0 HA PRO B 43 66.947 -1.700 -13.305 1.00 0.00 H new ATOM 0 HB2 PRO B 43 67.257 -2.014 -16.110 1.00 0.00 H new ATOM 0 HB3 PRO B 43 66.848 -0.490 -15.347 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.374 -1.260 -16.647 1.00 0.00 H new ATOM 0 HG3 PRO B 43 68.855 0.334 -16.138 1.00 0.00 H new ATOM 0 HD2 PRO B 43 70.809 -1.372 -14.820 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.278 0.215 -14.301 1.00 0.00 H new ATOM 2339 N SER B 44 68.456 -4.022 -15.034 1.00 0.00 N ATOM 2340 CA SER B 44 68.491 -5.509 -15.181 1.00 0.00 C ATOM 2341 C SER B 44 69.478 -6.116 -14.179 1.00 0.00 C ATOM 2342 O SER B 44 69.433 -7.291 -13.881 1.00 0.00 O ATOM 2343 CB SER B 44 68.927 -5.868 -16.602 1.00 0.00 C ATOM 2344 OG SER B 44 69.003 -7.283 -16.725 1.00 0.00 O ATOM 0 H SER B 44 69.010 -3.508 -15.719 1.00 0.00 H new ATOM 0 HA SER B 44 67.496 -5.909 -14.987 1.00 0.00 H new ATOM 0 HB2 SER B 44 68.218 -5.466 -17.325 1.00 0.00 H new ATOM 0 HB3 SER B 44 69.896 -5.419 -16.822 1.00 0.00 H new ATOM 0 HG SER B 44 69.281 -7.518 -17.635 1.00 0.00 H new ATOM 2350 N PHE B 45 70.383 -5.327 -13.678 1.00 0.00 N ATOM 2351 CA PHE B 45 71.395 -5.849 -12.711 1.00 0.00 C ATOM 2352 C PHE B 45 70.815 -5.896 -11.299 1.00 0.00 C ATOM 2353 O PHE B 45 71.415 -6.432 -10.388 1.00 0.00 O ATOM 2354 CB PHE B 45 72.582 -4.898 -12.697 1.00 0.00 C ATOM 2355 CG PHE B 45 73.325 -4.994 -14.006 1.00 0.00 C ATOM 2356 CD1 PHE B 45 74.149 -6.096 -14.259 1.00 0.00 C ATOM 2357 CD2 PHE B 45 73.192 -3.983 -14.965 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.842 -6.187 -15.472 1.00 0.00 C ATOM 2359 CE2 PHE B 45 73.884 -4.074 -16.178 1.00 0.00 C ATOM 2360 CZ PHE B 45 74.710 -5.176 -16.432 1.00 0.00 C ATOM 0 H PHE B 45 70.469 -4.334 -13.896 1.00 0.00 H new ATOM 0 HA PHE B 45 71.690 -6.853 -13.016 1.00 0.00 H new ATOM 0 HB2 PHE B 45 72.240 -3.876 -12.536 1.00 0.00 H new ATOM 0 HB3 PHE B 45 73.248 -5.145 -11.870 1.00 0.00 H new ATOM 0 HD1 PHE B 45 74.250 -6.876 -13.519 1.00 0.00 H new ATOM 0 HD2 PHE B 45 72.555 -3.133 -14.769 1.00 0.00 H new ATOM 0 HE1 PHE B 45 75.479 -7.037 -15.667 1.00 0.00 H new ATOM 0 HE2 PHE B 45 73.781 -3.294 -16.918 1.00 0.00 H new ATOM 0 HZ PHE B 45 75.245 -5.246 -17.368 1.00 0.00 H new ATOM 2370 N LEU B 46 69.670 -5.319 -11.106 1.00 0.00 N ATOM 2371 CA LEU B 46 69.057 -5.301 -9.742 1.00 0.00 C ATOM 2372 C LEU B 46 67.548 -5.250 -9.899 1.00 0.00 C ATOM 2373 O LEU B 46 66.812 -5.941 -9.224 1.00 0.00 O ATOM 2374 CB LEU B 46 69.559 -4.058 -8.990 1.00 0.00 C ATOM 2375 CG LEU B 46 68.960 -3.988 -7.560 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.005 -3.424 -6.583 1.00 0.00 C ATOM 2377 CD2 LEU B 46 67.721 -3.071 -7.541 1.00 0.00 C ATOM 0 H LEU B 46 69.124 -4.855 -11.832 1.00 0.00 H new ATOM 0 HA LEU B 46 69.333 -6.192 -9.178 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.647 -4.080 -8.931 1.00 0.00 H new ATOM 0 HB3 LEU B 46 69.288 -3.160 -9.545 1.00 0.00 H new ATOM 0 HG LEU B 46 68.672 -4.995 -7.259 1.00 0.00 H new ATOM 0 HD11 LEU B 46 69.578 -3.377 -5.581 1.00 0.00 H new ATOM 0 HD12 LEU B 46 70.882 -4.072 -6.574 1.00 0.00 H new ATOM 0 HD13 LEU B 46 70.297 -2.423 -6.900 1.00 0.00 H new ATOM 0 HD21 LEU B 46 67.312 -3.032 -6.531 1.00 0.00 H new ATOM 0 HD22 LEU B 46 68.006 -2.067 -7.856 1.00 0.00 H new ATOM 0 HD23 LEU B 46 66.967 -3.464 -8.223 1.00 0.00 H new ATOM 2389 N GLY B 47 67.089 -4.469 -10.830 1.00 0.00 N ATOM 2390 CA GLY B 47 65.629 -4.400 -11.094 1.00 0.00 C ATOM 2391 C GLY B 47 65.317 -5.569 -12.008 1.00 0.00 C ATOM 2392 O GLY B 47 64.371 -5.562 -12.771 1.00 0.00 O ATOM 0 H GLY B 47 67.665 -3.872 -11.423 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.061 -4.467 -10.166 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.361 -3.454 -11.564 1.00 0.00 H new ATOM 2396 N LYS B 48 66.158 -6.567 -11.949 1.00 0.00 N ATOM 2397 CA LYS B 48 65.997 -7.753 -12.815 1.00 0.00 C ATOM 2398 C LYS B 48 64.618 -8.393 -12.587 1.00 0.00 C ATOM 2399 O LYS B 48 64.286 -9.393 -13.190 1.00 0.00 O ATOM 2400 CB LYS B 48 67.101 -8.760 -12.471 1.00 0.00 C ATOM 2401 CG LYS B 48 67.302 -9.745 -13.627 1.00 0.00 C ATOM 2402 CD LYS B 48 68.599 -10.528 -13.400 1.00 0.00 C ATOM 2403 CE LYS B 48 68.473 -11.417 -12.153 1.00 0.00 C ATOM 2404 NZ LYS B 48 68.801 -10.617 -10.940 1.00 0.00 N ATOM 0 H LYS B 48 66.962 -6.603 -11.323 1.00 0.00 H new ATOM 0 HA LYS B 48 66.071 -7.458 -13.862 1.00 0.00 H new ATOM 0 HB2 LYS B 48 68.033 -8.233 -12.268 1.00 0.00 H new ATOM 0 HB3 LYS B 48 66.837 -9.303 -11.563 1.00 0.00 H new ATOM 0 HG2 LYS B 48 66.456 -10.429 -13.689 1.00 0.00 H new ATOM 0 HG3 LYS B 48 67.348 -9.208 -14.575 1.00 0.00 H new ATOM 0 HD2 LYS B 48 68.818 -11.143 -14.273 1.00 0.00 H new ATOM 0 HD3 LYS B 48 69.433 -9.837 -13.280 1.00 0.00 H new ATOM 0 HE2 LYS B 48 67.461 -11.815 -12.077 1.00 0.00 H new ATOM 0 HE3 LYS B 48 69.146 -12.271 -12.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 69.316 -11.212 -10.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.394 -9.806 -11.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 67.922 -10.273 -10.503 1.00 0.00 H new ATOM 2418 N ARG B 49 63.827 -7.820 -11.715 1.00 0.00 N ATOM 2419 CA ARG B 49 62.466 -8.368 -11.423 1.00 0.00 C ATOM 2420 C ARG B 49 62.561 -9.809 -10.917 1.00 0.00 C ATOM 2421 O ARG B 49 61.751 -10.648 -11.258 1.00 0.00 O ATOM 2422 CB ARG B 49 61.587 -8.322 -12.678 1.00 0.00 C ATOM 2423 CG ARG B 49 61.271 -6.868 -13.023 1.00 0.00 C ATOM 2424 CD ARG B 49 60.308 -6.828 -14.209 1.00 0.00 C ATOM 2425 NE ARG B 49 59.001 -7.414 -13.801 1.00 0.00 N ATOM 2426 CZ ARG B 49 57.940 -7.220 -14.533 1.00 0.00 C ATOM 2427 NH1 ARG B 49 58.032 -6.554 -15.652 1.00 0.00 N ATOM 2428 NH2 ARG B 49 56.788 -7.700 -14.151 1.00 0.00 N ATOM 0 H ARG B 49 64.070 -6.983 -11.185 1.00 0.00 H new ATOM 0 HA ARG B 49 62.014 -7.749 -10.648 1.00 0.00 H new ATOM 0 HB2 ARG B 49 62.099 -8.802 -13.512 1.00 0.00 H new ATOM 0 HB3 ARG B 49 60.664 -8.876 -12.509 1.00 0.00 H new ATOM 0 HG2 ARG B 49 60.828 -6.366 -12.163 1.00 0.00 H new ATOM 0 HG3 ARG B 49 62.189 -6.332 -13.267 1.00 0.00 H new ATOM 0 HD2 ARG B 49 60.170 -5.801 -14.546 1.00 0.00 H new ATOM 0 HD3 ARG B 49 60.723 -7.385 -15.049 1.00 0.00 H new ATOM 0 HE ARG B 49 58.936 -7.968 -12.947 1.00 0.00 H new ATOM 0 HH11 ARG B 49 58.934 -6.186 -15.953 1.00 0.00 H new ATOM 0 HH12 ARG B 49 57.202 -6.402 -16.225 1.00 0.00 H new ATOM 0 HH21 ARG B 49 56.718 -8.227 -13.280 1.00 0.00 H new ATOM 0 HH22 ARG B 49 55.957 -7.549 -14.723 1.00 0.00 H new ATOM 2442 N THR B 50 63.531 -10.100 -10.090 1.00 0.00 N ATOM 2443 CA THR B 50 63.674 -11.483 -9.537 1.00 0.00 C ATOM 2444 C THR B 50 63.125 -11.494 -8.108 1.00 0.00 C ATOM 2445 O THR B 50 62.044 -11.001 -7.852 1.00 0.00 O ATOM 2446 CB THR B 50 65.152 -11.875 -9.527 1.00 0.00 C