USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1036 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 20 ASN : amide:sc= -0.226 X(o=-0.55,f=-0.34) USER MOD Set 1.2: A 24 ASN : amide:sc= -0.324 X(o=-0.55,f=-0.065) USER MOD Single : A 1 MET CE :methyl 146:sc= -0.109 (180deg=-0.839) USER MOD Single : A 1 MET N :NH3+ 142:sc= -0.326 (180deg=-1.57!) USER MOD Single : A 2 MET CE :methyl 152:sc= 0 (180deg=-0.00277) USER MOD Single : A 3 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.71) USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00154) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 TYR OH : rot 180:sc= -0.12 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 162:sc= -1.9! USER MOD Single : A 29 GLN : amide:sc= -0.181 K(o=-0.18,f=-0.7) USER MOD Single : A 30 THR OG1 : rot -160:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -0.138 K(o=-0.14,f=-1.4!) USER MOD Single : A 35 ASN : amide:sc= -7.86! C(o=-7.9!,f=-21!) USER MOD Single : A 38 GLN :FLIP amide:sc= -1.1 F(o=-2.1!,f=-1.1) USER MOD Single : A 44 THR OG1 : rot 71:sc= 0.949 USER MOD Single : A 45 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.00844) USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0146) USER MOD Single : A 60 MET CE :methyl 153:sc= -4.46! (180deg=-5.04!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -152:sc= -6.88! (180deg=-9.39!) USER MOD Single : A 70 LYS NZ :NH3+ -161:sc= -3.42! (180deg=-5.48!) USER MOD Single : A 75 ASN : amide:sc= -0.0765 K(o=-0.076,f=-3.8!) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot -60:sc= -4.4! USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 136:sc= -0.287 (180deg=-3.09!) USER MOD Single : A 91 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.007) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 145:sc= -2.22! USER MOD Single : A 101 HIS : no HE2:sc= -31.1! C(o=-31!,f=-38!) 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+ 155:sc= -0.0186 (180deg=-0.231) USER MOD Single : A 118 TYR OH : rot 180:sc= -0.188 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.1 K(o=-1.1,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.028 -18.867 -5.449 1.00 0.00 N ATOM 2 CA MET A 1 9.283 -18.412 -4.240 1.00 0.00 C ATOM 3 C MET A 1 8.776 -16.986 -4.461 1.00 0.00 C ATOM 4 O MET A 1 9.537 -16.083 -4.744 1.00 0.00 O ATOM 5 CB MET A 1 10.215 -18.440 -3.027 1.00 0.00 C ATOM 6 CG MET A 1 11.499 -17.675 -3.351 1.00 0.00 C ATOM 7 SD MET A 1 11.672 -16.279 -2.213 1.00 0.00 S ATOM 8 CE MET A 1 11.835 -17.244 -0.692 1.00 0.00 C ATOM 0 H1 MET A 1 10.849 -19.435 -5.158 1.00 0.00 H new ATOM 0 H2 MET A 1 9.402 -19.444 -6.046 1.00 0.00 H new ATOM 0 H3 MET A 1 10.354 -18.039 -5.988 1.00 0.00 H new ATOM 0 HA MET A 1 8.436 -19.075 -4.063 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.720 -17.992 -2.165 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.451 -19.470 -2.760 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.361 -18.337 -3.265 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.472 -17.318 -4.380 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.510 -16.732 -0.007 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.857 -17.353 -0.224 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.236 -18.230 -0.928 1.00 0.00 H new ATOM 20 N MET A 2 7.494 -16.776 -4.333 1.00 0.00 N ATOM 21 CA MET A 2 6.940 -15.408 -4.535 1.00 0.00 C ATOM 22 C MET A 2 5.790 -15.173 -3.553 1.00 0.00 C ATOM 23 O MET A 2 4.871 -15.962 -3.458 1.00 0.00 O ATOM 24 CB MET A 2 6.421 -15.274 -5.968 1.00 0.00 C ATOM 25 CG MET A 2 7.353 -14.360 -6.765 1.00 0.00 C ATOM 26 SD MET A 2 7.024 -14.556 -8.534 1.00 0.00 S ATOM 27 CE MET A 2 8.115 -15.973 -8.813 1.00 0.00 C ATOM 0 H MET A 2 6.807 -17.492 -4.097 1.00 0.00 H new ATOM 0 HA MET A 2 7.723 -14.670 -4.361 1.00 0.00 H new ATOM 0 HB2 MET A 2 6.366 -16.255 -6.439 1.00 0.00 H new ATOM 0 HB3 MET A 2 5.410 -14.866 -5.963 1.00 0.00 H new ATOM 0 HG2 MET A 2 7.202 -13.322 -6.469 1.00 0.00 H new ATOM 0 HG3 MET A 2 8.393 -14.605 -6.548 1.00 0.00 H new ATOM 0 HE1 MET A 2 7.735 -16.567 -9.644 1.00 0.00 H new ATOM 0 HE2 MET A 2 9.118 -15.619 -9.049 1.00 0.00 H new ATOM 0 HE3 MET A 2 8.150 -16.588 -7.914 1.00 0.00 H new ATOM 37 N ASN A 3 5.833 -14.094 -2.821 1.00 0.00 N ATOM 38 CA ASN A 3 4.743 -13.809 -1.846 1.00 0.00 C ATOM 39 C ASN A 3 3.873 -12.665 -2.373 1.00 0.00 C ATOM 40 O ASN A 3 3.712 -12.494 -3.564 1.00 0.00 O ATOM 41 CB ASN A 3 5.353 -13.409 -0.501 1.00 0.00 C ATOM 42 CG ASN A 3 6.364 -14.470 -0.063 1.00 0.00 C ATOM 43 OD1 ASN A 3 7.463 -14.529 -0.578 1.00 0.00 O ATOM 44 ND2 ASN A 3 6.037 -15.316 0.876 1.00 0.00 N ATOM 0 H ASN A 3 6.577 -13.397 -2.856 1.00 0.00 H new ATOM 0 HA ASN A 3 4.130 -14.701 -1.716 1.00 0.00 H new ATOM 0 HB2 ASN A 3 5.842 -12.439 -0.586 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.569 -13.306 0.250 1.00 0.00 H new ATOM 0 HD21 ASN A 3 6.704 -16.026 1.177 1.00 0.00 H new ATOM 0 HD22 ASN A 3 5.114 -15.267 1.308 1.00 0.00 H new ATOM 51 N GLU A 4 3.312 -11.882 -1.494 1.00 0.00 N ATOM 52 CA GLU A 4 2.453 -10.751 -1.945 1.00 0.00 C ATOM 53 C GLU A 4 3.097 -9.426 -1.531 1.00 0.00 C ATOM 54 O GLU A 4 2.941 -8.971 -0.416 1.00 0.00 O ATOM 55 CB GLU A 4 1.071 -10.871 -1.299 1.00 0.00 C ATOM 56 CG GLU A 4 0.481 -12.248 -1.607 1.00 0.00 C ATOM 57 CD GLU A 4 0.215 -12.994 -0.297 1.00 0.00 C ATOM 58 OE1 GLU A 4 0.088 -12.334 0.722 1.00 0.00 O ATOM 59 OE2 GLU A 4 0.142 -14.211 -0.335 1.00 0.00 O ATOM 0 H GLU A 4 3.411 -11.976 -0.483 1.00 0.00 H new ATOM 0 HA GLU A 4 2.350 -10.782 -3.030 1.00 0.00 H new ATOM 0 HB2 GLU A 4 1.148 -10.730 -0.221 1.00 0.00 H new ATOM 0 HB3 GLU A 4 0.412 -10.089 -1.676 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -0.445 -12.141 -2.171 1.00 0.00 H new ATOM 0 HG3 GLU A 4 1.169 -12.819 -2.230 1.00 0.00 H new ATOM 66 N LYS A 5 3.817 -8.802 -2.422 1.00 0.00 N ATOM 67 CA LYS A 5 4.469 -7.508 -2.080 1.00 0.00 C ATOM 68 C LYS A 5 3.970 -6.418 -3.031 1.00 0.00 C ATOM 69 O LYS A 5 3.470 -6.697 -4.102 1.00 0.00 O ATOM 70 CB LYS A 5 5.987 -7.648 -2.215 1.00 0.00 C ATOM 71 CG LYS A 5 6.530 -8.469 -1.043 1.00 0.00 C ATOM 72 CD LYS A 5 6.523 -9.953 -1.413 1.00 0.00 C ATOM 73 CE LYS A 5 7.864 -10.581 -1.029 1.00 0.00 C ATOM 74 NZ LYS A 5 7.949 -10.702 0.454 1.00 0.00 N ATOM 0 H LYS A 5 3.982 -9.133 -3.373 1.00 0.00 H new ATOM 0 HA LYS A 5 4.220 -7.237 -1.054 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.236 -8.133 -3.159 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.454 -6.663 -2.230 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.543 -8.149 -0.799 1.00 0.00 H new ATOM 0 HG3 LYS A 5 5.921 -8.302 -0.155 1.00 0.00 H new ATOM 0 HD2 LYS A 5 5.709 -10.463 -0.897 1.00 0.00 H new ATOM 0 HD3 LYS A 5 6.347 -10.071 -2.482 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.963 -11.563 -1.491 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.685 -9.969 -1.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 8.853 -11.144 0.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.889 -9.757 0.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 7.164 -11.290 0.800 1.00 0.00 H new ATOM 88 N ILE A 6 4.103 -5.177 -2.649 1.00 0.00 N ATOM 89 CA ILE A 6 3.637 -4.072 -3.532 1.00 0.00 C ATOM 90 C ILE A 6 4.500 -2.832 -3.296 1.00 0.00 C ATOM 91 O ILE A 6 5.135 -2.691 -2.269 1.00 0.00 O ATOM 92 CB ILE A 6 2.177 -3.745 -3.213 1.00 0.00 C ATOM 93 CG1 ILE A 6 1.280 -4.876 -3.719 1.00 0.00 C ATOM 94 CG2 ILE A 6 1.783 -2.438 -3.902 1.00 0.00 C ATOM 95 CD1 ILE A 6 -0.187 -4.463 -3.590 1.00 0.00 C ATOM 0 H ILE A 6 4.514 -4.881 -1.764 1.00 0.00 H new ATOM 0 HA ILE A 6 3.721 -4.380 -4.574 1.00 0.00 H new ATOM 0 HB ILE A 6 2.057 -3.638 -2.135 1.00 0.00 H new ATOM 0 HG12 ILE A 6 1.515 -5.102 -4.759 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.464 -5.784 -3.146 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.743 -2.206 -3.674 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.422 -1.631 -3.544 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.903 -2.544 -4.980 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -0.825 -5.270 -3.951 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.417 -4.259 -2.544 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -0.366 -3.566 -4.183 1.00 0.00 H new ATOM 107 N LEU A 7 4.531 -1.931 -4.239 1.00 0.00 N ATOM 108 CA LEU A 7 5.355 -0.701 -4.070 1.00 0.00 C ATOM 109 C LEU A 7 4.526 0.524 -4.462 1.00 0.00 C ATOM 110 O LEU A 7 4.271 0.766 -5.625 1.00 0.00 O ATOM 111 CB LEU A 7 6.589 -0.790 -4.969 1.00 0.00 C ATOM 112 CG LEU A 7 7.629 0.234 -4.514 1.00 0.00 C ATOM 113 CD1 LEU A 7 7.088 1.647 -4.736 1.00 0.00 C ATOM 114 CD2 LEU A 7 7.927 0.029 -3.027 1.00 0.00 C ATOM 0 H LEU A 7 4.021 -1.994 -5.120 1.00 0.00 H new ATOM 0 HA LEU A 7 5.668 -0.611 -3.030 1.00 0.00 H new ATOM 0 HB2 LEU A 7 7.010 -1.794 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 7 6.310 -0.604 -6.006 1.00 0.00 H new ATOM 0 HG LEU A 7 8.544 0.103 -5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.830 2.376 -4.411 1.00 0.00 H new ATOM 0 HD12 LEU A 7 6.875 1.793 -5.795 1.00 0.00 H new ATOM 0 HD13 LEU A 7 6.172 1.781 -4.160 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.668 0.758 -2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 7 7.011 0.160 -2.451 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.314 -0.978 -2.869 1.00 0.00 H new ATOM 126 N ILE A 8 4.104 1.301 -3.501 1.00 0.00 N ATOM 127 CA ILE A 8 3.295 2.509 -3.821 1.00 0.00 C ATOM 128 C ILE A 8 4.228 3.703 -4.035 1.00 0.00 C ATOM 129 O ILE A 8 4.865 4.176 -3.115 1.00 0.00 O ATOM 130 CB ILE A 8 2.341 2.807 -2.664 1.00 0.00 C ATOM 131 CG1 ILE A 8 1.654 1.512 -2.224 1.00 0.00 C ATOM 132 CG2 ILE A 8 1.284 3.814 -3.119 1.00 0.00 C ATOM 133 CD1 ILE A 8 0.501 1.841 -1.274 1.00 0.00 C ATOM 0 H ILE A 8 4.285 1.150 -2.509 1.00 0.00 H new ATOM 0 HA ILE A 8 2.718 2.330 -4.728 1.00 0.00 H new ATOM 0 HB ILE A 8 2.903 3.224 -1.828 1.00 0.00 H new ATOM 0 HG12 ILE A 8 1.279 0.973 -3.094 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.371 0.858 -1.729 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.604 4.026 -2.294 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.772 4.737 -3.433 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.721 3.398 -3.955 1.00 0.00 H new ATOM 0 HD11 ILE A 8 0.013 0.918 -0.961 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.888 2.361 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.221 2.478 -1.785 1.00 0.00 H new ATOM 145 N VAL A 9 4.314 4.193 -5.241 1.00 0.00 N ATOM 146 CA VAL A 9 5.208 5.355 -5.510 1.00 0.00 C ATOM 147 C VAL A 9 4.405 6.653 -5.410 1.00 0.00 C ATOM 148 O VAL A 9 4.003 7.224 -6.405 1.00 0.00 O ATOM 149 CB VAL A 9 5.798 5.228 -6.916 1.00 0.00 C ATOM 150 CG1 VAL A 9 6.828 6.335 -7.139 1.00 0.00 C ATOM 151 CG2 VAL A 9 6.478 3.864 -7.062 1.00 0.00 C ATOM 0 H VAL A 9 3.805 3.840 -6.051 1.00 0.00 H new ATOM 0 HA VAL A 9 6.014 5.370 -4.776 1.00 0.00 H new ATOM 0 HB VAL A 9 5.001 5.319 -7.654 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.248 6.244 -8.141 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.346 7.307 -7.034 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.625 6.244 -6.401 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.899 3.772 -8.063 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.275 3.774 -6.324 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.745 3.073 -6.903 1.00 0.00 H new ATOM 161 N ASP A 10 4.168 7.124 -4.217 1.00 0.00 N ATOM 162 CA ASP A 10 3.393 8.385 -4.054 1.00 0.00 C ATOM 163 C ASP A 10 4.191 9.367 -3.196 1.00 0.00 C ATOM 164 O ASP A 10 4.722 9.014 -2.162 1.00 0.00 O ATOM 165 CB ASP A 10 2.057 8.079 -3.371 1.00 0.00 C ATOM 166 CG ASP A 10 1.331 9.389 -3.060 1.00 0.00 C ATOM 167 OD1 ASP A 10 1.161 10.180 -3.972 1.00 0.00 O ATOM 168 OD2 ASP A 10 0.956 9.577 -1.914 1.00 0.00 O ATOM 0 H ASP A 10 4.478 6.690 -3.348 1.00 0.00 H new ATOM 0 HA ASP A 10 3.208 8.826 -5.033 1.00 0.00 H new ATOM 0 HB2 ASP A 10 1.441 7.454 -4.017 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.226 7.518 -2.452 1.00 0.00 H new ATOM 173 N ASP A 11 4.286 10.599 -3.617 1.00 0.00 N ATOM 174 CA ASP A 11 5.052 11.601 -2.824 1.00 0.00 C ATOM 175 C ASP A 11 4.082 12.450 -2.000 1.00 0.00 C ATOM 176 O ASP A 11 4.293 12.688 -0.827 1.00 0.00 O ATOM 177 CB ASP A 11 5.842 12.506 -3.773 1.00 0.00 C ATOM 178 CG ASP A 11 4.879 13.437 -4.509 1.00 0.00 C ATOM 179 OD1 ASP A 11 4.219 12.973 -5.424 1.00 0.00 O ATOM 180 OD2 ASP A 11 4.816 14.600 -4.144 1.00 0.00 O ATOM 0 H ASP A 11 3.866 10.954 -4.476 1.00 0.00 H new ATOM 0 HA ASP A 11 5.741 11.085 -2.155 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.572 13.090 -3.212 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.399 11.902 -4.489 1.00 0.00 H new ATOM 185 N GLN A 12 3.021 12.909 -2.603 1.00 0.00 N ATOM 186 CA GLN A 12 2.040 13.742 -1.853 1.00 0.00 C ATOM 187 C GLN A 12 1.317 12.873 -0.822 1.00 0.00 C ATOM 188 O GLN A 12 0.555 11.990 -1.164 1.00 0.00 O ATOM 189 CB GLN A 12 1.020 14.331 -2.831 1.00 0.00 C ATOM 190 CG GLN A 12 0.186 15.397 -2.118 1.00 0.00 C ATOM 191 CD GLN A 12 0.211 16.692 -2.932 1.00 0.00 C ATOM 192 OE1 GLN A 12 -0.801 17.111 -3.461 1.00 0.00 O ATOM 193 NE2 GLN A 12 1.331 17.351 -3.053 1.00 0.00 N ATOM 0 H GLN A 12 2.791 12.743 -3.583 1.00 0.00 H new ATOM 0 HA GLN A 12 2.563 14.551 -1.343 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.532 14.768 -3.688 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.372 13.543 -3.215 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -0.840 15.050 -1.997 1.00 0.00 H new ATOM 0 HG3 GLN A 12 0.582 15.575 -1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 12 2.180 17.000 -2.609 1.00 0.00 H new ATOM 0 HE22 GLN A 12 1.358 18.217 -3.591 1.00 0.00 H new ATOM 202 N TYR A 13 1.549 13.116 0.439 1.00 0.00 N ATOM 203 CA TYR A 13 0.877 12.304 1.492 1.00 0.00 C ATOM 204 C TYR A 13 -0.599 12.120 1.132 1.00 0.00 C ATOM 205 O TYR A 13 -1.158 12.875 0.362 1.00 0.00 O ATOM 206 CB TYR A 13 0.987 13.021 2.839 1.00 0.00 C ATOM 207 CG TYR A 13 1.171 12.003 3.939 1.00 0.00 C ATOM 208 CD1 TYR A 13 2.418 11.396 4.130 1.00 0.00 C ATOM 209 CD2 TYR A 13 0.094 11.668 4.768 1.00 0.00 C ATOM 210 CE1 TYR A 13 2.587 10.452 5.150 1.00 0.00 C ATOM 211 CE2 TYR A 13 0.264 10.724 5.790 1.00 0.00 C ATOM 212 CZ TYR A 13 1.511 10.116 5.979 1.00 0.00 C ATOM 213 OH TYR A 13 1.678 9.186 6.985 1.00 0.00 O ATOM 0 H TYR A 13 2.176 13.843 0.786 1.00 0.00 H new ATOM 0 HA TYR A 13 1.359 11.329 1.559 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.828 13.714 2.826 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.090 13.612 3.023 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.249 11.656 3.491 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -0.868 12.137 4.620 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.549 9.983 5.297 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -0.566 10.466 6.431 1.00 0.00 H new ATOM 0 HH TYR A 13 0.833 9.070 7.467 1.00 0.00 H new ATOM 223 N GLY A 14 -1.234 11.123 1.683 1.00 0.00 N ATOM 224 CA GLY A 14 -2.673 10.891 1.372 1.00 0.00 C ATOM 225 C GLY A 14 -2.825 9.573 0.611 1.00 0.00 C ATOM 226 O GLY A 14 -3.380 8.615 1.112 1.00 0.00 O ATOM 0 H GLY A 14 -0.819 10.458 2.336 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -3.255 10.860 2.293 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.064 11.715 0.775 1.00 0.00 H new ATOM 230 N ILE A 15 -2.333 9.514 -0.597 1.00 0.00 N ATOM 231 CA ILE A 15 -2.449 8.257 -1.388 1.00 0.00 C ATOM 232 C ILE A 15 -1.632 7.155 -0.711 1.00 0.00 C ATOM 233 O ILE A 15 -1.735 5.994 -1.051 1.00 0.00 O ATOM 234 CB ILE A 15 -1.919 8.497 -2.805 1.00 0.00 C ATOM 235 CG1 ILE A 15 -2.951 9.298 -3.604 1.00 0.00 C ATOM 236 CG2 ILE A 15 -1.670 7.157 -3.501 1.00 0.00 C ATOM 237 CD1 ILE A 15 -2.283 10.538 -4.200 1.00 0.00 C ATOM 0 H ILE A 15 -1.856 10.282 -1.069 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.494 7.951 -1.441 1.00 0.00 H new ATOM 0 HB ILE A 15 -0.983 9.053 -2.749 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.371 8.681 -4.398 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.778 9.592 -2.958 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.293 7.335 -4.508 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.936 6.584 -2.935 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -2.603 6.597 -3.556 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.017 11.109 -4.769 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.884 11.158 -3.397 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.471 10.232 -4.859 1.00 0.00 H new ATOM 249 N ARG A 16 -0.821 7.509 0.245 1.00 0.00 N ATOM 250 CA ARG A 16 0.000 6.479 0.942 1.00 0.00 C ATOM 251 C ARG A 16 -0.831 5.840 2.055 1.00 0.00 C ATOM 252 O ARG A 16 -0.606 4.710 2.440 1.00 0.00 O ATOM 253 CB ARG A 16 1.241 7.138 1.545 1.00 0.00 C ATOM 254 CG ARG A 16 1.870 8.086 0.520 1.00 0.00 C ATOM 255 CD ARG A 16 3.147 7.458 -0.040 1.00 0.00 C ATOM 256 NE ARG A 16 4.277 7.714 0.897 1.00 0.00 N ATOM 257 CZ ARG A 16 5.511 7.598 0.484 1.00 0.00 C ATOM 258 NH1 ARG A 16 5.762 7.254 -0.750 1.00 0.00 N ATOM 259 NH2 ARG A 16 6.496 7.823 1.310 1.00 0.00 N ATOM 0 H ARG A 16 -0.690 8.465 0.574 1.00 0.00 H new ATOM 0 HA ARG A 16 0.308 5.713 0.230 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.971 7.688 2.446 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.962 6.376 1.841 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.165 8.285 -0.288 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.098 9.044 0.987 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.009 6.385 -0.176 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.371 7.877 -1.021 1.00 0.00 H new ATOM 0 HE ARG A 16 4.087 7.980 1.863 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.993 7.075 -1.396 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.727 7.165 -1.068 1.00 0.00 H new ATOM 0 HH21 ARG A 16 6.301 8.089 2.275 1.00 0.00 H new ATOM 0 HH22 ARG A 16 7.460 7.733 0.990 1.00 0.00 H new ATOM 273 N ILE A 17 -1.788 6.556 2.579 1.00 0.00 N ATOM 274 CA ILE A 17 -2.630 5.991 3.669 1.00 0.00 C ATOM 275 C ILE A 17 -3.854 5.294 3.070 1.00 0.00 C ATOM 276 O ILE A 17 -4.291 4.268 3.549 1.00 0.00 O ATOM 277 CB ILE A 17 -3.089 7.118 4.596 1.00 0.00 C ATOM 278 CG1 ILE A 17 -1.932 8.095 4.819 1.00 0.00 C ATOM 279 CG2 ILE A 17 -3.524 6.530 5.939 1.00 0.00 C ATOM 280 CD1 ILE A 17 -0.740 7.347 5.418 1.00 0.00 C ATOM 0 H ILE A 17 -2.023 7.508 2.299 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.045 5.267 4.236 1.00 0.00 H new ATOM 0 HB ILE A 17 -3.929 7.644 4.141 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -1.647 8.559 3.875 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -2.244 8.898 5.487 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.851 7.333 6.599 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.347 5.832 5.781 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.685 6.005 6.395 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.084 8.043 5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.030 6.904 6.371 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.423 6.560 4.734 1.00 0.00 H new ATOM 292 N LEU A 18 -4.415 5.848 2.030 1.00 0.00 N ATOM 293 CA LEU A 18 -5.613 5.217 1.408 1.00 0.00 C ATOM 294 C LEU A 18 -5.222 3.880 0.776 1.00 0.00 C ATOM 295 O LEU A 18 -5.758 2.843 1.112 1.00 0.00 O ATOM 296 CB LEU A 18 -6.176 6.146 0.329 1.00 0.00 C ATOM 297 CG LEU A 18 -6.999 7.254 0.988 1.00 0.00 C ATOM 298 CD1 LEU A 18 -6.578 8.610 0.421 1.00 0.00 C ATOM 299 CD2 LEU A 18 -8.484 7.022 0.703 1.00 0.00 C ATOM 0 H LEU A 18 -4.096 6.709 1.585 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.370 5.046 2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.363 6.580 -0.253 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.798 5.580 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.828 7.242 2.064 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.165 9.399 0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.520 8.776 0.622 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.749 8.623 -0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.072 7.811 1.172 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.654 7.034 -0.374 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.785 6.056 1.107 1.00 0.00 H new ATOM 311 N LEU A 19 -4.293 3.894 -0.140 1.00 0.00 N ATOM 312 CA LEU A 19 -3.871 2.623 -0.794 1.00 0.00 C ATOM 313 C LEU A 19 -3.264 1.690 0.254 1.00 0.00 C ATOM 314 O LEU A 19 -3.214 0.489 0.077 1.00 0.00 O ATOM 315 CB LEU A 19 -2.831 2.928 -1.871 1.00 0.00 C ATOM 316 CG LEU A 19 -3.541 3.414 -3.133 1.00 0.00 C ATOM 317 CD1 LEU A 19 -4.006 4.857 -2.936 1.00 0.00 C ATOM 318 CD2 LEU A 19 -2.576 3.348 -4.320 1.00 0.00 C ATOM 0 H LEU A 19 -3.808 4.731 -0.464 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.736 2.142 -1.251 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.135 3.688 -1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.245 2.036 -2.090 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.404 2.778 -3.329 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.512 5.202 -3.837 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.694 4.906 -2.092 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.143 5.493 -2.738 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.083 3.695 -5.221 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.712 3.983 -4.122 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.245 2.319 -4.463 1.00 0.00 H new ATOM 330 N ASN A 20 -2.805 2.234 1.344 1.00 0.00 N ATOM 331 CA ASN A 20 -2.200 1.383 2.407 1.00 0.00 C ATOM 332 C ASN A 20 -3.299 0.573 3.100 1.00 0.00 C ATOM 333 O ASN A 20 -3.350 -0.636 2.998 1.00 0.00 O ATOM 334 CB ASN A 20 -1.499 2.273 3.435 1.00 0.00 C ATOM 335 CG ASN A 20 -1.135 1.444 4.668 1.00 0.00 C ATOM 336 OD1 ASN A 20 -0.176 0.698 4.652 1.00 0.00 O ATOM 337 ND2 ASN A 20 -1.866 1.542 5.745 1.00 0.00 N ATOM 0 H ASN A 20 -2.822 3.234 1.547 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.475 0.703 1.959 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -0.600 2.710 3.000 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -2.150 3.100 3.719 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -1.632 0.993 6.572 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -2.671 2.168 5.760 1.00 0.00 H new ATOM 344 N GLU A 21 -4.177 1.231 3.806 1.00 0.00 N ATOM 345 CA GLU A 21 -5.271 0.500 4.507 1.00 0.00 C ATOM 346 C GLU A 21 -6.014 -0.391 3.509 1.00 0.00 C ATOM 347 O GLU A 21 -6.486 -1.458 3.848 1.00 0.00 O ATOM 348 CB GLU A 21 -6.248 1.508 5.116 1.00 0.00 C ATOM 349 CG GLU A 21 -6.215 1.395 6.642 1.00 0.00 C ATOM 350 CD GLU A 21 -6.762 2.681 7.261 1.00 0.00 C ATOM 351 OE1 GLU A 21 -7.858 3.073 6.894 1.00 0.00 O ATOM 352 OE2 GLU A 21 -6.077 3.253 8.094 1.00 0.00 O ATOM 0 H GLU A 21 -4.184 2.244 3.928 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.845 -0.118 5.297 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.981 2.519 4.810 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.257 1.320 4.749 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.809 0.541 6.967 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.194 1.221 6.982 1.00 0.00 H new ATOM 359 N VAL A 22 -6.121 0.037 2.281 1.00 0.00 N ATOM 360 CA VAL A 22 -6.834 -0.787 1.266 1.00 0.00 C ATOM 361 C VAL A 22 -6.088 -2.107 1.064 1.00 0.00 C ATOM 362 O VAL A 22 -6.626 -3.175 1.282 1.00 0.00 O ATOM 363 CB VAL A 22 -6.890 -0.026 -0.061 1.00 0.00 C ATOM 364 CG1 VAL A 22 -7.463 -0.935 -1.148 1.00 0.00 C ATOM 365 CG2 VAL A 22 -7.784 1.206 0.097 1.00 0.00 C ATOM 0 H VAL A 22 -5.746 0.921 1.937 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.847 -0.991 1.612 1.00 0.00 H new ATOM 0 HB VAL A 22 -5.885 0.287 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -7.503 -0.392 -2.093 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -6.827 -1.813 -1.260 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.468 -1.249 -0.867 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -7.825 1.749 -0.847 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -8.789 0.892 0.379 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.376 1.855 0.872 1.00 0.00 H new ATOM 375 N PHE A 23 -4.852 -2.045 0.648 1.00 0.00 N ATOM 376 CA PHE A 23 -4.073 -3.297 0.433 1.00 0.00 C ATOM 377 C PHE A 23 -3.594 -3.841 1.781 1.00 0.00 C ATOM 378 O PHE A 23 -2.909 -4.842 1.847 1.00 0.00 O ATOM 379 CB PHE A 23 -2.865 -2.997 -0.456 1.00 0.00 C ATOM 380 CG PHE A 23 -3.337 -2.453 -1.783 1.00 0.00 C ATOM 381 CD1 PHE A 23 -4.504 -2.955 -2.369 1.00 0.00 C ATOM 382 CD2 PHE A 23 -2.607 -1.446 -2.426 1.00 0.00 C ATOM 383 CE1 PHE A 23 -4.942 -2.451 -3.599 1.00 0.00 C ATOM 384 CE2 PHE A 23 -3.045 -0.942 -3.656 1.00 0.00 C ATOM 385 CZ PHE A 23 -4.213 -1.445 -4.244 1.00 0.00 C ATOM 0 H PHE A 23 -4.348 -1.181 0.448 1.00 0.00 H new ATOM 0 HA PHE A 23 -4.706 -4.040 -0.052 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.211 -2.275 0.033 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.280 -3.904 -0.610 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -5.067 -3.731 -1.872 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.706 -1.058 -1.973 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.843 -2.839 -4.051 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -2.482 -0.165 -4.152 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.550 -1.057 -5.194 1.00 0.00 H new ATOM 395 N ASN A 24 -3.947 -3.191 2.857 1.00 0.00 N ATOM 396 CA ASN A 24 -3.508 -3.676 4.196 1.00 0.00 C ATOM 397 C ASN A 24 -4.549 -4.649 4.753 1.00 0.00 C ATOM 398 O ASN A 24 -4.218 -5.682 5.300 1.00 0.00 O ATOM 399 CB ASN A 24 -3.363 -2.486 5.146 1.00 0.00 C ATOM 400 CG ASN A 24 -1.885 -2.109 5.270 1.00 0.00 C ATOM 401 OD1 ASN A 24 -1.362 -2.003 6.362 1.00 0.00 O ATOM 402 ND2 ASN A 24 -1.184 -1.901 4.188 1.00 0.00 N ATOM 0 H ASN A 24 -4.519 -2.347 2.866 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.549 -4.185 4.102 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.936 -1.637 4.773 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.769 -2.738 6.126 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -0.198 -1.650 4.260 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.622 -1.990 3.271 1.00 0.00 H new ATOM 409 N LYS A 25 -5.807 -4.327 4.619 1.00 0.00 N ATOM 410 CA LYS A 25 -6.868 -5.235 5.141 1.00 0.00 C ATOM 411 C LYS A 25 -7.026 -6.429 4.199 1.00 0.00 C ATOM 412 O LYS A 25 -7.276 -7.540 4.626 1.00 0.00 O ATOM 413 CB LYS A 25 -8.193 -4.473 5.227 1.00 0.00 C ATOM 414 CG LYS A 25 -8.486 -4.122 6.688 1.00 0.00 C ATOM 415 CD LYS A 25 -9.946 -3.686 6.825 1.00 0.00 C ATOM 416 CE LYS A 25 -10.131 -2.924 8.138 1.00 0.00 C ATOM 417 NZ LYS A 25 -11.390 -2.129 8.077 1.00 0.00 N ATOM 0 H LYS A 25 -6.146 -3.475 4.171 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.588 -5.590 6.133 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.142 -3.565 4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.001 -5.080 4.819 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.291 -4.984 7.326 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.824 -3.323 7.021 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.228 -3.054 5.983 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.600 -4.558 6.803 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.169 -3.622 8.974 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.280 -2.265 8.