USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1034 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 12 GLN : amide:sc= 0.0596 X(o=0.06,f=-0.28) USER MOD Set 1.2: A 32 GLN :FLIP amide:sc= 0 F(o=-2.7,f=0.06) USER MOD Set 2.1: A 20 ASN : amide:sc= 0.371 K(o=0.78,f=-1.4) USER MOD Set 2.2: A 30 THR OG1 : rot 175:sc= 0.406 USER MOD Set 3.1: A 5 LYS NZ :NH3+ -171:sc= -0.206 (180deg=-0.645) USER MOD Set 3.2: A 29 GLN : amide:sc= 0.147 K(o=-0.059,f=-2.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 135:sc= 0.0592 (180deg=0) USER MOD Single : A 2 MET CE :methyl -106:sc= -0.832 (180deg=-1.78!) USER MOD Single : A 3 ASN : amide:sc= 0.168 K(o=0.17,f=-3.3!) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -1.05 K(o=-1,f=-3.1!) USER MOD Single : A 38 GLN : amide:sc=-0.00614 X(o=-0.0061,f=-0.067) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.506 USER MOD Single : A 45 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.134) USER MOD Single : A 55 MET CE :methyl 145:sc= -14.5! (180deg=-17.2!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 144:sc= -2.39! (180deg=-3.99!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.213 K(o=-0.21,f=-1.9!) USER MOD Single : A 81 MET CE :methyl 167:sc= -14.9! (180deg=-15.4!) USER MOD Single : A 82 THR OG1 : rot -168:sc= 1.25 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 176:sc= -8.07! (180deg=-8.61!) USER MOD Single : A 91 GLN : amide:sc= -0.343 K(o=-0.34,f=-2.5!) USER MOD Single : A 93 SER OG : rot 89:sc= -0.956 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.0264! USER MOD Single : A 101 HIS : no HE2:sc= -12.1! C(o=-12!,f=-12!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot -94:sc= -5.61! USER MOD Single : A 122 LYS NZ :NH3+ -131:sc= 0.422 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.169 K(o=-0.17,f=-0.94) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.272 -12.633 19.056 1.00 0.00 N ATOM 2 CA MET A 1 -2.604 -11.307 18.562 1.00 0.00 C ATOM 3 C MET A 1 -3.697 -11.377 17.494 1.00 0.00 C ATOM 4 O MET A 1 -4.096 -12.465 17.080 1.00 0.00 O ATOM 5 CB MET A 1 -1.352 -10.655 17.970 1.00 0.00 C ATOM 6 CG MET A 1 -0.691 -9.718 18.982 1.00 0.00 C ATOM 7 SD MET A 1 0.650 -10.558 19.807 1.00 0.00 S ATOM 8 CE MET A 1 0.044 -10.536 21.486 1.00 0.00 C ATOM 0 H1 MET A 1 -1.238 -12.735 19.110 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.683 -12.764 20.002 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.657 -13.351 18.409 1.00 0.00 H new ATOM 0 HA MET A 1 -2.975 -10.711 19.396 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.644 -11.427 17.667 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.618 -10.097 17.072 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.317 -8.828 18.476 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.426 -9.383 19.714 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.766 -11.025 22.140 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.097 -9.504 21.808 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.908 -11.065 21.536 1.00 0.00 H new ATOM 18 N MET A 2 -4.150 -10.204 17.078 1.00 0.00 N ATOM 19 CA MET A 2 -5.189 -10.119 16.067 1.00 0.00 C ATOM 20 C MET A 2 -4.631 -10.438 14.679 1.00 0.00 C ATOM 21 O MET A 2 -3.419 -10.561 14.506 1.00 0.00 O ATOM 22 CB MET A 2 -5.786 -8.710 16.065 1.00 0.00 C ATOM 23 CG MET A 2 -7.291 -8.751 16.337 1.00 0.00 C ATOM 24 SD MET A 2 -7.602 -9.469 17.941 1.00 0.00 S ATOM 25 CE MET A 2 -8.307 -11.034 17.449 1.00 0.00 C ATOM 0 H MET A 2 -3.816 -9.304 17.423 1.00 0.00 H new ATOM 0 HA MET A 2 -5.961 -10.850 16.305 1.00 0.00 H new ATOM 0 HB2 MET A 2 -5.293 -8.101 16.823 1.00 0.00 H new ATOM 0 HB3 MET A 2 -5.600 -8.234 15.102 1.00 0.00 H new ATOM 0 HG2 MET A 2 -7.704 -7.743 16.294 1.00 0.00 H new ATOM 0 HG3 MET A 2 -7.793 -9.334 15.565 1.00 0.00 H new ATOM 0 HE1 MET A 2 -9.382 -11.021 17.627 1.00 0.00 H new ATOM 0 HE2 MET A 2 -8.117 -11.202 16.389 1.00 0.00 H new ATOM 0 HE3 MET A 2 -7.853 -11.836 18.030 1.00 0.00 H new ATOM 35 N ASN A 3 -5.542 -10.565 13.724 1.00 0.00 N ATOM 36 CA ASN A 3 -5.155 -10.868 12.357 1.00 0.00 C ATOM 37 C ASN A 3 -5.011 -9.564 11.571 1.00 0.00 C ATOM 38 O ASN A 3 -4.988 -8.482 12.156 1.00 0.00 O ATOM 39 CB ASN A 3 -6.216 -11.724 11.662 1.00 0.00 C ATOM 40 CG ASN A 3 -5.576 -12.909 10.937 1.00 0.00 C ATOM 41 OD1 ASN A 3 -4.899 -12.764 9.932 1.00 0.00 O ATOM 42 ND2 ASN A 3 -5.825 -14.088 11.501 1.00 0.00 N ATOM 0 H ASN A 3 -6.546 -10.463 13.871 1.00 0.00 H new ATOM 0 HA ASN A 3 -4.212 -11.414 12.387 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -6.934 -12.088 12.397 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -6.771 -11.114 10.949 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -5.441 -14.940 11.092 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -6.400 -14.140 12.342 1.00 0.00 H new ATOM 49 N GLU A 4 -4.916 -9.709 10.257 1.00 0.00 N ATOM 50 CA GLU A 4 -4.775 -8.555 9.385 1.00 0.00 C ATOM 51 C GLU A 4 -3.451 -7.840 9.662 1.00 0.00 C ATOM 52 O GLU A 4 -3.026 -7.736 10.812 1.00 0.00 O ATOM 53 CB GLU A 4 -5.959 -7.599 9.544 1.00 0.00 C ATOM 54 CG GLU A 4 -5.959 -6.539 8.441 1.00 0.00 C ATOM 55 CD GLU A 4 -7.327 -6.454 7.762 1.00 0.00 C ATOM 56 OE1 GLU A 4 -7.952 -7.526 7.609 1.00 0.00 O ATOM 57 OE2 GLU A 4 -7.718 -5.320 7.411 1.00 0.00 O ATOM 0 H GLU A 4 -4.934 -10.608 9.775 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.769 -8.903 8.352 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.892 -8.162 9.513 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.911 -7.114 10.519 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.698 -5.569 8.864 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.196 -6.779 7.701 1.00 0.00 H new ATOM 64 N LYS A 5 -2.836 -7.365 8.589 1.00 0.00 N ATOM 65 CA LYS A 5 -1.569 -6.662 8.702 1.00 0.00 C ATOM 66 C LYS A 5 -1.439 -5.665 7.550 1.00 0.00 C ATOM 67 O LYS A 5 -1.851 -5.952 6.426 1.00 0.00 O ATOM 68 CB LYS A 5 -0.410 -7.657 8.788 1.00 0.00 C ATOM 69 CG LYS A 5 -0.530 -8.533 10.037 1.00 0.00 C ATOM 70 CD LYS A 5 0.696 -9.434 10.195 1.00 0.00 C ATOM 71 CE LYS A 5 1.838 -8.691 10.891 1.00 0.00 C ATOM 72 NZ LYS A 5 1.639 -8.694 12.358 1.00 0.00 N ATOM 0 H LYS A 5 -3.191 -7.453 7.637 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.534 -6.087 9.627 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.400 -8.286 7.898 1.00 0.00 H new ATOM 0 HB3 LYS A 5 0.537 -7.117 8.808 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -0.638 -7.902 10.919 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -1.429 -9.145 9.971 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.429 -10.319 10.772 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.026 -9.780 9.215 1.00 0.00 H new ATOM 0 HE2 LYS A 5 2.790 -9.163 10.646 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.888 -7.665 10.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 2.333 -8.061 12.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 0.678 -8.364 12.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.766 -9.659 12.724 1.00 0.00 H new ATOM 86 N ILE A 6 -0.865 -4.513 7.867 1.00 0.00 N ATOM 87 CA ILE A 6 -0.676 -3.472 6.872 1.00 0.00 C ATOM 88 C ILE A 6 0.589 -2.678 7.204 1.00 0.00 C ATOM 89 O ILE A 6 0.957 -2.551 8.371 1.00 0.00 O ATOM 90 CB ILE A 6 -1.933 -2.606 6.757 1.00 0.00 C ATOM 91 CG1 ILE A 6 -2.850 -3.116 5.643 1.00 0.00 C ATOM 92 CG2 ILE A 6 -1.568 -1.133 6.569 1.00 0.00 C ATOM 93 CD1 ILE A 6 -4.265 -3.366 6.169 1.00 0.00 C ATOM 0 H ILE A 6 -0.525 -4.278 8.799 1.00 0.00 H new ATOM 0 HA ILE A 6 -0.527 -3.911 5.885 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.488 -2.683 7.692 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -2.883 -2.388 4.832 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -2.445 -4.038 5.227 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -2.479 -0.540 6.490 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -0.985 -0.791 7.424 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -0.980 -1.017 5.659 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -4.896 -3.728 5.357 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -4.232 -4.112 6.963 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -4.677 -2.436 6.562 1.00 0.00 H new ATOM 105 N LEU A 7 1.219 -2.166 6.158 1.00 0.00 N ATOM 106 CA LEU A 7 2.435 -1.388 6.324 1.00 0.00 C ATOM 107 C LEU A 7 2.325 -0.096 5.512 1.00 0.00 C ATOM 108 O LEU A 7 1.719 -0.082 4.441 1.00 0.00 O ATOM 109 CB LEU A 7 3.663 -2.231 5.974 1.00 0.00 C ATOM 110 CG LEU A 7 4.866 -2.086 6.908 1.00 0.00 C ATOM 111 CD1 LEU A 7 5.001 -3.305 7.822 1.00 0.00 C ATOM 112 CD2 LEU A 7 6.147 -1.819 6.115 1.00 0.00 C ATOM 0 H LEU A 7 0.911 -2.274 5.192 1.00 0.00 H new ATOM 0 HA LEU A 7 2.562 -1.099 7.367 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.366 -3.280 5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.980 -1.973 4.963 1.00 0.00 H new ATOM 0 HG LEU A 7 4.698 -1.221 7.549 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.864 -3.176 8.475 1.00 0.00 H new ATOM 0 HD12 LEU A 7 4.100 -3.408 8.427 1.00 0.00 H new ATOM 0 HD13 LEU A 7 5.136 -4.201 7.216 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.987 -1.720 6.803 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.332 -2.649 5.433 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.036 -0.898 5.543 1.00 0.00 H new ATOM 124 N ILE A 8 2.919 0.958 6.052 1.00 0.00 N ATOM 125 CA ILE A 8 2.894 2.251 5.391 1.00 0.00 C ATOM 126 C ILE A 8 4.289 2.568 4.849 1.00 0.00 C ATOM 127 O ILE A 8 5.293 2.175 5.441 1.00 0.00 O ATOM 128 CB ILE A 8 2.342 3.324 6.332 1.00 0.00 C ATOM 129 CG1 ILE A 8 1.098 2.821 7.067 1.00 0.00 C ATOM 130 CG2 ILE A 8 2.075 4.629 5.580 1.00 0.00 C ATOM 131 CD1 ILE A 8 0.706 3.774 8.197 1.00 0.00 C ATOM 0 H ILE A 8 3.421 0.943 6.940 1.00 0.00 H new ATOM 0 HA ILE A 8 2.216 2.229 4.538 1.00 0.00 H new ATOM 0 HB ILE A 8 3.098 3.537 7.087 1.00 0.00 H new ATOM 0 HG12 ILE A 8 0.270 2.725 6.364 1.00 0.00 H new ATOM 0 HG13 ILE A 8 1.288 1.828 7.474 1.00 0.00 H new ATOM 0 HG21 ILE A 8 1.683 5.374 6.272 1.00 0.00 H new ATOM 0 HG22 ILE A 8 3.004 4.993 5.142 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.347 4.451 4.789 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.181 3.393 8.703 1.00 0.00 H new ATOM 0 HD12 ILE A 8 1.527 3.849 8.911 1.00 0.00 H new ATOM 0 HD13 ILE A 8 0.493 4.760 7.784 1.00 0.00 H new ATOM 143 N VAL A 9 4.307 3.276 3.729 1.00 0.00 N ATOM 144 CA VAL A 9 5.562 3.650 3.100 1.00 0.00 C ATOM 145 C VAL A 9 5.376 4.966 2.342 1.00 0.00 C ATOM 146 O VAL A 9 4.483 5.083 1.504 1.00 0.00 O ATOM 147 CB VAL A 9 6.060 2.512 2.207 1.00 0.00 C ATOM 148 CG1 VAL A 9 7.538 2.696 1.857 1.00 0.00 C ATOM 149 CG2 VAL A 9 5.818 1.152 2.866 1.00 0.00 C ATOM 0 H VAL A 9 3.472 3.600 3.241 1.00 0.00 H new ATOM 0 HA VAL A 9 6.332 3.815 3.854 1.00 0.00 H new ATOM 0 HB VAL A 9 5.490 2.541 1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.867 1.874 1.222 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.672 3.639 1.328 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.130 2.706 2.772 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.181 0.360 2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.350 1.108 3.817 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.751 1.017 3.041 1.00 0.00 H new ATOM 159 N ASP A 10 6.233 5.924 2.664 1.00 0.00 N ATOM 160 CA ASP A 10 6.174 7.227 2.025 1.00 0.00 C ATOM 161 C ASP A 10 4.722 7.710 1.993 1.00 0.00 C ATOM 162 O ASP A 10 3.843 7.081 2.580 1.00 0.00 O ATOM 163 CB ASP A 10 6.680 7.157 0.582 1.00 0.00 C ATOM 164 CG ASP A 10 7.268 8.460 0.039 1.00 0.00 C ATOM 165 OD1 ASP A 10 8.367 8.826 0.508 1.00 0.00 O ATOM 166 OD2 ASP A 10 6.606 9.061 -0.834 1.00 0.00 O ATOM 0 H ASP A 10 6.972 5.823 3.360 1.00 0.00 H new ATOM 0 HA ASP A 10 6.803 7.910 2.595 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.440 6.378 0.517 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.855 6.852 -0.062 1.00 0.00 H new ATOM 171 N ASP A 11 4.517 8.822 1.303 1.00 0.00 N ATOM 172 CA ASP A 11 3.187 9.396 1.188 1.00 0.00 C ATOM 173 C ASP A 11 2.667 9.752 2.582 1.00 0.00 C ATOM 174 O ASP A 11 1.484 10.042 2.752 1.00 0.00 O ATOM 175 CB ASP A 11 2.210 8.401 0.559 1.00 0.00 C ATOM 176 CG ASP A 11 1.027 9.033 -0.177 1.00 0.00 C ATOM 177 OD1 ASP A 11 1.288 9.941 -0.996 1.00 0.00 O ATOM 178 OD2 ASP A 11 -0.111 8.594 0.095 1.00 0.00 O ATOM 0 H ASP A 11 5.249 9.341 0.818 1.00 0.00 H new ATOM 0 HA ASP A 11 3.256 10.282 0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.758 7.770 -0.140 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.824 7.749 1.343 1.00 0.00 H new ATOM 183 N GLN A 12 3.577 9.719 3.544 1.00 0.00 N ATOM 184 CA GLN A 12 3.225 10.034 4.918 1.00 0.00 C ATOM 185 C GLN A 12 3.044 11.544 5.087 1.00 0.00 C ATOM 186 O GLN A 12 4.005 12.304 4.980 1.00 0.00 O ATOM 187 CB GLN A 12 4.277 9.496 5.891 1.00 0.00 C ATOM 188 CG GLN A 12 5.691 9.799 5.391 1.00 0.00 C ATOM 189 CD GLN A 12 6.577 10.310 6.530 1.00 0.00 C ATOM 190 OE1 GLN A 12 7.556 9.691 6.915 1.00 0.00 O ATOM 191 NE2 GLN A 12 6.181 11.470 7.045 1.00 0.00 N ATOM 0 H GLN A 12 4.558 9.479 3.399 1.00 0.00 H new ATOM 0 HA GLN A 12 2.279 9.546 5.151 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.131 9.944 6.874 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.152 8.420 6.009 1.00 0.00 H new ATOM 0 HG2 GLN A 12 6.129 8.899 4.960 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.648 10.544 4.596 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.352 11.935 6.676 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.706 11.894 7.809 1.00 0.00 H new ATOM 200 N TYR A 13 1.805 11.933 5.347 1.00 0.00 N ATOM 201 CA TYR A 13 1.485 13.339 5.531 1.00 0.00 C ATOM 202 C TYR A 13 0.271 13.510 6.447 1.00 0.00 C ATOM 203 O TYR A 13 -0.452 14.500 6.347 1.00 0.00 O ATOM 204 CB TYR A 13 1.140 13.878 4.141 1.00 0.00 C ATOM 205 CG TYR A 13 1.777 15.233 3.824 1.00 0.00 C ATOM 206 CD1 TYR A 13 1.267 16.384 4.388 1.00 0.00 C ATOM 207 CD2 TYR A 13 2.862 15.303 2.973 1.00 0.00 C ATOM 208 CE1 TYR A 13 1.867 17.659 4.089 1.00 0.00 C ATOM 209 CE2 TYR A 13 3.462 16.577 2.675 1.00 0.00 C ATOM 210 CZ TYR A 13 2.935 17.693 3.247 1.00 0.00 C ATOM 211 OH TYR A 13 3.501 18.897 2.965 1.00 0.00 O ATOM 0 H TYR A 13 1.010 11.300 5.435 1.00 0.00 H new ATOM 0 HA TYR A 13 2.322 13.866 5.988 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.459 13.154 3.392 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.057 13.968 4.056 1.00 0.00 H new ATOM 0 HD1 TYR A 13 0.418 16.329 5.053 1.00 0.00 H new ATOM 0 HD2 TYR A 13 3.261 14.402 2.531 1.00 0.00 H new ATOM 0 HE1 TYR A 13 1.478 18.568 4.524 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.312 16.645 2.012 1.00 0.00 H new ATOM 0 HH TYR A 13 4.254 18.769 2.351 1.00 0.00 H new ATOM 221 N GLY A 14 0.085 12.530 7.318 1.00 0.00 N ATOM 222 CA GLY A 14 -1.029 12.559 8.251 1.00 0.00 C ATOM 223 C GLY A 14 -2.137 11.601 7.812 1.00 0.00 C ATOM 224 O GLY A 14 -3.127 11.424 8.521 1.00 0.00 O ATOM 0 H GLY A 14 0.687 11.710 7.398 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -0.681 12.286 9.247 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -1.425 13.572 8.319 1.00 0.00 H new ATOM 228 N ILE A 15 -1.935 11.007 6.645 1.00 0.00 N ATOM 229 CA ILE A 15 -2.905 10.071 6.102 1.00 0.00 C ATOM 230 C ILE A 15 -2.572 8.659 6.589 1.00 0.00 C ATOM 231 O ILE A 15 -3.470 7.875 6.889 1.00 0.00 O ATOM 232 CB ILE A 15 -2.976 10.196 4.579 1.00 0.00 C ATOM 233 CG1 ILE A 15 -3.480 11.580 4.165 1.00 0.00 C ATOM 234 CG2 ILE A 15 -3.823 9.073 3.976 1.00 0.00 C ATOM 235 