ATOM 2447 OG1 THR B 50 65.319 -13.078 -8.790 1.00 0.00 O ATOM 2448 CG2 THR B 50 65.976 -10.757 -8.884 1.00 0.00 C ATOM 0 H THR B 50 64.236 -9.435 -9.771 1.00 0.00 H new ATOM 0 HA THR B 50 63.122 -12.195 -10.151 1.00 0.00 H new ATOM 0 HB THR B 50 65.493 -12.029 -10.551 1.00 0.00 H new ATOM 0 HG1 THR B 50 66.167 -13.046 -8.300 1.00 0.00 H new ATOM 0 HG21 THR B 50 67.029 -11.039 -8.878 1.00 0.00 H new ATOM 0 HG22 THR B 50 65.850 -9.837 -9.455 1.00 0.00 H new ATOM 0 HG23 THR B 50 65.637 -10.598 -7.860 1.00 0.00 H new ATOM 2456 N ASP B 51 63.854 -12.033 -7.169 1.00 0.00 N ATOM 2457 CA ASP B 51 63.348 -12.039 -5.768 1.00 0.00 C ATOM 2458 C ASP B 51 63.486 -10.625 -5.203 1.00 0.00 C ATOM 2459 O ASP B 51 64.575 -10.155 -4.937 1.00 0.00 O ATOM 2460 CB ASP B 51 64.169 -13.018 -4.924 1.00 0.00 C ATOM 2461 CG ASP B 51 65.649 -12.639 -4.990 1.00 0.00 C ATOM 2462 OD1 ASP B 51 66.035 -11.999 -5.954 1.00 0.00 O ATOM 2463 OD2 ASP B 51 66.373 -12.998 -4.077 1.00 0.00 O ATOM 0 H ASP B 51 64.768 -12.465 -7.309 1.00 0.00 H new ATOM 0 HA ASP B 51 62.304 -12.352 -5.747 1.00 0.00 H new ATOM 0 HB2 ASP B 51 63.825 -12.999 -3.890 1.00 0.00 H new ATOM 0 HB3 ASP B 51 64.027 -14.035 -5.289 1.00 0.00 H new ATOM 2468 N GLU B 52 62.387 -9.934 -5.039 1.00 0.00 N ATOM 2469 CA GLU B 52 62.444 -8.534 -4.515 1.00 0.00 C ATOM 2470 C GLU B 52 62.163 -8.509 -3.011 1.00 0.00 C ATOM 2471 O GLU B 52 62.088 -7.457 -2.412 1.00 0.00 O ATOM 2472 CB GLU B 52 61.388 -7.684 -5.227 1.00 0.00 C ATOM 2473 CG GLU B 52 61.793 -7.473 -6.687 1.00 0.00 C ATOM 2474 CD GLU B 52 60.743 -6.606 -7.387 1.00 0.00 C ATOM 2475 OE1 GLU B 52 59.740 -7.153 -7.813 1.00 0.00 O ATOM 2476 OE2 GLU B 52 60.961 -5.411 -7.483 1.00 0.00 O ATOM 0 H GLU B 52 61.450 -10.279 -5.246 1.00 0.00 H new ATOM 0 HA GLU B 52 63.442 -8.135 -4.698 1.00 0.00 H new ATOM 0 HB2 GLU B 52 60.417 -8.176 -5.177 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.284 -6.722 -4.726 1.00 0.00 H new ATOM 0 HG2 GLU B 52 62.770 -6.993 -6.739 1.00 0.00 H new ATOM 0 HG3 GLU B 52 61.883 -8.434 -7.193 1.00 0.00 H new ATOM 2483 N ALA B 53 61.984 -9.641 -2.394 1.00 0.00 N ATOM 2484 CA ALA B 53 61.677 -9.640 -0.934 1.00 0.00 C ATOM 2485 C ALA B 53 62.788 -8.933 -0.149 1.00 0.00 C ATOM 2486 O ALA B 53 62.525 -8.027 0.617 1.00 0.00 O ATOM 2487 CB ALA B 53 61.545 -11.082 -0.441 1.00 0.00 C ATOM 0 H ALA B 53 62.036 -10.561 -2.831 1.00 0.00 H new ATOM 0 HA ALA B 53 60.741 -9.105 -0.774 1.00 0.00 H new ATOM 0 HB1 ALA B 53 61.321 -11.083 0.626 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.739 -11.579 -0.982 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.481 -11.613 -0.615 1.00 0.00 H new ATOM 2493 N ALA B 54 64.020 -9.323 -0.322 1.00 0.00 N ATOM 2494 CA ALA B 54 65.112 -8.644 0.434 1.00 0.00 C ATOM 2495 C ALA B 54 65.259 -7.212 -0.069 1.00 0.00 C ATOM 2496 O ALA B 54 65.450 -6.286 0.693 1.00 0.00 O ATOM 2497 CB ALA B 54 66.426 -9.372 0.218 1.00 0.00 C ATOM 0 H ALA B 54 64.317 -10.073 -0.946 1.00 0.00 H new ATOM 0 HA ALA B 54 64.863 -8.649 1.495 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.217 -8.868 0.774 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.334 -10.400 0.568 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.672 -9.371 -0.844 1.00 0.00 H new ATOM 2503 N PHE B 55 65.163 -7.020 -1.349 1.00 0.00 N ATOM 2504 CA PHE B 55 65.284 -5.648 -1.895 1.00 0.00 C ATOM 2505 C PHE B 55 64.096 -4.845 -1.394 1.00 0.00 C ATOM 2506 O PHE B 55 64.213 -3.696 -1.025 1.00 0.00 O ATOM 2507 CB PHE B 55 65.259 -5.692 -3.413 1.00 0.00 C ATOM 2508 CG PHE B 55 66.534 -6.328 -3.916 1.00 0.00 C ATOM 2509 CD1 PHE B 55 67.669 -5.540 -4.137 1.00 0.00 C ATOM 2510 CD2 PHE B 55 66.580 -7.706 -4.157 1.00 0.00 C ATOM 2511 CE1 PHE B 55 68.853 -6.131 -4.599 1.00 0.00 C ATOM 2512 CE2 PHE B 55 67.763 -8.297 -4.620 1.00 0.00 C ATOM 2513 CZ PHE B 55 68.899 -7.509 -4.839 1.00 0.00 C ATOM 0 H PHE B 55 65.006 -7.753 -2.040 1.00 0.00 H new ATOM 0 HA PHE B 55 66.222 -5.194 -1.574 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.395 -6.261 -3.757 1.00 0.00 H new ATOM 0 HB3 PHE B 55 65.158 -4.684 -3.816 1.00 0.00 H new ATOM 0 HD1 PHE B 55 67.633 -4.477 -3.952 1.00 0.00 H new ATOM 0 HD2 PHE B 55 65.704 -8.314 -3.986 1.00 0.00 H new ATOM 0 HE1 PHE B 55 69.729 -5.523 -4.770 1.00 0.00 H new ATOM 0 HE2 PHE B 55 67.798 -9.360 -4.808 1.00 0.00 H new ATOM 0 HZ PHE B 55 69.812 -7.965 -5.193 1.00 0.00 H new ATOM 2523 N GLN B 56 62.949 -5.461 -1.351 1.00 0.00 N ATOM 2524 CA GLN B 56 61.750 -4.743 -0.847 1.00 0.00 C ATOM 2525 C GLN B 56 62.047 -4.329 0.578 1.00 0.00 C ATOM 2526 O GLN B 56 61.643 -3.285 1.041 1.00 0.00 O ATOM 2527 CB GLN B 56 60.528 -5.673 -0.882 1.00 0.00 C ATOM 2528 CG GLN B 56 59.292 -4.933 -0.362 1.00 0.00 C ATOM 2529 CD GLN B 56 58.086 -5.876 -0.402 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.209 -7.048 -0.105 1.00 0.00 O ATOM 2531 NE2 GLN B 56 56.917 -5.413 -0.751 1.00 0.00 N ATOM 0 H GLN B 56 62.791 -6.426 -1.642 1.00 0.00 H new ATOM 0 HA GLN B 56 61.528 -3.873 -1.465 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.353 -6.019 -1.901 1.00 0.00 H new ATOM 0 HB3 GLN B 56 60.716 -6.557 -0.273 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.463 -4.586 0.657 1.00 0.00 H new ATOM 0 HG3 GLN B 56 59.099 -4.050 -0.972 1.00 0.00 H new ATOM 0 HE21 GLN B 56 56.812 -4.430 -1.001 1.00 0.00 H new ATOM 0 HE22 GLN B 56 56.109 -6.034 -0.774 1.00 0.00 H new ATOM 2540 N LYS B 57 62.786 -5.142 1.256 1.00 0.00 N ATOM 2541 CA LYS B 57 63.173 -4.823 2.651 1.00 0.00 C ATOM 2542 C LYS B 57 64.202 -3.698 2.603 1.00 0.00 C ATOM 2543 O LYS B 57 64.179 -2.783 3.400 1.00 0.00 O ATOM 2544 CB LYS B 57 63.722 -6.096 3.329 1.00 0.00 C ATOM 2545 CG LYS B 57 64.757 -5.750 4.411 1.00 0.00 C ATOM 2546 CD LYS B 57 64.898 -6.920 5.391 1.00 0.00 C ATOM 2547 CE LYS B 57 65.421 -8.151 4.648 1.00 0.00 C ATOM 2548 NZ LYS B 57 65.786 -9.208 5.631 1.00 0.00 N ATOM 0 H LYS B 57 63.146 -6.028 0.902 1.00 0.00 H new ATOM 0 HA LYS B 57 62.321 -4.488 3.242 1.00 0.00 H new ATOM 0 HB2 LYS B 57 62.900 -6.656 3.775 1.00 0.00 H new ATOM 0 HB3 LYS B 57 64.179 -6.742 2.579 1.00 0.00 H new ATOM 0 HG2 LYS B 57 65.720 -5.533 3.949 1.00 0.00 H new ATOM 0 HG3 LYS B 57 64.450 -4.851 4.946 1.00 0.00 H new ATOM 0 HD2 LYS B 57 65.581 -6.652 6.197 1.00 0.00 H new ATOM 0 HD3 LYS B 57 63.934 -7.142 5.850 1.00 0.00 H new ATOM 0 HE2 LYS B 57 64.661 -8.525 3.962 1.00 0.00 H new ATOM 0 HE3 LYS B 57 66.290 -7.884 4.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 66.141 -10.044 5.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 66.525 -8.849 6.