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.517 -1.610 8.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.336 -1.453 7.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.197 -2.768 7.930 1.00 0.00 H new ATOM 431 N GLU A 26 -6.883 -6.212 2.921 1.00 0.00 N ATOM 432 CA GLU A 26 -7.025 -7.337 1.954 1.00 0.00 C ATOM 433 C GLU A 26 -5.894 -8.343 2.172 1.00 0.00 C ATOM 434 O GLU A 26 -6.034 -9.519 1.897 1.00 0.00 O ATOM 435 CB GLU A 26 -6.956 -6.793 0.525 1.00 0.00 C ATOM 436 CG GLU A 26 -7.872 -7.619 -0.382 1.00 0.00 C ATOM 437 CD GLU A 26 -9.058 -6.761 -0.826 1.00 0.00 C ATOM 438 OE1 GLU A 26 -9.626 -6.088 0.017 1.00 0.00 O ATOM 439 OE2 GLU A 26 -9.377 -6.793 -2.003 1.00 0.00 O ATOM 0 H GLU A 26 -6.674 -5.305 2.504 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.984 -7.830 2.109 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.259 -5.746 0.508 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.930 -6.834 0.158 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.318 -7.971 -1.252 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.227 -8.502 0.149 1.00 0.00 H new ATOM 446 N GLY A 27 -4.772 -7.892 2.664 1.00 0.00 N ATOM 447 CA GLY A 27 -3.634 -8.823 2.899 1.00 0.00 C ATOM 448 C GLY A 27 -2.552 -8.584 1.846 1.00 0.00 C ATOM 449 O GLY A 27 -2.363 -9.376 0.945 1.00 0.00 O ATOM 0 H GLY A 27 -4.595 -6.919 2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.225 -8.669 3.897 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.980 -9.856 2.852 1.00 0.00 H new ATOM 453 N TYR A 28 -1.838 -7.497 1.952 1.00 0.00 N ATOM 454 CA TYR A 28 -0.768 -7.208 0.956 1.00 0.00 C ATOM 455 C TYR A 28 0.333 -6.376 1.615 1.00 0.00 C ATOM 456 O TYR A 28 0.068 -5.421 2.317 1.00 0.00 O ATOM 457 CB TYR A 28 -1.361 -6.424 -0.217 1.00 0.00 C ATOM 458 CG TYR A 28 -2.333 -7.300 -0.970 1.00 0.00 C ATOM 459 CD1 TYR A 28 -3.640 -7.464 -0.495 1.00 0.00 C ATOM 460 CD2 TYR A 28 -1.928 -7.948 -2.144 1.00 0.00 C ATOM 461 CE1 TYR A 28 -4.542 -8.276 -1.194 1.00 0.00 C ATOM 462 CE2 TYR A 28 -2.830 -8.759 -2.842 1.00 0.00 C ATOM 463 CZ TYR A 28 -4.136 -8.923 -2.367 1.00 0.00 C ATOM 464 OH TYR A 28 -5.025 -9.722 -3.056 1.00 0.00 O ATOM 0 H TYR A 28 -1.949 -6.797 2.685 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.348 -8.146 0.594 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.868 -5.531 0.148 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.566 -6.089 -0.883 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -3.952 -6.964 0.410 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -0.920 -7.822 -2.510 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -5.550 -8.403 -0.828 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -2.518 -9.258 -3.747 1.00 0.00 H new ATOM 0 HH TYR A 28 -4.700 -9.860 -3.970 1.00 0.00 H new ATOM 474 N GLN A 29 1.570 -6.729 1.391 1.00 0.00 N ATOM 475 CA GLN A 29 2.688 -5.956 2.002 1.00 0.00 C ATOM 476 C GLN A 29 3.169 -4.896 1.011 1.00 0.00 C ATOM 477 O GLN A 29 4.121 -5.098 0.284 1.00 0.00 O ATOM 478 CB GLN A 29 3.841 -6.903 2.337 1.00 0.00 C ATOM 479 CG GLN A 29 3.352 -7.979 3.311 1.00 0.00 C ATOM 480 CD GLN A 29 3.109 -7.352 4.684 1.00 0.00 C ATOM 481 OE1 GLN A 29 2.055 -6.802 4.937 1.00 0.00 O ATOM 482 NE2 GLN A 29 4.046 -7.411 5.590 1.00 0.00 N ATOM 0 H GLN A 29 1.854 -7.519 0.812 1.00 0.00 H new ATOM 0 HA GLN A 29 2.342 -5.472 2.915 1.00 0.00 H new ATOM 0 HB2 GLN A 29 4.221 -7.367 1.427 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.667 -6.346 2.779 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.433 -8.431 2.938 1.00 0.00 H new ATOM 0 HG3 GLN A 29 4.091 -8.777 3.389 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.931 -7.872 5.379 1.00 0.00 H new ATOM 0 HE22 GLN A 29 3.894 -6.996 6.509 1.00 0.00 H new ATOM 491 N THR A 30 2.517 -3.765 0.973 1.00 0.00 N ATOM 492 CA THR A 30 2.937 -2.694 0.026 1.00 0.00 C ATOM 493 C THR A 30 3.965 -1.786 0.703 1.00 0.00 C ATOM 494 O THR A 30 4.088 -1.762 1.912 1.00 0.00 O ATOM 495 CB THR A 30 1.716 -1.866 -0.381 1.00 0.00 C ATOM 496 OG1 THR A 30 1.418 -0.928 0.644 1.00 0.00 O ATOM 497 CG2 THR A 30 0.516 -2.790 -0.594 1.00 0.00 C ATOM 0 H THR A 30 1.712 -3.537 1.557 1.00 0.00 H new ATOM 0 HA THR A 30 3.382 -3.148 -0.860 1.00 0.00 H new ATOM 0 HB THR A 30 1.931 -1.335 -1.309 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.490 -0.626 0.552 1.00 0.00 H new ATOM 0 HG21 THR A 30 -0.352 -2.198 -0.884 1.00 0.00 H new ATOM 0 HG22 THR A 30 0.745 -3.508 -1.382 1.00 0.00 H new ATOM 0 HG23 THR A 30 0.299 -3.324 0.331 1.00 0.00 H new ATOM 505 N PHE A 31 4.705 -1.037 -0.068 1.00 0.00 N ATOM 506 CA PHE A 31 5.726 -0.130 0.529 1.00 0.00 C ATOM 507 C PHE A 31 5.432 1.311 0.107 1.00 0.00 C ATOM 508 O PHE A 31 4.384 1.609 -0.432 1.00 0.00 O ATOM 509 CB PHE A 31 7.116 -0.533 0.037 1.00 0.00 C ATOM 510 CG PHE A 31 7.605 -1.724 0.826 1.00 0.00 C ATOM 511 CD1 PHE A 31 7.021 -2.981 0.629 1.00 0.00 C ATOM 512 CD2 PHE A 31 8.641 -1.571 1.756 1.00 0.00 C ATOM 513 CE1 PHE A 31 7.474 -4.085 1.362 1.00 0.00 C ATOM 514 CE2 PHE A 31 9.093 -2.674 2.488 1.00 0.00 C ATOM 515 CZ PHE A 31 8.510 -3.932 2.291 1.00 0.00 C ATOM 0 H PHE A 31 4.647 -1.014 -1.086 1.00 0.00 H new ATOM 0 HA PHE A 31 5.691 -0.206 1.616 1.00 0.00 H new ATOM 0 HB2 PHE A 31 7.081 -0.777 -1.025 1.00 0.00 H new ATOM 0 HB3 PHE A 31 7.809 0.301 0.150 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.222 -3.099 -0.088 1.00 0.00 H new ATOM 0 HD2 PHE A 31 9.091 -0.601 1.908 1.00 0.00 H new ATOM 0 HE1 PHE A 31 7.024 -5.055 1.210 1.00 0.00 H new ATOM 0 HE2 PHE A 31 9.892 -2.555 3.205 1.00 0.00 H new ATOM 0 HZ PHE A 31 8.860 -4.784 2.856 1.00 0.00 H new ATOM 525 N GLN A 32 6.348 2.210 0.348 1.00 0.00 N ATOM 526 CA GLN A 32 6.116 3.630 -0.040 1.00 0.00 C ATOM 527 C GLN A 32 7.250 4.103 -0.952 1.00 0.00 C ATOM 528 O GLN A 32 8.368 3.635 -0.863 1.00 0.00 O ATOM 529 CB GLN A 32 6.074 4.501 1.216 1.00 0.00 C ATOM 530 CG GLN A 32 4.621 4.694 1.655 1.00 0.00 C ATOM 531 CD GLN A 32 4.199 3.527 2.550 1.00 0.00 C ATOM 532 OE1 GLN A 32 4.985 3.030 3.332 1.00 0.00 O ATOM 533 NE2 GLN A 32 2.980 3.065 2.468 1.00 0.00 N ATOM 0 H GLN A 32 7.245 2.023 0.796 1.00 0.00 H new ATOM 0 HA GLN A 32 5.167 3.711 -0.570 1.00 0.00 H new ATOM 0 HB2 GLN A 32 6.647 4.032 2.016 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.536 5.468 1.017 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.515 5.636 2.193 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.971 4.750 0.782 1.00 0.00 H new ATOM 0 HE21 GLN A 32 2.320 3.482 1.812 1.00 0.00 H new ATOM 0 HE22 GLN A 32 2.688 2.287 3.060 1.00 0.00 H new ATOM 542 N ALA A 33 6.972 5.029 -1.829 1.00 0.00 N ATOM 543 CA ALA A 33 8.033 5.534 -2.745 1.00 0.00 C ATOM 544 C ALA A 33 7.594 6.874 -3.341 1.00 0.00 C ATOM 545 O ALA A 33 6.477 7.313 -3.150 1.00 0.00 O ATOM 546 CB ALA A 33 8.257 4.524 -3.870 1.00 0.00 C ATOM 0 H ALA A 33 6.055 5.458 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 33 8.961 5.669 -2.189 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.033 4.893 -4.541 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.568 3.569 -3.445 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.330 4.389 -4.427 1.00 0.00 H new ATOM 552 N ALA A 34 8.464 7.527 -4.062 1.00 0.00 N ATOM 553 CA ALA A 34 8.094 8.838 -4.668 1.00 0.00 C ATOM 554 C ALA A 34 9.234 9.328 -5.563 1.00 0.00 C ATOM 555 O ALA A 34 9.022 9.735 -6.687 1.00 0.00 O ATOM 556 CB ALA A 34 7.841 9.860 -3.559 1.00 0.00 C ATOM 0 H ALA A 34 9.414 7.210 -4.258 1.00 0.00 H new ATOM 0 HA ALA A 34 7.190 8.719 -5.265 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.571 10.818 -4.002 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.028 9.512 -2.922 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.744 9.979 -2.961 1.00 0.00 H new ATOM 562 N ASN A 35 10.443 9.294 -5.072 1.00 0.00 N ATOM 563 CA ASN A 35 11.595 9.758 -5.895 1.00 0.00 C ATOM 564 C ASN A 35 11.848 8.763 -7.031 1.00 0.00 C ATOM 565 O ASN A 35 12.675 8.988 -7.892 1.00 0.00 O ATOM 566 CB ASN A 35 12.843 9.856 -5.016 1.00 0.00 C ATOM 567 CG ASN A 35 13.006 8.563 -4.214 1.00 0.00 C ATOM 568 OD1 ASN A 35 12.268 7.617 -4.408 1.00 0.00 O ATOM 569 ND2 ASN A 35 13.949 8.481 -3.316 1.00 0.00 N ATOM 0 H ASN A 35 10.682 8.965 -4.137 1.00 0.00 H new ATOM 0 HA ASN A 35 11.368 10.738 -6.316 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.724 10.026 -5.635 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.759 10.707 -4.340 1.00 0.00 H new ATOM 0 HD21 ASN A 35 14.067 7.623 -2.777 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.568 9.275 -3.153 1.00 0.00 H new ATOM 576 N GLY A 36 11.142 7.665 -7.041 1.00 0.00 N ATOM 577 CA GLY A 36 11.346 6.659 -8.122 1.00 0.00 C ATOM 578 C GLY A 36 12.490 5.719 -7.740 1.00 0.00 C ATOM 579 O GLY A 36 12.317 4.520 -7.649 1.00 0.00 O ATOM 0 H GLY A 36 10.434 7.421 -6.348 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.431 6.089 -8.279 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.574 7.162 -9.062 1.00 0.00 H new ATOM 583 N LEU A 37 13.660 6.254 -7.516 1.00 0.00 N ATOM 584 CA LEU A 37 14.814 5.391 -7.141 1.00 0.00 C ATOM 585 C LEU A 37 14.425 4.506 -5.954 1.00 0.00 C ATOM 586 O LEU A 37 14.771 3.344 -5.895 1.00 0.00 O ATOM 587 CB LEU A 37 16.005 6.269 -6.754 1.00 0.00 C ATOM 588 CG LEU A 37 15.619 7.159 -5.571 1.00 0.00 C ATOM 589 CD1 LEU A 37 15.924 6.429 -4.261 1.00 0.00 C ATOM 590 CD2 LEU A 37 16.426 8.459 -5.628 1.00 0.00 C ATOM 0 H LEU A 37 13.865 7.251 -7.577 1.00 0.00 H new ATOM 0 HA LEU A 37 15.087 4.763 -7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 37 16.860 5.646 -6.490 1.00 0.00 H new ATOM 0 HB3 LEU A 37 16.308 6.884 -7.602 1.00 0.00 H new ATOM 0 HG LEU A 37 14.554 7.387 -5.621 1.00 0.00 H new ATOM 0 HD11 LEU A 37 15.649 7.063 -3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 37 15.352 5.502 -4.219 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.989 6.201 -4.211 1.00 0.00 H new ATOM 0 HD21 LEU A 37 16.152 9.094 -4.786 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.490 8.229 -5.578 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.211 8.980 -6.561 1.00 0.00 H new ATOM 602 N GLN A 38 13.707 5.049 -5.009 1.00 0.00 N ATOM 603 CA GLN A 38 13.297 4.239 -3.827 1.00 0.00 C ATOM 604 C GLN A 38 12.329 3.142 -4.275 1.00 0.00 C ATOM 605 O GLN A 38 12.310 2.056 -3.730 1.00 0.00 O ATOM 606 CB GLN A 38 12.608 5.142 -2.804 1.00 0.00 C ATOM 607 CG GLN A 38 13.058 4.754 -1.394 1.00 0.00 C ATOM 608 CD GLN A 38 14.569 4.961 -1.266 1.00 0.00 C ATOM 609 OE1 GLN A 38 15.375 3.975 -1.548 1.00 0.00 O flip ATOM 610 NE2 GLN A 38 15.020 6.031 -0.907 1.00 0.00 N flip ATOM 0 H GLN A 38 13.387 6.017 -5.004 1.00 0.00 H new ATOM 0 HA GLN A 38 14.178 3.784 -3.373 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.853 6.186 -3.001 1.00 0.00 H new ATOM 0 HB3 GLN A 38 11.526 5.047 -2.891 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.533 5.358 -0.654 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.804 3.713 -1.193 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.390 6.802 -0.687 1.00 0.00 H new ATOM 0 HE22 GLN A 38 16.029 6.158 -0.826 1.00 0.00 H new ATOM 619 N ALA A 39 11.524 3.416 -5.265 1.00 0.00 N ATOM 620 CA ALA A 39 10.557 2.390 -5.746 1.00 0.00 C ATOM 621 C ALA A 39 11.325 1.200 -6.327 1.00 0.00 C ATOM 622 O ALA A 39 11.239 0.093 -5.834 1.00 0.00 O ATOM 623 CB ALA A 39 9.664 2.998 -6.830 1.00 0.00 C ATOM 0 H ALA A 39 11.494 4.307 -5.761 1.00 0.00 H new ATOM 0 HA ALA A 39 9.939 2.054 -4.913 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.956 2.247 -7.182 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.118 3.846 -6.418 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.281 3.334 -7.663 1.00 0.00 H new ATOM 629 N LEU A 40 12.077 1.420 -7.370 1.00 0.00 N ATOM 630 CA LEU A 40 12.850 0.301 -7.979 1.00 0.00 C ATOM 631 C LEU A 40 13.711 -0.366 -6.906 1.00 0.00 C ATOM 632 O LEU A 40 13.904 -1.566 -6.907 1.00 0.00 O ATOM 633 CB LEU A 40 13.749 0.846 -9.091 1.00 0.00 C ATOM 634 CG LEU A 40 12.890 1.242 -10.292 1.00 0.00 C ATOM 635 CD1 LEU A 40 13.587 2.359 -11.072 1.00 0.00 C ATOM 636 CD2 LEU A 40 12.697 0.029 -11.205 1.00 0.00 C ATOM 0 H LEU A 40 12.190 2.325 -7.827 1.00 0.00 H new ATOM 0 HA LEU A 40 12.160 -0.431 -8.398 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.309 1.709 -8.731 1.00 0.00 H new ATOM 0 HB3 LEU A 40 14.479 0.092 -9.385 1.00 0.00 H new ATOM 0 HG LEU A 40 11.919 1.593 -9.943 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.975 2.642 -11.928 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.725 3.224 -10.423 1.00 0.00 H new ATOM 0 HD13 LEU A 40 14.558 2.008 -11.420 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.084 0.312 -12.061 1.00 0.00 H new ATOM 0 HD22 LEU A 40 13.668 -0.322 -11.554 1.00 0.00 H new ATOM 0 HD23 LEU A 40 12.201 -0.768 -10.651 1.00 0.00 H new ATOM 648 N ASP A 41 14.229 0.402 -5.986 1.00 0.00 N ATOM 649 CA ASP A 41 15.075 -0.190 -4.913 1.00 0.00 C ATOM 650 C ASP A 41 14.273 -1.256 -4.164 1.00 0.00 C ATOM 651 O ASP A 41 14.701 -2.384 -4.024 1.00 0.00 O ATOM 652 CB ASP A 41 15.501 0.908 -3.935 1.00 0.00 C ATOM 653 CG ASP A 41 16.745 1.618 -4.475 1.00 0.00 C ATOM 654 OD1 ASP A 41 17.310 1.129 -5.438 1.00 0.00 O ATOM 655 OD2 ASP A 41 17.109 2.639 -3.915 1.00 0.00 O ATOM 0 H ASP A 41 14.103 1.413 -5.932 1.00 0.00 H new ATOM 0 HA ASP A 41 15.961 -0.645 -5.357 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.690 