CD1 ILE A 15 -2.583 12.189 3.085 1.00 0.00 C ATOM 0 H ILE A 15 -1.113 11.156 6.060 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.906 10.306 6.464 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.967 10.089 4.180 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.502 11.503 3.793 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.506 12.237 5.034 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.857 9.185 2.892 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.381 8.109 4.227 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.835 9.124 4.378 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.963 13.172 2.808 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.567 12.287 3.468 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.579 11.542 2.208 1.00 0.00 H new ATOM 247 N ARG A 16 -1.279 8.379 6.652 1.00 0.00 N ATOM 248 CA ARG A 16 -0.816 7.075 7.097 1.00 0.00 C ATOM 249 C ARG A 16 -1.474 6.705 8.428 1.00 0.00 C ATOM 250 O ARG A 16 -1.809 5.543 8.657 1.00 0.00 O ATOM 251 CB ARG A 16 0.704 7.059 7.266 1.00 0.00 C ATOM 252 CG ARG A 16 1.197 8.350 7.922 1.00 0.00 C ATOM 253 CD ARG A 16 2.590 8.160 8.527 1.00 0.00 C ATOM 254 NE ARG A 16 2.478 7.867 9.973 1.00 0.00 N ATOM 255 CZ ARG A 16 2.424 8.805 10.928 1.00 0.00 C ATOM 256 NH1 ARG A 16 2.470 10.103 10.596 1.00 0.00 N ATOM 257 NH2 ARG A 16 2.322 8.447 12.215 1.00 0.00 N ATOM 0 H ARG A 16 -0.537 9.033 6.402 1.00 0.00 H new ATOM 0 HA ARG A 16 -1.093 6.346 6.335 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.997 6.203 7.874 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.180 6.936 6.293 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.224 9.151 7.183 1.00 0.00 H new ATOM 0 HG3 ARG A 16 0.498 8.657 8.700 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.107 7.344 8.021 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.187 9.059 8.375 1.00 0.00 H new ATOM 0 HE ARG A 16 2.439 6.889 10.261 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.546 10.376 9.616 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.429 10.817 11.323 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.285 7.460 12.468 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.281 9.162 12.941 1.00 0.00 H new ATOM 271 N ILE A 17 -1.641 7.713 9.270 1.00 0.00 N ATOM 272 CA ILE A 17 -2.254 7.508 10.572 1.00 0.00 C ATOM 273 C ILE A 17 -3.742 7.203 10.388 1.00 0.00 C ATOM 274 O ILE A 17 -4.268 6.272 10.995 1.00 0.00 O ATOM 275 CB ILE A 17 -1.979 8.702 11.488 1.00 0.00 C ATOM 276 CG1 ILE A 17 -0.475 8.935 11.649 1.00 0.00 C ATOM 277 CG2 ILE A 17 -2.680 8.532 12.837 1.00 0.00 C ATOM 278 CD1 ILE A 17 -0.178 10.404 11.956 1.00 0.00 C ATOM 0 H ILE A 17 -1.363 8.675 9.077 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.811 6.646 11.070 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.395 9.594 11.020 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.090 8.307 12.452 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.042 8.639 10.737 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.468 9.395 13.469 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -3.756 8.453 12.681 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.317 7.627 13.324 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.898 10.543 12.066 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -0.543 11.027 11.140 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.677 10.690 12.882 1.00 0.00 H new ATOM 290 N LEU A 18 -4.378 8.007 9.549 1.00 0.00 N ATOM 291 CA LEU A 18 -5.795 7.834 9.278 1.00 0.00 C ATOM 292 C LEU A 18 -6.100 6.345 9.105 1.00 0.00 C ATOM 293 O LEU A 18 -6.951 5.797 9.805 1.00 0.00 O ATOM 294 CB LEU A 18 -6.220 8.691 8.083 1.00 0.00 C ATOM 295 CG LEU A 18 -7.697 9.087 8.034 1.00 0.00 C ATOM 296 CD1 LEU A 18 -7.969 10.303 8.922 1.00 0.00 C ATOM 297 CD2 LEU A 18 -8.155 9.317 6.592 1.00 0.00 C ATOM 0 H LEU A 18 -3.939 8.779 9.048 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.389 8.185 10.122 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.620 9.601 8.082 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.979 8.149 7.168 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.285 8.260 8.432 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.026 10.563 8.869 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.705 10.067 9.953 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.370 11.146 8.578 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.208 9.597 6.585 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.564 10.117 6.146 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.020 8.401 6.017 1.00 0.00 H new ATOM 309 N LEU A 19 -5.388 5.732 8.171 1.00 0.00 N ATOM 310 CA LEU A 19 -5.572 4.317 7.898 1.00 0.00 C ATOM 311 C LEU A 19 -4.981 3.499 9.048 1.00 0.00 C ATOM 312 O LEU A 19 -5.388 2.362 9.279 1.00 0.00 O ATOM 313 CB LEU A 19 -4.996 3.956 6.527 1.00 0.00 C ATOM 314 CG LEU A 19 -3.507 4.247 6.328 1.00 0.00 C ATOM 315 CD1 LEU A 19 -2.663 3.003 6.613 1.00 0.00 C ATOM 316 CD2 LEU A 19 -3.240 4.813 4.932 1.00 0.00 C ATOM 0 H LEU A 19 -4.682 6.190 7.594 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.633 4.074 7.846 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.165 2.893 6.352 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.557 4.497 5.765 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.209 5.010 7.047 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.609 3.237 6.464 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.822 2.684 7.643 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.956 2.201 5.935 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.174 5.011 4.817 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.558 4.091 4.180 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.797 5.741 4.803 1.00 0.00 H new ATOM 328 N ASN A 20 -4.030 4.111 9.739 1.00 0.00 N ATOM 329 CA ASN A 20 -3.379 3.454 10.859 1.00 0.00 C ATOM 330 C ASN A 20 -4.407 3.197 11.962 1.00 0.00 C ATOM 331 O ASN A 20 -4.640 2.051 12.344 1.00 0.00 O ATOM 332 CB ASN A 20 -2.269 4.331 11.443 1.00 0.00 C ATOM 333 CG ASN A 20 -1.395 3.535 12.414 1.00 0.00 C ATOM 334 OD1 ASN A 20 -1.533 2.333 12.572 1.00 0.00 O ATOM 335 ND2 ASN A 20 -0.489 4.270 13.053 1.00 0.00 N ATOM 0 H ASN A 20 -3.695 5.055 9.545 1.00 0.00 H new ATOM 0 HA ASN A 20 -2.949 2.520 10.498 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -1.653 4.729 10.637 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -2.709 5.184 11.960 1.00 0.00 H new ATOM 0 HD21 ASN A 20 0.144 3.831 13.722 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -0.427 5.272 12.874 1.00 0.00 H new ATOM 342 N GLU A 21 -4.995 4.282 12.443 1.00 0.00 N ATOM 343 CA GLU A 21 -5.994 4.188 13.495 1.00 0.00 C ATOM 344 C GLU A 21 -7.115 3.235 13.079 1.00 0.00 C ATOM 345 O GLU A 21 -7.813 2.683 13.928 1.00 0.00 O ATOM 346 CB GLU A 21 -6.551 5.569 13.847 1.00 0.00 C ATOM 347 CG GLU A 21 -7.417 5.506 15.107 1.00 0.00 C ATOM 348 CD GLU A 21 -7.331 6.814 15.897 1.00 0.00 C ATOM 349 OE1 GLU A 21 -8.066 7.753 15.521 1.00 0.00 O ATOM 350 OE2 GLU A 21 -6.533 6.845 16.858 1.00 0.00 O ATOM 0 H GLU A 21 -4.799 5.231 12.124 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.516 3.787 14.388 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.729 6.268 14.001 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.142 5.950 13.014 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.453 5.311 14.831 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.093 4.676 15.735 1.00 0.00 H new ATOM 357 N VAL A 22 -7.254 3.070 11.771 1.00 0.00 N ATOM 358 CA VAL A 22 -8.279 2.192 11.232 1.00 0.00 C ATOM 359 C VAL A 22 -7.879 0.736 11.480 1.00 0.00 C ATOM 360 O VAL A 22 -8.613 -0.011 12.125 1.00 0.00 O ATOM 361 CB VAL A 22 -8.510 2.505 9.752 1.00 0.00 C ATOM 362 CG1 VAL A 22 -9.074 1.288 9.016 1.00 0.00 C ATOM 363 CG2 VAL A 22 -9.425 3.720 9.585 1.00 0.00 C ATOM 0 H VAL A 22 -6.674 3.530 11.069 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.230 2.358 11.738 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.546 2.748 9.306 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -9.229 1.537 7.966 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -8.371 0.459 9.092 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.025 1.000 9.465 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -9.573 3.921 8.524 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.388 3.517 10.054 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.967 4.588 10.058 1.00 0.00 H new ATOM 373 N PHE A 23 -6.717 0.377 10.954 1.00 0.00 N ATOM 374 CA PHE A 23 -6.212 -0.976 11.110 1.00 0.00 C ATOM 375 C PHE A 23 -5.824 -1.252 12.564 1.00 0.00 C ATOM 376 O PHE A 23 -6.036 -2.354 13.069 1.00 0.00 O ATOM 377 CB PHE A 23 -4.965 -1.092 10.231 1.00 0.00 C ATOM 378 CG PHE A 23 -5.255 -1.033 8.729 1.00 0.00 C ATOM 379 CD1 PHE A 23 -6.261 -1.780 8.201 1.00 0.00 C ATOM 380 CD2 PHE A 23 -4.506 -0.234 7.923 1.00 0.00 C ATOM 381 CE1 PHE A 23 -6.529 -1.725 6.808 1.00 0.00 C ATOM 382 CE2 PHE A 23 -4.774 -0.179 6.530 1.00 0.00 C ATOM 383 CZ PHE A 23 -5.781 -0.926 6.002 1.00 0.00 C ATOM 0 H PHE A 23 -6.111 1.000 10.420 1.00 0.00 H new ATOM 0 HA PHE A 23 -6.980 -1.695 10.824 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.275 -0.289 10.489 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.460 -2.031 10.457 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -6.856 -2.415 8.841 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -3.707 0.359 8.343 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -7.328 -2.318 6.388 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -4.179 0.455 5.890 1.00 0.00 H new ATOM 0 HZ PHE A 23 -5.986 -0.884 4.942 1.00 0.00 H new ATOM 393 N ASN A 24 -5.261 -0.233 13.196 1.00 0.00 N ATOM 394 CA ASN A 24 -4.841 -0.352 14.582 1.00 0.00 C ATOM 395 C ASN A 24 -6.071 -0.561 15.467 1.00 0.00 C ATOM 396 O ASN A 24 -6.015 -1.296 16.452 1.00 0.00 O ATOM 397 CB ASN A 24 -4.130 0.918 15.053 1.00 0.00 C ATOM 398 CG ASN A 24 -3.043 0.590 16.079 1.00 0.00 C ATOM 399 OD1 ASN A 24 -1.894 0.349 15.748 1.00 0.00 O ATOM 400 ND2 ASN A 24 -3.469 0.593 17.339 1.00 0.00 N ATOM 0 H ASN A 24 -5.086 0.679 12.774 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.156 -1.197 14.655 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.686 1.429 14.198 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.855 1.603 15.492 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -2.819 0.385 18.097 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.445 0.803 17.547 1.00 0.00 H new ATOM 407 N LYS A 25 -7.155 0.100 15.085 1.00 0.00 N ATOM 408 CA LYS A 25 -8.397 -0.004 15.832 1.00 0.00 C ATOM 409 C LYS A 25 -8.752 -1.481 16.020 1.00 0.00 C ATOM 410 O LYS A 25 -9.508 -1.831 16.924 1.00 0.00 O ATOM 411 CB LYS A 25 -9.499 0.812 15.154 1.00 0.00 C ATOM 412 CG LYS A 25 -9.752 2.121 15.904 1.00 0.00 C ATOM 413 CD LYS A 25 -10.958 2.862 15.323 1.00 0.00 C ATOM 414 CE LYS A 25 -11.271 4.121 16.134 1.00 0.00 C ATOM 415 NZ LYS A 25 -12.483 4.788 15.609 1.00 0.00 N ATOM 0 H LYS A 25 -7.198 0.709 14.268 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.281 0.425 16.827 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.215 1.028 14.124 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.418 0.227 15.116 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.923 1.912 16.960 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.868 2.755 15.844 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.758 3.133 14.286 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.826 2.203 15.318 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.418 3.859 17.182 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.425 4.807 16.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.681 5.640 16.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.329 5.056 14.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.292 4.137 15.671 1.00 0.00 H new ATOM 429 N GLU A 26 -8.189 -2.307 15.150 1.00 0.00 N ATOM 430 CA GLU A 26 -8.437 -3.737 15.209 1.00 0.00 C ATOM 431 C GLU A 26 -7.323 -4.437 15.991 1.00 0.00 C ATOM 432 O GLU A 26 -7.516 -5.540 16.501 1.00 0.00 O ATOM 433 CB GLU A 26 -8.575 -4.328 13.804 1.00 0.00 C ATOM 434 CG GLU A 26 -9.680 -3.620 13.018 1.00 0.00 C ATOM 435 CD GLU A 26 -11.056 -3.918 13.616 1.00 0.00 C ATOM 436 OE1 GLU A 26 -11.341 -3.355 14.695 1.00 0.00 O ATOM 437 OE2 GLU A 26 -11.793 -4.703 12.980 1.00 0.00 O ATOM 0 H GLU A 26 -7.562 -2.013 14.401 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.380 -3.901 15.731 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.628 -4.235 13.272 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.798 -5.393 13.874 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.503 -2.545 13.023 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.654 -3.942 11.977 1.00 0.00 H new ATOM 444 N GLY A 27 -6.182 -3.768 16.061 1.00 0.00 N ATOM 445 CA GLY A 27 -5.038 -4.311 16.772 1.00 0.00 C ATOM 446 C GLY A 27 -3.989 -4.846 15.795 1.00 0.00 C ATOM 447 O GLY A 27 -2.981 -5.416 16.211 1.00 0.00 O ATOM 0 H GLY A 27 -6.025 -2.854 15.636 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.595 -3.538 17.400 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.364 -5.112 17.435 1.00 0.00 H new ATOM 451 N TYR A 28 -4.262 -4.644 14.514 1.00 0.00 N ATOM 452 CA TYR A 28 -3.354 -5.099 13.475 1.00 0.00 C ATOM 453 C TYR A 28 -2.017 -4.360 13.552 1.00 0.00 C ATOM 454 O TYR A 28 -1.981 -3.160 13.823 1.00 0.00 O ATOM 455 CB TYR A 28 -4.033 -4.762 12.145 1.00 0.00 C ATOM 456 CG TYR A 28 -5.458 -5.305 12.019 1.00 0.00 C ATOM 457 CD1 TYR A 28 -5.914 -6.257 12.907 1.00 0.00 C ATOM 458 CD2 TYR A 28 -6.286 -4.842 11.017 1.00 0.00 C ATOM 459 CE1 TYR A 28 -7.256 -6.768 12.789 1.00 0.00 C ATOM 460 CE2 TYR A 28 -7.627 -5.353 10.898 1.00 0.00 C ATOM 461 CZ TYR A 28 -8.046 -6.291 11.790 1.00 0.00 C ATOM 462 OH TYR A 28 -9.312 -6.773 11.678 1.00 0.00 O ATOM 0 H TYR A 28 -5.099 -4.171 14.172 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.150 -6.164 13.583 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.056 -3.679 12.025 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.430 -5.161 11.329 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -5.265 -6.619 13.691 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -5.928 -4.097 10.322 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -7.626 -7.513 13.478 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -8.285 -5.000 10.118 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.761 -6.342 10.921 1.00 0.00 H new ATOM 472 N GLN A 29 -0.949 -5.106 13.310 1.00 0.00 N ATOM 473 CA GLN A 29 0.387 -4.537 13.349 1.00 0.00 C ATOM 474 C GLN A 29 0.631 -3.671 12.112 1.00 0.00 C ATOM 475 O GLN A 29 0.326 -4.080 10.993 1.00 0.00 O ATOM 476 CB GLN A 29 1.447 -5.634 13.469 1.00 0.00 C ATOM 477 CG GLN A 29 2.389 -5.359 14.642 1.00 0.00 C ATOM 478 CD GLN A 29 3.000 -6.659 15.170 1.00 0.00 C ATOM 479 OE1 GLN A 29 3.604 -7.431 14.444 1.00 0.00 O ATOM 480 NE2 GLN A 29 2.809 -6.857 16.472 1.00 0.00 N ATOM 0 H GLN A 29 -0.982 -6.101 13.086 1.00 0.00 H new ATOM 0 HA GLN A 29 0.466 -3.904 14.233 1.00 0.00 H new ATOM 0 HB2 GLN A 29 0.962 -6.600 13.606 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.020 -5.694 12.544 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.183 -4.682 14.325 1.00 0.00 H new ATOM 0 HG3 GLN A 29 1.843 -4.858 15.442 1.00 0.00 H new ATOM 0 HE21 GLN A 29 2.294 -6.170 17.022 1.00 0.00 H new ATOM 0 HE22 GLN A 29 3.178 -7.696 16.920 1.00 0.00 H new ATOM 489 N THR A 