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 64.947 -9.470 6.187 1.00 0.00 H new ATOM 2562 N LEU B 58 65.082 -3.742 1.645 1.00 0.00 N ATOM 2563 CA LEU B 58 66.078 -2.651 1.524 1.00 0.00 C ATOM 2564 C LEU B 58 65.315 -1.414 1.098 1.00 0.00 C ATOM 2565 O LEU B 58 65.544 -0.321 1.574 1.00 0.00 O ATOM 2566 CB LEU B 58 67.128 -3.011 0.469 1.00 0.00 C ATOM 2567 CG LEU B 58 68.152 -1.876 0.323 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.873 -1.626 1.659 1.00 0.00 C ATOM 2569 CD2 LEU B 58 69.174 -2.264 -0.752 1.00 0.00 C ATOM 0 H LEU B 58 65.153 -4.482 0.946 1.00 0.00 H new ATOM 0 HA LEU B 58 66.598 -2.487 2.468 1.00 0.00 H new ATOM 0 HB2 LEU B 58 67.636 -3.933 0.752 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.642 -3.196 -0.489 1.00 0.00 H new ATOM 0 HG LEU B 58 67.635 -0.961 0.034 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.595 -0.819 1.537 1.00 0.00 H new ATOM 0 HD12 LEU B 58 68.143 -1.349 2.420 1.00 0.00 H new ATOM 0 HD13 LEU B 58 69.392 -2.533 1.968 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.906 -1.464 -0.864 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.682 -3.182 -0.457 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.662 -2.422 -1.701 1.00 0.00 H new ATOM 2581 N MET B 59 64.373 -1.593 0.216 1.00 0.00 N ATOM 2582 CA MET B 59 63.552 -0.442 -0.223 1.00 0.00 C ATOM 2583 C MET B 59 62.619 -0.063 0.914 1.00 0.00 C ATOM 2584 O MET B 59 62.313 1.095 1.116 1.00 0.00 O ATOM 2585 CB MET B 59 62.746 -0.806 -1.471 1.00 0.00 C ATOM 2586 CG MET B 59 63.697 -1.147 -2.625 1.00 0.00 C ATOM 2587 SD MET B 59 64.388 0.373 -3.326 1.00 0.00 S ATOM 2588 CE MET B 59 62.983 0.824 -4.378 1.00 0.00 C ATOM 0 H MET B 59 64.139 -2.487 -0.217 1.00 0.00 H new ATOM 0 HA MET B 59 64.197 0.400 -0.475 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.097 -1.656 -1.260 1.00 0.00 H new ATOM 0 HB3 MET B 59 62.101 0.026 -1.753 1.00 0.00 H new ATOM 0 HG2 MET B 59 64.501 -1.791 -2.267 1.00 0.00 H new ATOM 0 HG3 MET B 59 63.163 -1.703 -3.396 1.00 0.00 H new ATOM 0 HE1 MET B 59 63.203 0.559 -5.412 1.00 0.00 H new ATOM 0 HE2 MET B 59 62.094 0.288 -4.047 1.00 0.00 H new ATOM 0 HE3 MET B 59 62.806 1.897 -4.308 1.00 0.00 H new ATOM 2598 N SER B 60 62.174 -1.024 1.681 1.00 0.00 N ATOM 2599 CA SER B 60 61.279 -0.671 2.817 1.00 0.00 C ATOM 2600 C SER B 60 62.023 0.319 3.698 1.00 0.00 C ATOM 2601 O SER B 60 61.441 1.182 4.320 1.00 0.00 O ATOM 2602 CB SER B 60 60.929 -1.912 3.640 1.00 0.00 C ATOM 2603 OG SER B 60 60.211 -2.832 2.833 1.00 0.00 O ATOM 0 H SER B 60 62.386 -2.016 1.573 1.00 0.00 H new ATOM 0 HA SER B 60 60.352 -0.244 2.435 1.00 0.00 H new ATOM 0 HB2 SER B 60 61.839 -2.378 4.019 1.00 0.00 H new ATOM 0 HB3 SER B 60 60.331 -1.629 4.506 1.00 0.00 H new ATOM 0 HG SER B 60 60.796 -3.169 2.122 1.00 0.00 H new ATOM 2609 N ASN B 61 63.320 0.215 3.738 1.00 0.00 N ATOM 2610 CA ASN B 61 64.095 1.179 4.561 1.00 0.00 C ATOM 2611 C ASN B 61 64.013 2.534 3.877 1.00 0.00 C ATOM 2612 O ASN B 61 63.874 3.557 4.515 1.00 0.00 O ATOM 2613 CB ASN B 61 65.553 0.734 4.700 1.00 0.00 C ATOM 2614 CG ASN B 61 65.622 -0.509 5.588 1.00 0.00 C ATOM 2615 OD1 ASN B 61 64.694 -0.803 6.315 1.00 0.00 O ATOM 2616 ND2 ASN B 61 66.699 -1.247 5.578 1.00 0.00 N ATOM 0 H ASN B 61 63.871 -0.486 3.243 1.00 0.00 H new ATOM 0 HA ASN B 61 63.680 1.232 5.567 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.974 0.517 3.718 1.00 0.00 H new ATOM 0 HB3 ASN B 61 66.150 1.537 5.132 1.00 0.00 H new ATOM 0 HD21 ASN B 61 66.760 -2.068 6.180 1.00 0.00 H new ATOM 0 HD22 ASN B 61 67.479 -1.002 4.968 1.00 0.00 H new ATOM 2623 N LEU B 62 64.065 2.559 2.573 1.00 0.00 N ATOM 2624 CA LEU B 62 63.948 3.860 1.876 1.00 0.00 C ATOM 2625 C LEU B 62 62.595 4.434 2.286 1.00 0.00 C ATOM 2626 O LEU B 62 62.391 5.631 2.341 1.00 0.00 O ATOM 2627 CB LEU B 62 64.084 3.647 0.341 1.00 0.00 C ATOM 2628 CG LEU B 62 62.737 3.798 -0.406 1.00 0.00 C ATOM 2629 CD1 LEU B 62 62.286 5.283 -0.455 1.00 0.00 C ATOM 2630 CD2 LEU B 62 62.907 3.253 -1.834 1.00 0.00 C ATOM 0 H LEU B 62 64.182 1.744 1.971 1.00 0.00 H new ATOM 0 HA LEU B 62 64.738 4.561 2.147 1.00 0.00 H new ATOM 0 HB2 LEU B 62 64.799 4.366 -0.059 1.00 0.00 H new ATOM 0 HB3 LEU B 62 64.490 2.654 0.151 1.00 0.00 H new ATOM 0 HG LEU B 62 61.969 3.237 0.125 1.00 0.00 H new ATOM 0 HD11 LEU B 62 61.337 5.358 -0.986 1.00 0.00 H new ATOM 0 HD12 LEU B 62 62.164 5.660 0.560 1.00 0.00 H new ATOM 0 HD13 LEU B 62 63.040 5.875 -0.974 1.00 0.00 H new ATOM 0 HD21 LEU B 62 61.966 3.352 -2.375 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.683 3.819 -2.349 1.00 0.00 H new ATOM 0 HD23 LEU B 62 63.192 2.202 -1.791 1.00 0.00 H new ATOM 2642 N ASP B 63 61.689 3.558 2.627 1.00 0.00 N ATOM 2643 CA ASP B 63 60.350 3.989 3.099 1.00 0.00 C ATOM 2644 C ASP B 63 60.427 4.156 4.619 1.00 0.00 C ATOM 2645 O ASP B 63 59.430 4.336 5.290 1.00 0.00 O ATOM 2646 CB ASP B 63 59.304 2.929 2.741 1.00 0.00 C ATOM 2647 CG ASP B 63 59.084 2.924 1.227 1.00 0.00 C ATOM 2648 OD1 ASP B 63 59.315 3.950 0.611 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.682 1.894 0.710 1.00 0.00 O ATOM 0 H ASP B 63 61.826 2.548 2.597 1.00 0.00 H new ATOM 0 HA ASP B 63 60.060 4.927 2.626 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.637 1.946 3.075 1.00 0.00 H new ATOM 0 HB3 ASP B 63 58.366 3.139 3.255 1.00 0.00 H new ATOM 2654 N SER B 64 61.620 4.084 5.165 1.00 0.00 N ATOM 2655 CA SER B 64 61.782 4.225 6.641 1.00 0.00 C ATOM 2656 C SER B 64 61.252 5.593 7.081 1.00 0.00 C ATOM 2657 O SER B 64 61.471 6.589 6.421 1.00 0.00 O ATOM 2658 CB SER B 64 63.263 4.144 7.019 1.00 0.00 C ATOM 2659 OG SER B 64 63.401 4.382 8.414 1.00 0.00 O ATOM 0 H SER B 64 62.486 3.933 4.648 1.00 0.00 H new ATOM 0 HA SER B 64 61.230 3.423 7.131 1.00 0.00 H new ATOM 0 HB2 SER B 64 63.663 3.163 6.764 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.836 4.879 6.454 1.00 0.00 H new ATOM 0 HG SER B 64 64.347 4.330 8.663 1.00 0.00 H new ATOM 2665 N ASN B 65 60.567 5.661 8.193 1.00 0.00 N ATOM 2666 CA ASN B 65 60.044 6.980 8.665 1.00 0.00 C ATOM 2667 C ASN B 65 61.078 7.646 9.578 1.00 0.00 C ATOM 2668 O ASN B 65 60.923 8.785 9.977 1.00 0.00 O ATOM 2669 CB ASN B 65 58.735 6.769 9.435 1.00 0.00 C ATOM 2670 CG ASN B 65 58.983 5.859 10.640 1.00 0.00 C ATOM 2671 OD1 ASN B 65 60.041 5.278 10.771 1.00 0.00 O ATOM 2672 ND2 ASN B 65 58.041 5.709 11.533 1.00 0.00 N ATOM 0 H ASN B 65 60.347 4.866 8.793 1.00 0.00 H new ATOM 0 HA ASN B 65 59.856 7.623 7.805 1.00 0.00 H new ATOM 0 HB2 ASN B 65 58.339 7.729 9.768 1.00 0.00 H new ATOM 0 HB3 ASN B 65 57.985 6.325 8.781 1.00 0.00 H new ATOM 0 HD21 ASN B 65 58.195 5.104 12.340 1.00 0.00 H new ATOM 0 HD22 ASN B 65 57.152 6.197 11.423 1.00 0.00 H new ATOM 2679 N ARG B 66 62.131 6.949 9.916 1.00 0.00 N ATOM 2680 CA ARG B 66 63.171 7.545 10.806 1.00 0.00 C ATOM 2681 C ARG B 66 64.148 8.399 9.983 1.00 0.00 C ATOM 2682 O ARG B 66 64.164 9.609 10.089 