1.624 -3.800 1.00 0.00 H new ATOM 0 HB3 ASP A 41 15.711 0.477 -2.956 1.00 0.00 H new ATOM 660 N ILE A 42 13.110 -0.908 -3.684 1.00 0.00 N ATOM 661 CA ILE A 42 12.281 -1.903 -2.949 1.00 0.00 C ATOM 662 C ILE A 42 11.862 -3.021 -3.906 1.00 0.00 C ATOM 663 O ILE A 42 11.514 -4.108 -3.492 1.00 0.00 O ATOM 664 CB ILE A 42 11.034 -1.214 -2.390 1.00 0.00 C ATOM 665 CG1 ILE A 42 11.431 -0.323 -1.210 1.00 0.00 C ATOM 666 CG2 ILE A 42 10.034 -2.270 -1.915 1.00 0.00 C ATOM 667 CD1 ILE A 42 11.214 1.144 -1.582 1.00 0.00 C ATOM 0 H ILE A 42 12.699 0.022 -3.769 1.00 0.00 H new ATOM 0 HA ILE A 42 12.860 -2.325 -2.128 1.00 0.00 H new ATOM 0 HB ILE A 42 10.576 -0.606 -3.170 1.00 0.00 H new ATOM 0 HG12 ILE A 42 10.837 -0.578 -0.332 1.00 0.00 H new ATOM 0 HG13 ILE A 42 12.476 -0.492 -0.948 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.147 -1.778 -1.517 1.00 0.00 H new ATOM 0 HG22 ILE A 42 9.751 -2.906 -2.754 1.00 0.00 H new ATOM 0 HG23 ILE A 42 10.491 -2.879 -1.135 1.00 0.00 H new ATOM 0 HD11 ILE A 42 11.497 1.778 -0.742 1.00 0.00 H new ATOM 0 HD12 ILE A 42 11.827 1.394 -2.448 1.00 0.00 H new ATOM 0 HD13 ILE A 42 10.163 1.307 -1.822 1.00 0.00 H new ATOM 679 N VAL A 43 11.894 -2.762 -5.185 1.00 0.00 N ATOM 680 CA VAL A 43 11.499 -3.810 -6.167 1.00 0.00 C ATOM 681 C VAL A 43 12.676 -4.759 -6.402 1.00 0.00 C ATOM 682 O VAL A 43 12.501 -5.890 -6.807 1.00 0.00 O ATOM 683 CB VAL A 43 11.107 -3.148 -7.490 1.00 0.00 C ATOM 684 CG1 VAL A 43 10.514 -4.197 -8.430 1.00 0.00 C ATOM 685 CG2 VAL A 43 10.066 -2.057 -7.224 1.00 0.00 C ATOM 0 H VAL A 43 12.177 -1.870 -5.592 1.00 0.00 H new ATOM 0 HA VAL A 43 10.651 -4.372 -5.776 1.00 0.00 H new ATOM 0 HB VAL A 43 11.990 -2.706 -7.950 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.235 -3.725 -9.372 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.253 -4.976 -8.619 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.630 -4.640 -7.970 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.786 -1.584 -8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.183 -2.501 -6.764 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.487 -1.308 -6.553 1.00 0.00 H new ATOM 695 N THR A 44 13.874 -4.306 -6.151 1.00 0.00 N ATOM 696 CA THR A 44 15.061 -5.184 -6.360 1.00 0.00 C ATOM 697 C THR A 44 15.361 -5.954 -5.072 1.00 0.00 C ATOM 698 O THR A 44 15.895 -7.044 -5.100 1.00 0.00 O ATOM 699 CB THR A 44 16.270 -4.324 -6.735 1.00 0.00 C ATOM 700 OG1 THR A 44 15.887 -3.371 -7.717 1.00 0.00 O ATOM 701 CG2 THR A 44 17.381 -5.216 -7.292 1.00 0.00 C ATOM 0 H THR A 44 14.082 -3.367 -5.811 1.00 0.00 H new ATOM 0 HA THR A 44 14.854 -5.890 -7.164 1.00 0.00 H new ATOM 0 HB THR A 44 16.635 -3.805 -5.849 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.314 -2.690 -7.306 1.00 0.00 H new ATOM 0 HG21 THR A 44 18.241 -4.602 -7.559 1.00 0.00 H new ATOM 0 HG22 THR A 44 17.675 -5.945 -6.537 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.019 -5.738 -8.178 1.00 0.00 H new ATOM 709 N LYS A 45 15.023 -5.394 -3.943 1.00 0.00 N ATOM 710 CA LYS A 45 15.291 -6.093 -2.655 1.00 0.00 C ATOM 711 C LYS A 45 14.116 -7.014 -2.319 1.00 0.00 C ATOM 712 O LYS A 45 14.294 -8.103 -1.810 1.00 0.00 O ATOM 713 CB LYS A 45 15.465 -5.061 -1.540 1.00 0.00 C ATOM 714 CG LYS A 45 16.942 -4.679 -1.423 1.00 0.00 C ATOM 715 CD LYS A 45 17.216 -4.116 -0.027 1.00 0.00 C ATOM 716 CE LYS A 45 18.698 -4.284 0.311 1.00 0.00 C ATOM 717 NZ LYS A 45 18.944 -5.673 0.788 1.00 0.00 N ATOM 0 H LYS A 45 14.573 -4.483 -3.857 1.00 0.00 H new ATOM 0 HA LYS A 45 16.202 -6.685 -2.747 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.865 -4.176 -1.753 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.108 -5.468 -0.594 1.00 0.00 H new ATOM 0 HG2 LYS A 45 17.569 -5.552 -1.604 1.00 0.00 H new ATOM 0 HG3 LYS A 45 17.198 -3.939 -2.181 1.00 0.00 H new ATOM 0 HD2 LYS A 45 16.941 -3.062 0.012 1.00 0.00 H new ATOM 0 HD3 LYS A 45 16.603 -4.633 0.712 1.00 0.00 H new ATOM 0 HE2 LYS A 45 19.308 -4.077 -0.568 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.990 -3.567 1.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 19.946 -5.916 0.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.709 -5.740 1.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 18.349 -6.335 0.250 1.00 0.00 H new ATOM 731 N GLU A 46 12.916 -6.586 -2.600 1.00 0.00 N ATOM 732 CA GLU A 46 11.732 -7.437 -2.296 1.00 0.00 C ATOM 733 C GLU A 46 11.248 -8.115 -3.580 1.00 0.00 C ATOM 734 O GLU A 46 10.865 -9.268 -3.578 1.00 0.00 O ATOM 735 CB GLU A 46 10.609 -6.565 -1.727 1.00 0.00 C ATOM 736 CG GLU A 46 11.176 -5.647 -0.643 1.00 0.00 C ATOM 737 CD GLU A 46 10.743 -6.156 0.734 1.00 0.00 C ATOM 738 OE1 GLU A 46 9.550 -6.176 0.988 1.00 0.00 O ATOM 739 OE2 GLU A 46 11.612 -6.517 1.510 1.00 0.00 O ATOM 0 H GLU A 46 12.705 -5.684 -3.027 1.00 0.00 H new ATOM 0 HA GLU A 46 12.009 -8.197 -1.565 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.157 -5.971 -2.522 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.821 -7.193 -1.311 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.264 -5.620 -0.707 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.822 -4.627 -0.793 1.00 0.00 H new ATOM 746 N ARG A 47 11.264 -7.409 -4.676 1.00 0.00 N ATOM 747 CA ARG A 47 10.806 -8.014 -5.959 1.00 0.00 C ATOM 748 C ARG A 47 9.322 -8.379 -5.849 1.00 0.00 C ATOM 749 O ARG A 47 8.969 -9.541 -5.862 1.00 0.00 O ATOM 750 CB ARG A 47 11.622 -9.275 -6.248 1.00 0.00 C ATOM 751 CG ARG A 47 12.734 -8.946 -7.245 1.00 0.00 C ATOM 752 CD ARG A 47 13.633 -10.170 -7.432 1.00 0.00 C ATOM 753 NE ARG A 47 13.444 -10.722 -8.803 1.00 0.00 N ATOM 754 CZ ARG A 47 13.992 -10.129 -9.830 1.00 0.00 C ATOM 755 NH1 ARG A 47 14.708 -9.050 -9.661 1.00 0.00 N ATOM 756 NH2 ARG A 47 13.823 -10.618 -11.029 1.00 0.00 N ATOM 0 H ARG A 47 11.574 -6.439 -4.739 1.00 0.00 H new ATOM 0 HA ARG A 47 10.945 -7.298 -6.769 1.00 0.00 H new ATOM 0 HB2 ARG A 47 12.051 -9.663 -5.324 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.976 -10.054 -6.652 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.303 -8.649 -8.201 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.322 -8.102 -6.884 1.00 0.00 H new ATOM 0 HD2 ARG A 47 14.677 -9.894 -7.280 1.00 0.00 H new ATOM 0 HD3 ARG A 47 13.392 -10.928 -6.687 1.00 0.00 H new ATOM 0 HE ARG A 47 12.886 -11.565 -8.940 1.00 0.00 H new ATOM 0 HH11 ARG A 47 14.841 -8.668 -8.725 1.00 0.00 H new ATOM 0 HH12 ARG A 47 15.134 -8.590 -10.465 1.00 0.00 H new ATOM 0 HH21 ARG A 47 13.264 -11.461 -11.162 1.00 0.00 H new ATOM 0 HH22 ARG A 47 14.250 -10.157 -11.833 1.00 0.00 H new ATOM 770 N PRO A 48 8.498 -7.369 -5.746 1.00 0.00 N ATOM 771 CA PRO A 48 7.039 -7.542 -5.635 1.00 0.00 C ATOM 772 C PRO A 48 6.432 -7.862 -7.004 1.00 0.00 C ATOM 773 O PRO A 48 7.119 -8.278 -7.915 1.00 0.00 O ATOM 774 CB PRO A 48 6.553 -6.182 -5.125 1.00 0.00 C ATOM 775 CG PRO A 48 7.648 -5.156 -5.509 1.00 0.00 C ATOM 776 CD PRO A 48 8.943 -5.960 -5.733 1.00 0.00 C ATOM 0 HA PRO A 48 6.754 -8.364 -4.978 1.00 0.00 H new ATOM 0 HB2 PRO A 48 5.597 -5.917 -5.576 1.00 0.00 H new ATOM 0 HB3 PRO A 48 6.401 -6.203 -4.046 1.00 0.00 H new ATOM 0 HG2 PRO A 48 7.369 -4.611 -6.411 1.00 0.00 H new ATOM 0 HG3 PRO A 48 7.782 -4.418 -4.718 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.424 -5.686 -6.672 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.667 -5.778 -4.939 1.00 0.00 H new ATOM 784 N ASP A 49 5.150 -7.672 -7.153 1.00 0.00 N ATOM 785 CA ASP A 49 4.502 -7.967 -8.462 1.00 0.00 C ATOM 786 C ASP A 49 3.551 -6.826 -8.831 1.00 0.00 C ATOM 787 O ASP A 49 2.786 -6.922 -9.769 1.00 0.00 O ATOM 788 CB ASP A 49 3.714 -9.275 -8.359 1.00 0.00 C ATOM 789 CG ASP A 49 3.234 -9.694 -9.750 1.00 0.00 C ATOM 790 OD1 ASP A 49 4.030 -9.639 -10.672 1.00 0.00 O ATOM 791 OD2 ASP A 49 2.077 -10.062 -9.868 1.00 0.00 O ATOM 0 H ASP A 49 4.524 -7.326 -6.426 1.00 0.00 H new ATOM 0 HA ASP A 49 5.268 -8.064 -9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 49 4.341 -10.056 -7.929 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.861 -9.147 -7.692 1.00 0.00 H new ATOM 796 N LEU A 50 3.592 -5.746 -8.099 1.00 0.00 N ATOM 797 CA LEU A 50 2.689 -4.602 -8.409 1.00 0.00 C ATOM 798 C LEU A 50 3.395 -3.287 -8.074 1.00 0.00 C ATOM 799 O LEU A 50 3.575 -2.945 -6.921 1.00 0.00 O ATOM 800 CB LEU A 50 1.410 -4.720 -7.576 1.00 0.00 C ATOM 801 CG LEU A 50 0.222 -5.001 -8.497 1.00 0.00 C ATOM 802 CD1 LEU A 50 0.196 -3.972 -9.629 1.00 0.00 C ATOM 803 CD2 LEU A 50 0.358 -6.405 -9.090 1.00 0.00 C ATOM 0 H LEU A 50 4.211 -5.607 -7.301 1.00 0.00 H new ATOM 0 HA LEU A 50 2.436 -4.618 -9.469 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.513 -5.521 -6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.241 -3.799 -7.018 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.703 -4.934 -7.925 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.651 -4.174 -10.285 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.099 -2.971 -9.209 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.121 -4.037 -10.201 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.488 -6.606 -9.747 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.284 -6.471 -9.661 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.375 -7.140 -8.285 1.00 0.00 H new ATOM 815 N VAL A 51 3.795 -2.546 -9.071 1.00 0.00 N ATOM 816 CA VAL A 51 4.488 -1.253 -8.805 1.00 0.00 C ATOM 817 C VAL A 51 3.607 -0.097 -9.283 1.00 0.00 C ATOM 818 O VAL A 51 3.425 0.109 -10.466 1.00 0.00 O ATOM 819 CB VAL A 51 5.821 -1.221 -9.556 1.00 0.00 C ATOM 820 CG1 VAL A 51 6.796 -0.295 -8.828 1.00 0.00 C ATOM 821 CG2 VAL A 51 6.408 -2.634 -9.613 1.00 0.00 C ATOM 0 H VAL A 51 3.672 -2.779 -10.056 1.00 0.00 H new ATOM 0 HA VAL A 51 4.673 -1.154 -7.735 1.00 0.00 H new ATOM 0 HB VAL A 51 5.658 -0.853 -10.569 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.745 -0.273 -9.363 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.379 0.711 -8.786 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.959 -0.663 -7.815 1.00 0.00 H new ATOM 0 HG21 VAL A 51 7.358 -2.612 -10.148 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.571 -3.002 -8.600 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.714 -3.295 -10.132 1.00 0.00 H new ATOM 831 N LEU A 52 3.059 0.660 -8.372 1.00 0.00 N ATOM 832 CA LEU A 52 2.190 1.800 -8.776 1.00 0.00 C ATOM 833 C LEU A 52 3.041 3.062 -8.929 1.00 0.00 C ATOM 834 O LEU A 52 3.786 3.432 -8.043 1.00 0.00 O ATOM 835 CB LEU A 52 1.123 2.033 -7.704 1.00 0.00 C ATOM 836 CG LEU A 52 0.513 0.693 -7.292 1.00 0.00 C ATOM 837 CD1 LEU A 52 0.988 0.326 -5.885 1.00 0.00 C ATOM 838 CD2 LEU A 52 -1.013 0.805 -7.301 1.00 0.00 C ATOM 0 H LEU A 52 3.176 0.538 -7.366 1.00 0.00 H new ATOM 0 HA LEU A 52 1.708 1.569 -9.726 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.564 2.526 -6.838 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.347 2.696 -8.086 1.00 0.00 H new ATOM 0 HG LEU A 52 0.826 -0.080 -7.994 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.553 -0.629 -5.592 1.00 0.00 H new ATOM 0 HD12 LEU A 52 2.075 0.247 -5.877 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.675 1.098 -5.182 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.450 -0.150 -7.007 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.325 1.578 -6.599 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.353 1.066 -8.303 1.00 0.00 H new ATOM 850 N LEU A 53 2.937 3.727 -10.048 1.00 0.00 N ATOM 851 CA LEU A 53 3.741 4.964 -10.255 1.00 0.00 C ATOM 852 C LEU A 53 2.805 6.174 -10.326 1.00 0.00 C ATOM 853 O LEU A 53 1.697 6.087 -10.818 1.00 0.00 O ATOM 854 CB LEU A 53 4.528 4.853 -11.563 1.00 0.00 C ATOM 855 CG LEU A 53 5.516 3.686 -11.477 1.00 0.00 C ATOM 856 CD1 LEU A 53 6.244 3.722 -10.131 1.00 0.00 C ATOM 857 CD2 LEU A 53 4.758 2.364 -11.609 1.00 0.00 C ATOM 0 H LEU A 53 2.331 3.467 -10.826 1.00 0.00 H new ATOM 0 HA LEU A 53 4.435 5.087 -9.424 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.844 4.701 -12.398 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.064 5.782 -11.755 1.00 0.00 H new ATOM 0 HG LEU A 53 6.244 3.772 -12.284 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.946 2.890 -10.075 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.787 4.662 -10.036 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.518 3.640 -9.322 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.461 1.534 -11.548 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.028 2.281 -10.804 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.244 2.334 -12.570 1.00 0.00 H new ATOM 869 N ASP A 54 3.245 7.302 -9.840 1.00 0.00 N ATOM 870 CA ASP A 54 2.384 8.518 -9.881 1.00 0.00 C ATOM 871 C ASP A 54 3.072 9.599 -10.717 1.00 0.00 C ATOM 872 O ASP A 54 4.087 10.145 -10.331 1.00 0.00 O ATOM 873 CB ASP A 54 2.165 9.036 -8.457 1.00 0.00 C ATOM 874 CG ASP A 54 1.534 10.428 -8.513 1.00 0.00 C ATOM 875 OD1 ASP A 54 0.348 10.508 -8.786 1.00 0.00 O ATOM 876 OD2 ASP A 54 2.246 11.390 -8.281 1.00 0.00 O ATOM 0 H ASP A 54 4.163 7.434 -9.416 1.00 0.00 H new ATOM 0 HA ASP A 54 1.422 8.269 -10.328 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.518 8.354 -7.906 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.114 9.076 -7.923 1.00 0.00 H new ATOM 881 N MET A 55 2.530 9.911 -11.861 1.00 0.00 N ATOM 882 CA MET A 55 3.155 10.955 -12.722 1.00 0.00 C ATOM 883 C MET A 55 2.968 12.331 -12.078 1.00 0.00 C ATOM 884 O MET A 55 3.474 13.325 -12.560 1.00 0.00 O ATOM 885 CB MET A 55 2.491 10.943 -14.101 1.00 0.00 C ATOM 886 CG MET A 55 2.540 9.528 -14.680 1.00 0.00 C ATOM 887 SD MET A 55 4.262 8.982 -14.795 1.00 0.00 S ATOM 888 CE MET A 55 4.004 7.293 -14.198 1.00 0.00 C ATOM 0 H MET A 55 1.681 9.489 -12.238 1.00 0.00 H new ATOM 0 HA MET A 55 4.220 10.747 -12.828 1.00 0.00 H new ATOM 0 HB2 MET A 55 1.457 11.279 -14.021 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.001 11.638 -14.768 1.00 0.00 H new ATOM 0 HG2 MET A 55 1.972 8.845 -14.048 1.00 0.00 H new ATOM 0 HG3 MET A 55 2.075 9.511 -15.666 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.956 6.762 -14.186 1.00 0.00 H new ATOM 0 HE2 MET A 55 3.593 7.323 -13.189 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.308 6.776 -14.859 1.00 0.00 H new ATOM 898 N LYS A 56 2.244 12.400 -10.994 1.00 0.00 N ATOM 899 CA LYS A 56 2.027 13.713 -10.325 1.00 0.00 C ATOM 900 C LYS A 56 3.130 13.953 -9.291 1.00 0.00 C ATOM 901 O LYS A 56 3.025 14.823 -8.450 1.00 0.00 O ATOM 902 CB LYS A 56 0.665 13.709 -9.625 1.00 0.00 C ATOM 903 CG LYS A 56 -0.447 13.630 -10.672 1.00 0.00 C ATOM 904 CD LYS A 56 -1.794 13.441 -9.973 1.00 0.00 C ATOM 905 CE LYS A 56 -2.911 13.392 -11.017 1.00 0.00 C ATOM 906 NZ LYS A 56 -3.939 14.420 -10.694 1.00 0.00 N ATOM 0 H LYS A 56 1.794 11.603 -10.543 1.00 0.00 H new ATOM 0 HA LYS A 56 2.052 14.507 -11.071 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.597 12.862 -8.943 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.550 14.611 -9.025 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.461 14.540 -11.272 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.260 12.801 -11.355 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.787 12.520 -9.390 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.971 14.259 -9.275 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.502 13.571 -12.011 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.365 12.401 -11.