30 1.179 -2.489 12.355 1.00 0.00 N ATOM 490 CA THR A 30 1.468 -1.562 11.274 1.00 0.00 C ATOM 491 C THR A 30 2.891 -1.016 11.406 1.00 0.00 C ATOM 492 O THR A 30 3.415 -0.897 12.513 1.00 0.00 O ATOM 493 CB THR A 30 0.395 -0.471 11.287 1.00 0.00 C ATOM 494 OG1 THR A 30 0.409 0.013 12.628 1.00 0.00 O ATOM 495 CG2 THR A 30 -1.016 -1.036 11.109 1.00 0.00 C ATOM 0 H THR A 30 1.430 -2.152 13.284 1.00 0.00 H new ATOM 0 HA THR A 30 1.433 -2.061 10.305 1.00 0.00 H new ATOM 0 HB THR A 30 0.600 0.250 10.495 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.199 0.778 12.706 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.739 -0.221 11.126 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.081 -1.559 10.155 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.234 -1.731 11.920 1.00 0.00 H new ATOM 503 N PHE A 31 3.477 -0.698 10.261 1.00 0.00 N ATOM 504 CA PHE A 31 4.830 -0.167 10.234 1.00 0.00 C ATOM 505 C PHE A 31 4.983 0.889 9.137 1.00 0.00 C ATOM 506 O PHE A 31 4.155 0.973 8.232 1.00 0.00 O ATOM 507 CB PHE A 31 5.764 -1.340 9.931 1.00 0.00 C ATOM 508 CG PHE A 31 6.941 -1.464 10.901 1.00 0.00 C ATOM 509 CD1 PHE A 31 6.769 -2.074 12.104 1.00 0.00 C ATOM 510 CD2 PHE A 31 8.160 -0.965 10.560 1.00 0.00 C ATOM 511 CE1 PHE A 31 7.861 -2.190 13.005 1.00 0.00 C ATOM 512 CE2 PHE A 31 9.252 -1.081 11.460 1.00 0.00 C ATOM 513 CZ PHE A 31 9.079 -1.691 12.663 1.00 0.00 C ATOM 0 H PHE A 31 3.040 -0.798 9.345 1.00 0.00 H new ATOM 0 HA PHE A 31 5.065 0.304 11.189 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.188 -2.265 9.954 1.00 0.00 H new ATOM 0 HB3 PHE A 31 6.151 -1.231 8.918 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.802 -2.471 12.375 1.00 0.00 H new ATOM 0 HD2 PHE A 31 8.297 -0.481 9.605 1.00 0.00 H new ATOM 0 HE1 PHE A 31 7.724 -2.674 13.961 1.00 0.00 H new ATOM 0 HE2 PHE A 31 10.220 -0.685 11.189 1.00 0.00 H new ATOM 0 HZ PHE A 31 9.910 -1.779 13.348 1.00 0.00 H new ATOM 523 N GLN A 32 6.048 1.667 9.255 1.00 0.00 N ATOM 524 CA GLN A 32 6.321 2.714 8.285 1.00 0.00 C ATOM 525 C GLN A 32 7.728 2.550 7.708 1.00 0.00 C ATOM 526 O GLN A 32 8.663 2.209 8.430 1.00 0.00 O ATOM 527 CB GLN A 32 6.143 4.100 8.909 1.00 0.00 C ATOM 528 CG GLN A 32 7.054 5.127 8.233 1.00 0.00 C ATOM 529 CD GLN A 32 6.462 6.534 8.331 1.00 0.00 C ATOM 530 OE1 GLN A 32 6.348 7.156 7.161 1.00 0.00 O flip ATOM 531 NE2 GLN A 32 6.130 7.023 9.399 1.00 0.00 N flip ATOM 0 H GLN A 32 6.733 1.594 10.008 1.00 0.00 H new ATOM 0 HA GLN A 32 5.602 2.623 7.470 1.00 0.00 H new ATOM 0 HB2 GLN A 32 5.103 4.414 8.816 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.368 4.055 9.975 1.00 0.00 H new ATOM 0 HG2 GLN A 32 8.038 5.109 8.701 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.195 4.860 7.186 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.245 6.490 10.261 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.738 7.964 9.429 1.00 0.00 H new ATOM 540 N ALA A 33 7.835 2.800 6.411 1.00 0.00 N ATOM 541 CA ALA A 33 9.112 2.684 5.729 1.00 0.00 C ATOM 542 C ALA A 33 9.413 3.991 4.993 1.00 0.00 C ATOM 543 O ALA A 33 8.533 4.835 4.835 1.00 0.00 O ATOM 544 CB ALA A 33 9.080 1.479 4.786 1.00 0.00 C ATOM 0 H ALA A 33 7.057 3.083 5.815 1.00 0.00 H new ATOM 0 HA ALA A 33 9.916 2.516 6.446 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.038 1.392 4.274 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.892 0.572 5.361 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.287 1.613 4.051 1.00 0.00 H new ATOM 550 N ALA A 34 10.660 4.117 4.563 1.00 0.00 N ATOM 551 CA ALA A 34 11.088 5.307 3.848 1.00 0.00 C ATOM 552 C ALA A 34 11.677 4.901 2.496 1.00 0.00 C ATOM 553 O ALA A 34 12.701 5.436 2.074 1.00 0.00 O ATOM 554 CB ALA A 34 12.086 6.088 4.707 1.00 0.00 C ATOM 0 H ALA A 34 11.387 3.415 4.696 1.00 0.00 H new ATOM 0 HA ALA A 34 10.240 5.963 3.654 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.407 6.981 4.171 1.00 0.00 H new ATOM 0 HB2 ALA A 34 11.610 6.379 5.644 1.00 0.00 H new ATOM 0 HB3 ALA A 34 12.952 5.461 4.919 1.00 0.00 H new ATOM 560 N ASN A 35 11.004 3.958 1.853 1.00 0.00 N ATOM 561 CA ASN A 35 11.447 3.473 0.557 1.00 0.00 C ATOM 562 C ASN A 35 10.866 2.079 0.313 1.00 0.00 C ATOM 563 O ASN A 35 10.107 1.566 1.134 1.00 0.00 O ATOM 564 CB ASN A 35 12.972 3.366 0.501 1.00 0.00 C ATOM 565 CG ASN A 35 13.567 4.471 -0.374 1.00 0.00 C ATOM 566 OD1 ASN A 35 12.911 5.434 -0.735 1.00 0.00 O ATOM 567 ND2 ASN A 35 14.844 4.280 -0.693 1.00 0.00 N ATOM 0 H ASN A 35 10.155 3.517 2.206 1.00 0.00 H new ATOM 0 HA ASN A 35 11.107 4.178 -0.201 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.382 3.434 1.509 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.258 2.391 0.106 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.332 4.962 -1.273 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.335 3.451 -0.357 1.00 0.00 H new ATOM 574 N GLY A 36 11.245 1.505 -0.819 1.00 0.00 N ATOM 575 CA GLY A 36 10.771 0.180 -1.182 1.00 0.00 C ATOM 576 C GLY A 36 11.697 -0.904 -0.626 1.00 0.00 C ATOM 577 O GLY A 36 11.231 -1.935 -0.143 1.00 0.00 O ATOM 0 H GLY A 36 11.875 1.933 -1.497 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.761 0.033 -0.798 1.00 0.00 H new ATOM 0 HA3 GLY A 36 10.715 0.094 -2.267 1.00 0.00 H new ATOM 581 N LEU A 37 12.991 -0.635 -0.714 1.00 0.00 N ATOM 582 CA LEU A 37 13.986 -1.575 -0.226 1.00 0.00 C ATOM 583 C LEU A 37 13.692 -1.906 1.239 1.00 0.00 C ATOM 584 O LEU A 37 13.584 -3.076 1.605 1.00 0.00 O ATOM 585 CB LEU A 37 15.397 -1.032 -0.462 1.00 0.00 C ATOM 586 CG LEU A 37 16.339 -1.940 -1.256 1.00 0.00 C ATOM 587 CD1 LEU A 37 17.398 -1.118 -1.994 1.00 0.00 C ATOM 588 CD2 LEU A 37 16.966 -3.003 -0.352 1.00 0.00 C ATOM 0 H LEU A 37 13.374 0.221 -1.116 1.00 0.00 H new ATOM 0 HA LEU A 37 13.932 -2.511 -0.783 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.316 -0.079 -0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.853 -0.826 0.506 1.00 0.00 H new ATOM 0 HG LEU A 37 15.754 -2.464 -2.011 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.055 -1.787 -2.551 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.909 -0.431 -2.685 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.985 -0.550 -1.273 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.631 -3.635 -0.941 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.535 -2.517 0.441 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.180 -3.615 0.089 1.00 0.00 H new ATOM 600 N GLN A 38 13.572 -0.856 2.038 1.00 0.00 N ATOM 601 CA GLN A 38 13.293 -1.021 3.454 1.00 0.00 C ATOM 602 C GLN A 38 11.941 -1.711 3.652 1.00 0.00 C ATOM 603 O GLN A 38 11.714 -2.356 4.674 1.00 0.00 O ATOM 604 CB GLN A 38 13.334 0.324 4.182 1.00 0.00 C ATOM 605 CG GLN A 38 14.701 0.554 4.830 1.00 0.00 C ATOM 606 CD GLN A 38 15.038 2.046 4.882 1.00 0.00 C ATOM 607 OE1 GLN A 38 15.093 2.732 3.875 1.00 0.00 O ATOM 608 NE2 GLN A 38 15.260 2.508 6.110 1.00 0.00 N ATOM 0 H GLN A 38 13.663 0.113 1.731 1.00 0.00 H new ATOM 0 HA GLN A 38 14.069 -1.654 3.885 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.121 1.129 3.479 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.556 0.353 4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.703 0.141 5.839 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.469 0.023 4.267 1.00 0.00 H new ATOM 0 HE21 GLN A 38 15.198 1.879 6.911 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.492 3.491 6.251 1.00 0.00 H new ATOM 617 N ALA A 39 11.080 -1.550 2.658 1.00 0.00 N ATOM 618 CA ALA A 39 9.757 -2.148 2.711 1.00 0.00 C ATOM 619 C ALA A 39 9.837 -3.595 2.219 1.00 0.00 C ATOM 620 O ALA A 39 9.015 -4.429 2.597 1.00 0.00 O ATOM 621 CB ALA A 39 8.782 -1.305 1.886 1.00 0.00 C ATOM 0 H ALA A 39 11.273 -1.014 1.812 1.00 0.00 H new ATOM 0 HA ALA A 39 9.385 -2.167 3.735 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.789 -1.754 1.926 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.740 -0.295 2.293 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.121 -1.265 0.851 1.00 0.00 H new ATOM 627 N LEU A 40 10.833 -3.849 1.384 1.00 0.00 N ATOM 628 CA LEU A 40 11.031 -5.180 0.837 1.00 0.00 C ATOM 629 C LEU A 40 11.323 -6.157 1.978 1.00 0.00 C ATOM 630 O LEU A 40 10.824 -7.281 1.980 1.00 0.00 O ATOM 631 CB LEU A 40 12.111 -5.160 -0.246 1.00 0.00 C ATOM 632 CG LEU A 40 11.648 -4.756 -1.647 1.00 0.00 C ATOM 633 CD1 LEU A 40 12.761 -4.971 -2.675 1.00 0.00 C ATOM 634 CD2 LEU A 40 10.362 -5.490 -2.032 1.00 0.00 C ATOM 0 H LEU A 40 11.512 -3.155 1.073 1.00 0.00 H new ATOM 0 HA LEU A 40 10.124 -5.527 0.343 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.899 -4.474 0.067 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.557 -6.153 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 40 11.420 -3.690 -1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.406 -4.676 -3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.627 -4.367 -2.405 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.044 -6.024 -2.690 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.054 -5.185 -3.032 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.539 -6.565 -2.019 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.575 -5.243 -1.319 1.00 0.00 H new ATOM 646 N ASP A 41 12.130 -5.693 2.921 1.00 0.00 N ATOM 647 CA ASP A 41 12.494 -6.512 4.064 1.00 0.00 C ATOM 648 C ASP A 41 11.318 -6.566 5.042 1.00 0.00 C ATOM 649 O ASP A 41 10.852 -7.648 5.397 1.00 0.00 O ATOM 650 CB ASP A 41 13.696 -5.921 4.804 1.00 0.00 C ATOM 651 CG ASP A 41 14.639 -6.951 5.431 1.00 0.00 C ATOM 652 OD1 ASP A 41 14.247 -7.516 6.475 1.00 0.00 O ATOM 653 OD2 ASP A 41 15.729 -7.148 4.854 1.00 0.00 O ATOM 0 H ASP A 41 12.542 -4.760 2.917 1.00 0.00 H new ATOM 0 HA ASP A 41 12.748 -7.507 3.699 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.266 -5.305 4.108 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.331 -5.259 5.589 1.00 0.00 H new ATOM 658 N ILE A 42 10.873 -5.387 5.448 1.00 0.00 N ATOM 659 CA ILE A 42 9.760 -5.287 6.377 1.00 0.00 C ATOM 660 C ILE A 42 8.533 -5.971 5.772 1.00 0.00 C ATOM 661 O ILE A 42 7.634 -6.395 6.497 1.00 0.00 O ATOM 662 CB ILE A 42 9.520 -3.828 6.770 1.00 0.00 C ATOM 663 CG1 ILE A 42 10.716 -3.262 7.538 1.00 0.00 C ATOM 664 CG2 ILE A 42 8.214 -3.679 7.554 1.00 0.00 C ATOM 665 CD1 ILE A 42 10.257 -2.467 8.761 1.00 0.00 C ATOM 0 H ILE A 42 11.263 -4.492 5.151 1.00 0.00 H new ATOM 0 HA ILE A 42 9.991 -5.809 7.306 1.00 0.00 H new ATOM 0 HB ILE A 42 9.417 -3.242 5.857 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.368 -4.076 7.853 1.00 0.00 H new ATOM 0 HG13 ILE A 42 11.303 -2.619 6.882 1.00 0.00 H new ATOM 0 HG21 ILE A 42 8.067 -2.632 7.821 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.380 -4.017 6.939 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.263 -4.281 8.461 1.00 0.00 H new ATOM 0 HD11 ILE A 42 11.127 -2.076 9.288 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.625 -1.639 8.440 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.691 -3.118 9.427 1.00 0.00 H new ATOM 677 N VAL A 43 8.535 -6.058 4.450 1.00 0.00 N ATOM 678 CA VAL A 43 7.432 -6.683 3.740 1.00 0.00 C ATOM 679 C VAL A 43 7.176 -8.072 4.327 1.00 0.00 C ATOM 680 O VAL A 43 6.067 -8.368 4.769 1.00 0.00 O ATOM 681 CB VAL A 43 7.728 -6.714 2.239 1.00 0.00 C ATOM 682 CG1 VAL A 43 7.395 -8.083 1.642 1.00 0.00 C ATOM 683 CG2 VAL A 43 6.975 -5.600 1.509 1.00 0.00 C ATOM 0 H VAL A 43 9.283 -5.706 3.852 1.00 0.00 H new ATOM 0 HA VAL A 43 6.518 -6.103 3.866 1.00 0.00 H new ATOM 0 HB VAL A 43 8.796 -6.541 2.105 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.615 -8.078 0.574 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.995 -8.849 2.132 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.337 -8.299 1.794 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.203 -5.644 0.444 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.903 -5.728 1.656 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.282 -4.632 1.906 1.00 0.00 H new ATOM 693 N THR A 44 8.220 -8.888 4.312 1.00 0.00 N ATOM 694 CA THR A 44 8.121 -10.239 4.838 1.00 0.00 C ATOM 695 C THR A 44 8.225 -10.227 6.364 1.00 0.00 C ATOM 696 O THR A 44 7.580 -11.026 7.041 1.00 0.00 O ATOM 697 CB THR A 44 9.200 -11.089 4.162 1.00 0.00 C ATOM 698 OG1 THR A 44 9.010 -10.849 2.771 1.00 0.00 O ATOM 699 CG2 THR A 44 8.946 -12.590 4.320 1.00 0.00 C ATOM 0 H THR A 44 9.138 -8.640 3.944 1.00 0.00 H new ATOM 0 HA THR A 44 7.150 -10.680 4.614 1.00 0.00 H new ATOM 0 HB THR A 44 10.175 -10.840 4.581 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.670 -11.360 2.258 1.00 0.00 H new ATOM 0 HG21 THR A 44 9.740 -13.148 3.823 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.931 -12.847 5.379 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.986 -12.846 3.871 1.00 0.00 H new ATOM 707 N LYS A 45 9.043 -9.310 6.862 1.00 0.00 N ATOM 708 CA LYS A 45 9.240 -9.183 8.296 1.00 0.00 C ATOM 709 C LYS A 45 7.893 -8.911 8.969 1.00 0.00 C ATOM 710 O LYS A 45 7.610 -9.449 10.039 1.00 0.00 O ATOM 711 CB LYS A 45 10.303 -8.126 8.599 1.00 0.00 C ATOM 712 CG LYS A 45 11.414 -8.702 9.480 1.00 0.00 C ATOM 713 CD LYS A 45 11.777 -7.735 10.608 1.00 0.00 C ATOM 714 CE LYS A 45 13.294 -7.594 10.743 1.00 0.00 C ATOM 715 NZ LYS A 45 13.912 -8.906 11.042 1.00 0.00 N ATOM 0 H LYS A 45 9.576 -8.649 6.298 1.00 0.00 H new ATOM 0 HA LYS A 45 9.623 -10.115 8.712 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.729 -7.756 7.666 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.842 -7.274 9.099 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.091 -9.654 9.902 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.296 -8.905 8.873 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.334 -6.759 10.412 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.356 -8.093 11.548 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.711 -7.191 9.820 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.530 -6.885 11.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.896 -8.765 11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.379 -9.376 11.