1.00 0.00 O ATOM 2683 CB ARG B 66 63.935 6.424 11.514 1.00 0.00 C ATOM 2684 CG ARG B 66 62.990 5.700 12.478 1.00 0.00 C ATOM 2685 CD ARG B 66 63.743 4.577 13.191 1.00 0.00 C ATOM 2686 NE ARG B 66 64.847 5.167 14.000 1.00 0.00 N ATOM 2687 CZ ARG B 66 65.450 4.448 14.908 1.00 0.00 C ATOM 2688 NH1 ARG B 66 65.082 3.213 15.116 1.00 0.00 N ATOM 2689 NH2 ARG B 66 66.420 4.967 15.609 1.00 0.00 N ATOM 0 H ARG B 66 62.316 5.992 9.614 1.00 0.00 H new ATOM 0 HA ARG B 66 62.686 8.182 11.546 1.00 0.00 H new ATOM 0 HB2 ARG B 66 64.335 5.722 10.782 1.00 0.00 H new ATOM 0 HB3 ARG B 66 64.785 6.835 12.059 1.00 0.00 H new ATOM 0 HG2 ARG B 66 62.591 6.404 13.208 1.00 0.00 H new ATOM 0 HG3 ARG B 66 62.140 5.291 11.931 1.00 0.00 H new ATOM 0 HD2 ARG B 66 63.063 4.018 13.834 1.00 0.00 H new ATOM 0 HD3 ARG B 66 64.145 3.873 12.463 1.00 0.00 H new ATOM 0 HE ARG B 66 65.132 6.134 13.844 1.00 0.00 H new ATOM 0 HH11 ARG B 66 64.322 2.808 14.569 1.00 0.00 H new ATOM 0 HH12 ARG B 66 65.554 2.653 15.826 1.00 0.00 H new ATOM 0 HH21 ARG B 66 66.706 5.933 15.447 1.00 0.00 H new ATOM 0 HH22 ARG B 66 66.892 4.407 16.319 1.00 0.00 H new ATOM 2703 N ASP B 67 64.968 7.775 9.171 1.00 0.00 N ATOM 2704 CA ASP B 67 65.957 8.542 8.340 1.00 0.00 C ATOM 2705 C ASP B 67 65.454 8.655 6.899 1.00 0.00 C ATOM 2706 O ASP B 67 65.156 7.666 6.260 1.00 0.00 O ATOM 2707 CB ASP B 67 67.302 7.811 8.345 1.00 0.00 C ATOM 2708 CG ASP B 67 67.938 7.917 9.732 1.00 0.00 C ATOM 2709 OD1 ASP B 67 67.551 8.805 10.474 1.00 0.00 O ATOM 2710 OD2 ASP B 67 68.803 7.109 10.028 1.00 0.00 O ATOM 0 H ASP B 67 64.997 6.763 9.046 1.00 0.00 H new ATOM 0 HA ASP B 67 66.075 9.541 8.761 1.00 0.00 H new ATOM 0 HB2 ASP B 67 67.159 6.764 8.078 1.00 0.00 H new ATOM 0 HB3 ASP B 67 67.965 8.243 7.596 1.00 0.00 H new ATOM 2715 N ASN B 68 65.358 9.858 6.386 1.00 0.00 N ATOM 2716 CA ASN B 68 64.872 10.061 4.983 1.00 0.00 C ATOM 2717 C ASN B 68 66.024 10.528 4.081 1.00 0.00 C ATOM 2718 O ASN B 68 65.878 10.596 2.876 1.00 0.00 O ATOM 2719 CB ASN B 68 63.768 11.121 4.985 1.00 0.00 C ATOM 2720 CG ASN B 68 63.095 11.162 3.612 1.00 0.00 C ATOM 2721 OD1 ASN B 68 62.802 10.135 3.035 1.00 0.00 O ATOM 2722 ND2 ASN B 68 62.835 12.317 3.061 1.00 0.00 N ATOM 0 H ASN B 68 65.598 10.716 6.883 1.00 0.00 H new ATOM 0 HA ASN B 68 64.485 9.117 4.599 1.00 0.00 H new ATOM 0 HB2 ASN B 68 63.032 10.893 5.756 1.00 0.00 H new ATOM 0 HB3 ASN B 68 64.188 12.098 5.225 1.00 0.00 H new ATOM 0 HD21 ASN B 68 62.386 12.356 2.146 1.00 0.00 H new ATOM 0 HD22 ASN B 68 63.081 13.180 3.546 1.00 0.00 H new ATOM 2729 N GLU B 69 67.161 10.867 4.649 1.00 0.00 N ATOM 2730 CA GLU B 69 68.317 11.353 3.817 1.00 0.00 C ATOM 2731 C GLU B 69 69.417 10.287 3.764 1.00 0.00 C ATOM 2732 O GLU B 69 69.527 9.439 4.627 1.00 0.00 O ATOM 2733 CB GLU B 69 68.885 12.639 4.432 1.00 0.00 C ATOM 2734 CG GLU B 69 69.758 13.372 3.405 1.00 0.00 C ATOM 2735 CD GLU B 69 68.880 13.928 2.283 1.00 0.00 C ATOM 2736 OE1 GLU B 69 67.708 14.159 2.533 1.00 0.00 O ATOM 2737 OE2 GLU B 69 69.393 14.110 1.191 1.00 0.00 O ATOM 0 H GLU B 69 67.340 10.829 5.652 1.00 0.00 H new ATOM 0 HA GLU B 69 67.965 11.552 2.805 1.00 0.00 H new ATOM 0 HB2 GLU B 69 68.071 13.287 4.757 1.00 0.00 H new ATOM 0 HB3 GLU B 69 69.474 12.399 5.317 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.302 14.183 3.889 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.502 12.690 2.993 1.00 0.00 H new ATOM 2744 N VAL B 70 70.225 10.331 2.737 1.00 0.00 N ATOM 2745 CA VAL B 70 71.327 9.338 2.571 1.00 0.00 C ATOM 2746 C VAL B 70 72.658 10.040 2.774 1.00 0.00 C ATOM 2747 O VAL B 70 73.079 10.845 1.968 1.00 0.00 O ATOM 2748 CB VAL B 70 71.296 8.784 1.139 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.170 7.534 1.064 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.849 8.443 0.694 1.00 0.00 C ATOM 0 H VAL B 70 70.166 11.026 1.993 1.00 0.00 H new ATOM 0 HA VAL B 70 71.203 8.532 3.294 1.00 0.00 H new ATOM 0 HB VAL B 70 71.680 9.550 0.465 1.00 0.00 H new ATOM 0 HG11 VAL B 70 72.151 7.137 0.049 1.00 0.00 H new ATOM 0 HG12 VAL B 70 73.194 7.790 1.335 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.789 6.782 1.755 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.864 8.054 -0.324 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.430 7.692 1.364 1.00 0.00 H new ATOM 0 HG23 VAL B 70 69.236 9.343 0.729 1.00 0.00 H new ATOM 2760 N ASP B 71 73.348 9.706 3.812 1.00 0.00 N ATOM 2761 CA ASP B 71 74.679 10.319 4.021 1.00 0.00 C ATOM 2762 C ASP B 71 75.626 9.555 3.114 1.00 0.00 C ATOM 2763 O ASP B 71 75.281 8.500 2.620 1.00 0.00 O ATOM 2764 CB ASP B 71 75.117 10.157 5.481 1.00 0.00 C ATOM 2765 CG ASP B 71 74.255 11.043 6.382 1.00 0.00 C ATOM 2766 OD1 ASP B 71 73.662 11.977 5.869 1.00 0.00 O ATOM 2767 OD2 ASP B 71 74.205 10.774 7.570 1.00 0.00 O ATOM 0 H ASP B 71 73.053 9.038 4.525 1.00 0.00 H new ATOM 0 HA ASP B 71 74.668 11.386 3.798 1.00 0.00 H new ATOM 0 HB2 ASP B 71 75.024 9.114 5.785 1.00 0.00 H new ATOM 0 HB3 ASP B 71 76.168 10.427 5.587 1.00 0.00 H new ATOM 2772 N PHE B 72 76.808 10.033 2.879 1.00 0.00 N ATOM 2773 CA PHE B 72 77.711 9.261 2.001 1.00 0.00 C ATOM 2774 C PHE B 72 77.823 7.860 2.596 1.00 0.00 C ATOM 2775 O PHE B 72 77.877 6.866 1.900 1.00 0.00 O ATOM 2776 CB PHE B 72 79.085 9.923 1.955 1.00 0.00 C ATOM 2777 CG PHE B 72 79.920 9.192 0.947 1.00 0.00 C ATOM 2778 CD1 PHE B 72 79.864 9.570 -0.393 1.00 0.00 C ATOM 2779 CD2 PHE B 72 80.721 8.119 1.344 1.00 0.00 C ATOM 2780 CE1 PHE B 72 80.614 8.882 -1.344 1.00 0.00 C ATOM 2781 CE2 PHE B 72 81.473 7.425 0.393 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.421 7.806 -0.953 1.00 0.00 C ATOM 0 H PHE B 72 77.182 10.907 3.249 1.00 0.00 H new ATOM 0 HA PHE B 72 77.324 9.220 0.983 1.00 0.00 H new ATOM 0 HB2 PHE B 72 78.992 10.974 1.682 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.557 9.889 2.937 1.00 0.00 H new ATOM 0 HD1 PHE B 72 79.239 10.397 -0.695 1.00 0.00 H new ATOM 0 HD2 PHE B 72 80.759 7.827 2.383 1.00 0.00 H new ATOM 0 HE1 PHE B 72 80.573 9.178 -2.382 1.00 0.00 H new ATOM 0 HE2 PHE B 72 82.094 6.595 0.696 1.00 0.00 H new ATOM 0 HZ PHE B 72 82.002 7.271 -1.689 1.00 0.00 H new ATOM 2792 N GLN B 73 77.834 7.799 3.894 1.00 0.00 N ATOM 2793 CA GLN B 73 77.916 6.497 4.599 1.00 0.00 C ATOM 2794 C GLN B 73 76.633 5.680 4.376 1.00 0.00 C ATOM 2795 O GLN B 73 76.689 4.483 4.205 1.00 0.00 O ATOM 2796 CB GLN B 73 78.097 6.767 6.096 1.00 0.00 C ATOM 2797 CG GLN B 73 78.186 5.449 6.866 1.00 0.00 C ATOM 2798 CD GLN B 73 78.463 5.749 8.340 1.00 0.00 C ATOM 2799 OE1 GLN B 73 78.756 6.873 8.698 1.00 0.00 O ATOM 2800 NE2 GLN B 73 78.377 4.788 9.219 1.00 0.00 N ATOM 0 H GLN B 73 77.789 8.613 4.507 1.00 0.00 H new ATOM 0 HA GLN B 73 78.759 5.926 4.209 