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -4.723 14.353 -11.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.300 14.259 -9.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.513 15.367 -10.750 1.00 0.00 H new ATOM 920 N ILE A 57 4.188 13.190 -9.346 1.00 0.00 N ATOM 921 CA ILE A 57 5.293 13.379 -8.364 1.00 0.00 C ATOM 922 C ILE A 57 6.115 14.613 -8.757 1.00 0.00 C ATOM 923 O ILE A 57 6.370 14.836 -9.924 1.00 0.00 O ATOM 924 CB ILE A 57 6.193 12.142 -8.367 1.00 0.00 C ATOM 925 CG1 ILE A 57 5.414 10.945 -7.815 1.00 0.00 C ATOM 926 CG2 ILE A 57 7.419 12.397 -7.488 1.00 0.00 C ATOM 927 CD1 ILE A 57 6.268 9.682 -7.930 1.00 0.00 C ATOM 0 H ILE A 57 4.335 12.445 -10.027 1.00 0.00 H new ATOM 0 HA ILE A 57 4.877 13.521 -7.367 1.00 0.00 H new ATOM 0 HB ILE A 57 6.515 11.931 -9.387 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.146 11.122 -6.773 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.483 10.818 -8.367 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.059 11.515 -7.491 1.00 0.00 H new ATOM 0 HG22 ILE A 57 7.975 13.250 -7.877 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.098 12.608 -6.468 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.713 8.830 -7.537 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.514 9.503 -8.977 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.187 9.811 -7.358 1.00 0.00 H new ATOM 939 N PRO A 58 6.504 15.381 -7.769 1.00 0.00 N ATOM 940 CA PRO A 58 7.299 16.604 -7.982 1.00 0.00 C ATOM 941 C PRO A 58 8.769 16.250 -8.233 1.00 0.00 C ATOM 942 O PRO A 58 9.437 16.870 -9.037 1.00 0.00 O ATOM 943 CB PRO A 58 7.140 17.369 -6.666 1.00 0.00 C ATOM 944 CG PRO A 58 6.757 16.321 -5.595 1.00 0.00 C ATOM 945 CD PRO A 58 6.191 15.104 -6.352 1.00 0.00 C ATOM 0 HA PRO A 58 6.974 17.181 -8.847 1.00 0.00 H new ATOM 0 HB2 PRO A 58 8.066 17.877 -6.398 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.369 18.135 -6.753 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.626 16.038 -5.002 1.00 0.00 H new ATOM 0 HG3 PRO A 58 6.017 16.726 -4.904 1.00 0.00 H new ATOM 0 HD2 PRO A 58 6.653 14.176 -6.016 1.00 0.00 H new ATOM 0 HD3 PRO A 58 5.117 15.001 -6.194 1.00 0.00 H new ATOM 953 N GLY A 59 9.276 15.260 -7.551 1.00 0.00 N ATOM 954 CA GLY A 59 10.700 14.869 -7.750 1.00 0.00 C ATOM 955 C GLY A 59 11.024 14.855 -9.245 1.00 0.00 C ATOM 956 O GLY A 59 12.056 15.331 -9.671 1.00 0.00 O ATOM 0 H GLY A 59 8.765 14.705 -6.864 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.356 15.569 -7.232 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.881 13.884 -7.319 1.00 0.00 H new ATOM 960 N MET A 60 10.147 14.311 -10.046 1.00 0.00 N ATOM 961 CA MET A 60 10.406 14.266 -11.512 1.00 0.00 C ATOM 962 C MET A 60 9.249 13.546 -12.210 1.00 0.00 C ATOM 963 O MET A 60 8.212 13.304 -11.624 1.00 0.00 O ATOM 964 CB MET A 60 11.710 13.512 -11.778 1.00 0.00 C ATOM 965 CG MET A 60 11.546 12.047 -11.367 1.00 0.00 C ATOM 966 SD MET A 60 11.600 11.917 -9.563 1.00 0.00 S ATOM 967 CE MET A 60 9.924 11.274 -9.332 1.00 0.00 C ATOM 0 H MET A 60 9.264 13.897 -9.748 1.00 0.00 H new ATOM 0 HA MET A 60 10.490 15.282 -11.898 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.971 13.577 -12.834 1.00 0.00 H new ATOM 0 HB3 MET A 60 12.527 13.968 -11.219 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.600 11.657 -11.742 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.338 11.443 -11.810 1.00 0.00 H new ATOM 0 HE1 MET A 60 9.884 10.684 -8.417 1.00 0.00 H new ATOM 0 HE2 MET A 60 9.222 12.105 -9.259 1.00 0.00 H new ATOM 0 HE3 MET A 60 9.655 10.646 -10.181 1.00 0.00 H new ATOM 977 N ASP A 61 9.419 13.203 -13.458 1.00 0.00 N ATOM 978 CA ASP A 61 8.329 12.499 -14.190 1.00 0.00 C ATOM 979 C ASP A 61 8.461 10.991 -13.972 1.00 0.00 C ATOM 980 O ASP A 61 9.464 10.391 -14.307 1.00 0.00 O ATOM 981 CB ASP A 61 8.436 12.810 -15.685 1.00 0.00 C ATOM 982 CG ASP A 61 8.057 14.271 -15.932 1.00 0.00 C ATOM 983 OD1 ASP A 61 7.973 15.012 -14.966 1.00 0.00 O ATOM 984 OD2 ASP A 61 7.859 14.624 -17.083 1.00 0.00 O ATOM 0 H ASP A 61 10.264 13.380 -14.001 1.00 0.00 H new ATOM 0 HA ASP A 61 7.362 12.837 -13.817 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.451 12.623 -16.034 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.778 12.152 -16.252 1.00 0.00 H new ATOM 989 N GLY A 62 7.458 10.372 -13.413 1.00 0.00 N ATOM 990 CA GLY A 62 7.528 8.903 -13.175 1.00 0.00 C ATOM 991 C GLY A 62 7.758 8.179 -14.503 1.00 0.00 C ATOM 992 O GLY A 62 8.135 7.024 -14.534 1.00 0.00 O ATOM 0 H GLY A 62 6.593 10.820 -13.111 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.336 8.675 -12.480 1.00 0.00 H new ATOM 0 HA3 GLY A 62 6.604 8.554 -12.714 1.00 0.00 H new ATOM 996 N ILE A 63 7.536 8.848 -15.600 1.00 0.00 N ATOM 997 CA ILE A 63 7.743 8.197 -16.925 1.00 0.00 C ATOM 998 C ILE A 63 9.055 7.410 -16.907 1.00 0.00 C ATOM 999 O ILE A 63 9.100 6.252 -17.271 1.00 0.00 O ATOM 1000 CB ILE A 63 7.804 9.267 -18.016 1.00 0.00 C ATOM 1001 CG1 ILE A 63 6.427 9.919 -18.167 1.00 0.00 C ATOM 1002 CG2 ILE A 63 8.209 8.620 -19.342 1.00 0.00 C ATOM 1003 CD1 ILE A 63 5.441 8.904 -18.750 1.00 0.00 C ATOM 0 H ILE A 63 7.220 9.817 -15.637 1.00 0.00 H new ATOM 0 HA ILE A 63 6.915 7.518 -17.129 1.00 0.00 H new ATOM 0 HB ILE A 63 8.538 10.025 -17.742 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.072 10.272 -17.199 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.495 10.791 -18.818 1.00 0.00 H new ATOM 0 HG21 ILE A 63 8.253 9.382 -20.120 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.188 8.154 -19.235 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.475 7.863 -19.617 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.461 9.369 -18.857 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.794 8.573 -19.727 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.364 8.046 -18.082 1.00 0.00 H new ATOM 1015 N GLU A 64 10.123 8.030 -16.487 1.00 0.00 N ATOM 1016 CA GLU A 64 11.431 7.316 -16.447 1.00 0.00 C ATOM 1017 C GLU A 64 11.354 6.169 -15.437 1.00 0.00 C ATOM 1018 O GLU A 64 11.885 5.098 -15.659 1.00 0.00 O ATOM 1019 CB GLU A 64 12.532 8.292 -16.026 1.00 0.00 C ATOM 1020 CG GLU A 64 12.325 9.631 -16.736 1.00 0.00 C ATOM 1021 CD GLU A 64 13.678 10.320 -16.932 1.00 0.00 C ATOM 1022 OE1 GLU A 64 14.687 9.663 -16.738 1.00 0.00 O ATOM 1023 OE2 GLU A 64 13.680 11.490 -17.274 1.00 0.00 O ATOM 0 H GLU A 64 10.147 8.999 -16.170 1.00 0.00 H new ATOM 0 HA GLU A 64 11.658 6.916 -17.435 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.513 8.434 -14.946 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.511 7.883 -16.276 1.00 0.00 H new ATOM 0 HG2 GLU A 64 11.843 9.472 -17.701 1.00 0.00 H new ATOM 0 HG3 GLU A 64 11.663 10.267 -16.149 1.00 0.00 H new ATOM 1030 N ILE A 65 10.698 6.383 -14.330 1.00 0.00 N ATOM 1031 CA ILE A 65 10.588 5.303 -13.308 1.00 0.00 C ATOM 1032 C ILE A 65 10.045 4.033 -13.964 1.00 0.00 C ATOM 1033 O ILE A 65 10.690 3.004 -13.972 1.00 0.00 O ATOM 1034 CB ILE A 65 9.639 5.748 -12.195 1.00 0.00 C ATOM 1035 CG1 ILE A 65 10.107 7.093 -11.634 1.00 0.00 C ATOM 1036 CG2 ILE A 65 9.637 4.705 -11.077 1.00 0.00 C ATOM 1037 CD1 ILE A 65 9.226 7.486 -10.447 1.00 0.00 C ATOM 0 H ILE A 65 10.233 7.258 -14.089 1.00 0.00 H new ATOM 0 HA ILE A 65 11.573 5.101 -12.886 1.00 0.00 H new ATOM 0 HB ILE A 65 8.631 5.851 -12.598 1.00 0.00 H new ATOM 0 HG12 ILE A 65 11.149 7.025 -11.320 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.056 7.859 -12.408 1.00 0.00 H new ATOM 0 HG21 ILE A 65 8.960 5.023 -10.284 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.305 3.746 -11.475 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.645 4.601 -10.674 1.00 0.00 H new ATOM 0 HD11 ILE A 65 9.560 8.444 -10.048 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.190 7.571 -10.775 1.00 0.00 H new ATOM 0 HD13 ILE A 65 9.300 6.724 -9.671 1.00 0.00 H new ATOM 1049 N LEU A 66 8.863 4.095 -14.512 1.00 0.00 N ATOM 1050 CA LEU A 66 8.280 2.889 -15.166 1.00 0.00 C ATOM 1051 C LEU A 66 9.295 2.289 -16.140 1.00 0.00 C ATOM 1052 O LEU A 66 9.726 1.164 -15.982 1.00 0.00 O ATOM 1053 CB LEU A 66 7.014 3.287 -15.928 1.00 0.00 C ATOM 1054 CG LEU A 66 5.788 2.712 -15.216 1.00 0.00 C ATOM 1055 CD1 LEU A 66 4.519 3.157 -15.943 1.00 0.00 C ATOM 1056 CD2 LEU A 66 5.869 1.184 -15.221 1.00 0.00 C ATOM 0 H LEU A 66 8.275 4.928 -14.535 1.00 0.00 H new ATOM 0 HA LEU A 66 8.031 2.149 -14.405 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.938 4.373 -15.986 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.061 2.915 -16.952 1.00 0.00 H new ATOM 0 HG LEU A 66 5.762 3.073 -14.188 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.646 2.747 -15.435 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.462 4.245 -15.942 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.543 2.796 -16.971 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.996 0.772 -14.714 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.895 0.824 -16.250 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.774 0.866 -14.703 1.00 0.00 H new ATOM 1068 N LYS A 67 9.678 3.028 -17.145 1.00 0.00 N ATOM 1069 CA LYS A 67 10.665 2.500 -18.133 1.00 0.00 C ATOM 1070 C LYS A 67 11.769 1.735 -17.400 1.00 0.00 C ATOM 1071 O LYS A 67 12.301 0.763 -17.900 1.00 0.00 O ATOM 1072 CB LYS A 67 11.282 3.665 -18.908 1.00 0.00 C ATOM 1073 CG LYS A 67 11.450 3.270 -20.377 1.00 0.00 C ATOM 1074 CD LYS A 67 12.867 2.742 -20.605 1.00 0.00 C ATOM 1075 CE LYS A 67 12.798 1.329 -21.188 1.00 0.00 C ATOM 1076 NZ LYS A 67 13.207 1.362 -22.621 1.00 0.00 N ATOM 0 H LYS A 67 9.350 3.977 -17.326 1.00 0.00 H new ATOM 0 HA LYS A 67 10.158 1.828 -18.825 1.00 0.00 H new ATOM 0 HB2 LYS A 67 10.646 4.546 -18.828 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.248 3.930 -18.479 1.00 0.00 H new ATOM 0 HG2 LYS A 67 10.719 2.507 -20.645 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.263 4.131 -21.020 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.407 3.401 -21.285 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.418 2.732 -19.665 1.00 0.00 H new ATOM 0 HE2 LYS A 67 13.452 0.661 -20.628 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.786 0.935 -21.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 13.160 0.402 -23.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.566 1.987 -23.