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.895 -9.500 10.189 1.00 0.00 H new ATOM 729 N GLU A 46 7.098 -8.077 8.315 1.00 0.00 N ATOM 730 CA GLU A 46 5.788 -7.728 8.837 1.00 0.00 C ATOM 731 C GLU A 46 4.696 -8.487 8.081 1.00 0.00 C ATOM 732 O GLU A 46 3.529 -8.451 8.467 1.00 0.00 O ATOM 733 CB GLU A 46 5.555 -6.217 8.767 1.00 0.00 C ATOM 734 CG GLU A 46 5.960 -5.539 10.077 1.00 0.00 C ATOM 735 CD GLU A 46 4.739 -5.288 10.965 1.00 0.00 C ATOM 736 OE1 GLU A 46 4.114 -6.293 11.367 1.00 0.00 O ATOM 737 OE2 GLU A 46 4.459 -4.098 11.222 1.00 0.00 O ATOM 0 H GLU A 46 7.336 -7.633 7.428 1.00 0.00 H new ATOM 0 HA GLU A 46 5.746 -8.021 9.886 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.129 -5.795 7.942 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.504 -6.017 8.559 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.678 -6.165 10.608 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.459 -4.594 9.862 1.00 0.00 H new ATOM 744 N ARG A 47 5.113 -9.156 7.016 1.00 0.00 N ATOM 745 CA ARG A 47 4.185 -9.922 6.202 1.00 0.00 C ATOM 746 C ARG A 47 2.786 -9.307 6.271 1.00 0.00 C ATOM 747 O ARG A 47 1.840 -9.954 6.718 1.00 0.00 O ATOM 748 CB ARG A 47 4.117 -11.378 6.667 1.00 0.00 C ATOM 749 CG ARG A 47 3.825 -11.462 8.166 1.00 0.00 C ATOM 750 CD ARG A 47 3.078 -12.753 8.508 1.00 0.00 C ATOM 751 NE ARG A 47 3.877 -13.926 8.088 1.00 0.00 N ATOM 752 CZ ARG A 47 3.464 -15.196 8.202 1.00 0.00 C ATOM 753 NH1 ARG A 47 2.259 -15.465 8.722 1.00 0.00 N ATOM 754 NH2 ARG A 47 4.256 -16.197 7.795 1.00 0.00 N ATOM 0 H ARG A 47 6.082 -9.183 6.698 1.00 0.00 H new ATOM 0 HA ARG A 47 4.547 -9.897 5.174 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.341 -11.905 6.112 1.00 0.00 H new ATOM 0 HB3 ARG A 47 5.061 -11.878 6.448 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.760 -11.420 8.725 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.231 -10.601 8.473 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.886 -12.799 9.580 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.109 -12.765 8.009 1.00 0.00 H new ATOM 0 HE ARG A 47 4.799 -13.757 7.687 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.655 -14.703 9.031 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.945 -16.432 8.809 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.173 -15.993 7.398 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.942 -17.163 7.882 1.00 0.00 H new ATOM 768 N PRO A 48 2.696 -8.030 5.810 1.00 0.00 N ATOM 769 CA PRO A 48 1.428 -7.320 5.815 1.00 0.00 C ATOM 770 C PRO A 48 0.513 -7.825 4.697 1.00 0.00 C ATOM 771 O PRO A 48 0.983 -8.403 3.718 1.00 0.00 O ATOM 772 CB PRO A 48 1.798 -5.854 5.662 1.00 0.00 C ATOM 773 CG PRO A 48 3.216 -5.836 5.113 1.00 0.00 C ATOM 774 CD PRO A 48 3.795 -7.233 5.273 1.00 0.00 C ATOM 0 HA PRO A 48 0.859 -7.480 6.731 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.111 -5.347 4.985 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.743 -5.336 6.619 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.216 -5.541 4.064 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.824 -5.107 5.649 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.142 -7.629 4.319 1.00 0.00 H new ATOM 0 HD3 PRO A 48 4.651 -7.232 5.948 1.00 0.00 H new ATOM 782 N ASP A 49 -0.778 -7.588 4.881 1.00 0.00 N ATOM 783 CA ASP A 49 -1.763 -8.012 3.901 1.00 0.00 C ATOM 784 C ASP A 49 -1.961 -6.900 2.869 1.00 0.00 C ATOM 785 O ASP A 49 -2.595 -7.111 1.837 1.00 0.00 O ATOM 786 CB ASP A 49 -3.115 -8.288 4.563 1.00 0.00 C ATOM 787 CG ASP A 49 -3.147 -9.511 5.482 1.00 0.00 C ATOM 788 OD1 ASP A 49 -2.538 -9.420 6.569 1.00 0.00 O ATOM 789 OD2 ASP A 49 -3.781 -10.509 5.075 1.00 0.00 O ATOM 0 H ASP A 49 -1.164 -7.108 5.694 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.398 -8.925 3.430 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -3.406 -7.411 5.141 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -3.865 -8.419 3.783 1.00 0.00 H new ATOM 794 N LEU A 50 -1.406 -5.738 3.185 1.00 0.00 N ATOM 795 CA LEU A 50 -1.513 -4.593 2.298 1.00 0.00 C ATOM 796 C LEU A 50 -0.542 -3.504 2.759 1.00 0.00 C ATOM 797 O LEU A 50 -0.487 -3.177 3.943 1.00 0.00 O ATOM 798 CB LEU A 50 -2.965 -4.121 2.204 1.00 0.00 C ATOM 799 CG LEU A 50 -3.387 -3.508 0.867 1.00 0.00 C ATOM 800 CD1 LEU A 50 -3.796 -4.595 -0.130 1.00 0.00 C ATOM 801 CD2 LEU A 50 -4.490 -2.467 1.065 1.00 0.00 C ATOM 0 H LEU A 50 -0.881 -5.566 4.043 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.226 -4.870 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.616 -4.970 2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.138 -3.385 2.989 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.528 -2.989 0.443 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.091 -4.132 -1.072 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.954 -5.265 -0.303 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.634 -5.163 0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.771 -2.047 0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -5.359 -2.940 1.522 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.127 -1.671 1.715 1.00 0.00 H new ATOM 813 N VAL A 51 0.200 -2.972 1.798 1.00 0.00 N ATOM 814 CA VAL A 51 1.166 -1.927 2.091 1.00 0.00 C ATOM 815 C VAL A 51 1.015 -0.798 1.069 1.00 0.00 C ATOM 816 O VAL A 51 0.919 -1.052 -0.131 1.00 0.00 O ATOM 817 CB VAL A 51 2.578 -2.515 2.128 1.00 0.00 C ATOM 818 CG1 VAL A 51 2.794 -3.496 0.974 1.00 0.00 C ATOM 819 CG2 VAL A 51 3.634 -1.408 2.112 1.00 0.00 C ATOM 0 H VAL A 51 0.151 -3.245 0.816 1.00 0.00 H new ATOM 0 HA VAL A 51 0.980 -1.500 3.077 1.00 0.00 H new ATOM 0 HB VAL A 51 2.686 -3.067 3.062 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.805 -3.899 1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 51 2.074 -4.311 1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 51 2.656 -2.978 0.025 1.00 0.00 H new ATOM 0 HG21 VAL A 51 4.628 -1.853 2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.526 -0.815 1.203 1.00 0.00 H new ATOM 0 HG23 VAL A 51 3.501 -0.765 2.982 1.00 0.00 H new ATOM 829 N LEU A 52 1.000 0.423 1.581 1.00 0.00 N ATOM 830 CA LEU A 52 0.862 1.591 0.728 1.00 0.00 C ATOM 831 C LEU A 52 2.251 2.132 0.384 1.00 0.00 C ATOM 832 O LEU A 52 3.096 2.289 1.264 1.00 0.00 O ATOM 833 CB LEU A 52 -0.057 2.626 1.380 1.00 0.00 C ATOM 834 CG LEU A 52 0.525 3.379 2.579 1.00 0.00 C ATOM 835 CD1 LEU A 52 0.542 4.887 2.324 1.00 0.00 C ATOM 836 CD2 LEU A 52 -0.224 3.023 3.865 1.00 0.00 C ATOM 0 H LEU A 52 1.081 0.629 2.577 1.00 0.00 H new ATOM 0 HA LEU A 52 0.382 1.321 -0.213 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -0.345 3.355 0.623 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -0.969 2.122 1.700 1.00 0.00 H new ATOM 0 HG LEU A 52 1.560 3.064 2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.960 5.398 3.191 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.153 5.101 1.447 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.475 5.238 2.151 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.209 3.571 4.702 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.275 3.292 3.760 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.140 1.952 4.050 1.00 0.00 H new ATOM 848 N LEU A 53 2.445 2.403 -0.898 1.00 0.00 N ATOM 849 CA LEU A 53 3.717 2.924 -1.370 1.00 0.00 C ATOM 850 C LEU A 53 3.463 3.996 -2.431 1.00 0.00 C ATOM 851 O LEU A 53 2.654 3.799 -3.336 1.00 0.00 O ATOM 852 CB LEU A 53 4.617 1.784 -1.850 1.00 0.00 C ATOM 853 CG LEU A 53 5.965 2.198 -2.444 1.00 0.00 C ATOM 854 CD1 LEU A 53 6.942 1.021 -2.460 1.00 0.00 C ATOM 855 CD2 LEU A 53 5.786 2.813 -3.833 1.00 0.00 C ATOM 0 H LEU A 53 1.742 2.272 -1.625 1.00 0.00 H new ATOM 0 HA LEU A 53 4.258 3.405 -0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.803 1.116 -1.009 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.073 1.209 -2.600 1.00 0.00 H new ATOM 0 HG LEU A 53 6.398 2.967 -1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.892 1.342 -2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.103 0.668 -1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.528 0.213 -3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.759 3.099 -4.233 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.321 2.084 -4.497 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.150 3.695 -3.761 1.00 0.00 H new ATOM 867 N ASP A 54 4.169 5.107 -2.285 1.00 0.00 N ATOM 868 CA ASP A 54 4.030 6.211 -3.220 1.00 0.00 C ATOM 869 C ASP A 54 5.138 6.124 -4.272 1.00 0.00 C ATOM 870 O ASP A 54 6.314 6.002 -3.932 1.00 0.00 O ATOM 871 CB ASP A 54 4.161 7.557 -2.506 1.00 0.00 C ATOM 872 CG ASP A 54 4.678 8.704 -3.377 1.00 0.00 C ATOM 873 OD1 ASP A 54 4.396 8.664 -4.594 1.00 0.00 O ATOM 874 OD2 ASP A 54 5.344 9.594 -2.806 1.00 0.00 O ATOM 0 H ASP A 54 4.839 5.267 -1.533 1.00 0.00 H new ATOM 0 HA ASP A 54 3.044 6.142 -3.680 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.186 7.835 -2.106 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.832 7.436 -1.655 1.00 0.00 H new ATOM 879 N MET A 55 4.723 6.191 -5.529 1.00 0.00 N ATOM 880 CA MET A 55 5.665 6.122 -6.633 1.00 0.00 C ATOM 881 C MET A 55 6.764 7.175 -6.482 1.00 0.00 C ATOM 882 O MET A 55 7.924 6.838 -6.246 1.00 0.00 O ATOM 883 CB MET A 55 4.922 6.344 -7.952 1.00 0.00 C ATOM 884 CG MET A 55 3.662 5.479 -8.025 1.00 0.00 C ATOM 885 SD MET A 55 4.029 3.820 -7.478 1.00 0.00 S ATOM 886 CE MET A 55 3.378 3.890 -5.817 1.00 0.00 C ATOM 0 H MET A 55 3.747 6.292 -5.807 1.00 0.00 H new ATOM 0 HA MET A 55 6.130 5.136 -6.629 1.00 0.00 H new ATOM 0 HB2 MET A 55 4.651 7.395 -8.048 1.00 0.00 H new ATOM 0 HB3 MET A 55 5.579 6.106 -8.788 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.878 5.911 -7.403 1.00 0.00 H new ATOM 0 HG3 MET A 55 3.283 5.459 -9.047 1.00 0.00 H new ATOM 0 HE1 MET A 55 2.951 2.923 -5.553 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.181 4.134 -5.121 1.00 0.00 H new ATOM 0 HE3 MET A 55 2.604 4.656 -5.761 1.00 0.00 H new ATOM 896 N LYS A 56 6.362 8.429 -6.624 1.00 0.00 N ATOM 897 CA LYS A 56 7.299 9.534 -6.507 1.00 0.00 C ATOM 898 C LYS A 56 7.985 9.472 -5.141 1.00 0.00 C ATOM 899 O LYS A 56 7.370 9.774 -4.119 1.00 0.00 O ATOM 900 CB LYS A 56 6.596 10.864 -6.783 1.00 0.00 C ATOM 901 CG LYS A 56 7.062 11.466 -8.110 1.00 0.00 C ATOM 902 CD LYS A 56 6.747 12.962 -8.174 1.00 0.00 C ATOM 903 CE LYS A 56 7.963 13.796 -7.767 1.00 0.00 C ATOM 904 NZ LYS A 56 7.975 15.085 -8.494 1.00 0.00 N ATOM 0 H LYS A 56 5.400 8.705 -6.819 1.00 0.00 H new ATOM 0 HA LYS A 56 8.082 9.452 -7.261 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.517 10.711 -6.808 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.800 11.562 -5.971 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.135 11.311 -8.227 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.574 10.952 -8.938 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.440 13.230 -9.185 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.909 13.189 -7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 56 7.943 13.978 -6.692 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.878 13.243 -7.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.807 15.638 -8.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 8.016 14.906 -9.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.110 15.618 -8.270 1.00 0.00 H new ATOM 918 N ILE A 57 9.250 9.078 -5.167 1.00 0.00 N ATOM 919 CA ILE A 57 10.026 8.973 -3.943 1.00 0.00 C ATOM 920 C ILE A 57 11.439 9.503 -4.193 1.00 0.00 C ATOM 921 O ILE A 57 11.923 9.480 -5.323 1.00 0.00 O ATOM 922 CB ILE A 57 9.992 7.540 -3.408 1.00 0.00 C ATOM 923 CG1 ILE A 57 9.183 7.456 -2.112 1.00 0.00 C ATOM 924 CG2 ILE A 57 11.407 6.985 -3.237 1.00 0.00 C ATOM 925 CD1 ILE A 57 8.769 6.014 -1.816 1.00 0.00 C ATOM 0 H ILE A 57 9.757 8.828 -6.016 1.00 0.00 H new ATOM 0 HA ILE A 57 9.587 9.591 -3.160 1.00 0.00 H new ATOM 0 HB ILE A 57 9.487 6.914 -4.143 1.00 0.00 H new ATOM 0 HG12 ILE A 57 9.775 7.845 -1.284 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.295 8.084 -2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 57 11.354 5.965 -2.856 1.00 0.00 H new ATOM 0 HG22 ILE A 57 11.917 6.986 -4.200 1.00 0.00 H new ATOM 0 HG23 ILE A 57 11.959 7.608 -2.533 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.195 5.983 -0.890 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.157 5.636 -2.635 1.00 0.00 H new ATOM 0 HD13 ILE A 57 9.659 5.394 -1.712 1.00 0.00 H new ATOM 937 N PRO A 58 12.077 9.980 -3.091 1.00 0.00 N ATOM 938 CA PRO A 58 13.425 10.515 -3.180 1.00 0.00 C ATOM 939 C PRO A 58 14.452 9.391 -3.330 1.00 0.00 C ATOM 940 O PRO A 58 14.491 8.468 -2.518 1.00 0.00 O ATOM 941 CB PRO A 58 13.612 11.324 -1.907 1.00 0.00 C ATOM 942 CG PRO A 58 12.544 10.836 -0.942 1.00 0.00 C ATOM 943 CD PRO A 58 11.535 10.024 -1.736 1.00 0.00 C ATOM 0 HA PRO A 58 13.572 11.142 -4.060 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.609 11.176 -1.493 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.503 12.391 -2.103 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.990 10.227 -0.155 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.056 11.680 -0.454 1.00 0.00 H new ATOM 0 HD2 PRO A 58 11.420 9.022 -1.323 1.00 0.00 H new ATOM 0 HD3 PRO A 58 10.550 10.490 -1.719 1.00 0.00 H new ATOM 951 N GLY A 59 15.259 9.506 -4.374 1.00 0.00 N ATOM 952 CA GLY A 59 16.284 8.510 -4.642 1.00 0.00 C ATOM 953 C GLY A 59 15.659 7.185 -5.084 1.00 0.00 C ATOM 954 O GLY A 59 15.006 6.508 -4.291 1.00 0.00 O ATOM 0 H GLY A 59 15.224 10.274 -5.045 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.957 8.875 -5.418 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.885 8.352 -3.747 1.00 0.00 H new ATOM 958 N MET A 60 15.882 6.856 -6.347 1.00 0.00 N ATOM 959 CA MET A 60 15.349 5.624 -6.904 1.00 0.00 C ATOM 960 C MET A 60 13.823 5.587 -6.793 1.00 0.00 C ATOM 961 O MET A 60 13.282 5.211 -5.754 1.00 0.00 O ATOM 962 CB MET A 60 15.944 4.427 -6.160 1.00 0.00 C ATOM 963 CG MET A 60 16.218 3.266 -7.118 1.00 0.00 C ATOM 964 SD MET A 60 16.155 1.717 -6.234 1.00 0.00 S ATOM 965 CE MET A 60 14.392 1.569 -5.992 1.00 0.00 C ATOM 0 H MET A 60 16.424 7.421 -7.001 1.00 0.00 H new ATOM 0 HA MET A 60 15.619 5.578 -7.959 1.00 0.00 H new ATOM 0 HB2 MET A 60 16.871 4.724 -5.669 1.00 0.00 H new ATOM 0 HB3 MET A 60 15.258 4.103 -5.378 1.00 0.00 H new ATOM 0 HG2 MET A 60 15.482 3.266 -7.922 1.00 0.00 H new ATOM 0 HG3 MET A 60 17.197 3.390 -7.582 1.00 0.00 H new ATOM 0 HE1 MET A 60 14.101 0.521 -6.068 1.00 0.00 H new ATOM 0 HE2 MET A 60 14.127 1.948 -5.005 1.00 0.00 H new ATOM 0 HE3 MET A 60 13.870 2.147 -6.755 1.00 0.00 H new ATOM 975 N ASP A 61 13.173 5.982 -7.878 1.00 0.00 N ATOM 976 CA ASP A 61 11.721 5.999 -7.915 1.00 0.00 C ATOM 977 C ASP A 61 11.188 4.637 -7.465 1.00 0.00 C ATOM 978 O ASP A 61 11.962 3.715 -7.215 1.00 0.00 O ATOM 979 CB ASP A 61 11.209 6.262 -9.333 1.00 0.00 C ATOM 980 CG ASP A 61 12.173 5.863 -10.452 1.00 0.00 C ATOM 981 OD1 ASP A 61 12.618 4.695 -10.428 1.00 0.00 O ATOM 982 OD2 ASP A 61 12.442 6.734 -11.307 1.00 0.00 O ATOM 0 H ASP A 61 13.625 6.293 -8.738 1.00 0.00 H new ATOM 0 HA ASP A 61 11.376 6.794 -7.254 1.00 0.00 H new ATOM 0 HB2 ASP A 61 10.272 5.722 -9.471 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.982 7.324 -9.430 1.00 0.00 H new ATOM 987 N GLY A 62 9.868 4.554 -7.375 1.00 0.00 N ATOM 988 CA GLY A 62 9.222 3.321 -6.959 1.00 0.00 C ATOM 989 C GLY A 62 8.864 2.455 -8.169 1.00 0.00 C ATOM 990 O GLY A 62 8.397 1.328 -8.013 1.00 0.00 O ATOM 0 H GLY A 62 9.229 5.321 -7.583 1.00 0.00 H new ATOM 0 HA2 GLY A 62 9.883 2.766 -6.293 1.00 0.00 H new ATOM 0 HA3 GLY A 62 8.320 3.552 -6.393 1.00 0.00 H new ATOM 994 N ILE A 63 9.097 3.015 -9.347 1.00 0.00 N ATOM 995 CA ILE A 63 8.804 2.308 -10.582 1.00 0.00 C ATOM 996 C ILE A 63 9.465 0.928 -10.544 1.00 0.00 C ATOM 997 O ILE A 63 8.905 -0.046 -11.044 1.00 0.00 O ATOM 998 CB ILE A 63 9.212 3.152 -11.792 1.00 0.00 C ATOM 999 CG1 ILE A 63 8.495 4.503 -11.785 1.00 0.00 C ATOM 1000 CG2 ILE A 63 8.982 2.387 -13.096 1.00 0.00 C ATOM 1001 CD1 ILE A 63 9.295 5.553 -12.558 1.00 0.00 C ATOM 0 H ILE A 63 9.485 3.950 -9.472 1.00 0.00 H new ATOM 0 HA ILE A 63 7.731 2.145 -10.683 1.00 0.00 H new ATOM 0 HB ILE A 63 10.281 3.355 -11.722 1.00 0.00 H new ATOM 0 HG12 ILE A 63 7.505 4.396 -12.229 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.349 4.836 -10.757 1.00 0.00 H new ATOM 0 HG21 ILE A 63 9.280 3.009 -13.940 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.576 1.473 -13.091 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.926 2.133 -13.187 1.00 0.00 H new ATOM 0 HD11 ILE A 63 8.763 6.504 -12.537 1.00 0.00 H new ATOM 0 HD12 ILE A 63 10.275 5.676 -12.097 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.418 5.229 -13.591 1.00 0.00 H new ATOM 1013 N GLU A 64 10.646 0.889 -9.945 1.00 0.00 N ATOM 1014 CA GLU A 64 11.389 -0.355 -9.835 1.00 0.00 C ATOM 1015 C GLU A 64 10.949 -1.126 -8.589 1.00 0.00 C ATOM 1016 O GLU A 64 10.705 -2.330 -8.654 1.00 0.00 O ATOM 1017 CB GLU A 64 12.896 -0.094 -9.815 1.00 0.00 C ATOM 1018 CG GLU A 64 13.412 0.244 -11.215 1.00 0.00 C ATOM 1019 CD GLU A 64 13.748 -1.027 -11.997 1.00 0.00 C ATOM 1020 OE1 GLU A 64 13.051 -2.038 -11.764 1.00 0.00 O ATOM 1021 OE2 GLU A 64 14.695 -0.960 -12.811 1.00 0.00 O ATOM 0 H GLU A 64 11.107 1.699 -9.531 1.00 0.00 H new ATOM 0 HA GLU A 64 11.172 -0.965 -10.712 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.117 0.727 -9.134 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.416 -0.973 -9.434 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.660 0.819 -11.755 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.299 0.873 -11.138 1.00 0.00 H new ATOM 1028 N ILE A 65 10.862 -0.402 -7.483 1.00 0.00 N ATOM 1029 CA ILE A 65 10.457 -1.003 -6.224 1.00 0.00 C ATOM 1030 C ILE A 65 9.225 -1.880 -6.456 1.00 0.00 C ATOM 1031 O ILE A 65 9.275 -3.093 -6.257 1.00 0.00 O ATOM 1032 CB ILE A 65 10.253 0.074 -5.157 1.00 0.00 C ATOM 1033 CG1 ILE A 65 11.595 0.563 -4.608 1.00 0.00 C ATOM 1034 CG2 ILE A 65 9.326 -0.423 -4.046 1.00 0.00 C ATOM 1035 CD1 ILE A 65 12.424 -0.604 -4.067 1.00 0.00 C ATOM 0 H ILE A 65 11.065 0.596 -7.433 1.00 0.00 H new ATOM 0 HA ILE A 65 11.244 -1.653 -5.841 1.00 0.00 H new ATOM 0 HB ILE A 65 9.765 0.929 -5.624 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.150 1.074 -5.395 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.424 1.291 -3.815 1.00 0.00 H new ATOM 0 HG21 ILE A 65 9.198 0.362 -3.301 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.356 -0.682 -4.470 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.763 -1.303 -3.574 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.373 -0.229 -3.683 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.877 -1.097 -3.264 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.614 -1.318 -4.869 1.00 0.00 H new ATOM 1047 N LEU A 66 8.147 -1.232 -6.874 1.00 0.00 N ATOM 1048 CA LEU A 66 6.904 -1.938 -7.135 1.00 0.00 C ATOM 1049 C LEU A 66 7.164 -3.067 -8.135 1.00 0.00 C ATOM 1050 O LEU A 66 6.581 -4.144 -8.025 1.00 0.00 O ATOM 1051 CB LEU A 66 5.816 -0.959 -7.582 1.00 0.00 C ATOM 1052 CG LEU A 66 5.362 0.062 -6.537 1.00 0.00 C ATOM 1053 CD1 LEU A 66 5.451 -0.522 -5.126 1.00 0.00 C ATOM 1054 CD2 LEU A 66 6.148 1.368 -6.667 1.00 0.00 C ATOM 0 H LEU A 66 8.109 -0.226 -7.038 1.00 0.00 H new ATOM 0 HA LEU A 66 6.529 -2.400 -6.222 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.179 -0.418 -8.456 1.00 0.00 H new ATOM 0 HB3 LEU A 66 4.947 -1.534 -7.901 1.00 0.00 H new ATOM 0 HG LEU A 66 4.314 0.298 -6.723 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.123 0.224 -4.402 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.812 -1.402 -5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.482 -0.805 -4.914 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.805 2.076 -5.912 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.210 1.169 -6.522 1.00 0.00 H new ATOM 0 HD23 LEU A 66 5.990 1.791 -7.659 1.00 0.00 H new ATOM 1066 N LYS A 67 8.039 -2.780 -9.088 1.00 0.00 N ATOM 1067 CA LYS A 67 8.383 -3.758 -10.106 1.00 0.00 C ATOM 1068 C LYS A 67 9.022 -4.978 -9.440 1.00 0.00 C ATOM 1069 O LYS A 67 8.462 -6.073 -9.473 1.00 0.00 O ATOM 1070 CB LYS A 67 9.257 -3.120 -11.188 1.00 0.00 C ATOM 1071 CG LYS A 67 8.513 -3.050 -12.523 1.00 0.00 C ATOM 1072 CD LYS A 67 9.494 -2.964 -13.694 1.00 0.00 C ATOM 1073 CE LYS A 67 8.950 -2.056 -14.799 1.00 0.00 C ATOM 1074 NZ LYS A 67 9.732 -2.230 -16.043 1.00 0.00 N ATOM 0 H LYS A 67 8.520 -1.885 -9.176 1.00 0.00 H new ATOM 0 HA LYS A 67 7.486 -4.107 -10.618 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.551 -2.117 -10.878 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.173 -3.698 -11.308 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.881 -3.931 -12.638 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.854 -2.181 -12.531 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.452 -2.581 -13.343 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.676 -3.961 -14.095 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.902 -2.288 -14.986 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.993 -1.015 -14.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.350 -1.607 -16.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.727 -1.986 -15.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.669 -3.219 -16.357 1.00 0.00 H new ATOM 1088 N ARG A 68 10.187 -4.749 -8.851 1.00 0.00 N ATOM 1089 CA ARG A 68 10.908 -5.816 -8.178 1.00 0.00 C ATOM 1090 C ARG A 68 9.992 -6.529 -7.180 1.00 0.00 C ATOM 1091 O ARG A 68 10.105 -7.737 -6.983 1.00 0.00 O ATOM 1092 CB ARG A 68 12.132 -5.273 -7.439 1.00 0.00 C ATOM 1093 CG ARG A 68 13.393 -5.407 -8.294 1.00 0.00 C ATOM 1094 CD ARG A 68 14.575 -4.682 -7.646 1.00 0.00 C ATOM 1095 NE ARG A 68 15.307 -5.607 -6.752 1.00 0.00 N ATOM 1096 CZ ARG A 68 16.432 -5.286 -6.098 1.00 0.00 C ATOM 1097 NH1 ARG A 68 16.960 -4.062 -6.234 1.00 0.00 N ATOM 1098 NH2 ARG A 68 17.029 -6.190 -5.308 1.00 0.00 N ATOM 0 H ARG A 68 10.649 -3.840 -8.826 1.00 0.00 H new ATOM 0 HA ARG A 68 11.241 -6.522 -8.939 1.00 0.00 H new ATOM 0 HB2 ARG A 68 11.972 -4.226 -7.183 1.00 0.00 H new ATOM 0 HB3 ARG A 68 12.265 -5.814 -6.502 1.00 0.00 H new ATOM 0 HG2 ARG A 68 13.637 -6.461 -8.426 1.00 0.00 H new ATOM 0 HG3 ARG A 68 13.209 -4.995 -9.286 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.245 -4.301 -8.416 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.218 -3.822 -7.080 1.00 0.00 H new ATOM 0 HE ARG A 68 14.932 -6.547 -6.626 1.00 0.00 H new ATOM 0 HH11 ARG A 68 16.506 -3.375 -6.835 1.00 0.00 H new ATOM 0 HH12 ARG A 68 17.816 -3.818 -5.736 1.00 0.00 H new ATOM 0 HH21 ARG A 68 16.627 -7.122 -5.205 1.00 0.00 H new ATOM 0 HH22 ARG A 68 17.885 -5.946 -4.810 1.00 0.00 H new ATOM 1112 N MET A 69 9.107 -5.749 -6.577 1.00 0.00 N ATOM 1113 CA MET A 69 8.173 -6.290 -5.605 1.00 0.00 C ATOM 1114 C MET A 69 7.371 -7.449 -6.200 1.00 0.00 C ATOM 1115 O MET A 69 7.403 -8.563 -5.679 1.00 0.00 O ATOM 1116 CB MET A 69 7.215 -5.188 -5.149 1.00 0.00 C ATOM 1117 CG MET A 69 7.213 -5.059 -3.624 1.00 0.00 C ATOM 1118 SD MET A 69 5.726 -4.233 -3.083 1.00 0.00 S ATOM 1119 CE MET A 69 6.438 -2.923 -2.102 1.00 0.00 C ATOM 0 H MET A 69 9.017 -4.747 -6.743 1.00 0.00 H new ATOM 0 HA MET A 69 8.741 -6.665 -4.754 1.00 0.00 H new ATOM 0 HB2 MET A 69 7.507 -4.239 -5.597 1.00 0.00 H new ATOM 0 HB3 MET A 69 6.207 -5.409 -5.500 1.00 0.00 H new ATOM 0 HG2 MET A 69 7.277 -6.047 -3.167 1.00 0.00 H new ATOM 0 HG3 MET A 69 8.089 -4.499 -3.297 1.00 0.00 H new ATOM 0 HE1 MET A 69 5.642 -2.306 -1.686 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.025 -3.354 -1.291 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.083 -2.308 -2.730 1.00 0.00 H new ATOM 1129 N LYS A 70 6.672 -7.148 -7.284 1.00 0.00 N ATOM 1130 CA LYS A 70 5.864 -8.151 -7.956 1.00 0.00 C ATOM 1131 C LYS A 70 6.782 -9.159 -8.650 1.00 0.00 C ATOM 1132 O LYS A 70 6.528 -10.362 -8.615 1.00 0.00 O ATOM 1133 CB LYS A 70 4.858 -7.486 -8.899 1.00 0.00 C ATOM 1134 CG LYS A 70 5.491 -7.199 -10.262 1.00 0.00 C ATOM 1135 CD LYS A 70 5.631 -8.484 -11.082 1.00 0.00 C ATOM 1136 CE LYS A 70 4.859 -8.381 -12.398 1.00 0.00 C ATOM 1137 NZ LYS A 70 5.156 -9.542 -13.266 1.00 0.00 N ATOM 0 H LYS A 70 6.648 -6.223 -7.714 1.00 0.00 H new ATOM 0 HA LYS A 70 5.269 -8.707 -7.232 1.00 0.00 H new ATOM 0 HB2 LYS A 70 3.990 -8.133 -9.026 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.500 -6.556 -8.457 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.879 -6.480 -10.807 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.471 -6.743 -10.123 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.684 -8.675 -11.288 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.260 -9.331 -10.504 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.789 -8.335 -12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.126 -7.458 -12.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 4.624 -9.456 -14.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.175 -9.569 -13.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.879 -10.419 -12.780 1.00 0.00 H new ATOM 1151 N VAL A 71 7.831 -8.631 -9.263 1.00 0.00 N ATOM 1152 CA VAL A 71 8.789 -9.470 -9.964 1.00 0.00 C ATOM 1153 C VAL A 71 9.373 -10.494 -8.988 1.00 0.00 C ATOM 1154 O VAL A 71 9.727 -11.603 -9.385 1.00 0.00 O ATOM 1155 CB VAL A 71 9.858 -8.600 -10.629 1.00 0.00 C ATOM 1156 CG1 VAL A 71 10.815 -9.452 -11.465 1.00 0.00 C ATOM 1157 CG2 VAL A 71 9.220 -7.499 -11.477 1.00 0.00 C ATOM 0 H VAL A 71 8.039 -7.633 -9.289 1.00 0.00 H new ATOM 0 HA VAL A 71 8.298 -10.026 -10.763 1.00 0.00 H new ATOM 0 HB VAL A 71 10.438 -8.120 -9.841 1.00 0.00 H new ATOM 0 HG11 VAL A 71 11.565 -8.810 -11.927 1.00 0.00 H new ATOM 0 HG12 VAL A 71 11.308 -10.182 -10.823 1.00 0.00 H new ATOM 0 HG13 VAL A 71 10.255 -9.972 -12.242 1.00 0.00 H new ATOM 0 HG21 VAL A 71 10.002 -6.896 -11.938 1.00 0.00 H new ATOM 0 HG22 VAL A 71 8.604 -7.950 -12.255 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.599 -6.866 -10.844 1.00 0.00 H new ATOM 1167 N ILE A 72 9.456 -10.085 -7.731 1.00 0.00 N ATOM 1168 CA ILE A 72 9.990 -10.953 -6.695 1.00 0.00 C ATOM 1169 C ILE A 72 8.932 -11.988 -6.307 1.00 0.00 C ATOM 1170 O ILE A 72 9.234 -13.175 -6.187 1.00 0.00 O ATOM 1171 CB ILE A 72 10.504 -10.126 -5.515 1.00 0.00 C ATOM 1172 CG1 ILE A 72 11.918 -9.607 -5.784 1.00 0.00 C ATOM 1173 CG2 ILE A 72 10.425 -10.923 -4.211 1.00 0.00 C ATOM 1174 CD1 ILE A 72 12.965 -10.677 -5.468 1.00 0.00 C ATOM 0 H ILE A 72 9.162 -9.164 -7.406 1.00 0.00 H new ATOM 0 HA ILE A 72 10.853 -11.504 -7.068 1.00 0.00 H new ATOM 0 HB ILE A 72 9.858 -9.256 -5.401 1.00 0.00 H new ATOM 0 HG12 ILE A 72 12.006 -9.305 -6.828 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.105 -8.720 -5.178 1.00 0.00 H new ATOM 0 HG21 ILE A 72 10.796 -10.312 -3.388 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.389 -11.202 -4.017 1.00 0.00 H new ATOM 0 HG23 ILE A 72 11.033 -11.823 -4.298 1.00 0.00 H new ATOM 0 HD11 ILE A 72 13.961 -10.282 -5.668 1.00 0.00 H new ATOM 0 HD12 ILE A 72 12.891 -10.960 -4.418 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.790 -11.553 -6.093 1.00 0.00 H new ATOM 1186 N ASP A 73 7.715 -11.501 -6.120 1.00 0.00 N ATOM 1187 CA ASP A 73 6.610 -12.369 -5.747 1.00 0.00 C ATOM 1188 C ASP A 73 5.350 -11.933 -6.497 1.00 0.00 C ATOM 1189 O ASP A 73 4.970 -10.764 -6.454 1.00 0.00 O ATOM 1190 CB ASP A 73 6.323 -12.281 -4.247 1.00 0.00 C ATOM 1191 CG ASP A 73 7.141 -11.231 -3.493 1.00 0.00 C ATOM 1192 OD1 ASP A 73 6.997 -10.040 -3.843 1.00 0.00 O ATOM 1193 OD2 ASP A 73 7.892 -11.644 -2.582 1.00 0.00 O ATOM 0 H ASP A 73 7.469 -10.516 -6.220 1.00 0.00 H new ATOM 0 HA ASP A 73 6.884 -13.393 -6.002 1.00 0.00 H new ATOM 0 HB2 ASP A 73 5.264 -12.064 -4.107 1.00 0.00 H new ATOM 0 HB3 ASP A 73 6.510 -13.257 -3.799 1.00 0.00 H new ATOM 1198 N GLU A 74 4.735 -12.898 -7.167 1.00 0.00 N ATOM 1199 CA GLU A 74 3.525 -12.629 -7.925 1.00 0.00 C ATOM 1200 C GLU A 74 2.294 -12.776 -7.029 1.00 0.00 C ATOM 1201 O GLU A 74 1.162 -12.703 -7.506 1.00 0.00 O ATOM 1202 CB GLU A 74 3.428 -13.545 -9.146 1.00 0.00 C ATOM 1203 CG GLU A 74 2.859 -14.912 -8.761 1.00 0.00 C ATOM 1204 CD GLU A 74 2.833 -15.855 -9.966 1.00 0.00 C ATOM 1205 OE1 GLU A 74 3.935 -16.280 -10.377 1.00 0.00 O ATOM 1206 OE2 GLU A 74 1.713 -16.129 -10.448 1.00 0.00 O ATOM 0 H GLU A 74 5.053 -13.867 -7.200 1.00 0.00 H new ATOM 0 HA GLU A 74 3.566 -11.601 -8.286 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.794 -13.083 -9.902 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.415 -13.670 -9.591 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.462 -15.350 -7.965 1.00 0.00 H new ATOM 0 HG3 GLU A 74 1.850 -14.792 -8.367 1.00 0.00 H new ATOM 1213 N ASN A 75 2.556 -12.980 -5.746 1.00 0.00 N ATOM 1214 CA ASN A 75 1.483 -13.138 -4.779 1.00 0.00 C ATOM 1215 C ASN A 75 1.469 -11.932 -3.838 1.00 0.00 C ATOM 1216 O ASN A 75 0.578 -11.805 -2.999 1.00 0.00 O ATOM 1217 CB ASN A 75 1.685 -14.396 -3.932 1.00 0.00 C ATOM 1218 CG ASN A 75 0.343 -15.035 -3.569 1.00 0.00 C ATOM 1219 OD1 ASN A 75 -0.648 -14.896 -4.266 1.00 0.00 O ATOM 1220 ND2 ASN A 75 0.368 -15.741 -2.442 1.00 0.00 N ATOM 0 H ASN A 75 3.496 -13.039 -5.354 1.00 0.00 H new ATOM 0 HA ASN A 75 0.545 -13.220 -5.327 1.00 0.00 H new ATOM 0 HB2 ASN A 75 2.297 -15.113 -4.480 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.229 -14.142 -3.022 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.478 -16.207 -2.113 1.00 0.00 H new ATOM 0 HD22 ASN A 75 1.233 -15.816 -1.906 1.00 0.00 H new ATOM 1227 N ILE A 76 2.466 -11.077 -4.008 1.00 0.00 N ATOM 1228 CA ILE A 76 2.579 -9.885 -3.185 1.00 0.00 C ATOM 1229 C ILE A 76 1.444 -8.920 -3.532 1.00 0.00 C ATOM 1230 O ILE A 76 1.189 -8.653 -4.706 1.00 0.00 O ATOM 1231 CB ILE A 76 3.973 -9.270 -3.321 1.00 0.00 C ATOM 1232 CG1 ILE A 76 4.234 -8.250 -2.211 1.00 0.00 C ATOM 1233 CG2 ILE A 76 4.172 -8.666 -4.713 1.00 0.00 C ATOM 1234 CD1 ILE A 76 5.249 -7.198 -2.661 1.00 0.00 C ATOM 0 H ILE A 76 3.204 -11.186 -4.704 1.00 0.00 H new ATOM 0 HA ILE A 76 2.470 -10.139 -2.131 1.00 0.00 H new ATOM 0 HB ILE A 76 4.710 -10.065 -3.206 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.299 -7.763 -1.933 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.604 -8.761 -1.322 1.00 0.00 H new ATOM 0 HG21 ILE A 76 5.171 -8.235 -4.783 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.059 -9.445 -5.467 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.428 -7.887 -4.881 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.416 -6.485 -1.854 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.190 -7.686 -2.915 1.00 0.00 H new ATOM 0 HD13 ILE A 76 4.865 -6.672 -3.535 1.00 0.00 H new ATOM 1246 N ARG A 77 0.793 -8.424 -2.491 1.00 0.00 N ATOM 1247 CA ARG A 77 -0.310 -7.494 -2.672 1.00 0.00 C ATOM 1248 C ARG A 77 0.097 -6.093 -2.211 1.00 0.00 C ATOM 1249 O ARG A 77 0.345 -5.873 -1.027 1.00 0.00 O ATOM 1250 CB ARG A 77 -1.543 -7.944 -1.886 1.00 0.00 C ATOM 1251 CG ARG A 77 -2.479 -6.764 -1.614 1.00 0.00 C ATOM 1252 CD ARG A 77 -3.924 -7.239 -1.442 1.00 0.00 C ATOM 1253 NE ARG A 77 -4.279 -8.181 -2.527 1.00 0.00 N ATOM 1254 CZ ARG A 77 -4.251 -9.515 -2.402 1.00 0.00 C ATOM 1255 NH1 ARG A 77 -3.883 -10.072 -1.240 1.00 0.00 N ATOM 1256 NH2 ARG A 77 -4.589 -10.292 -3.440 1.00 0.00 N ATOM 0 H ARG A 77 1.007 -8.648 -1.519 1.00 0.00 H new ATOM 0 HA ARG A 77 -0.557 -7.474 -3.733 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.075 -8.714 -2.446 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -1.234 -8.393 -0.942 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.156 -6.238 -0.716 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.422 -6.052 -2.438 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.043 -7.725 -0.474 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.601 -6.384 -1.455 1.00 0.00 H new ATOM 0 HE ARG A 77 -4.563 -7.791 -3.426 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.624 -9.481 -0.450 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.862 -11.087 -1.145 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -4.867 -9.868 -4.325 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -4.568 -11.307 -3.345 1.00 0.00 H new ATOM 1270 N VAL A 78 0.153 -5.182 -3.172 1.00 0.00 N ATOM 1271 CA VAL A 78 0.525 -3.808 -2.880 1.00 0.00 C ATOM 1272 C VAL A 78 -0.335 -2.862 -3.720 1.00 0.00 C ATOM 1273 O VAL A 78 -0.789 -3.227 -4.803 1.00 0.00 O ATOM 1274 CB VAL A 78 2.026 -3.613 -3.108 1.00 0.00 C ATOM 1275 CG1 VAL A 78 2.375 -2.128 -3.215 1.00 0.00 C ATOM 1276 CG2 VAL A 78 2.840 -4.290 -2.003 1.00 0.00 C ATOM 0 H VAL A 78 -0.053 -5.369 -4.153 1.00 0.00 H new ATOM 0 HA VAL A 78 0.336 -3.575 -1.832 1.00 0.00 H new ATOM 0 HB VAL A 78 2.286 -4.087 -4.054 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.447 -2.017 -3.377 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.834 -1.687 -4.052 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.093 -1.621 -2.293 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.903 -4.137 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.574 -3.858 -1.038 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.624 -5.358 -1.994 1.00 0.00 H new ATOM 1286 N ILE A 79 -0.533 -1.665 -3.188 1.00 0.00 N ATOM 1287 CA ILE A 79 -1.330 -0.663 -3.875 1.00 0.00 C ATOM 1288 C ILE A 79 -0.468 0.572 -4.145 1.00 0.00 C ATOM 1289 O ILE A 79 0.349 0.957 -3.310 1.00 0.00 O ATOM 1290 CB ILE A 79 -2.607 -0.362 -3.087 1.00 0.00 C ATOM 1291 CG1 ILE A 79 -3.756 -1.265 -3.539 1.00 0.00 C ATOM 1292 CG2 ILE A 79 -2.972 1.121 -3.180 1.00 0.00 C ATOM 1293 CD1 ILE A 79 -5.110 -0.656 -3.170 1.00 0.00 C ATOM 0 H ILE A 79 -0.155 -1.366 -2.289 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.661 -1.038 -4.843 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.420 -0.582 -2.036 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.703 -1.415 -4.617 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.656 -2.246 -3.075 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.883 1.308 -2.611 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.160 1.722 -2.771 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.134 1.391 -4.224 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.910 -1.318 -3.503 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.170 -0.530 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.217 0.314 -3.655 1.00 0.00 H new ATOM 1305 N ILE A 80 -0.681 1.159 -5.313 1.00 0.00 N ATOM 1306 CA ILE A 80 0.066 2.342 -5.703 1.00 0.00 C ATOM 1307 C ILE A 80 -0.825 3.576 -5.549 1.00 0.00 C ATOM 1308 O ILE A 80 -2.049 3.475 -5.617 1.00 0.00 O ATOM 1309 CB ILE A 80 0.643 2.172 -7.110 1.00 0.00 C ATOM 1310 CG1 ILE A 80 -0.369 2.605 -8.173 1.00 0.00 C ATOM 1311 CG2 ILE A 80 1.131 0.739 -7.334 1.00 0.00 C ATOM 1312 CD1 ILE A 80 -0.395 4.128 -8.317 1.00 0.00 C ATOM 0 H ILE A 80 -1.361 0.837 -6.002 1.00 0.00 H new ATOM 0 HA ILE A 80 0.924 2.484 -5.047 1.00 0.00 H new ATOM 0 HB ILE A 80 1.510 2.826 -7.205 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.114 2.150 -9.130 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.362 2.245 -7.903 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.536 0.646 -8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.908 0.501 -6.607 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.297 0.048 -7.213 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.122 4.409 -9.079 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.674 4.579 -7.365 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.593 4.483 -8.610 1.00 0.00 H new ATOM 1324 N MET A 81 -0.176 4.713 -5.343 1.00 0.00 N ATOM 1325 CA MET A 81 -0.894 5.965 -5.178 1.00 0.00 C ATOM 1326 C MET A 81 -0.175 7.109 -5.898 1.00 0.00 C ATOM 1327 O MET A 81 1.016 7.331 -5.682 1.00 0.00 O ATOM 1328 CB MET A 81 -1.013 6.294 -3.689 1.00 0.00 C ATOM 1329 CG MET A 81 -0.181 5.325 -2.846 1.00 0.00 C ATOM 1330 SD MET A 81 -0.172 5.852 -1.141 1.00 0.00 S ATOM 1331 CE MET A 81 1.564 5.670 -0.768 1.00 0.00 C ATOM 0 H MET A 81 0.839 4.793 -5.287 1.00 0.00 H new ATOM 0 HA MET A 81 -1.886 5.853 -5.614 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.679 7.316 -3.511 1.00 0.00 H new ATOM 0 HB3 MET A 81 -2.058 6.242 -3.384 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.592 4.318 -2.922 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.839 5.282 -3.227 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.788 6.169 0.175 1.00 0.00 H new ATOM 0 HE2 MET A 81 1.809 4.611 -0.685 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.156 6.118 -1.565 1.00 0.00 H new ATOM 1341 N THR A 82 -0.928 7.804 -6.737 1.00 0.00 N ATOM 1342 CA THR A 82 -0.377 8.918 -7.489 1.00 0.00 C ATOM 1343 C THR A 82 -1.442 9.519 -8.409 1.00 0.00 C ATOM 1344 O THR A 82 -2.295 8.801 -8.929 1.00 0.00 O ATOM 1345 CB THR A 82 0.860 8.418 -8.238 1.00 0.00 C ATOM 1346 OG1 THR A 82 1.013 9.342 -9.312 1.00 0.00 O ATOM 1347 CG2 THR A 82 0.622 7.076 -8.932 1.00 0.00 C ATOM 0 H THR A 82 -1.915 7.617 -6.913 1.00 0.00 H new ATOM 0 HA THR A 82 -0.069 9.727 -6.827 1.00 0.00 H new ATOM 0 HB THR A 82 1.692 8.323 -7.541 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.671 8.996 -9.950 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.531 6.767 -9.448 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.353 6.325 -8.189 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.188 7.178 -9.654 1.00 0.00 H new ATOM 1355 N ALA A 83 -1.358 10.830 -8.581 1.00 0.00 N ATOM 1356 CA ALA A 83 -2.304 11.536 -9.429 1.00 0.00 C ATOM 1357 C ALA A 83 -2.288 10.918 -10.828 1.00 0.00 C ATOM 1358 O ALA A 83 -1.315 10.272 -11.214 1.00 0.00 O ATOM 1359 CB ALA A 83 -1.961 13.027 -9.446 1.00 0.00 C ATOM 0 H ALA A 83 -0.649 11.422 -8.148 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.317 11.439 -9.038 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.671 13.556 -10.082 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.015 13.424 -8.433 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.952 13.164 -9.836 1.00 0.00 H new ATOM 1365 N TYR A 84 -3.377 11.137 -11.550 1.00 0.00 N ATOM 1366 CA TYR A 84 -3.500 10.610 -12.898 1.00 0.00 C ATOM 1367 C TYR A 84 -2.505 11.285 -13.844 1.00 0.00 C ATOM 1368 O TYR A 84 -1.429 11.706 -13.421 1.00 0.00 O ATOM 1369 CB TYR A 84 -4.923 10.942 -13.353 1.00 0.00 C ATOM 1370 CG TYR A 84 -5.243 12.439 -13.353 1.00 0.00 C ATOM 1371 CD1 TYR A 84 -5.723 13.042 -12.208 1.00 0.00 C ATOM 1372 CD2 TYR A 84 -5.051 13.185 -14.498 1.00 0.00 C ATOM 1373 CE1 TYR A 84 -6.024 14.450 -12.208 1.00 0.00 C ATOM 1374 CE2 TYR A 84 -5.352 14.593 -14.498 1.00 0.00 C ATOM 1375 CZ TYR A 84 -5.823 15.156 -13.353 1.00 0.00 C ATOM 1376 OH TYR A 84 -6.108 16.486 -13.353 1.00 0.00 O ATOM 0 H TYR A 84 -4.183 11.673 -11.226 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.296 9.539 -12.911 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.073 10.549 -14.358 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.631 10.430 -12.701 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -5.873 12.458 -11.312 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -4.675 12.713 -15.394 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -6.401 14.934 -11.319 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -5.207 15.189 -15.387 1.00 0.00 H new ATOM 0 HH TYR A 84 -5.915 16.862 -14.237 1.00 0.00 H new ATOM 1386 N GLY A 85 -2.899 11.367 -15.106 1.00 0.00 N ATOM 1387 CA GLY A 85 -2.055 11.984 -16.115 1.00 0.00 C ATOM 1388 C GLY A 85 -0.924 11.043 -16.534 1.00 0.00 C ATOM 1389 O GLY A 85 -0.738 10.778 -17.721 1.00 0.00 O ATOM 0 H GLY A 85 -3.792 11.016 -15.453 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.656 12.247 -16.986 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.636 12.912 -15.726 1.00 0.00 H new ATOM 1393 N GLU A 86 -0.197 10.562 -15.535 1.00 0.00 N ATOM 1394 CA GLU A 86 0.911 9.656 -15.785 1.00 0.00 C ATOM 1395 C GLU A 86 0.415 8.209 -15.826 1.00 0.00 C ATOM 1396 O GLU A 86 1.056 7.313 -15.279 1.00 0.00 O ATOM 1397 CB GLU A 86 2.009 9.830 -14.733 1.00 0.00 C ATOM 1398 CG GLU A 86 1.418 9.844 -13.321 1.00 0.00 C ATOM 1399 CD GLU A 86 2.399 9.245 -12.311 1.00 0.00 C ATOM 1400 OE1 GLU A 86 3.580 9.650 -12.358 1.00 0.00 O ATOM 1401 OE2 GLU A 86 1.944 8.395 -11.514 1.00 0.00 O ATOM 0 H GLU A 86 -0.354 10.783 -14.552 1.00 0.00 H new ATOM 0 HA GLU A 86 1.342 9.899 -16.756 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.733 9.020 -14.820 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.548 10.760 -14.915 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.175 10.867 -13.035 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.486 9.279 -13.307 1.00 0.00 H new ATOM 1408 N LEU A 87 -0.723 8.026 -16.479 1.00 0.00 N ATOM 1409 CA LEU A 87 -1.313 6.704 -16.599 1.00 0.00 C ATOM 1410 C LEU A 87 -0.225 5.697 -16.980 1.00 0.00 C ATOM 1411 O LEU A 87 -0.268 4.543 -16.558 1.00 0.00 O ATOM 1412 CB LEU A 87 -2.494 6.730 -17.570 1.00 0.00 C ATOM 1413 CG LEU A 87 -3.664 7.635 -17.180 1.00 0.00 C ATOM 1414 CD1 LEU A 87 -4.520 7.982 -18.400 1.00 0.00 C ATOM 1415 CD2 LEU A 87 -4.494 7.006 -16.059 1.00 0.00 C ATOM 0 H LEU A 87 -1.252 8.772 -16.931 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.725 6.383 -15.642 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.128 7.044 -18.548 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.869 5.713 -17.682 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.258 8.570 -16.795 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.345 8.626 -18.095 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.908 8.501 -19.138 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.918 7.066 -18.838 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.319 7.670 -15.801 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.890 6.047 -16.394 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.864 6.852 -15.183 1.00 0.00 H new ATOM 1427 N ASP A 88 0.724 6.172 -17.773 1.00 0.00 N ATOM 1428 CA ASP A 88 1.821 5.329 -18.216 1.00 0.00 C ATOM 1429 C ASP A 88 2.343 4.515 -17.030 1.00 0.00 C ATOM 1430 O ASP A 88 2.553 3.308 -17.146 1.00 0.00 O ATOM 1431 CB ASP A 88 2.978 6.170 -18.758 1.00 0.00 C ATOM 1432 CG ASP A 88 3.081 6.221 -20.284 1.00 0.00 C ATOM 1433 OD1 ASP A 88 2.241 6.925 -20.885 1.00 0.00 O ATOM 1434 OD2 ASP A 88 3.997 5.556 -20.814 1.00 0.00 O ATOM 0 H ASP A 88 0.756 7.131 -18.120 1.00 0.00 H new ATOM 0 HA ASP A 88 1.448 4.678 -19.006 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.875 7.188 -18.382 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.912 5.775 -18.359 1.00 0.00 H new ATOM 1439 N MET A 89 2.537 5.207 -15.917 1.00 0.00 N ATOM 1440 CA MET A 89 3.030 4.563 -14.712 1.00 0.00 C ATOM 1441 C MET A 89 1.951 3.682 -14.080 1.00 0.00 C ATOM 1442 O MET A 89 2.203 2.524 -13.751 1.00 0.00 O ATOM 1443 CB MET A 89 3.472 5.630 -13.708 1.00 0.00 C ATOM 1444 CG MET A 89 4.690 5.160 -12.910 1.00 0.00 C ATOM 1445 SD MET A 89 4.179 4.574 -11.303 1.00 0.00 S ATOM 1446 CE MET A 89 5.774 4.327 -10.541 1.00 0.00 C ATOM 0 H MET A 89 2.362 6.208 -15.825 1.00 0.00 H new ATOM 0 HA MET A 89 3.876 3.931 -14.980 1.00 0.00 H new ATOM 0 HB2 MET A 89 3.712 6.553 -14.235 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.651 5.856 -13.027 1.00 0.00 H new ATOM 0 HG2 MET A 89 5.204 4.364 -13.450 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.400 5.979 -12.798 1.00 0.00 H new ATOM 0 HE1 MET A 89 5.638 4.027 -9.502 1.00 0.00 H new ATOM 0 HE2 MET A 89 6.316 3.547 -11.076 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.343 5.256 -10.580 1.00 0.00 H new ATOM 1456 N ILE A 90 0.771 4.265 -13.928 1.00 0.00 N ATOM 1457 CA ILE A 90 -0.348 3.548 -13.341 1.00 0.00 C ATOM 1458 C ILE A 90 -0.580 2.250 -14.117 1.00 0.00 C ATOM 1459 O ILE A 90 -0.929 1.226 -13.532 1.00 0.00 O ATOM 1460 CB ILE A 90 -1.582 4.449 -13.266 1.00 0.00 C ATOM 1461 CG1 ILE A 90 -1.326 5.657 -12.362 1.00 0.00 C ATOM 1462 CG2 ILE A 90 -2.815 3.655 -12.826 1.00 0.00 C ATOM 1463 CD1 ILE A 90 -1.428 6.963 -13.152 1.00 0.00 C ATOM 0 H ILE A 90 0.566 5.226 -14.201 1.00 0.00 H new ATOM 0 HA ILE A 90 -0.123 3.269 -12.312 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.785 4.833 -14.266 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.048 5.664 -11.545 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -0.336 5.576 -11.912 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.678 4.319 -12.781 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -3.008 2.857 -13.542 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.637 3.223 -11.841 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -1.242 7.806 -12.487 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.688 6.963 -13.953 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.426 7.052 -13.580 1.00 0.00 H new ATOM 1475 N GLN A 91 -0.378 2.336 -15.424 1.00 0.00 N ATOM 1476 CA GLN A 91 -0.560 1.181 -16.287 1.00 0.00 C ATOM 1477 C GLN A 91 0.377 0.048 -15.864 1.00 0.00 C ATOM 1478 O GLN A 91 -0.076 -1.049 -15.541 1.00 0.00 O ATOM 1479 CB GLN A 91 -0.342 1.553 -17.755 1.00 0.00 C ATOM 1480 CG GLN A 91 -1.671 1.871 -18.443 1.00 0.00 C ATOM 1481 CD GLN A 91 -1.992 0.833 -19.521 1.00 0.00 C ATOM 1482 OE1 GLN A 91 -1.138 0.094 -19.981 1.00 0.00 O ATOM 1483 NE2 GLN A 91 -3.268 0.820 -19.896 1.00 0.00 N ATOM 0 H GLN A 91 -0.090 3.188 -15.906 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.588 0.834 -16.183 1.00 0.00 H new ATOM 0 HB2 GLN A 91 0.321 2.416 -17.821 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.152 0.731 -18.273 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -2.472 1.892 -17.704 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -1.624 2.864 -18.891 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -3.932 1.467 -19.470 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -3.583 0.163 -20.610 1.00 0.00 H new ATOM 1492 N GLU A 92 1.666 0.353 -15.879 1.00 0.00 N ATOM 1493 CA GLU A 92 2.671 -0.626 -15.500 1.00 0.00 C ATOM 1494 C GLU A 92 2.285 -1.301 -14.183 1.00 0.00 C ATOM 1495 O GLU A 92 2.278 -2.527 -14.088 1.00 0.00 O ATOM 1496 CB GLU A 92 4.055 0.019 -15.401 1.00 0.00 C ATOM 1497 CG GLU A 92 4.920 -0.350 -16.608 1.00 0.00 C ATOM 1498 CD GLU A 92 5.015 0.817 -17.593 1.00 0.00 C ATOM 1499 OE1 GLU A 92 5.662 1.820 -17.223 1.00 0.00 O ATOM 1500 OE2 GLU A 92 4.437 0.679 -18.693 1.00 0.00 O ATOM 0 H GLU A 92 2.038 1.264 -16.148 1.00 0.00 H new ATOM 0 HA GLU A 92 2.717 -1.389 -16.277 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.952 1.102 -15.341 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.547 -0.306 -14.484 1.00 0.00 H new ATOM 0 HG2 GLU A 92 5.919 -0.629 -16.272 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.498 -1.220 -17.110 1.00 0.00 H new ATOM 1507 N SER A 93 1.974 -0.470 -13.198 1.00 0.00 N ATOM 1508 CA SER A 93 1.588 -0.972 -11.890 1.00 0.00 C ATOM 1509 C SER A 93 0.526 -2.063 -12.041 1.00 0.00 C ATOM 1510 O SER A 93 0.502 -3.022 -11.270 1.00 0.00 O ATOM 1511 CB SER A 93 1.066 0.158 -11.000 1.00 0.00 C ATOM 1512 OG SER A 93 0.663 1.294 -11.759 1.00 0.00 O ATOM 0 H SER A 93 1.982 0.547 -13.280 1.00 0.00 H new ATOM 0 HA SER A 93 2.470 -1.397 -11.412 1.00 0.00 H new ATOM 0 HB2 SER A 93 0.222 -0.204 -10.413 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.843 0.451 -10.294 1.00 0.00 H new ATOM 0 HG SER A 93 -0.280 1.203 -12.008 1.00 0.00 H new ATOM 1518 N LYS A 94 -0.328 -1.881 -13.038 1.00 0.00 N ATOM 1519 CA LYS A 94 -1.389 -2.838 -13.299 1.00 0.00 C ATOM 1520 C LYS A 94 -0.775 -4.160 -13.763 1.00 0.00 C ATOM 1521 O LYS A 94 -1.080 -5.217 -13.214 1.00 0.00 O ATOM 1522 CB LYS A 94 -2.407 -2.254 -14.281 1.00 0.00 C ATOM 1523 CG LYS A 94 -3.835 -2.431 -13.760 1.00 0.00 C ATOM 1524 CD LYS A 94 -4.670 -3.273 -14.726 1.00 0.00 C ATOM 1525 CE LYS A 94 -6.014 -2.602 -15.018 1.00 0.00 C ATOM 1526 NZ LYS A 94 -5.895 -1.688 -16.176 1.00 0.00 N ATOM 0 H LYS A 94 -0.306 -1.084 -13.675 1.00 0.00 H new ATOM 0 HA LYS A 94 -1.946 -3.048 -12.386 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.201 -1.195 -14.437 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.306 -2.744 -15.249 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -3.812 -2.910 -12.781 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.301 -1.455 -13.627 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.121 -3.416 -15.657 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.838 -4.262 -14.300 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.770 -3.361 -15.222 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.348 -2.047 -14.