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.001 7.354 6.260 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.261 7.359 6.469 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.256 4.890 6.764 1.00 0.00 H new ATOM 0 HG3 GLN B 73 78.979 4.825 6.454 1.00 0.00 H new ATOM 0 HE21 GLN B 73 78.131 3.844 8.920 1.00 0.00 H new ATOM 0 HE22 GLN B 73 78.556 4.981 10.205 1.00 0.00 H new ATOM 2809 N GLU B 74 75.473 6.292 4.389 1.00 0.00 N ATOM 2810 CA GLU B 74 74.238 5.491 4.194 1.00 0.00 C ATOM 2811 C GLU B 74 74.192 4.953 2.773 1.00 0.00 C ATOM 2812 O GLU B 74 73.799 3.827 2.543 1.00 0.00 O ATOM 2813 CB GLU B 74 73.012 6.364 4.462 1.00 0.00 C ATOM 2814 CG GLU B 74 72.921 6.681 5.958 1.00 0.00 C ATOM 2815 CD GLU B 74 72.595 5.407 6.739 1.00 0.00 C ATOM 2816 OE1 GLU B 74 71.553 4.827 6.480 1.00 0.00 O ATOM 2817 OE2 GLU B 74 73.392 5.033 7.585 1.00 0.00 O ATOM 0 H GLU B 74 75.335 7.294 4.524 1.00 0.00 H new ATOM 0 HA GLU B 74 74.239 4.652 4.890 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.079 7.288 3.888 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.109 5.850 4.134 1.00 0.00 H new ATOM 0 HG2 GLU B 74 73.864 7.102 6.308 1.00 0.00 H new ATOM 0 HG3 GLU B 74 72.152 7.433 6.134 1.00 0.00 H new ATOM 2824 N TYR B 75 74.583 5.732 1.813 1.00 0.00 N ATOM 2825 CA TYR B 75 74.541 5.220 0.423 1.00 0.00 C ATOM 2826 C TYR B 75 75.437 3.985 0.330 1.00 0.00 C ATOM 2827 O TYR B 75 75.110 3.010 -0.320 1.00 0.00 O ATOM 2828 CB TYR B 75 75.055 6.284 -0.549 1.00 0.00 C ATOM 2829 CG TYR B 75 75.022 5.736 -1.962 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.795 5.504 -2.599 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.220 5.454 -2.632 1.00 0.00 C ATOM 2832 CE1 TYR B 75 73.769 4.994 -3.903 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.193 4.944 -3.935 1.00 0.00 C ATOM 2834 CZ TYR B 75 74.968 4.714 -4.571 1.00 0.00 C ATOM 2835 OH TYR B 75 74.941 4.210 -5.855 1.00 0.00 O ATOM 0 H TYR B 75 74.925 6.686 1.926 1.00 0.00 H new ATOM 0 HA TYR B 75 73.513 4.968 0.161 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.440 7.181 -0.481 1.00 0.00 H new ATOM 0 HB3 TYR B 75 76.072 6.574 -0.284 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.870 5.718 -2.084 1.00 0.00 H new ATOM 0 HD2 TYR B 75 77.166 5.631 -2.142 1.00 0.00 H new ATOM 0 HE1 TYR B 75 72.824 4.816 -4.394 1.00 0.00 H new ATOM 0 HE2 TYR B 75 77.118 4.728 -4.450 1.00 0.00 H new ATOM 0 HH TYR B 75 75.858 4.073 -6.172 1.00 0.00 H new ATOM 2845 N CYS B 76 76.570 4.024 0.980 1.00 0.00 N ATOM 2846 CA CYS B 76 77.499 2.866 0.942 1.00 0.00 C ATOM 2847 C CYS B 76 76.904 1.719 1.757 1.00 0.00 C ATOM 2848 O CYS B 76 76.973 0.573 1.360 1.00 0.00 O ATOM 2849 CB CYS B 76 78.866 3.282 1.514 1.00 0.00 C ATOM 2850 SG CYS B 76 78.860 3.189 3.325 1.00 0.00 S ATOM 0 H CYS B 76 76.890 4.815 1.538 1.00 0.00 H new ATOM 0 HA CYS B 76 77.639 2.535 -0.087 1.00 0.00 H new ATOM 0 HB2 CYS B 76 79.645 2.633 1.114 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.104 4.298 1.198 1.00 0.00 H new ATOM 0 HG CYS B 76 77.851 3.864 3.791 1.00 0.00 H new ATOM 2856 N VAL B 77 76.297 2.005 2.884 1.00 0.00 N ATOM 2857 CA VAL B 77 75.694 0.898 3.667 1.00 0.00 C ATOM 2858 C VAL B 77 74.646 0.229 2.788 1.00 0.00 C ATOM 2859 O VAL B 77 74.524 -0.979 2.750 1.00 0.00 O ATOM 2860 CB VAL B 77 75.046 1.447 4.942 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.217 0.351 5.616 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.143 1.911 5.903 1.00 0.00 C ATOM 0 H VAL B 77 76.197 2.938 3.283 1.00 0.00 H new ATOM 0 HA VAL B 77 76.457 0.178 3.962 1.00 0.00 H new ATOM 0 HB VAL B 77 74.397 2.284 4.686 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.759 0.747 6.522 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.438 0.012 4.933 1.00 0.00 H new ATOM 0 HG13 VAL B 77 74.864 -0.488 5.873 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.688 2.303 6.813 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.787 1.068 6.154 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.736 2.693 5.428 1.00 0.00 H new ATOM 2872 N PHE B 78 73.904 1.014 2.058 1.00 0.00 N ATOM 2873 CA PHE B 78 72.880 0.437 1.157 1.00 0.00 C ATOM 2874 C PHE B 78 73.588 -0.283 0.003 1.00 0.00 C ATOM 2875 O PHE B 78 73.179 -1.344 -0.418 1.00 0.00 O ATOM 2876 CB PHE B 78 71.967 1.556 0.630 1.00 0.00 C ATOM 2877 CG PHE B 78 70.872 1.843 1.645 1.00 0.00 C ATOM 2878 CD1 PHE B 78 71.206 2.178 2.966 1.00 0.00 C ATOM 2879 CD2 PHE B 78 69.526 1.764 1.268 1.00 0.00 C ATOM 2880 CE1 PHE B 78 70.196 2.436 3.902 1.00 0.00 C ATOM 2881 CE2 PHE B 78 68.516 2.022 2.205 1.00 0.00 C ATOM 2882 CZ PHE B 78 68.852 2.358 3.521 1.00 0.00 C ATOM 0 H PHE B 78 73.966 2.032 2.050 1.00 0.00 H new ATOM 0 HA PHE B 78 72.261 -0.280 1.696 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.550 2.458 0.445 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.526 1.261 -0.322 1.00 0.00 H new ATOM 0 HD1 PHE B 78 72.243 2.237 3.262 1.00 0.00 H new ATOM 0 HD2 PHE B 78 69.265 1.504 0.253 1.00 0.00 H new ATOM 0 HE1 PHE B 78 70.455 2.695 4.918 1.00 0.00 H new ATOM 0 HE2 PHE B 78 67.478 1.961 1.911 1.00 0.00 H new ATOM 0 HZ PHE B 78 68.074 2.557 4.243 1.00 0.00 H new ATOM 2892 N LEU B 79 74.653 0.276 -0.513 1.00 0.00 N ATOM 2893 CA LEU B 79 75.367 -0.412 -1.632 1.00 0.00 C ATOM 2894 C LEU B 79 76.040 -1.679 -1.093 1.00 0.00 C ATOM 2895 O LEU B 79 76.082 -2.703 -1.745 1.00 0.00 O ATOM 2896 CB LEU B 79 76.425 0.524 -2.229 1.00 0.00 C ATOM 2897 CG LEU B 79 77.142 -0.159 -3.405 1.00 0.00 C ATOM 2898 CD1 LEU B 79 76.139 -0.458 -4.537 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.248 0.775 -3.921 1.00 0.00 C ATOM 0 H LEU B 79 75.055 1.165 -0.214 1.00 0.00 H new ATOM 0 HA LEU B 79 74.653 -0.679 -2.411 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.954 1.446 -2.568 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.150 0.799 -1.463 1.00 0.00 H new ATOM 0 HG LEU B 79 77.578 -1.100 -3.070 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.658 -0.942 -5.365 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.356 -1.118 -4.164 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.693 0.474 -4.884 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.764 0.301 -4.756 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.805 1.714 -4.254 1.00 0.00 H new ATOM 0 HD23 LEU B 79 78.960 0.973 -3.120 1.00 0.00 H new ATOM 2911 N SER B 80 76.577 -1.601 0.089 1.00 0.00 N ATOM 2912 CA SER B 80 77.269 -2.777 0.689 1.00 0.00 C ATOM 2913 C SER B 80 76.244 -3.864 0.971 1.00 0.00 C ATOM 2914 O SER B 80 76.477 -5.031 0.726 1.00 0.00 O ATOM 2915 CB SER B 80 77.944 -2.365 1.998 1.00 0.00 C ATOM 2916 OG SER B 80 78.877 -3.367 2.379 1.00 0.00 O ATOM 0 H SER B 80 76.567 -0.765 0.673 1.00 0.00 H new ATOM 0 HA SER