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.180 1.720 -22.696 1.00 0.00 H new ATOM 1090 N ARG A 68 12.115 2.161 -16.217 1.00 0.00 N ATOM 1091 CA ARG A 68 13.182 1.457 -15.454 1.00 0.00 C ATOM 1092 C ARG A 68 12.646 0.114 -14.952 1.00 0.00 C ATOM 1093 O ARG A 68 13.141 -0.935 -15.316 1.00 0.00 O ATOM 1094 CB ARG A 68 13.609 2.314 -14.262 1.00 0.00 C ATOM 1095 CG ARG A 68 14.336 3.563 -14.763 1.00 0.00 C ATOM 1096 CD ARG A 68 15.522 3.867 -13.845 1.00 0.00 C ATOM 1097 NE ARG A 68 16.185 5.124 -14.292 1.00 0.00 N ATOM 1098 CZ ARG A 68 16.980 5.114 -15.329 1.00 0.00 C ATOM 1099 NH1 ARG A 68 17.197 4.003 -15.979 1.00 0.00 N ATOM 1100 NH2 ARG A 68 17.559 6.218 -15.716 1.00 0.00 N ATOM 0 H ARG A 68 11.704 2.967 -15.746 1.00 0.00 H new ATOM 0 HA ARG A 68 14.041 1.287 -16.103 1.00 0.00 H new ATOM 0 HB2 ARG A 68 12.736 2.600 -13.675 1.00 0.00 H new ATOM 0 HB3 ARG A 68 14.262 1.740 -13.604 1.00 0.00 H new ATOM 0 HG2 ARG A 68 14.684 3.409 -15.785 1.00 0.00 H new ATOM 0 HG3 ARG A 68 13.652 4.411 -14.783 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.181 3.969 -12.815 1.00 0.00 H new ATOM 0 HD3 ARG A 68 16.233 3.041 -13.865 1.00 0.00 H new ATOM 0 HE ARG A 68 16.018 5.995 -13.787 1.00 0.00 H new ATOM 0 HH11 ARG A 68 16.745 3.139 -15.678 1.00 0.00 H new ATOM 0 HH12 ARG A 68 17.818 3.998 -16.788 1.00 0.00 H new ATOM 0 HH21 ARG A 68 17.391 7.087 -15.209 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.180 6.212 -16.525 1.00 0.00 H new ATOM 1114 N MET A 69 11.647 0.142 -14.108 1.00 0.00 N ATOM 1115 CA MET A 69 11.085 -1.139 -13.568 1.00 0.00 C ATOM 1116 C MET A 69 11.016 -2.181 -14.689 1.00 0.00 C ATOM 1117 O MET A 69 11.096 -3.367 -14.445 1.00 0.00 O ATOM 1118 CB MET A 69 9.670 -0.949 -12.981 1.00 0.00 C ATOM 1119 CG MET A 69 9.246 0.524 -12.986 1.00 0.00 C ATOM 1120 SD MET A 69 10.105 1.416 -11.666 1.00 0.00 S ATOM 1121 CE MET A 69 8.916 1.067 -10.347 1.00 0.00 C ATOM 0 H MET A 69 11.195 0.991 -13.769 1.00 0.00 H new ATOM 0 HA MET A 69 11.745 -1.473 -12.768 1.00 0.00 H new ATOM 0 HB2 MET A 69 8.955 -1.535 -13.558 1.00 0.00 H new ATOM 0 HB3 MET A 69 9.645 -1.331 -11.960 1.00 0.00 H new ATOM 0 HG2 MET A 69 9.477 0.975 -13.951 1.00 0.00 H new ATOM 0 HG3 MET A 69 8.168 0.602 -12.847 1.00 0.00 H new ATOM 0 HE1 MET A 69 8.943 1.871 -9.611 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.914 0.995 -10.770 1.00 0.00 H new ATOM 0 HE3 MET A 69 9.174 0.124 -9.864 1.00 0.00 H new ATOM 1131 N LYS A 70 10.873 -1.753 -15.916 1.00 0.00 N ATOM 1132 CA LYS A 70 10.807 -2.738 -17.037 1.00 0.00 C ATOM 1133 C LYS A 70 12.220 -3.226 -17.358 1.00 0.00 C ATOM 1134 O LYS A 70 12.520 -4.400 -17.268 1.00 0.00 O ATOM 1135 CB LYS A 70 10.214 -2.089 -18.295 1.00 0.00 C ATOM 1136 CG LYS A 70 9.365 -0.874 -17.922 1.00 0.00 C ATOM 1137 CD LYS A 70 8.407 -1.243 -16.787 1.00 0.00 C ATOM 1138 CE LYS A 70 6.964 -1.041 -17.250 1.00 0.00 C ATOM 1139 NZ LYS A 70 6.864 0.228 -18.024 1.00 0.00 N ATOM 0 H LYS A 70 10.800 -0.773 -16.189 1.00 0.00 H new ATOM 0 HA LYS A 70 10.172 -3.570 -16.733 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.016 -1.786 -18.968 1.00 0.00 H new ATOM 0 HB3 LYS A 70 9.604 -2.815 -18.833 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.008 -0.049 -17.614 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.801 -0.532 -18.790 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.562 -2.280 -16.489 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.609 -0.626 -15.912 1.00 0.00 H new ATOM 0 HE2 LYS A 70 6.648 -1.882 -17.867 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.296 -1.008 -16.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 5.871 0.534 -18.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.435 0.963 -17.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.217 0.074 -18.990 1.00 0.00 H new ATOM 1153 N VAL A 71 13.088 -2.329 -17.735 1.00 0.00 N ATOM 1154 CA VAL A 71 14.483 -2.731 -18.069 1.00 0.00 C ATOM 1155 C VAL A 71 14.994 -3.728 -17.025 1.00 0.00 C ATOM 1156 O VAL A 71 15.850 -4.545 -17.301 1.00 0.00 O ATOM 1157 CB VAL A 71 15.381 -1.492 -18.077 1.00 0.00 C ATOM 1158 CG1 VAL A 71 16.682 -1.810 -18.815 1.00 0.00 C ATOM 1159 CG2 VAL A 71 14.659 -0.345 -18.789 1.00 0.00 C ATOM 0 H VAL A 71 12.891 -1.332 -17.826 1.00 0.00 H new ATOM 0 HA VAL A 71 14.500 -3.199 -19.053 1.00 0.00 H new ATOM 0 HB VAL A 71 15.607 -1.200 -17.051 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.322 -0.928 -18.821 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.196 -2.628 -18.310 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.457 -2.102 -19.841 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.297 0.538 -18.796 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.434 -0.638 -19.815 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.731 -0.118 -18.264 1.00 0.00 H new ATOM 1169 N ILE A 72 14.474 -3.670 -15.830 1.00 0.00 N ATOM 1170 CA ILE A 72 14.931 -4.617 -14.774 1.00 0.00 C ATOM 1171 C ILE A 72 14.144 -5.924 -14.888 1.00 0.00 C ATOM 1172 O ILE A 72 14.709 -6.994 -14.989 1.00 0.00 O ATOM 1173 CB ILE A 72 14.694 -3.998 -13.396 1.00 0.00 C ATOM 1174 CG1 ILE A 72 15.453 -2.672 -13.294 1.00 0.00 C ATOM 1175 CG2 ILE A 72 15.197 -4.954 -12.312 1.00 0.00 C ATOM 1176 CD1 ILE A 72 15.147 -2.009 -11.951 1.00 0.00 C ATOM 0 H ILE A 72 13.754 -3.009 -15.539 1.00 0.00 H new ATOM 0 HA ILE A 72 15.994 -4.820 -14.903 1.00 0.00 H new ATOM 0 HB ILE A 72 13.627 -3.820 -13.259 1.00 0.00 H new ATOM 0 HG12 ILE A 72 16.525 -2.846 -13.389 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.164 -2.012 -14.112 1.00 0.00 H new ATOM 0 HG21 ILE A 72 15.028 -4.512 -11.330 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.659 -5.899 -12.382 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.263 -5.133 -12.451 1.00 0.00 H new ATOM 0 HD11 ILE A 72 15.688 -1.065 -11.880 1.00 0.00 H new ATOM 0 HD12 ILE A 72 14.076 -1.820 -11.874 1.00 0.00 H new ATOM 0 HD13 ILE A 72 15.459 -2.668 -11.141 1.00 0.00 H new ATOM 1188 N ASP A 73 12.841 -5.843 -14.873 1.00 0.00 N ATOM 1189 CA ASP A 73 12.015 -7.079 -14.982 1.00 0.00 C ATOM 1190 C ASP A 73 10.853 -6.828 -15.945 1.00 0.00 C ATOM 1191 O ASP A 73 10.080 -5.905 -15.774 1.00 0.00 O ATOM 1192 CB ASP A 73 11.465 -7.448 -13.602 1.00 0.00 C ATOM 1193 CG ASP A 73 12.540 -8.186 -12.803 1.00 0.00 C ATOM 1194 OD1 ASP A 73 13.431 -7.524 -12.296 1.00 0.00 O ATOM 1195 OD2 ASP A 73 12.455 -9.399 -12.713 1.00 0.00 O ATOM 0 H ASP A 73 12.313 -4.974 -14.790 1.00 0.00 H new ATOM 0 HA ASP A 73 12.629 -7.897 -15.358 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.155 -6.548 -13.070 1.00 0.00 H new ATOM 0 HB3 ASP A 73 10.580 -8.076 -13.708 1.00 0.00 H new ATOM 1200 N GLU A 74 10.722 -7.641 -16.957 1.00 0.00 N ATOM 1201 CA GLU A 74 9.610 -7.446 -17.931 1.00 0.00 C ATOM 1202 C GLU A 74 8.334 -8.089 -17.385 1.00 0.00 C ATOM 1203 O GLU A 74 7.260 -7.917 -17.928 1.00 0.00 O ATOM 1204 CB GLU A 74 9.981 -8.099 -19.264 1.00 0.00 C ATOM 1205 CG GLU A 74 11.212 -7.406 -19.848 1.00 0.00 C ATOM 1206 CD GLU A 74 10.806 -6.595 -21.080 1.00 0.00 C ATOM 1207 OE1 GLU A 74 9.910 -7.033 -21.784 1.00 0.00 O ATOM 1208 OE2 GLU A 74 11.397 -5.551 -21.300 1.00 0.00 O ATOM 0 H GLU A 74 11.336 -8.432 -17.152 1.00 0.00 H new ATOM 0 HA GLU A 74 9.442 -6.380 -18.082 1.00 0.00 H new ATOM 0 HB2 GLU A 74 10.184 -9.160 -19.117 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.146 -8.027 -19.961 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.662 -6.752 -19.101 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.965 -8.146 -20.119 1.00 0.00 H new ATOM 1215 N ASN A 75 8.441 -8.831 -16.317 1.00 0.00 N ATOM 1216 CA ASN A 75 7.231 -9.484 -15.741 1.00 0.00 C ATOM 1217 C ASN A 75 6.833 -8.772 -14.447 1.00 0.00 C ATOM 1218 O ASN A 75 6.633 -9.392 -13.421 1.00 0.00 O ATOM 1219 CB ASN A 75 7.539 -10.953 -15.442 1.00 0.00 C ATOM 1220 CG ASN A 75 7.757 -11.706 -16.756 1.00 0.00 C ATOM 1221 OD1 ASN A 75 7.738 -11.116 -17.818 1.00 0.00 O ATOM 1222 ND2 ASN A 75 7.962 -12.994 -16.729 1.00 0.00 N ATOM 0 H ASN A 75 9.312 -9.013 -15.819 1.00 0.00 H new ATOM 0 HA ASN A 75 6.410 -9.423 -16.455 1.00 0.00 H new ATOM 0 HB2 ASN A 75 8.427 -11.029 -14.815 1.00 0.00 H new ATOM 0 HB3 ASN A 75 6.717 -11.402 -14.885 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.106 -13.506 -17.599 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.978 -13.489 -15.837 1.00 0.00 H new ATOM 1229 N ILE A 76 6.716 -7.473 -14.486 1.00 0.00 N ATOM 1230 CA ILE A 76 6.330 -6.722 -13.258 1.00 0.00 C ATOM 1231 C ILE A 76 5.102 -5.858 -13.552 1.00 0.00 C ATOM 1232 O ILE A 76 5.192 -4.837 -14.205 1.00 0.00 O ATOM 1233 CB ILE A 76 7.491 -5.828 -12.822 1.00 0.00 C ATOM 1234 CG1 ILE A 76 7.046 -4.951 -11.648 1.00 0.00 C ATOM 1235 CG2 ILE A 76 7.917 -4.937 -13.990 1.00 0.00 C ATOM 1236 CD1 ILE A 76 7.055 -5.777 -10.361 1.00 0.00 C ATOM 0 H ILE A 76 6.871 -6.899 -15.315 1.00 0.00 H new ATOM 0 HA ILE A 76 6.094 -7.426 -12.460 1.00 0.00 H new ATOM 0 HB ILE A 76 8.332 -6.450 -12.514 1.00 0.00 H new ATOM 0 HG12 ILE A 76 7.712 -4.094 -11.547 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.047 -4.557 -11.833 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.745 -4.300 -13.679 1.00 0.00 H new ATOM 0 HG22 ILE A 76 8.234 -5.560 -14.826 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.077 -4.315 -14.299 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.738 -5.153 -9.526 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.371 -6.619 -10.464 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.062 -6.149 -10.174 1.00 0.00 H new ATOM 1248 N ARG A 77 3.955 -6.258 -13.076 1.00 0.00 N ATOM 1249 CA ARG A 77 2.723 -5.458 -13.330 1.00 0.00 C ATOM 1250 C ARG A 77 2.941 -4.020 -12.853 1.00 0.00 C ATOM 1251 O ARG A 77 3.760 -3.758 -11.995 1.00 0.00 O ATOM 1252 CB ARG A 77 1.548 -6.076 -12.567 1.00 0.00 C ATOM 1253 CG ARG A 77 1.061 -7.324 -13.305 1.00 0.00 C ATOM 1254 CD ARG A 77 0.099 -8.104 -12.408 1.00 0.00 C ATOM 1255 NE ARG A 77 -0.434 -9.279 -13.154 1.00 0.00 N ATOM 1256 CZ ARG A 77 0.305 -10.344 -13.317 1.00 0.00 C ATOM 1257 NH1 ARG A 77 1.515 -10.385 -12.825 1.00 0.00 N ATOM 1258 NH2 ARG A 77 -0.165 -11.369 -13.973 1.00 0.00 N ATOM 0 H ARG A 77 3.817 -7.104 -12.522 1.00 0.00 H new ATOM 0 HA ARG A 77 2.504 -5.457 -14.398 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.855 -6.336 -11.554 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.737 -5.353 -12.479 1.00 0.00 H new ATOM 0 HG2 ARG A 77 0.562 -7.040 -14.231 1.00 0.00 H new ATOM 0 HG3 ARG A 77 1.909 -7.951 -13.579 1.00 0.00 H new ATOM 0 HD2 ARG A 77 0.614 -8.435 -11.506 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -0.721 -7.460 -12.089 1.00 0.00 H new ATOM 0 HE ARG A 77 -1.378 -9.252 -13.538 1.00 0.00 H new ATOM 0 HH11 ARG A 77 1.884 -9.584 -12.312 1.00 0.00 H new ATOM 0 HH12 ARG A 77 2.090 -11.218 -12.954 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -1.109 -11.339 -14.358 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.411 -12.201 -14.101 1.00 0.00 H new ATOM 1272 N VAL A 78 2.217 -3.086 -13.406 1.00 0.00 N ATOM 1273 CA VAL A 78 2.387 -1.666 -12.986 1.00 0.00 C ATOM 1274 C VAL A 78 1.027 -0.968 -12.975 1.00 0.00 C ATOM 1275 O VAL A 78 0.213 -1.156 -13.856 1.00 0.00 O ATOM 1276 CB VAL A 78 3.318 -0.953 -13.967 1.00 0.00 C ATOM 1277 CG1 VAL A 78 3.840 0.335 -13.332 1.00 0.00 C ATOM 1278 CG2 VAL A 78 4.497 -1.868 -14.307 1.00 0.00 C ATOM 0 H VAL A 78 1.516 -3.244 -14.130 1.00 0.00 H new ATOM 0 HA VAL A 78 2.818 -1.634 -11.985 1.00 0.00 H new ATOM 0 HB VAL A 78 2.770 -0.712 -14.878 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.504 0.843 -14.032 1.00 0.00 H new ATOM 0 HG12 VAL A 78 3.001 0.987 -13.089 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.388 0.095 -12.421 1.00 0.00 H new ATOM 0 HG21 VAL A 78 5.161 -1.361 -15.006 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.045 -2.109 -13.396 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.125 -2.787 -14.761 1.00 0.00 H new ATOM 1288 N ILE A 79 0.776 -0.157 -11.983 1.00 0.00 N ATOM 1289 CA ILE A 79 -0.530 0.559 -11.915 1.00 0.00 C ATOM 1290 C ILE A 79 -0.277 2.068 -11.895 1.00 0.00 C ATOM 1291 O ILE A 79 0.430 2.577 -11.049 1.00 0.00 O ATOM 1292 CB ILE A 79 -1.271 0.149 -10.641 1.00 0.00 C ATOM 1293 CG1 ILE A 79 -1.196 -1.369 -10.475 1.00 0.00 C ATOM 1294 CG2 ILE A 79 -2.735 0.582 -10.738 1.00 0.00 C ATOM 1295 CD1 ILE A 79 -2.097 -2.033 -11.511 1.00 0.00 C ATOM 0 H ILE A 79 1.419 0.041 -11.216 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.135 0.301 -12.784 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.808 0.632 -9.780 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.168 -1.710 -10.598 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.508 -1.653 -9.470 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.262 0.289 -9.830 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.787 1.664 -10.855 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.200 0.101 -11.598 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.047 -3.116 -11.396 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.125 -1.700 -11.366 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.764 -1.758 -12.512 1.00 0.00 H new ATOM 1307 N ILE A 80 -0.847 2.789 -12.821 1.00 0.00 N ATOM 1308 CA ILE A 80 -0.634 4.265 -12.851 1.00 0.00 C ATOM 1309 C ILE A 80 -1.707 4.951 -12.005 1.00 0.00 C ATOM 1310 O ILE A 80 -2.843 4.523 -11.961 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.724 4.774 -14.292 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.309 3.661 -15.261 1.00 0.00 C ATOM 1313 CG2 ILE A 80 0.211 5.974 -14.465 1.00 0.00 C ATOM 1314 CD1 ILE A 80 -0.081 4.248 -16.656 1.00 0.00 C ATOM 0 H ILE A 80 -1.450 2.422 -13.557 1.00 0.00 H new ATOM 0 HA ILE A 80 0.353 4.493 -12.449 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.750 5.074 -14.506 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.601 3.178 -14.906 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.082 2.894 -15.301 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.149 6.339 -15.490 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.085 6.768 -13.779 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.236 5.671 -14.249 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.214 3.453 -17.341 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.002 4.710 -17.011 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.708 4.999 -16.610 1.00 0.00 H new ATOM 1326 N MET A 81 -1.358 6.013 -11.332 1.00 0.00 N ATOM 1327 CA MET A 81 -2.362 6.722 -10.490 1.00 0.00 C ATOM 1328 C MET A 81 -2.427 8.195 -10.903 1.00 0.00 C ATOM 1329 O MET A 81 -2.222 9.083 -10.100 1.00 0.00 O ATOM 1330 CB MET A 81 -1.959 6.622 -9.017 1.00 0.00 C ATOM 1331 CG MET A 81 -1.249 5.291 -8.768 1.00 0.00 C ATOM 1332 SD MET A 81 -1.345 4.874 -7.009 1.00 0.00 S ATOM 1333 CE MET A 81 0.112 5.805 -6.475 1.00 0.00 C ATOM 0 H MET A 81 -0.423 6.420 -11.329 1.00 0.00 H new ATOM 0 HA MET A 81 -3.340 6.262 -10.630 1.00 0.00 H new ATOM 0 HB2 MET A 81 -1.303 7.451 -8.752 1.00 0.00 H new ATOM 0 HB3 MET A 81 -2.842 6.699 -8.382 1.00 0.00 H new ATOM 0 HG2 MET