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.815 -1.241 -16.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -5.189 -0.954 -15.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.597 -2.227 -17.014 1.00 0.00 H new ATOM 1540 N GLU A 95 0.079 -4.057 -14.771 1.00 0.00 N ATOM 1541 CA GLU A 95 0.739 -5.232 -15.316 1.00 0.00 C ATOM 1542 C GLU A 95 1.702 -5.825 -14.286 1.00 0.00 C ATOM 1543 O GLU A 95 2.143 -6.964 -14.427 1.00 0.00 O ATOM 1544 CB GLU A 95 1.468 -4.896 -16.618 1.00 0.00 C ATOM 1545 CG GLU A 95 2.957 -4.653 -16.366 1.00 0.00 C ATOM 1546 CD GLU A 95 3.620 -4.005 -17.584 1.00 0.00 C ATOM 1547 OE1 GLU A 95 2.889 -3.318 -18.329 1.00 0.00 O ATOM 1548 OE2 GLU A 95 4.843 -4.212 -17.741 1.00 0.00 O ATOM 0 H GLU A 95 0.329 -3.178 -15.225 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.021 -5.978 -15.546 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.345 -5.713 -17.329 1.00 0.00 H new ATOM 0 HB3 GLU A 95 1.023 -4.010 -17.070 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.082 -4.010 -15.494 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.450 -5.598 -16.139 1.00 0.00 H new ATOM 1555 N LEU A 96 1.999 -5.026 -13.272 1.00 0.00 N ATOM 1556 CA LEU A 96 2.902 -5.458 -12.218 1.00 0.00 C ATOM 1557 C LEU A 96 2.180 -6.456 -11.312 1.00 0.00 C ATOM 1558 O LEU A 96 2.819 -7.218 -10.588 1.00 0.00 O ATOM 1559 CB LEU A 96 3.471 -4.250 -11.472 1.00 0.00 C ATOM 1560 CG LEU A 96 4.928 -3.896 -11.780 1.00 0.00 C ATOM 1561 CD1 LEU A 96 5.104 -3.533 -13.255 1.00 0.00 C ATOM 1562 CD2 LEU A 96 5.431 -2.788 -10.853 1.00 0.00 C ATOM 0 H LEU A 96 1.631 -4.082 -13.158 1.00 0.00 H new ATOM 0 HA LEU A 96 3.762 -5.976 -12.642 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.851 -3.383 -11.700 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.381 -4.434 -10.401 1.00 0.00 H new ATOM 0 HG LEU A 96 5.541 -4.777 -11.590 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.148 -3.286 -13.447 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.812 -4.380 -13.876 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.478 -2.674 -13.496 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.469 -2.556 -11.093 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.819 -1.896 -10.987 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.364 -3.122 -9.817 1.00 0.00 H new ATOM 1574 N GLY A 97 0.857 -6.420 -11.380 1.00 0.00 N ATOM 1575 CA GLY A 97 0.041 -7.313 -10.575 1.00 0.00 C ATOM 1576 C GLY A 97 -0.504 -6.593 -9.340 1.00 0.00 C ATOM 1577 O GLY A 97 -0.771 -7.222 -8.317 1.00 0.00 O ATOM 0 H GLY A 97 0.330 -5.786 -11.981 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -0.787 -7.694 -11.173 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.634 -8.174 -10.266 1.00 0.00 H new ATOM 1581 N ALA A 98 -0.653 -5.283 -9.475 1.00 0.00 N ATOM 1582 CA ALA A 98 -1.161 -4.471 -8.384 1.00 0.00 C ATOM 1583 C ALA A 98 -2.686 -4.584 -8.336 1.00 0.00 C ATOM 1584 O ALA A 98 -3.335 -4.717 -9.373 1.00 0.00 O ATOM 1585 CB ALA A 98 -0.689 -3.026 -8.560 1.00 0.00 C ATOM 0 H ALA A 98 -0.430 -4.764 -10.325 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.774 -4.827 -7.429 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.070 -2.416 -7.741 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.401 -2.996 -8.558 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.061 -2.635 -9.507 1.00 0.00 H new ATOM 1591 N LEU A 99 -3.214 -4.528 -7.122 1.00 0.00 N ATOM 1592 CA LEU A 99 -4.651 -4.623 -6.926 1.00 0.00 C ATOM 1593 C LEU A 99 -5.337 -3.458 -7.642 1.00 0.00 C ATOM 1594 O LEU A 99 -6.244 -3.667 -8.446 1.00 0.00 O ATOM 1595 CB LEU A 99 -4.983 -4.710 -5.435 1.00 0.00 C ATOM 1596 CG LEU A 99 -3.948 -5.417 -4.557 1.00 0.00 C ATOM 1597 CD1 LEU A 99 -3.248 -6.537 -5.329 1.00 0.00 C ATOM 1598 CD2 LEU A 99 -2.951 -4.415 -3.971 1.00 0.00 C ATOM 0 H LEU A 99 -2.673 -4.418 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.037 -5.541 -7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.122 -3.698 -5.055 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.937 -5.226 -5.325 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.469 -5.880 -3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.518 -7.023 -4.682 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.986 -7.269 -5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.741 -6.118 -6.198 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.226 -4.943 -3.351 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.431 -3.903 -4.781 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.484 -3.684 -3.363 1.00 0.00 H new ATOM 1610 N THR A 100 -4.878 -2.257 -7.323 1.00 0.00 N ATOM 1611 CA THR A 100 -5.436 -1.058 -7.926 1.00 0.00 C ATOM 1612 C THR A 100 -4.469 0.117 -7.771 1.00 0.00 C ATOM 1613 O THR A 100 -3.355 -0.052 -7.278 1.00 0.00 O ATOM 1614 CB THR A 100 -6.807 -0.805 -7.294 1.00 0.00 C ATOM 1615 OG1 THR A 100 -7.247 0.410 -7.894 1.00 0.00 O ATOM 1616 CG2 THR A 100 -6.712 -0.472 -5.804 1.00 0.00 C ATOM 0 H THR A 100 -4.126 -2.088 -6.655 1.00 0.00 H new ATOM 0 HA THR A 100 -5.575 -1.183 -9.000 1.00 0.00 H new ATOM 0 HB THR A 100 -7.437 -1.684 -7.430 1.00 0.00 H new ATOM 0 HG1 THR A 100 -8.130 0.648 -7.542 1.00 0.00 H new ATOM 0 HG21 THR A 100 -7.712 -0.302 -5.405 1.00 0.00 H new ATOM 0 HG22 THR A 100 -6.247 -1.303 -5.274 1.00 0.00 H new ATOM 0 HG23 THR A 100 -6.110 0.426 -5.670 1.00 0.00 H new ATOM 1624 N HIS A 101 -4.931 1.283 -8.200 1.00 0.00 N ATOM 1625 CA HIS A 101 -4.121 2.486 -8.115 1.00 0.00 C ATOM 1626 C HIS A 101 -5.008 3.677 -7.746 1.00 0.00 C ATOM 1627 O HIS A 101 -6.025 3.921 -8.393 1.00 0.00 O ATOM 1628 CB HIS A 101 -3.340 2.708 -9.412 1.00 0.00 C ATOM 1629 CG HIS A 101 -2.898 1.432 -10.089 1.00 0.00 C ATOM 1630 ND1 HIS A 101 -3.249 1.113 -11.389 1.00 0.00 N ATOM 1631 CD2 HIS A 101 -2.130 0.401 -9.633 1.00 0.00 C ATOM 1632 CE1 HIS A 101 -2.712 -0.060 -11.691 1.00 0.00 C ATOM 1633 NE2 HIS A 101 -2.020 -0.500 -10.602 1.00 0.00 N ATOM 0 H HIS A 101 -5.856 1.420 -8.607 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.377 2.373 -7.326 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.959 3.279 -10.104 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -2.461 3.316 -9.196 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -3.823 1.684 -12.009 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -1.687 0.330 -8.651 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -2.806 -0.577 -12.635 1.00 0.00 H new ATOM 1641 N PHE A 102 -4.590 4.385 -6.708 1.00 0.00 N ATOM 1642 CA PHE A 102 -5.333 5.544 -6.245 1.00 0.00 C ATOM 1643 C PHE A 102 -4.623 6.843 -6.633 1.00 0.00 C ATOM 1644 O PHE A 102 -3.410 6.854 -6.837 1.00 0.00 O ATOM 1645 CB PHE A 102 -5.403 5.451 -4.719 1.00 0.00 C ATOM 1646 CG PHE A 102 -6.006 4.144 -4.202 1.00 0.00 C ATOM 1647 CD1 PHE A 102 -7.071 3.588 -4.839 1.00 0.00 C ATOM 1648 CD2 PHE A 102 -5.478 3.538 -3.105 1.00 0.00 C ATOM 1649 CE1 PHE A 102 -7.631 2.374 -4.360 1.00 0.00 C ATOM 1650 CE2 PHE A 102 -6.038 2.325 -2.625 1.00 0.00 C ATOM 1651 CZ PHE A 102 -7.103 1.769 -3.262 1.00 0.00 C ATOM 0 H PHE A 102 -3.746 4.178 -6.174 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.324 5.555 -6.698 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.398 5.561 -4.312 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.993 6.286 -4.341 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -7.491 4.070 -5.709 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.632 3.980 -2.599 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.476 1.931 -4.867 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.618 1.844 -1.754 1.00 0.00 H new ATOM 0 HZ PHE A 102 -7.530 0.847 -2.896 1.00 0.00 H new ATOM 1661 N ALA A 103 -5.409 7.906 -6.723 1.00 0.00 N ATOM 1662 CA ALA A 103 -4.870 9.206 -7.083 1.00 0.00 C ATOM 1663 C ALA A 103 -4.887 10.118 -5.855 1.00 0.00 C ATOM 1664 O ALA A 103 -5.766 10.002 -5.003 1.00 0.00 O ATOM 1665 CB ALA A 103 -5.671 9.785 -8.251 1.00 0.00 C ATOM 0 H ALA A 103 -6.415 7.893 -6.553 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.835 9.115 -7.411 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.267 10.761 -8.521 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -5.603 9.114 -9.107 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -6.715 9.894 -7.958 1.00 0.00 H new ATOM 1671 N LYS A 104 -3.905 11.006 -5.804 1.00 0.00 N ATOM 1672 CA LYS A 104 -3.796 11.938 -4.694 1.00 0.00 C ATOM 1673 C LYS A 104 -5.172 12.121 -4.050 1.00 0.00 C ATOM 1674 O LYS A 104 -5.352 11.831 -2.869 1.00 0.00 O ATOM 1675 CB LYS A 104 -3.153 13.247 -5.155 1.00 0.00 C ATOM 1676 CG LYS A 104 -1.757 13.416 -4.552 1.00 0.00 C ATOM 1677 CD LYS A 104 -1.064 14.659 -5.113 1.00 0.00 C ATOM 1678 CE LYS A 104 0.248 14.935 -4.375 1.00 0.00 C ATOM 1679 NZ LYS A 104 0.272 16.323 -3.862 1.00 0.00 N ATOM 0 H LYS A 104 -3.178 11.100 -6.513 1.00 0.00 H new ATOM 0 HA LYS A 104 -3.135 11.539 -3.925 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.087 13.260 -6.243 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -3.783 14.088 -4.864 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -1.833 13.496 -3.468 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -1.155 12.532 -4.765 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.866 14.521 -6.176 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -1.725 15.521 -5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 104 0.362 14.234 -3.548 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.091 14.775 -5.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.169 16.494 -3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.185 16.988 -4.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -0.521 16.464 -3.204 1.00 0.00 H new ATOM 1693 N PRO A 105 -6.132 12.613 -4.878 1.00 0.00 N ATOM 1694 CA PRO A 105 -7.486 12.838 -4.401 1.00 0.00 C ATOM 1695 C PRO A 105 -8.242 11.517 -4.254 1.00 0.00 C ATOM 1696 O PRO A 105 -8.850 11.035 -5.209 1.00 0.00 O ATOM 1697 CB PRO A 105 -8.114 13.770 -5.426 1.00 0.00 C ATOM 1698 CG PRO A 105 -7.250 13.662 -6.672 1.00 0.00 C ATOM 1699 CD PRO A 105 -5.955 12.968 -6.283 1.00 0.00 C ATOM 0 HA PRO A 105 -7.513 13.284 -3.407 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.143 13.481 -5.638 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -8.141 14.795 -5.057 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.768 13.097 -7.448 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -7.045 14.651 -7.081 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -5.780 12.084 -6.896 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.097 13.626 -6.420 1.00 0.00 H new ATOM 1707 N PHE A 106 -8.181 10.968 -3.050 1.00 0.00 N ATOM 1708 CA PHE A 106 -8.852 9.711 -2.765 1.00 0.00 C ATOM 1709 C PHE A 106 -9.698 9.817 -1.494 1.00 0.00 C ATOM 1710 O PHE A 106 -9.422 10.645 -0.628 1.00 0.00 O ATOM 1711 CB PHE A 106 -7.761 8.660 -2.551 1.00 0.00 C ATOM 1712 CG PHE A 106 -6.431 9.234 -2.061 1.00 0.00 C ATOM 1713 CD1 PHE A 106 -6.395 10.011 -0.945 1.00 0.00 C ATOM 1714 CD2 PHE A 106 -5.283 8.968 -2.741 1.00 0.00 C ATOM 1715 CE1 PHE A 106 -5.160 10.545 -0.491 1.00 0.00 C ATOM 1716 CE2 PHE A 106 -4.048 9.501 -2.286 1.00 0.00 C ATOM 1717 CZ PHE A 106 -4.013 10.278 -1.171 1.00 0.00 C ATOM 0 H PHE A 106 -7.677 11.371 -2.260 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.515 9.448 -3.589 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -8.116 7.925 -1.829 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.593 8.130 -3.488 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.306 10.222 -0.404 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.311 8.351 -3.627 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.132 11.163 0.394 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -3.137 9.289 -2.826 1.00 0.00 H new ATOM 0 HZ PHE A 106 -3.074 10.683 -0.825 1.00 0.00 H new ATOM 1727 N ASP A 107 -10.711 8.966 -1.423 1.00 0.00 N ATOM 1728 CA ASP A 107 -11.599 8.954 -0.273 1.00 0.00 C ATOM 1729 C ASP A 107 -11.435 7.631 0.478 1.00 0.00 C ATOM 1730 O ASP A 107 -11.257 6.581 -0.138 1.00 0.00 O ATOM 1731 CB ASP A 107 -13.062 9.074 -0.705 1.00 0.00 C ATOM 1732 CG ASP A 107 -13.939 9.927 0.213 1.00 0.00 C ATOM 1733 OD1 ASP A 107 -13.462 10.238 1.326 1.00 0.00 O ATOM 1734 OD2 ASP A 107 -15.067 10.249 -0.218 1.00 0.00 O ATOM 0 H ASP A 107 -10.937 8.280 -2.143 1.00 0.00 H new ATOM 0 HA ASP A 107 -11.340 9.801 0.362 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.095 9.496 -1.709 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -13.491 8.074 -0.765 1.00 0.00 H new ATOM 1739 N ILE A 108 -11.501 7.724 1.798 1.00 0.00 N ATOM 1740 CA ILE A 108 -11.362 6.548 2.639 1.00 0.00 C ATOM 1741 C ILE A 108 -12.631 5.700 2.536 1.00 0.00 C ATOM 1742 O ILE A 108 -12.599 4.496 2.787 1.00 0.00 O ATOM 1743 CB ILE A 108 -11.008 6.953 4.072 1.00 0.00 C ATOM 1744 CG1 ILE A 108 -9.493 7.068 4.250 1.00 0.00 C ATOM 1745 CG2 ILE A 108 -11.632 5.990 5.084 1.00 0.00 C ATOM 1746 CD1 ILE A 108 -8.836 7.657 2.999 1.00 0.00 C ATOM 0 H ILE A 108 -11.649 8.596 2.306 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.535 5.928 2.293 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.431 7.939 4.263 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.271 7.697 5.112 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.072 6.084 4.457 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -11.365 6.300 6.094 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.717 6.001 4.976 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -11.260 4.982 4.904 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.759 7.728 3.153 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.039 7.012 2.144 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -9.241 8.651 2.809 1.00 0.00 H new ATOM 1758 N ASP A 109 -13.718 6.361 2.166 1.00 0.00 N ATOM 1759 CA ASP A 109 -14.995 5.682 2.026 1.00 0.00 C ATOM 1760 C ASP A 109 -14.960 4.790 0.784 1.00 0.00 C ATOM 1761 O ASP A 109 -15.521 3.695 0.786 1.00 0.00 O ATOM 1762 CB ASP A 109 -16.136 6.687 1.855 1.00 0.00 C ATOM 1763 CG ASP A 109 -17.325 6.482 2.796 1.00 0.00 C ATOM 1764 OD1 ASP A 109 -17.094 6.544 4.023 1.00 0.00 O ATOM 1765 OD2 ASP A 109 -18.437 6.269 2.268 1.00 0.00 O ATOM 0 H ASP A 109 -13.741 7.359 1.959 1.00 0.00 H new ATOM 0 HA ASP A 109 -15.165 5.093 2.927 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -15.741 7.692 2.007 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -16.493 6.637 0.826 1.00 0.00 H new ATOM 1770 N GLU A 110 -14.297 5.291 -0.248 1.00 0.00 N ATOM 1771 CA GLU A 110 -14.182 4.553 -1.494 1.00 0.00 C ATOM 1772 C GLU A 110 -13.162 3.422 -1.349 1.00 0.00 C ATOM 1773 O GLU A 110 -13.227 2.426 -2.067 1.00 0.00 O ATOM 1774 CB GLU A 110 -13.809 5.483 -2.650 1.00 0.00 C ATOM 1775 CG GLU A 110 -12.377 6.001 -2.496 1.00 0.00 C ATOM 1776 CD GLU A 110 -11.695 6.138 -3.859 1.00 0.00 C ATOM 1777 OE1 GLU A 110 -11.187 5.104 -4.346 1.00 0.00 O ATOM 1778 OE2 GLU A 110 -11.696 7.273 -4.383 1.00 0.00 O ATOM 0 H GLU A 110 -13.834 6.200 -0.247 1.00 0.00 H new ATOM 0 HA GLU A 110 -15.153 4.113 -1.724 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -13.907 4.951 -3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -14.502 6.324 -2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -12.388 