B 80 78.024 -3.149 -0.003 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.451 -1.408 1.874 1.00 0.00 H new ATOM 0 HB3 SER B 80 77.197 -2.231 2.780 1.00 0.00 H new ATOM 0 HG SER B 80 79.603 -2.959 2.896 1.00 0.00 H new ATOM 2922 N CYS B 81 75.101 -3.490 1.467 1.00 0.00 N ATOM 2923 CA CYS B 81 74.063 -4.505 1.736 1.00 0.00 C ATOM 2924 C CYS B 81 73.736 -5.180 0.414 1.00 0.00 C ATOM 2925 O CYS B 81 73.474 -6.361 0.354 1.00 0.00 O ATOM 2926 CB CYS B 81 72.809 -3.846 2.334 1.00 0.00 C ATOM 2927 SG CYS B 81 71.785 -3.116 1.029 1.00 0.00 S ATOM 0 H CYS B 81 74.846 -2.529 1.695 1.00 0.00 H new ATOM 0 HA CYS B 81 74.420 -5.238 2.459 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.230 -4.587 2.885 1.00 0.00 H new ATOM 0 HB3 CYS B 81 73.102 -3.075 3.047 1.00 0.00 H new ATOM 0 HG CYS B 81 72.497 -2.278 0.336 1.00 0.00 H new ATOM 2933 N ILE B 82 73.768 -4.432 -0.656 1.00 0.00 N ATOM 2934 CA ILE B 82 73.468 -5.050 -1.981 1.00 0.00 C ATOM 2935 C ILE B 82 74.615 -5.981 -2.360 1.00 0.00 C ATOM 2936 O ILE B 82 74.412 -7.051 -2.897 1.00 0.00 O ATOM 2937 CB ILE B 82 73.303 -3.972 -3.056 1.00 0.00 C ATOM 2938 CG1 ILE B 82 72.009 -3.193 -2.795 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.234 -4.636 -4.439 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.947 -1.961 -3.706 1.00 0.00 C ATOM 0 H ILE B 82 73.985 -3.436 -0.672 1.00 0.00 H new ATOM 0 HA ILE B 82 72.535 -5.610 -1.912 1.00 0.00 H new ATOM 0 HB ILE B 82 74.152 -3.289 -3.025 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.146 -3.834 -2.976 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.964 -2.886 -1.750 1.00 0.00 H new ATOM 0 HG21 ILE B 82 73.117 -3.870 -5.205 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.153 -5.193 -4.621 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.384 -5.317 -4.474 1.00 0.00 H new ATOM 0 HD11 ILE B 82 71.025 -1.413 -3.514 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.802 -1.315 -3.503 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.971 -2.278 -4.749 1.00 0.00 H new ATOM 2952 N ALA B 83 75.823 -5.576 -2.095 1.00 0.00 N ATOM 2953 CA ALA B 83 76.979 -6.440 -2.451 1.00 0.00 C ATOM 2954 C ALA B 83 76.863 -7.776 -1.722 1.00 0.00 C ATOM 2955 O ALA B 83 77.011 -8.824 -2.313 1.00 0.00 O ATOM 2956 CB ALA B 83 78.274 -5.750 -2.036 1.00 0.00 C ATOM 0 H ALA B 83 76.059 -4.689 -1.650 1.00 0.00 H new ATOM 0 HA ALA B 83 76.984 -6.612 -3.527 1.00 0.00 H new ATOM 0 HB1 ALA B 83 79.123 -6.382 -2.296 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.360 -4.795 -2.555 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.266 -5.578 -0.960 1.00 0.00 H new ATOM 2962 N MET B 84 76.587 -7.757 -0.447 1.00 0.00 N ATOM 2963 CA MET B 84 76.453 -9.045 0.292 1.00 0.00 C ATOM 2964 C MET B 84 75.293 -9.841 -0.289 1.00 0.00 C ATOM 2965 O MET B 84 75.355 -11.050 -0.388 1.00 0.00 O ATOM 2966 CB MET B 84 76.254 -8.785 1.786 1.00 0.00 C ATOM 2967 CG MET B 84 77.566 -8.257 2.383 1.00 0.00 C ATOM 2968 SD MET B 84 77.352 -7.942 4.154 1.00 0.00 S ATOM 2969 CE MET B 84 76.260 -6.507 4.009 1.00 0.00 C ATOM 0 H MET B 84 76.450 -6.914 0.111 1.00 0.00 H new ATOM 0 HA MET B 84 77.367 -9.627 0.179 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.453 -8.061 1.938 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.954 -9.703 2.291 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.365 -8.982 2.227 1.00 0.00 H new ATOM 0 HG3 MET B 84 77.864 -7.340 1.875 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.376 -5.872 4.887 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.520 -5.941 3.115 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.225 -6.843 3.938 1.00 0.00 H new ATOM 2979 N MET B 85 74.249 -9.188 -0.714 1.00 0.00 N ATOM 2980 CA MET B 85 73.136 -9.954 -1.324 1.00 0.00 C ATOM 2981 C MET B 85 73.723 -10.702 -2.515 1.00 0.00 C ATOM 2982 O MET B 85 73.244 -11.748 -2.904 1.00 0.00 O ATOM 2983 CB MET B 85 72.020 -9.013 -1.793 1.00 0.00 C ATOM 2984 CG MET B 85 71.267 -8.466 -0.580 1.00 0.00 C ATOM 2985 SD MET B 85 70.175 -7.123 -1.109 1.00 0.00 S ATOM 2986 CE MET B 85 69.756 -6.507 0.540 1.00 0.00 C ATOM 0 H MET B 85 74.121 -8.177 -0.666 1.00 0.00 H new ATOM 0 HA MET B 85 72.698 -10.640 -0.599 1.00 0.00 H new ATOM 0 HB2 MET B 85 72.442 -8.192 -2.372 1.00 0.00 H new ATOM 0 HB3 MET B 85 71.333 -9.546 -2.450 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.685 -9.259 -0.111 1.00 0.00 H new ATOM 0 HG3 MET B 85 71.973 -8.103 0.167 1.00 0.00 H new ATOM 0 HE1 MET B 85 69.338 -5.504 0.458 1.00 0.00 H new ATOM 0 HE2 MET B 85 69.023 -7.169 1.000 1.00 0.00 H new ATOM 0 HE3 MET B 85 70.655 -6.476 1.156 1.00 0.00 H new ATOM 2996 N CYS B 86 74.790 -10.183 -3.083 1.00 0.00 N ATOM 2997 CA CYS B 86 75.429 -10.889 -4.230 1.00 0.00 C ATOM 2998 C CYS B 86 76.903 -10.487 -4.354 1.00 0.00 C ATOM 2999 O CYS B 86 77.311 -9.873 -5.320 1.00 0.00 O ATOM 3000 CB CYS B 86 74.685 -10.551 -5.524 1.00 0.00 C ATOM 3001 SG CYS B 86 74.644 -8.756 -5.746 1.00 0.00 S ATOM 0 H CYS B 86 75.237 -9.311 -2.802 1.00 0.00 H new ATOM 0 HA CYS B 86 75.376 -11.963 -4.054 1.00 0.00 H new ATOM 0 HB2 CYS B 86 75.179 -11.022 -6.374 1.00 0.00 H new ATOM 0 HB3 CYS B 86 73.670 -10.947 -5.486 1.00 0.00 H new ATOM 0 HG CYS B 86 74.551 -8.177 -4.586 1.00 0.00 H new ATOM 3007 N ASN B 87 77.702 -10.844 -3.385 1.00 0.00 N ATOM 3008 CA ASN B 87 79.154 -10.502 -3.438 1.00 0.00 C ATOM 3009 C ASN B 87 79.885 -11.492 -4.355 1.00 0.00 C ATOM 3010 O ASN B 87 80.655 -11.105 -5.213 1.00 0.00 O ATOM 3011 CB ASN B 87 79.743 -10.583 -2.027 1.00 0.00 C ATOM 3012 CG ASN B 87 81.211 -10.157 -2.056 1.00 0.00 C ATOM 3013 OD1 ASN B 87 81.729 -9.790 -3.092 1.00 0.00 O ATOM 3014 ND2 ASN B 87 81.911 -10.191 -0.953 1.00 0.00 N ATOM 0 H ASN B 87 77.411 -11.360 -2.555 1.00 0.00 H new ATOM 0 HA ASN B 87 79.276 -9.492 -3.830 1.00 0.00 H new ATOM 0 HB2 ASN B 87 79.181 -9.939 -1.350 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.657 -11.600 -1.644 1.00 0.00 H new ATOM 0 HD21 ASN B 87 82.891 -9.910 -0.962 1.00 0.00 H new ATOM 0 HD22 ASN B 87 81.477 -10.499 -0.083 1.00 0.00 H new ATOM 3021 N GLU B 88 79.652 -12.765 -4.174 1.00 0.00 N ATOM 3022 CA GLU B 88 80.330 -13.790 -5.026 1.00 0.00 C ATOM 3023 C GLU B 88 79.661 -13.837 -6.406 1.00 0.00 C ATOM 3024 O GLU B 88 78.524 -13.438 -6.565 1.00 0.00 O ATOM 3025 CB GLU B 88 80.223 -15.161 -4.354 1.00 0.00 C ATOM 3026 CG GLU B 88 81.042 -15.169 -3.058 1.00 0.00 C ATOM 3027 CD GLU B 88 80.296 -14.396 -1.967 1.00 0.00 C ATOM 3028 OE1 GLU B 88 79.142 -14.064 -2.184 1.00 0.00 O ATOM 3029 OE2 GLU B 88 80.892 -14.147 -0.932 1.00 0.00 O ATOM 0 H GLU B 88 79.018 -13.142 -3.469 1.00 0.00 H new ATOM 0 HA GLU B 88 81.381 -13.526 -5.146 1.00 0.00 H new ATOM 0 HB2 GLU B 88 79.180 -15.389 -4.137 