A 81 -1.710 4.504 -9.365 1.00 0.00 H new ATOM 0 HG3 MET A 81 -0.207 5.359 -9.080 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.245 5.687 -5.400 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.994 5.429 -6.994 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.025 6.861 -6.710 1.00 0.00 H new ATOM 1343 N THR A 82 -2.712 8.460 -12.147 1.00 0.00 N ATOM 1344 CA THR A 82 -2.791 9.875 -12.608 1.00 0.00 C ATOM 1345 C THR A 82 -3.391 9.923 -14.014 1.00 0.00 C ATOM 1346 O THR A 82 -2.878 10.582 -14.896 1.00 0.00 O ATOM 1347 CB THR A 82 -1.385 10.482 -12.631 1.00 0.00 C ATOM 1348 OG1 THR A 82 -1.482 11.891 -12.789 1.00 0.00 O ATOM 1349 CG2 THR A 82 -0.590 9.889 -13.796 1.00 0.00 C ATOM 0 H THR A 82 -2.894 7.759 -12.865 1.00 0.00 H new ATOM 0 HA THR A 82 -3.422 10.444 -11.926 1.00 0.00 H new ATOM 0 HB THR A 82 -0.875 10.255 -11.694 1.00 0.00 H new ATOM 0 HG1 THR A 82 -1.938 12.095 -13.632 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.410 10.322 -13.811 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.516 8.808 -13.673 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.097 10.114 -14.734 1.00 0.00 H new ATOM 1357 N ALA A 83 -4.474 9.228 -14.231 1.00 0.00 N ATOM 1358 CA ALA A 83 -5.105 9.234 -15.581 1.00 0.00 C ATOM 1359 C ALA A 83 -6.034 10.444 -15.706 1.00 0.00 C ATOM 1360 O ALA A 83 -7.242 10.315 -15.706 1.00 0.00 O ATOM 1361 CB ALA A 83 -5.915 7.950 -15.771 1.00 0.00 C ATOM 0 H ALA A 83 -4.949 8.657 -13.532 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.328 9.291 -16.344 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.377 7.954 -16.758 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.255 7.087 -15.682 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.691 7.893 -15.008 1.00 0.00 H new ATOM 1367 N TYR A 84 -5.479 11.621 -15.811 1.00 0.00 N ATOM 1368 CA TYR A 84 -6.330 12.838 -15.935 1.00 0.00 C ATOM 1369 C TYR A 84 -6.748 13.021 -17.396 1.00 0.00 C ATOM 1370 O TYR A 84 -6.760 12.085 -18.171 1.00 0.00 O ATOM 1371 CB TYR A 84 -5.540 14.064 -15.473 1.00 0.00 C ATOM 1372 CG TYR A 84 -6.449 14.986 -14.696 1.00 0.00 C ATOM 1373 CD1 TYR A 84 -7.045 14.544 -13.509 1.00 0.00 C ATOM 1374 CD2 TYR A 84 -6.695 16.282 -15.163 1.00 0.00 C ATOM 1375 CE1 TYR A 84 -7.887 15.399 -12.788 1.00 0.00 C ATOM 1376 CE2 TYR A 84 -7.539 17.137 -14.442 1.00 0.00 C ATOM 1377 CZ TYR A 84 -8.134 16.695 -13.255 1.00 0.00 C ATOM 1378 OH TYR A 84 -8.965 17.538 -12.545 1.00 0.00 O ATOM 0 H TYR A 84 -4.473 11.792 -15.816 1.00 0.00 H new ATOM 0 HA TYR A 84 -7.218 12.724 -15.314 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -4.700 13.755 -14.851 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.124 14.587 -16.334 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -6.855 13.543 -13.149 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -6.235 16.623 -16.079 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -8.346 15.059 -11.872 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -7.730 18.137 -14.802 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.028 18.400 -13.007 1.00 0.00 H new ATOM 1388 N GLY A 85 -7.091 14.221 -17.778 1.00 0.00 N ATOM 1389 CA GLY A 85 -7.508 14.463 -19.189 1.00 0.00 C ATOM 1390 C GLY A 85 -6.312 14.253 -20.120 1.00 0.00 C ATOM 1391 O GLY A 85 -6.456 14.184 -21.324 1.00 0.00 O ATOM 0 H GLY A 85 -7.101 15.044 -17.175 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -8.317 13.785 -19.461 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.892 15.477 -19.297 1.00 0.00 H new ATOM 1395 N GLU A 86 -5.132 14.149 -19.571 1.00 0.00 N ATOM 1396 CA GLU A 86 -3.929 13.942 -20.426 1.00 0.00 C ATOM 1397 C GLU A 86 -3.778 12.453 -20.741 1.00 0.00 C ATOM 1398 O GLU A 86 -3.468 11.655 -19.879 1.00 0.00 O ATOM 1399 CB GLU A 86 -2.685 14.436 -19.684 1.00 0.00 C ATOM 1400 CG GLU A 86 -2.730 13.951 -18.233 1.00 0.00 C ATOM 1401 CD GLU A 86 -1.324 14.006 -17.633 1.00 0.00 C ATOM 1402 OE1 GLU A 86 -0.784 15.097 -17.537 1.00 0.00 O ATOM 1403 OE2 GLU A 86 -0.810 12.957 -17.279 1.00 0.00 O ATOM 0 H GLU A 86 -4.950 14.198 -18.569 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.043 14.500 -21.355 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.785 14.066 -20.175 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.639 15.525 -19.714 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.410 14.573 -17.651 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.115 12.932 -18.191 1.00 0.00 H new ATOM 1410 N LEU A 87 -3.992 12.073 -21.970 1.00 0.00 N ATOM 1411 CA LEU A 87 -3.859 10.635 -22.338 1.00 0.00 C ATOM 1412 C LEU A 87 -2.846 10.491 -23.475 1.00 0.00 C ATOM 1413 O LEU A 87 -3.131 9.912 -24.505 1.00 0.00 O ATOM 1414 CB LEU A 87 -5.218 10.098 -22.796 1.00 0.00 C ATOM 1415 CG LEU A 87 -5.824 9.233 -21.688 1.00 0.00 C ATOM 1416 CD1 LEU A 87 -7.349 9.361 -21.718 1.00 0.00 C ATOM 1417 CD2 LEU A 87 -5.431 7.771 -21.912 1.00 0.00 C ATOM 0 H LEU A 87 -4.253 12.695 -22.735 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.517 10.069 -21.472 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.887 10.925 -23.033 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.101 9.511 -23.707 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.450 9.567 -20.720 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.781 8.745 -20.929 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.630 10.402 -21.561 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.723 9.027 -22.686 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.862 7.154 -21.124 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.806 7.438 -22.880 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.345 7.679 -21.892 1.00 0.00 H new ATOM 1429 N ASP A 88 -1.663 11.013 -23.297 1.00 0.00 N ATOM 1430 CA ASP A 88 -0.632 10.904 -24.367 1.00 0.00 C ATOM 1431 C ASP A 88 0.389 9.830 -23.986 1.00 0.00 C ATOM 1432 O ASP A 88 0.755 8.996 -24.791 1.00 0.00 O ATOM 1433 CB ASP A 88 0.080 12.249 -24.528 1.00 0.00 C ATOM 1434 CG ASP A 88 0.752 12.632 -23.208 1.00 0.00 C ATOM 1435 OD1 ASP A 88 1.842 12.146 -22.958 1.00 0.00 O ATOM 1436 OD2 ASP A 88 0.164 13.405 -22.469 1.00 0.00 O ATOM 0 H ASP A 88 -1.366 11.510 -22.457 1.00 0.00 H new ATOM 0 HA ASP A 88 -1.112 10.631 -25.307 1.00 0.00 H new ATOM 0 HB2 ASP A 88 0.824 12.186 -25.322 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -0.635 13.018 -24.821 1.00 0.00 H new ATOM 1441 N MET A 89 0.850 9.843 -22.765 1.00 0.00 N ATOM 1442 CA MET A 89 1.845 8.822 -22.336 1.00 0.00 C ATOM 1443 C MET A 89 1.114 7.573 -21.835 1.00 0.00 C ATOM 1444 O MET A 89 1.721 6.557 -21.558 1.00 0.00 O ATOM 1445 CB MET A 89 2.707 9.394 -21.208 1.00 0.00 C ATOM 1446 CG MET A 89 1.826 9.694 -19.994 1.00 0.00 C ATOM 1447 SD MET A 89 2.534 11.075 -19.061 1.00 0.00 S ATOM 1448 CE MET A 89 1.611 12.399 -19.881 1.00 0.00 C ATOM 0 H MET A 89 0.580 10.516 -22.047 1.00 0.00 H new ATOM 0 HA MET A 89 2.480 8.556 -23.181 1.00 0.00 H new ATOM 0 HB2 MET A 89 3.488 8.684 -20.937 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.205 10.304 -21.543 1.00 0.00 H new ATOM 0 HG2 MET A 89 0.815 9.940 -20.317 1.00 0.00 H new ATOM 0 HG3 MET A 89 1.752 8.812 -19.358 1.00 0.00 H new ATOM 0 HE1 MET A 89 1.245 13.104 -19.134 1.00 0.00 H new ATOM 0 HE2 MET A 89 2.265 12.919 -20.581 1.00 0.00 H new ATOM 0 HE3 MET A 89 0.767 11.972 -20.422 1.00 0.00 H new ATOM 1458 N ILE A 90 -0.183 7.640 -21.716 1.00 0.00 N ATOM 1459 CA ILE A 90 -0.949 6.456 -21.234 1.00 0.00 C ATOM 1460 C ILE A 90 -1.166 5.481 -22.394 1.00 0.00 C ATOM 1461 O ILE A 90 -1.051 4.282 -22.238 1.00 0.00 O ATOM 1462 CB ILE A 90 -2.305 6.912 -20.692 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -2.093 8.024 -19.661 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -3.012 5.730 -20.027 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -3.422 8.345 -18.976 1.00 0.00 C ATOM 0 H ILE A 90 -0.746 8.463 -21.932 1.00 0.00 H new ATOM 0 HA ILE A 90 -0.389 5.959 -20.442 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.917 7.287 -21.512 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.356 7.712 -18.921 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.698 8.916 -20.148 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.978 6.054 -19.641 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -3.162 4.937 -20.759 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.400 5.355 -19.206 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.271 9.137 -18.242 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.145 8.675 -19.722 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.798 7.453 -18.475 1.00 0.00 H new ATOM 1477 N GLN A 91 -1.478 5.987 -23.556 1.00 0.00 N ATOM 1478 CA GLN A 91 -1.702 5.088 -24.723 1.00 0.00 C ATOM 1479 C GLN A 91 -0.426 4.292 -25.007 1.00 0.00 C ATOM 1480 O GLN A 91 -0.475 3.162 -25.451 1.00 0.00 O ATOM 1481 CB GLN A 91 -2.062 5.928 -25.951 1.00 0.00 C ATOM 1482 CG GLN A 91 -3.032 5.145 -26.838 1.00 0.00 C ATOM 1483 CD GLN A 91 -2.281 4.592 -28.052 1.00 0.00 C ATOM 1484 OE1 GLN A 91 -2.253 3.397 -28.271 1.00 0.00 O ATOM 1485 NE2 GLN A 91 -1.667 5.418 -28.854 1.00 0.00 N ATOM 0 H GLN A 91 -1.587 6.983 -23.747 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.517 4.400 -24.500 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.515 6.869 -25.641 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -1.161 6.178 -26.511 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -3.481 4.329 -26.272 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -3.846 5.792 -27.164 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -1.691 6.421 -28.669 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -1.163 5.061 -29.666 1.00 0.00 H new ATOM 1494 N GLU A 92 0.715 4.872 -24.755 1.00 0.00 N ATOM 1495 CA GLU A 92 1.992 4.147 -25.011 1.00 0.00 C ATOM 1496 C GLU A 92 2.397 3.369 -23.757 1.00 0.00 C ATOM 1497 O GLU A 92 3.015 2.326 -23.836 1.00 0.00 O ATOM 1498 CB GLU A 92 3.089 5.155 -25.363 1.00 0.00 C ATOM 1499 CG GLU A 92 3.342 6.074 -24.166 1.00 0.00 C ATOM 1500 CD GLU A 92 3.908 7.407 -24.657 1.00 0.00 C ATOM 1501 OE1 GLU A 92 3.265 8.034 -25.482 1.00 0.00 O ATOM 1502 OE2 GLU A 92 4.976 7.780 -24.198 1.00 0.00 O ATOM 0 H GLU A 92 0.819 5.816 -24.383 1.00 0.00 H new ATOM 0 HA GLU A 92 1.856 3.453 -25.841 1.00 0.00 H new ATOM 0 HB2 GLU A 92 4.006 4.631 -25.633 1.00 0.00 H new ATOM 0 HB3 GLU A 92 2.791 5.744 -26.231 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.414 6.240 -23.619 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.040 5.603 -23.474 1.00 0.00 H new ATOM 1509 N SER A 93 2.056 3.868 -22.601 1.00 0.00 N ATOM 1510 CA SER A 93 2.423 3.157 -21.345 1.00 0.00 C ATOM 1511 C SER A 93 1.800 1.760 -21.349 1.00 0.00 C ATOM 1512 O SER A 93 2.470 0.770 -21.132 1.00 0.00 O ATOM 1513 CB SER A 93 1.901 3.944 -20.142 1.00 0.00 C ATOM 1514 OG SER A 93 3.001 4.408 -19.370 1.00 0.00 O ATOM 0 H SER A 93 1.539 4.738 -22.472 1.00 0.00 H new ATOM 0 HA SER A 93 3.508 3.071 -21.280 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.297 4.787 -20.479 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.255 3.312 -19.532 1.00 0.00 H new ATOM 0 HG SER A 93 2.669 4.914 -18.599 1.00 0.00 H new ATOM 1520 N LYS A 94 0.521 1.671 -21.594 1.00 0.00 N ATOM 1521 CA LYS A 94 -0.143 0.337 -21.611 1.00 0.00 C ATOM 1522 C LYS A 94 0.614 -0.597 -22.556 1.00 0.00 C ATOM 1523 O LYS A 94 1.080 -1.649 -22.163 1.00 0.00 O ATOM 1524 CB LYS A 94 -1.586 0.493 -22.096 1.00 0.00 C ATOM 1525 CG LYS A 94 -2.330 -0.832 -21.916 1.00 0.00 C ATOM 1526 CD LYS A 94 -3.828 -0.560 -21.768 1.00 0.00 C ATOM 1527 CE LYS A 94 -4.588 -1.888 -21.732 1.00 0.00 C ATOM 1528 NZ LYS A 94 -5.491 -1.976 -22.913 1.00 0.00 N ATOM 0 H LYS A 94 -0.092 2.464 -21.783 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.140 -0.084 -20.605 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.086 1.282 -21.535 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.599 0.790 -23.145 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.150 -1.481 -22.773 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.956 -1.355 -21.036 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.017 0.004 -20.855 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.181 0.051 -22.599 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.885 -2.721 -21.735 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.167 -1.963 -20.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.007 -2.878 -22.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.169 -1.188 -22.