6.967 -1.992 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -11.805 5.319 -1.866 1.00 0.00 H new ATOM 1785 N ILE A 111 -12.242 3.614 -0.414 1.00 0.00 N ATOM 1786 CA ILE A 111 -11.210 2.623 -0.165 1.00 0.00 C ATOM 1787 C ILE A 111 -11.797 1.478 0.663 1.00 0.00 C ATOM 1788 O ILE A 111 -11.252 0.375 0.678 1.00 0.00 O ATOM 1789 CB ILE A 111 -9.982 3.276 0.472 1.00 0.00 C ATOM 1790 CG1 ILE A 111 -9.104 3.945 -0.588 1.00 0.00 C ATOM 1791 CG2 ILE A 111 -9.197 2.266 1.312 1.00 0.00 C ATOM 1792 CD1 ILE A 111 -8.166 4.974 0.047 1.00 0.00 C ATOM 0 H ILE A 111 -12.191 4.442 0.180 1.00 0.00 H new ATOM 0 HA ILE A 111 -10.862 2.192 -1.104 1.00 0.00 H new ATOM 0 HB ILE A 111 -10.325 4.060 1.148 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -8.519 3.189 -1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -9.734 4.432 -1.332 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -8.329 2.756 1.753 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -9.836 1.877 2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -8.866 1.444 0.677 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.553 5.435 -0.728 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.755 5.742 0.549 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.521 4.479 0.773 1.00 0.00 H new ATOM 1804 N ARG A 112 -12.900 1.779 1.331 1.00 0.00 N ATOM 1805 CA ARG A 112 -13.567 0.789 2.160 1.00 0.00 C ATOM 1806 C ARG A 112 -14.288 -0.238 1.284 1.00 0.00 C ATOM 1807 O ARG A 112 -14.603 -1.336 1.739 1.00 0.00 O ATOM 1808 CB ARG A 112 -14.579 1.448 3.099 1.00 0.00 C ATOM 1809 CG ARG A 112 -13.904 2.498 3.983 1.00 0.00 C ATOM 1810 CD ARG A 112 -14.140 2.200 5.465 1.00 0.00 C ATOM 1811 NE ARG A 112 -13.072 1.314 5.980 1.00 0.00 N ATOM 1812 CZ ARG A 112 -13.089 0.743 7.192 1.00 0.00 C ATOM 1813 NH1 ARG A 112 -14.119 0.962 8.021 1.00 0.00 N ATOM 1814 NH2 ARG A 112 -12.077 -0.047 7.575 1.00 0.00 N ATOM 0 H ARG A 112 -13.349 2.695 1.315 1.00 0.00 H new ATOM 0 HA ARG A 112 -12.805 0.290 2.759 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.372 1.915 2.515 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.048 0.689 3.724 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -12.834 2.517 3.778 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.293 3.487 3.741 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -14.158 3.130 6.033 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.113 1.726 5.599 1.00 0.00 H new ATOM 0 HE ARG A 112 -12.273 1.126 5.374 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.890 1.563 7.729 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.132 0.527 8.944 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -11.293 -0.214 6.944 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -12.090 -0.482 8.498 1.00 0.00 H new ATOM 1828 N ASP A 113 -14.528 0.156 0.042 1.00 0.00 N ATOM 1829 CA ASP A 113 -15.206 -0.716 -0.902 1.00 0.00 C ATOM 1830 C ASP A 113 -14.187 -1.663 -1.538 1.00 0.00 C ATOM 1831 O ASP A 113 -14.390 -2.876 -1.558 1.00 0.00 O ATOM 1832 CB ASP A 113 -15.864 0.092 -2.023 1.00 0.00 C ATOM 1833 CG ASP A 113 -17.364 -0.151 -2.200 1.00 0.00 C ATOM 1834 OD1 ASP A 113 -17.869 -1.088 -1.545 1.00 0.00 O ATOM 1835 OD2 ASP A 113 -17.973 0.606 -2.987 1.00 0.00 O ATOM 0 H ASP A 113 -14.265 1.068 -0.333 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.972 -1.270 -0.359 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.703 1.152 -1.829 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.360 -0.140 -2.961 1.00 0.00 H new ATOM 1840 N ALA A 114 -13.112 -1.074 -2.041 1.00 0.00 N ATOM 1841 CA ALA A 114 -12.061 -1.850 -2.675 1.00 0.00 C ATOM 1842 C ALA A 114 -11.444 -2.801 -1.647 1.00 0.00 C ATOM 1843 O ALA A 114 -10.950 -3.870 -2.003 1.00 0.00 O ATOM 1844 CB ALA A 114 -11.026 -0.904 -3.288 1.00 0.00 C ATOM 0 H ALA A 114 -12.947 -0.068 -2.022 1.00 0.00 H new ATOM 0 HA ALA A 114 -12.468 -2.457 -3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.237 -1.487 -3.764 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -11.508 -0.270 -4.032 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -10.594 -0.280 -2.505 1.00 0.00 H new ATOM 1850 N VAL A 115 -11.493 -2.378 -0.393 1.00 0.00 N ATOM 1851 CA VAL A 115 -10.946 -3.178 0.689 1.00 0.00 C ATOM 1852 C VAL A 115 -11.704 -4.504 0.771 1.00 0.00 C ATOM 1853 O VAL A 115 -11.103 -5.555 0.993 1.00 0.00 O ATOM 1854 CB VAL A 115 -10.984 -2.386 1.997 1.00 0.00 C ATOM 1855 CG1 VAL A 115 -10.899 -3.320 3.206 1.00 0.00 C ATOM 1856 CG2 VAL A 115 -9.872 -1.336 2.036 1.00 0.00 C ATOM 0 H VAL A 115 -11.903 -1.491 -0.102 1.00 0.00 H new ATOM 0 HA VAL A 115 -9.899 -3.413 0.498 1.00 0.00 H new ATOM 0 HB VAL A 115 -11.939 -1.863 2.044 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -10.928 -2.732 4.123 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -11.742 -4.011 3.192 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -9.967 -3.883 3.166 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -9.922 -0.788 2.977 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -8.903 -1.829 1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -9.997 -0.642 1.205 1.00 0.00 H new ATOM 1866 N LYS A 116 -13.013 -4.413 0.587 1.00 0.00 N ATOM 1867 CA LYS A 116 -13.860 -5.593 0.637 1.00 0.00 C ATOM 1868 C LYS A 116 -13.437 -6.566 -0.466 1.00 0.00 C ATOM 1869 O LYS A 116 -13.827 -7.732 -0.452 1.00 0.00 O ATOM 1870 CB LYS A 116 -15.336 -5.196 0.574 1.00 0.00 C ATOM 1871 CG LYS A 116 -16.240 -6.425 0.688 1.00 0.00 C ATOM 1872 CD LYS A 116 -16.743 -6.865 -0.689 1.00 0.00 C ATOM 1873 CE LYS A 116 -17.892 -7.867 -0.558 1.00 0.00 C ATOM 1874 NZ LYS A 116 -18.067 -8.622 -1.819 1.00 0.00 N ATOM 0 H LYS A 116 -13.508 -3.540 0.403 1.00 0.00 H new ATOM 0 HA LYS A 116 -13.734 -6.113 1.587 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -15.563 -4.497 1.379 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -15.537 -4.678 -0.364 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -15.692 -7.242 1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -17.088 -6.198 1.334 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -17.077 -5.994 -1.253 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -15.925 -7.315 -1.252 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -17.689 -8.557 0.261 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -18.814 -7.341 -0.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -18.851 -9.298 -1.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -18.282 -7.961 -2.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -17.192 -9.139 -2.039 1.00 0.00 H new ATOM 1888 N LYS A 117 -12.646 -6.050 -1.395 1.00 0.00 N ATOM 1889 CA LYS A 117 -12.166 -6.859 -2.502 1.00 0.00 C ATOM 1890 C LYS A 117 -10.681 -7.165 -2.299 1.00 0.00 C ATOM 1891 O LYS A 117 -10.184 -8.186 -2.772 1.00 0.00 O ATOM 1892 CB LYS A 117 -12.476 -6.177 -3.837 1.00 0.00 C ATOM 1893 CG LYS A 117 -13.973 -6.238 -4.149 1.00 0.00 C ATOM 1894 CD LYS A 117 -14.529 -4.842 -4.438 1.00 0.00 C ATOM 1895 CE LYS A 117 -14.096 -4.356 -5.822 1.00 0.00 C ATOM 1896 NZ LYS A 117 -15.134 -4.670 -6.830 1.00 0.00 N ATOM 0 H LYS A 117 -12.326 -5.082 -1.404 1.00 0.00 H new ATOM 0 HA LYS A 117 -12.688 -7.816 -2.529 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -12.150 -5.137 -3.803 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.914 -6.661 -4.636 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -14.143 -6.886 -5.008 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.506 -6.679 -3.307 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -15.617 -4.861 -4.379 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -14.180 -4.143 -3.678 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -13.918 -3.281 -5.797 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.154 -4.828 -6.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.824 -4.333 -7.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.284 -5.699 -6.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -16.024 -4.199 -6.570 1.00 0.00 H new ATOM 1910 N TYR A 118 -10.015 -6.263 -1.594 1.00 0.00 N ATOM 1911 CA TYR A 118 -8.596 -6.424 -1.322 1.00 0.00 C ATOM 1912 C TYR A 118 -8.370 -7.322 -0.104 1.00 0.00 C ATOM 1913 O TYR A 118 -7.571 -8.255 -0.155 1.00 0.00 O ATOM 1914 CB TYR A 118 -8.064 -5.023 -1.014 1.00 0.00 C ATOM 1915 CG TYR A 118 -7.286 -4.928 0.300 1.00 0.00 C ATOM 1916 CD1 TYR A 118 -6.332 -5.877 0.607 1.00 0.00 C ATOM 1917 CD2 TYR A 118 -7.538 -3.893 1.177 1.00 0.00 C ATOM 1918 CE1 TYR A 118 -5.600 -5.787 1.844 1.00 0.00 C ATOM 1919 CE2 TYR A 118 -6.805 -3.803 2.414 1.00 0.00 C ATOM 1920 CZ TYR A 118 -5.873 -4.755 2.686 1.00 0.00 C ATOM 1921 OH TYR A 118 -5.181 -4.670 3.854 1.00 0.00 O ATOM 0 H TYR A 118 -10.431 -5.418 -1.203 1.00 0.00 H new ATOM 0 HA TYR A 118 -8.092 -6.885 -2.172 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -7.417 -4.703 -1.831 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -8.902 -4.327 -0.979 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -6.135 -6.687 -0.080 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -8.284 -3.151 0.936 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -4.851 -6.523 2.097 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -6.991 -2.998 3.109 1.00 0.00 H new ATOM 0 HH TYR A 118 -5.690 -5.106 4.569 1.00 0.00 H new ATOM 1931 N LEU A 119 -9.089 -7.007 0.964 1.00 0.00 N ATOM 1932 CA LEU A 119 -8.977 -7.774 2.194 1.00 0.00 C ATOM 1933 C LEU A 119 -10.377 -8.071 2.734 1.00 0.00 C ATOM 1934 O LEU A 119 -11.290 -7.260 2.583 1.00 0.00 O ATOM 1935 CB LEU A 119 -8.072 -7.052 3.194 1.00 0.00 C ATOM 1936 CG LEU A 119 -6.872 -7.849 3.710 1.00 0.00 C ATOM 1937 CD1 LEU A 119 -7.148 -8.415 5.104 1.00 0.00 C ATOM 1938 CD2 LEU A 119 -6.472 -8.941 2.716 1.00 0.00 C ATOM 0 H LEU A 119 -9.751 -6.232 1.003 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.499 -8.735 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.703 -6.139 2.726 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.677 -6.750 4.049 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.024 -7.170 3.801 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -6.279 -8.977 5.447 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.347 -7.597 5.796 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.014 -9.075 5.064 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.617 -9.493 3.106 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.309 -9.624 2.570 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.205 -8.485 1.763 1.00 0.00 H new ATOM 1950 N PRO A 120 -10.506 -9.266 3.370 1.00 0.00 N ATOM 1951 CA PRO A 120 -11.780 -9.680 3.933 1.00 0.00 C ATOM 1952 C PRO A 120 -12.080 -8.920 5.227 1.00 0.00 C ATOM 1953 O PRO A 120 -12.287 -9.530 6.275 1.00 0.00 O ATOM 1954 CB PRO A 120 -11.649 -11.180 4.142 1.00 0.00 C ATOM 1955 CG PRO A 120 -10.158 -11.474 4.125 1.00 0.00 C ATOM 1956 CD PRO A 120 -9.447 -10.251 3.568 1.00 0.00 C ATOM 0 HA PRO A 120 -12.622 -9.455 3.279 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -12.096 -11.483 5.089 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -12.165 -11.731 3.355 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -9.802 -11.697 5.131 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -9.949 -12.350 3.511 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.689 -9.884 4.260 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -8.939 -10.480 2.631 1.00 0.00 H new ATOM 1964 N LEU A 121 -12.094 -7.601 5.111 1.00 0.00 N ATOM 1965 CA LEU A 121 -12.365 -6.751 6.259 1.00 0.00 C ATOM 1966 C LEU A 121 -13.861 -6.432 6.309 1.00 0.00 C ATOM 1967 O LEU A 121 -14.580 -6.653 5.336 1.00 0.00 O ATOM 1968 CB LEU A 121 -11.472 -5.510 6.229 1.00 0.00 C ATOM 1969 CG LEU A 121 -11.805 -4.420 7.250 1.00 0.00 C ATOM 1970 CD1 LEU A 121 -11.574 -4.917 8.678 1.00 0.00 C ATOM 1971 CD2 LEU A 121 -11.023 -3.137 6.957 1.00 0.00 C ATOM 0 H LEU A 121 -11.922 -7.099 4.240 1.00 0.00 H new ATOM 0 HA LEU A 121 -12.118 -7.270 7.185 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.440 -5.825 6.387 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -11.523 -5.074 5.231 1.00 0.00 H new ATOM 0 HG LEU A 121 -12.864 -4.180 7.160 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -11.818 -4.123 9.384 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -12.210 -5.781 8.870 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -10.529 -5.202 8.800 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -11.278 -2.378 7.697 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -9.954 -3.344 7.003 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -11.280 -2.774 5.962 1.00 0.00 H new ATOM 1983 N LYS A 122 -14.285 -5.917 7.454 1.00 0.00 N ATOM 1984 CA LYS A 122 -15.682 -5.565 7.644 1.00 0.00 C ATOM 1985 C LYS A 122 -16.155 -4.716 6.463 1.00 0.00 C ATOM 1986 O LYS A 122 -15.591 -3.657 6.189 1.00 0.00 O ATOM 1987 CB LYS A 122 -15.884 -4.893 9.004 1.00 0.00 C ATOM 1988 CG LYS A 122 -17.311 -4.357 9.144 1.00 0.00 C ATOM 1989 CD LYS A 122 -17.334 -2.830 9.051 1.00 0.00 C ATOM 1990 CE LYS A 122 -18.770 -2.305 9.018 1.00 0.00 C ATOM 1991 NZ LYS A 122 -18.799 -0.903 8.544 1.00 0.00 N ATOM 0 H LYS A 122 -13.686 -5.735 8.259 1.00 0.00 H new ATOM 0 HA LYS A 122 -16.302 -6.461 7.661 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.680 -5.608 9.801 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.172 -4.076 9.119 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -17.941 -4.782 8.363 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -17.730 -4.673 10.099 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -16.806 -2.402 9.903 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -16.805 -2.509 8.154 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -19.377 -2.929 8.362 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -19.209 -2.368 10.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -19.375 -0.329 9.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.830 -0.526 8.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -19.212 -0.867 7.590 1.00 0.00 H new ATOM 2005 N SER A 123 -17.185 -5.212 5.794 1.00 0.00 N ATOM 2006 CA SER A 123 -17.740 -4.512 4.648 1.00 0.00 C ATOM 2007 C SER A 123 -18.039 -3.058 5.017 1.00 0.00 C ATOM 2008 O SER A 123 -18.451 -2.771 6.140 1.00 0.00 O ATOM 2009 CB SER A 123 -19.009 -5.202 4.142 1.00 0.00 C ATOM 2010 OG SER A 123 -19.401 -4.725 2.858 1.00 0.00 O ATOM 0 H SER A 123 -17.650 -6.090 6.023 1.00 0.00 H new ATOM 0 HA SER A 123 -17.003 -4.533 3.846 1.00 0.00 H new ATOM 0 HB2 SER A 123 -18.842 -6.278 4.093 1.00 0.00 H new ATOM 0 HB3 SER A 123 -19.819 -5.037 4.853 1.00 0.00 H new ATOM 0 HG SER A 123 -20.213 -5.191 2.570 1.00 0.00 H new ATOM 2016 N ASN A 124 -17.819 -2.178 4.051 1.00 0.00 N ATOM 2017 CA ASN A 124 -18.060 -0.761 4.260 1.00 0.00 C ATOM 2018 C ASN A 124 -19.544 -0.538 4.558 1.00 0.00 C ATOM 2019 O ASN A 124 -19.955 -0.536 5.717 1.00 0.00 O ATOM 2020 CB ASN A 124 -17.701 0.049 3.013 1.00 0.00 C ATOM 2021 CG ASN A 124 -18.011 1.534 3.215 1.00 0.00 C ATOM 2022 OD1 ASN A 124 -18.056 2.040 4.324 1.00 0.00 O ATOM 2023 ND2 ASN A 124 -18.224 2.201 2.084 1.00 0.00 N ATOM 0 H ASN A 124 -17.476 -2.420 3.121 1.00 0.00 H new ATOM 0 HA ASN A 124 -17.439 -0.433 5.094 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -16.643 -0.077 2.785 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -18.259 -0.329 2.156 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -18.440 3.197 2.113 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -18.171 1.716 1.188 1.00 0.00 H new TER 2030 ASN A 124