1.00 0.00 H new ATOM 0 HB3 GLU B 88 80.585 -15.936 -5.029 1.00 0.00 H new ATOM 0 HG2 GLU B 88 81.217 -16.195 -2.734 1.00 0.00 H new ATOM 0 HG3 GLU B 88 82.019 -14.718 -3.232 1.00 0.00 H new ATOM 3036 N PHE B 89 80.360 -14.306 -7.409 1.00 0.00 N ATOM 3037 CA PHE B 89 79.759 -14.354 -8.777 1.00 0.00 C ATOM 3038 C PHE B 89 78.499 -15.224 -8.774 1.00 0.00 C ATOM 3039 O PHE B 89 77.407 -14.747 -9.013 1.00 0.00 O ATOM 3040 CB PHE B 89 80.767 -14.971 -9.751 1.00 0.00 C ATOM 3041 CG PHE B 89 81.929 -14.032 -9.960 1.00 0.00 C ATOM 3042 CD1 PHE B 89 83.042 -14.101 -9.115 1.00 0.00 C ATOM 3043 CD2 PHE B 89 81.903 -13.104 -11.009 1.00 0.00 C ATOM 3044 CE1 PHE B 89 84.127 -13.242 -9.313 1.00 0.00 C ATOM 3045 CE2 PHE B 89 82.988 -12.243 -11.208 1.00 0.00 C ATOM 3046 CZ PHE B 89 84.101 -12.311 -10.360 1.00 0.00 C ATOM 0 H PHE B 89 81.316 -14.656 -7.341 1.00 0.00 H new ATOM 0 HA PHE B 89 79.502 -13.339 -9.081 1.00 0.00 H new ATOM 0 HB2 PHE B 89 81.125 -15.924 -9.361 1.00 0.00 H new ATOM 0 HB3 PHE B 89 80.282 -15.179 -10.705 1.00 0.00 H new ATOM 0 HD1 PHE B 89 83.063 -14.819 -8.309 1.00 0.00 H new ATOM 0 HD2 PHE B 89 81.046 -13.053 -11.664 1.00 0.00 H new ATOM 0 HE1 PHE B 89 84.985 -13.296 -8.659 1.00 0.00 H new ATOM 0 HE2 PHE B 89 82.967 -11.526 -12.015 1.00 0.00 H new ATOM 0 HZ PHE B 89 84.938 -11.646 -10.513 1.00 0.00 H new ATOM 3056 N PHE B 90 78.649 -16.499 -8.512 1.00 0.00 N ATOM 3057 CA PHE B 90 77.469 -17.429 -8.495 1.00 0.00 C ATOM 3058 C PHE B 90 77.410 -18.199 -7.172 1.00 0.00 C ATOM 3059 O PHE B 90 76.378 -18.720 -6.800 1.00 0.00 O ATOM 3060 CB PHE B 90 77.586 -18.413 -9.661 1.00 0.00 C ATOM 3061 CG PHE B 90 78.981 -18.985 -9.706 1.00 0.00 C ATOM 3062 CD1 PHE B 90 79.283 -20.154 -9.000 1.00 0.00 C ATOM 3063 CD2 PHE B 90 79.974 -18.342 -10.458 1.00 0.00 C ATOM 3064 CE1 PHE B 90 80.580 -20.682 -9.045 1.00 0.00 C ATOM 3065 CE2 PHE B 90 81.269 -18.870 -10.503 1.00 0.00 C ATOM 3066 CZ PHE B 90 81.572 -20.041 -9.797 1.00 0.00 C ATOM 0 H PHE B 90 79.545 -16.942 -8.307 1.00 0.00 H new ATOM 0 HA PHE B 90 76.555 -16.844 -8.595 1.00 0.00 H new ATOM 0 HB2 PHE B 90 76.857 -19.215 -9.547 1.00 0.00 H new ATOM 0 HB3 PHE B 90 77.359 -17.908 -10.600 1.00 0.00 H new ATOM 0 HD1 PHE B 90 78.517 -20.649 -8.421 1.00 0.00 H new ATOM 0 HD2 PHE B 90 79.740 -17.439 -11.003 1.00 0.00 H new ATOM 0 HE1 PHE B 90 80.815 -21.584 -8.499 1.00 0.00 H new ATOM 0 HE2 PHE B 90 82.035 -18.375 -11.082 1.00 0.00 H new ATOM 0 HZ PHE B 90 82.571 -20.450 -9.833 1.00 0.00 H new ATOM 3076 N GLU B 91 78.502 -18.289 -6.462 1.00 0.00 N ATOM 3077 CA GLU B 91 78.479 -19.039 -5.172 1.00 0.00 C ATOM 3078 C GLU B 91 77.600 -18.303 -4.162 1.00 0.00 C ATOM 3079 O GLU B 91 77.607 -17.092 -4.080 1.00 0.00 O ATOM 3080 CB GLU B 91 79.901 -19.176 -4.618 1.00 0.00 C ATOM 3081 CG GLU B 91 80.710 -20.144 -5.487 1.00 0.00 C ATOM 3082 CD GLU B 91 80.142 -21.558 -5.346 1.00 0.00 C ATOM 3083 OE1 GLU B 91 79.941 -21.987 -4.221 1.00 0.00 O ATOM 3084 OE2 GLU B 91 79.910 -22.187 -6.367 1.00 0.00 O ATOM 0 H GLU B 91 79.401 -17.880 -6.715 1.00 0.00 H new ATOM 0 HA GLU B 91 78.070 -20.034 -5.348 1.00 0.00 H new ATOM 0 HB2 GLU B 91 80.387 -18.201 -4.596 1.00 0.00 H new ATOM 0 HB3 GLU B 91 79.867 -19.538 -3.591 1.00 0.00 H new ATOM 0 HG2 GLU B 91 80.674 -19.829 -6.530 1.00 0.00 H new ATOM 0 HG3 GLU B 91 81.757 -20.130 -5.186 1.00 0.00 H new ATOM 3091 N GLY B 92 76.835 -19.029 -3.394 1.00 0.00 N ATOM 3092 CA GLY B 92 75.949 -18.374 -2.391 1.00 0.00 C ATOM 3093 C GLY B 92 76.779 -17.430 -1.520 1.00 0.00 C ATOM 3094 O GLY B 92 77.910 -17.714 -1.181 1.00 0.00 O ATOM 0 H GLY B 92 76.785 -20.048 -3.418 1.00 0.00 H new ATOM 0 HA2 GLY B 92 75.158 -17.820 -2.896 1.00 0.00 H new ATOM 0 HA3 GLY B 92 75.464 -19.128 -1.770 1.00 0.00 H new ATOM 3098 N PHE B 93 76.225 -16.302 -1.160 1.00 0.00 N ATOM 3099 CA PHE B 93 76.980 -15.329 -0.315 1.00 0.00 C ATOM 3100 C PHE B 93 76.769 -15.669 1.175 1.00 0.00 C ATOM 3101 O PHE B 93 75.728 -16.177 1.543 1.00 0.00 O ATOM 3102 CB PHE B 93 76.460 -13.914 -0.598 1.00 0.00 C ATOM 3103 CG PHE B 93 74.949 -13.904 -0.545 1.00 0.00 C ATOM 3104 CD1 PHE B 93 74.207 -14.376 -1.636 1.00 0.00 C ATOM 3105 CD2 PHE B 93 74.288 -13.417 0.591 1.00 0.00 C ATOM 3106 CE1 PHE B 93 72.808 -14.364 -1.590 1.00 0.00 C ATOM 3107 CE2 PHE B 93 72.888 -13.405 0.635 1.00 0.00 C ATOM 3108 CZ PHE B 93 72.148 -13.878 -0.455 1.00 0.00 C ATOM 0 H PHE B 93 75.281 -16.012 -1.415 1.00 0.00 H new ATOM 0 HA PHE B 93 78.043 -15.384 -0.549 1.00 0.00 H new ATOM 0 HB2 PHE B 93 76.863 -13.215 0.135 1.00 0.00 H new ATOM 0 HB3 PHE B 93 76.801 -13.581 -1.578 1.00 0.00 H new ATOM 0 HD1 PHE B 93 74.715 -14.749 -2.513 1.00 0.00 H new ATOM 0 HD2 PHE B 93 74.858 -13.051 1.432 1.00 0.00 H new ATOM 0 HE1 PHE B 93 72.237 -14.730 -2.431 1.00 0.00 H new ATOM 0 HE2 PHE B 93 72.379 -13.030 1.511 1.00 0.00 H new ATOM 0 HZ PHE B 93 71.069 -13.868 -0.420 1.00 0.00 H new ATOM 3118 N PRO B 94 77.732 -15.394 2.038 1.00 0.00 N ATOM 3119 CA PRO B 94 77.567 -15.699 3.491 1.00 0.00 C ATOM 3120 C PRO B 94 76.445 -14.868 4.130 1.00 0.00 C ATOM 3121 O PRO B 94 75.669 -14.225 3.451 1.00 0.00 O ATOM 3122 CB PRO B 94 78.945 -15.313 4.070 1.00 0.00 C ATOM 3123 CG PRO B 94 79.692 -14.494 3.004 1.00 0.00 C ATOM 3124 CD PRO B 94 79.033 -14.774 1.646 1.00 0.00 C ATOM 0 HA PRO B 94 77.284 -16.734 3.680 1.00 0.00 H new ATOM 0 HB2 PRO B 94 78.826 -14.731 4.984 1.00 0.00 H new ATOM 0 HB3 PRO B 94 79.512 -16.206 4.332 1.00 0.00 H new ATOM 0 HG2 PRO B 94 79.646 -13.430 3.238 1.00 0.00 H new ATOM 0 HG3 PRO B 94 80.746 -14.770 2.981 1.00 0.00 H new ATOM 0 HD2 PRO B 94 78.889 -13.861 1.069 1.00 0.00 H new ATOM 0 HD3 PRO B 94 79.635 -15.446 1.034 1.00 0.00 H new ATOM 3132 N ASP B 95 76.366 -14.873 5.432 1.00 0.00 N ATOM 3133 CA ASP B 95 75.311 -14.080 6.123 1.00 0.00 C ATOM 3134 C ASP B 95 75.671 -12.593 6.046 1.00 0.00 C ATOM 3135 O ASP B 95 76.810 -12.234 5.823 1.00 0.00 O ATOM 3136 CB ASP B 95 75.224 -14.514 7.588 1.00 0.00 C ATOM 3137 CG ASP B 95 74.634 -15.924 7.669 1.00 0.00 C ATOM 3138 OD1 ASP B 95 73.899 -16.289 6.767 1.00 0.00 O ATOM 3139 OD2 ASP B 95 74.930 -16.613 8.631 1.00 0.00 O ATOM 0 H ASP B 95 76.989 -15.394 6.049 1.00 0.00 H new ATOM 0 HA ASP B 95 74.348 -14.248 5.641 1.00 0.00 H new ATOM 0 HB2 ASP B 95 76.214 -14.496 8.043 1.00 0.00 H new ATOM 0 HB3 ASP B 95 74.603 -13.816 8.149 1.00 0.00 H new ATOM 3144 N LYS B 96 74.713 -11.727 6.228 1.00 0.00 N ATOM 3145 CA LYS B 96 75.007 -10.266 6.161 1.00 0.00 C ATOM 3146 C LYS B 96 75.620 -9.809 7.487 1.00 0.00 C ATOM 3147 O LYS B 96 76.783 -9.471 7.554 1.00 0.00 O ATOM 3148 CB LYS B 96 73.712 -9.492 5.908 1.00 0.00 C ATOM 3149 CG LYS B 96 73.225 -9.758 4.481 1.00 0.00 C ATOM 3150 CD LYS B 96 72.049 -8.830 4.154 1.00 0.00 C ATOM 3151 CE LYS B 96 70.828 -9.212 4.995 1.00 0.00 C ATOM 3152 NZ LYS B 96 69.605 -8.599 4.403 1.00 0.00 N ATOM 0 H LYS B 96 73.740 -11.966 6.420 1.00 0.00 H new ATOM 0 HA LYS B 96 75.708 -10.075 5.348 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.949 -9.795 6.626 1.00 0.00 H new ATOM 0 HB3 LYS B 96 73.880 -8.425 6.053 1.00 0.00 H new ATOM 0 HG2 LYS B 96 74.037 -9.594 3.773 1.00 0.00 H new ATOM 0 HG3 LYS B 96 72.918 -10.799 4.379 1.00 0.00 H new ATOM 0 HD2 LYS B 96 72.327 -7.795 4.351 1.00 0.00 H new ATOM 0 HD3 LYS B 96 71.806 -8.898 3.094 1.00 0.00 H new ATOM 0 HE2 LYS B 96 70.723 -10.296 5.031 1.00 0.00 H new ATOM 0 HE3 LYS B 96 70.959 -8.870 6.022 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 68.775 -8.858 4.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 69.707 -7.564 4.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 69.478 -8.946 3.431 1.00 0.00 H new ATOM 3166 N GLN B 97 74.840 -9.789 8.539 1.00 0.00 N ATOM 3167 CA GLN B 97 75.362 -9.349 9.875 1.00 0.00 C ATOM 3168 C GLN B 97 75.558 -10.586 10.783 1.00 0.00 C ATOM 3169 O GLN B 97 74.592 -11.121 11.289 1.00 0.00 O ATOM 3170 CB GLN B 97 74.319 -8.426 10.516 1.00 0.00 C ATOM 3171 CG GLN B 97 74.881 -7.804 11.800 1.00 0.00 C ATOM 3172 CD GLN B 97 75.895 -6.711 11.451 1.00 0.00 C ATOM 3173 OE1 GLN B 97 76.894 -6.557 12.126 1.00 0.00 O ATOM 3174 NE2 GLN B 97 75.679 -5.936 10.422 1.00 0.00 N ATOM 0 H GLN B 97 73.857 -10.060 8.532 1.00 0.00 H new ATOM 0 HA GLN B 97 76.313 -8.831 9.754 1.00 0.00 H new ATOM 0 HB2 GLN B 97 74.038 -7.640 9.815 1.00 0.00 H new ATOM 0 HB3 GLN B 97 73.414 -8.990 10.742 1.00 0.00 H new ATOM 0 HG2 GLN B 97 74.071 -7.383 12.395 1.00 0.00 H new ATOM 0 HG3 GLN B 97 75.357 -8.573 12.408 1.00 0.00 H new ATOM 0 HE21 GLN B 97 74.841 -6.064 9.854 1.00 0.00 H new ATOM 0 HE22 GLN B 97 76.348 -5.203 10.186 1.00 0.00 H new ATOM 3183 N PRO B 98 76.778 -11.049 11.010 1.00 0.00 N ATOM 3184 CA PRO B 98 76.986 -12.235 11.891 1.00 0.00 C ATOM 3185 C PRO B 98 76.843 -11.884 13.382 1.00 0.00 C ATOM 3186 O PRO B 98 77.109 -12.697 14.245 1.00 0.00 O ATOM 3187 CB PRO B 98 78.432 -12.646 11.551 1.00 0.00 C ATOM 3188 CG PRO B 98 79.106 -11.468 10.821 1.00 0.00 C ATOM 3189 CD PRO B 98 78.015 -10.458 10.419 1.00 0.00 C ATOM 0 HA PRO B 98 76.251 -13.023 11.726 1.00 0.00 H new ATOM 0 HB2 PRO B 98 78.981 -12.895 12.460 1.00 0.00 H new ATOM 0 HB3 PRO B 98 78.437 -13.536 10.922 1.00 0.00 H new ATOM 0 HG2 PRO B 98 79.843 -10.993 11.468 1.00 0.00 H new ATOM 0 HG3 PRO B 98 79.638 -11.823 9.938 1.00 0.00 H new ATOM 0 HD2 PRO B 98 78.218 -9.464 10.818 1.00 0.00 H new ATOM 0 HD3 PRO B 98 77.937 -10.357 9.336 1.00 0.00 H new ATOM 3197 N ARG B 99 76.435 -10.678 13.689 1.00 0.00 N ATOM 3198 CA ARG B 99 76.286 -10.271 15.123 1.00 0.00 C ATOM 3199 C ARG B 99 74.815 -10.354 15.541 1.00 0.00 C ATOM 3200 O ARG B 99 73.975 -9.633 15.039 1.00 0.00 O ATOM 3201 CB ARG B 99 76.779 -8.828 15.283 1.00 0.00 C ATOM 3202 CG ARG B 99 76.695 -8.406 16.754 1.00 0.00 C ATOM 3203 CD ARG B 99 77.189 -6.966 16.897 1.00 0.00 C ATOM 3204 NE ARG B 99 78.625 -6.870 16.463 1.00 0.00 N ATOM 3205 CZ ARG B 99 79.571 -7.560 17.045 1.00 0.00 C ATOM 3206 NH1 ARG B 99 79.323 -8.242 18.129 1.00 0.00 N ATOM 3207 NH2 ARG B 99 80.783 -7.528 16.565 1.00 0.00 N ATOM 0 H ARG B 99 76.198 -9.956 13.009 1.00 0.00 H new ATOM 0 HA ARG B 99 76.872 -10.940 15.753 1.00 0.00 H new ATOM 0 HB2 ARG B 99 77.807 -8.745 14.930 1.00 0.00 H new ATOM 0 HB3 ARG B 99 76.176 -8.159 14.669 1.00 0.00 H new ATOM 0 HG2 ARG B 99 75.668 -8.487 17.109 1.00 0.00 H new ATOM 0 HG3 ARG B 99 77.299 -9.072 17.370 1.00 0.00 H new ATOM 0 HD2 ARG B 99 76.573 -6.300 16.293 1.00 0.00 H new ATOM 0 HD3 ARG B 99 77.091 -6.640 17.933 1.00 0.00 H new ATOM 0 HE ARG B 99 78.869 -6.248 15.692 1.00 0.00 H new ATOM 0 HH11 ARG B 99 78.385 -8.240 18.529 1.00 0.00 H new ATOM 0 HH12 ARG B 99 80.067 -8.777 18.576 1.00 0.00 H new ATOM 0 HH21 ARG B 99 80.990 -6.966 15.739 1.00 0.00 H new ATOM 0 HH22 ARG B 99 81.524 -8.065 17.016 1.00 0.00 H new ATOM 3221 N LYS B 100 74.500 -11.219 16.469 1.00 0.00 N ATOM 3222 CA LYS B 100 73.088 -11.333 16.937 1.00 0.00 C ATOM 3223 C LYS B 100 72.731 -10.118 17.799 1.00 0.00 C ATOM 3224 O LYS B 100 73.576 -9.546 18.460 1.00 0.00 O ATOM 3225 CB LYS B 100 72.910 -12.618 17.748 1.00 0.00 C ATOM 3226 CG LYS B 100 73.224 -13.825 16.860 1.00 0.00 C ATOM 3227 CD LYS B 100 73.049 -15.117 17.663 1.00 0.00 C ATOM 3228 CE LYS B 100 73.366 -16.318 16.769 1.00 0.00 C ATOM 3229 NZ LYS B 100 73.444 -17.552 17.600 1.00 0.00 N ATOM 0 H LYS B 100 75.160 -11.851 16.923 1.00 0.00 H new ATOM 0 HA LYS B 100 72.425 -11.366 16.072 1.00 0.00 H new ATOM 0 HB2 LYS B 100 73.570 -12.609 18.615 1.00 0.00 H new ATOM 0 HB3 LYS B 100 71.889 -12.685 18.125 1.00 0.00 H new ATOM 0 HG2 LYS B 100 72.563 -13.832 15.993 1.00 0.00 H new ATOM 0 HG3 LYS B 100 74.244 -13.755 16.483 1.00 0.00 H new ATOM 0 HD2 LYS B 100 73.709 -15.111 18.531 1.00 0.00 H new ATOM 0 HD3 LYS B 100 72.029 -15.189 18.039 1.00 0.00 H new ATOM 0 HE2 LYS B 100 72.596 -16.429 16.006 1.00 0.00 H new ATOM 0 HE3 LYS B 100 74.310 -16.158 16.248 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 73.659 -18.367 16.991 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 74.194 -17.444 18.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 72.533 -17.707 18.077 1.00 0.00 H new ATOM 3243 N LYS B 101 71.486 -9.718 17.802 1.00 0.00 N ATOM 3244 CA LYS B 101 71.079 -8.539 18.626 1.00 0.00 C ATOM 3245 C LYS B 101 70.712 -9.004 20.036 1.00 0.00 C ATOM 3246 O LYS B 101 70.271 -10.134 20.172 1.00 0.00 O ATOM 3247 CB LYS B 101 69.866 -7.857 17.987 1.00 0.00 C ATOM 3248 CG LYS B 101 70.280 -7.211 16.664 1.00 0.00 C ATOM 3249 CD LYS B 101 69.069 -6.528 16.026 1.00 0.00 C ATOM 3250 CE LYS B 101 69.485 -5.882 14.703 1.00 0.00 C ATOM 3251 NZ LYS B 101 68.332 -5.130 14.132 1.00 0.00 N ATOM 3252 OXT LYS B 101 70.876 -8.222 20.957 1.00 0.00 O ATOM 0 H LYS B 101 70.734 -10.156 17.270 1.00 0.00 H new ATOM 0 HA LYS B 101 71.908 -7.833 18.677 1.00 0.00 H new ATOM 0 HB2 LYS B 101 69.074 -8.586 17.815 1.00 0.00 H new ATOM 0 HB3 LYS B 101 69.463 -7.102 18.662 1.00 0.00 H new ATOM 0 HG2 LYS B 101 71.073 -6.483 16.836 1.00 0.00 H new ATOM 0 HG3 LYS B 101 70.682 -7.966 15.989 1.00 0.00 H new ATOM 0 HD2 LYS B 101 68.276 -7.256 15.854 1.00 0.00 H new ATOM 0 HD3 LYS B 101 68.667 -5.773 16.701 1.00 0.00 H new ATOM 0 HE2 LYS B 101 70.328 -5.209 14.864 1.00 0.00 H new ATOM 0 HE3 LYS B 101 69.817 -6.647 14.001 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 68.615 -4.691 13.233 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 67.540 -5.783 13.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 68.035 -4.390 14.800 1.00 0.00 H new TER 3266 LYS B 101