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.928 -1.923 -23.786 1.00 0.00 H new ATOM 1542 N GLU A 95 0.742 -0.223 -23.799 1.00 0.00 N ATOM 1543 CA GLU A 95 1.470 -1.091 -24.768 1.00 0.00 C ATOM 1544 C GLU A 95 2.753 -1.615 -24.120 1.00 0.00 C ATOM 1545 O GLU A 95 3.027 -2.799 -24.134 1.00 0.00 O ATOM 1546 CB GLU A 95 1.823 -0.278 -26.015 1.00 0.00 C ATOM 1547 CG GLU A 95 0.539 0.132 -26.739 1.00 0.00 C ATOM 1548 CD GLU A 95 0.872 0.555 -28.170 1.00 0.00 C ATOM 1549 OE1 GLU A 95 1.990 0.312 -28.594 1.00 0.00 O ATOM 1550 OE2 GLU A 95 0.004 1.115 -28.818 1.00 0.00 O ATOM 0 H GLU A 95 0.374 0.646 -24.186 1.00 0.00 H new ATOM 0 HA GLU A 95 0.836 -1.932 -25.050 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.394 0.608 -25.735 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.455 -0.867 -26.679 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.166 -0.699 -26.749 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.057 0.953 -26.209 1.00 0.00 H new ATOM 1557 N LEU A 96 3.540 -0.744 -23.552 1.00 0.00 N ATOM 1558 CA LEU A 96 4.804 -1.194 -22.904 1.00 0.00 C ATOM 1559 C LEU A 96 4.495 -2.311 -21.905 1.00 0.00 C ATOM 1560 O LEU A 96 5.139 -3.341 -21.893 1.00 0.00 O ATOM 1561 CB LEU A 96 5.448 -0.017 -22.169 1.00 0.00 C ATOM 1562 CG LEU A 96 6.080 0.936 -23.185 1.00 0.00 C ATOM 1563 CD1 LEU A 96 6.272 2.311 -22.544 1.00 0.00 C ATOM 1564 CD2 LEU A 96 7.438 0.384 -23.625 1.00 0.00 C ATOM 0 H LEU A 96 3.363 0.260 -23.508 1.00 0.00 H new ATOM 0 HA LEU A 96 5.490 -1.566 -23.665 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.699 0.510 -21.578 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.206 -0.379 -21.474 1.00 0.00 H new ATOM 0 HG LEU A 96 5.426 1.028 -24.052 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.722 2.990 -23.268 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.305 2.704 -22.230 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.926 2.220 -21.676 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.889 1.062 -24.349 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.092 0.292 -22.758 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.302 -0.596 -24.082 1.00 0.00 H new ATOM 1576 N GLY A 97 3.515 -2.116 -21.066 1.00 0.00 N ATOM 1577 CA GLY A 97 3.166 -3.168 -20.069 1.00 0.00 C ATOM 1578 C GLY A 97 2.492 -2.522 -18.859 1.00 0.00 C ATOM 1579 O GLY A 97 2.773 -2.860 -17.725 1.00 0.00 O ATOM 0 H GLY A 97 2.941 -1.274 -21.028 1.00 0.00 H new ATOM 0 HA2 GLY A 97 2.500 -3.904 -20.519 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.065 -3.700 -19.757 1.00 0.00 H new ATOM 1583 N ALA A 98 1.604 -1.593 -19.087 1.00 0.00 N ATOM 1584 CA ALA A 98 0.912 -0.927 -17.947 1.00 0.00 C ATOM 1585 C ALA A 98 -0.470 -1.553 -17.753 1.00 0.00 C ATOM 1586 O ALA A 98 -1.315 -1.498 -18.624 1.00 0.00 O ATOM 1587 CB ALA A 98 0.758 0.565 -18.248 1.00 0.00 C ATOM 0 H ALA A 98 1.328 -1.266 -20.013 1.00 0.00 H new ATOM 0 HA ALA A 98 1.500 -1.057 -17.038 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.252 1.054 -17.415 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.743 1.012 -18.387 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.169 0.694 -19.156 1.00 0.00 H new ATOM 1593 N LEU A 99 -0.708 -2.147 -16.615 1.00 0.00 N ATOM 1594 CA LEU A 99 -2.036 -2.775 -16.367 1.00 0.00 C ATOM 1595 C LEU A 99 -3.139 -1.737 -16.581 1.00 0.00 C ATOM 1596 O LEU A 99 -3.757 -1.679 -17.624 1.00 0.00 O ATOM 1597 CB LEU A 99 -2.097 -3.291 -14.927 1.00 0.00 C ATOM 1598 CG LEU A 99 -1.133 -4.466 -14.763 1.00 0.00 C ATOM 1599 CD1 LEU A 99 -1.400 -5.162 -13.428 1.00 0.00 C ATOM 1600 CD2 LEU A 99 -1.342 -5.461 -15.906 1.00 0.00 C ATOM 0 H LEU A 99 -0.041 -2.224 -15.847 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.178 -3.606 -17.058 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.835 -2.493 -14.232 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.113 -3.604 -14.685 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.107 -4.099 -14.783 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -0.713 -6.000 -13.311 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.252 -4.454 -12.613 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.426 -5.529 -13.408 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.655 -6.299 -15.789 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.368 -5.828 -15.886 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.152 -4.966 -16.858 1.00 0.00 H new ATOM 1612 N THR A 100 -3.391 -0.915 -15.599 1.00 0.00 N ATOM 1613 CA THR A 100 -4.454 0.118 -15.745 1.00 0.00 C ATOM 1614 C THR A 100 -3.872 1.497 -15.429 1.00 0.00 C ATOM 1615 O THR A 100 -2.729 1.626 -15.040 1.00 0.00 O ATOM 1616 CB THR A 100 -5.598 -0.188 -14.775 1.00 0.00 C ATOM 1617 OG1 THR A 100 -6.374 0.986 -14.576 1.00 0.00 O ATOM 1618 CG2 THR A 100 -5.024 -0.655 -13.436 1.00 0.00 C ATOM 0 H THR A 100 -2.906 -0.915 -14.702 1.00 0.00 H new ATOM 0 HA THR A 100 -4.832 0.109 -16.767 1.00 0.00 H new ATOM 0 HB THR A 100 -6.227 -0.975 -15.191 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.318 0.741 -14.476 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.840 -0.872 -12.746 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.429 -1.555 -13.589 1.00 0.00 H new ATOM 0 HG23 THR A 100 -4.394 0.129 -13.017 1.00 0.00 H new ATOM 1626 N HIS A 101 -4.652 2.531 -15.594 1.00 0.00 N ATOM 1627 CA HIS A 101 -4.146 3.902 -15.304 1.00 0.00 C ATOM 1628 C HIS A 101 -5.290 4.756 -14.752 1.00 0.00 C ATOM 1629 O HIS A 101 -6.086 5.297 -15.492 1.00 0.00 O ATOM 1630 CB HIS A 101 -3.617 4.532 -16.595 1.00 0.00 C ATOM 1631 CG HIS A 101 -3.023 5.880 -16.291 1.00 0.00 C ATOM 1632 ND1 HIS A 101 -2.106 6.488 -17.133 1.00 0.00 N ATOM 1633 CD2 HIS A 101 -3.206 6.747 -15.244 1.00 0.00 C ATOM 1634 CE1 HIS A 101 -1.774 7.671 -16.582 1.00 0.00 C ATOM 1635 NE2 HIS A 101 -2.416 7.879 -15.430 1.00 0.00 N ATOM 0 H HIS A 101 -5.618 2.485 -15.917 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.342 3.849 -14.570 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -2.865 3.885 -17.046 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.425 4.634 -17.320 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -1.748 6.109 -18.010 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -3.863 6.578 -14.403 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -1.073 8.367 -17.019 1.00 0.00 H new ATOM 1643 N PHE A 102 -5.380 4.880 -13.456 1.00 0.00 N ATOM 1644 CA PHE A 102 -6.475 5.698 -12.860 1.00 0.00 C ATOM 1645 C PHE A 102 -5.894 6.988 -12.280 1.00 0.00 C ATOM 1646 O PHE A 102 -4.715 7.079 -11.999 1.00 0.00 O ATOM 1647 CB PHE A 102 -7.160 4.903 -11.746 1.00 0.00 C ATOM 1648 CG PHE A 102 -7.691 3.603 -12.302 1.00 0.00 C ATOM 1649 CD1 PHE A 102 -8.052 3.511 -13.652 1.00 0.00 C ATOM 1650 CD2 PHE A 102 -7.824 2.488 -11.466 1.00 0.00 C ATOM 1651 CE1 PHE A 102 -8.545 2.306 -14.165 1.00 0.00 C ATOM 1652 CE2 PHE A 102 -8.317 1.282 -11.978 1.00 0.00 C ATOM 1653 CZ PHE A 102 -8.678 1.191 -13.328 1.00 0.00 C ATOM 0 H PHE A 102 -4.743 4.451 -12.784 1.00 0.00 H new ATOM 0 HA PHE A 102 -7.203 5.943 -13.633 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -6.453 4.704 -10.941 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -7.975 5.487 -11.318 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -7.950 4.371 -14.298 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -7.546 2.558 -10.425 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.823 2.236 -15.206 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.419 0.422 -11.332 1.00 0.00 H new ATOM 0 HZ PHE A 102 -9.059 0.261 -13.724 1.00 0.00 H new ATOM 1663 N ALA A 103 -6.715 7.986 -12.094 1.00 0.00 N ATOM 1664 CA ALA A 103 -6.213 9.269 -11.528 1.00 0.00 C ATOM 1665 C ALA A 103 -7.093 9.680 -10.345 1.00 0.00 C ATOM 1666 O ALA A 103 -8.148 9.121 -10.121 1.00 0.00 O ATOM 1667 CB ALA A 103 -6.266 10.357 -12.604 1.00 0.00 C ATOM 0 H ALA A 103 -7.712 7.967 -12.310 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.184 9.141 -11.191 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.899 11.296 -12.190 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -5.642 10.064 -13.449 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -7.295 10.486 -12.940 1.00 0.00 H new ATOM 1673 N LYS A 104 -6.668 10.652 -9.584 1.00 0.00 N ATOM 1674 CA LYS A 104 -7.484 11.092 -8.418 1.00 0.00 C ATOM 1675 C LYS A 104 -8.431 12.216 -8.852 1.00 0.00 C ATOM 1676 O LYS A 104 -8.081 13.030 -9.683 1.00 0.00 O ATOM 1677 CB LYS A 104 -6.557 11.604 -7.313 1.00 0.00 C ATOM 1678 CG LYS A 104 -5.803 12.838 -7.812 1.00 0.00 C ATOM 1679 CD LYS A 104 -6.683 14.078 -7.642 1.00 0.00 C ATOM 1680 CE LYS A 104 -5.913 15.151 -6.869 1.00 0.00 C ATOM 1681 NZ LYS A 104 -6.146 14.973 -5.408 1.00 0.00 N ATOM 0 H LYS A 104 -5.793 11.159 -9.719 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.067 10.251 -8.043 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.136 11.853 -6.424 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -5.851 10.825 -7.025 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -4.874 12.959 -7.255 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -5.532 12.712 -8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.981 14.462 -8.618 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.597 13.817 -7.109 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -4.848 15.080 -7.090 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.238 16.143 -7.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -5.623 15.702 -4.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -7.162 15.062 -5.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.816 14.031 -5.116 1.00 0.00 H new ATOM 1695 N PRO A 105 -9.605 12.225 -8.274 1.00 0.00 N ATOM 1696 CA PRO A 105 -10.020 11.232 -7.266 1.00 0.00 C ATOM 1697 C PRO A 105 -10.415 9.916 -7.945 1.00 0.00 C ATOM 1698 O PRO A 105 -11.189 9.898 -8.881 1.00 0.00 O ATOM 1699 CB PRO A 105 -11.231 11.885 -6.595 1.00 0.00 C ATOM 1700 CG PRO A 105 -11.782 12.920 -7.604 1.00 0.00 C ATOM 1701 CD PRO A 105 -10.633 13.240 -8.579 1.00 0.00 C ATOM 0 HA PRO A 105 -9.230 10.984 -6.557 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -11.988 11.140 -6.350 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -10.944 12.368 -5.661 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -12.643 12.519 -8.139 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -12.117 13.821 -7.091 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -10.961 13.175 -9.616 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -10.252 14.250 -8.428 1.00 0.00 H new ATOM 1709 N PHE A 106 -9.888 8.816 -7.480 1.00 0.00 N ATOM 1710 CA PHE A 106 -10.232 7.506 -8.099 1.00 0.00 C ATOM 1711 C PHE A 106 -11.248 6.776 -7.216 1.00 0.00 C ATOM 1712 O PHE A 106 -11.729 7.308 -6.236 1.00 0.00 O ATOM 1713 CB PHE A 106 -8.967 6.656 -8.230 1.00 0.00 C ATOM 1714 CG PHE A 106 -8.120 6.818 -6.991 1.00 0.00 C ATOM 1715 CD1 PHE A 106 -8.636 6.465 -5.739 1.00 0.00 C ATOM 1716 CD2 PHE A 106 -6.818 7.322 -7.095 1.00 0.00 C ATOM 1717 CE1 PHE A 106 -7.850 6.614 -4.590 1.00 0.00 C ATOM 1718 CE2 PHE A 106 -6.032 7.471 -5.946 1.00 0.00 C ATOM 1719 CZ PHE A 106 -6.548 7.118 -4.693 1.00 0.00 C ATOM 0 H PHE A 106 -9.234 8.769 -6.698 1.00 0.00 H new ATOM 0 HA PHE A 106 -10.662 7.672 -9.087 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.233 5.608 -8.367 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.402 6.959 -9.112 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -9.641 6.077 -5.659 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.420 7.596 -8.061 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.248 6.340 -3.624 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.027 7.858 -6.026 1.00 0.00 H new ATOM 0 HZ PHE A 106 -5.942 7.234 -3.807 1.00 0.00 H new ATOM 1729 N ASP A 107 -11.576 5.560 -7.557 1.00 0.00 N ATOM 1730 CA ASP A 107 -12.560 4.797 -6.738 1.00 0.00 C ATOM 1731 C ASP A 107 -11.851 3.635 -6.040 1.00 0.00 C ATOM 1732 O ASP A 107 -11.598 2.605 -6.632 1.00 0.00 O ATOM 1733 CB ASP A 107 -13.664 4.248 -7.645 1.00 0.00 C ATOM 1734 CG ASP A 107 -14.787 3.665 -6.787 1.00 0.00 C ATOM 1735 OD1 ASP A 107 -14.865 4.024 -5.624 1.00 0.00 O ATOM 1736 OD2 ASP A 107 -15.552 2.869 -7.308 1.00 0.00 O ATOM 0 H ASP A 107 -11.206 5.062 -8.367 1.00 0.00 H new ATOM 0 HA ASP A 107 -12.999 5.458 -5.990 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -14.054 5.042 -8.282 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -13.259 3.480 -8.304 1.00 0.00 H new ATOM 1741 N ILE A 108 -11.529 3.791 -4.785 1.00 0.00 N ATOM 1742 CA ILE A 108 -10.838 2.692 -4.054 1.00 0.00 C ATOM 1743 C ILE A 108 -11.517 1.361 -4.379 1.00 0.00 C ATOM 1744 O ILE A 108 -10.888 0.322 -4.404 1.00 0.00 O ATOM 1745 CB ILE A 108 -10.919 2.953 -2.548 1.00 0.00 C ATOM 1746 CG1 ILE A 108 -9.993 4.115 -2.183 1.00 0.00 C ATOM 1747 CG2 ILE A 108 -10.483 1.699 -1.788 1.00 0.00 C ATOM 1748 CD1 ILE A 108 -8.597 3.855 -2.751 1.00 0.00 C ATOM 0 H ILE A 108 -11.714 4.630 -4.235 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.792 2.651 -4.359 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.945 3.204 -2.278 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.390 5.049 -2.580 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.941 4.226 -1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.541 1.885 -0.716 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.140 0.869 -2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.457 1.448 -2.058 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.938 4.683 -2.490 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.200 2.930 -2.332 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.656 3.766 -3.836 1.00 0.00 H new ATOM 1760 N ASP A 109 -12.797 1.383 -4.631 1.00 0.00 N ATOM 1761 CA ASP A 109 -13.514 0.119 -4.957 1.00 0.00 C ATOM 1762 C ASP A 109 -12.963 -0.455 -6.263 1.00 0.00 C ATOM 1763 O ASP A 109 -12.600 -1.613 -6.339 1.00 0.00 O ATOM 1764 CB ASP A 109 -15.010 0.406 -5.117 1.00 0.00 C ATOM 1765 CG ASP A 109 -15.660 0.513 -3.737 1.00 0.00 C ATOM 1766 OD1 ASP A 109 -15.906 -0.521 -3.138 1.00 0.00 O ATOM 1767 OD2 ASP A 109 -15.900 1.627 -3.301 1.00 0.00 O ATOM 0 H ASP A 109 -13.377 2.222 -4.625 1.00 0.00 H new ATOM 0 HA ASP A 109 -13.367 -0.601 -4.152 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -15.156 1.333 -5.672 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -15.484 -0.389 -5.693 1.00 0.00 H new ATOM 1772 N GLU A 110 -12.895 0.343 -7.293 1.00 0.00 N ATOM 1773 CA GLU A 110 -12.365 -0.159 -8.591 1.00 0.00 C ATOM 1774 C GLU A 110 -10.951 -0.708 -8.384 1.00 0.00 C ATOM 1775 O GLU A 110 -10.621 -1.785 -8.836 1.00 0.00 O ATOM 1776 CB GLU A 110 -12.324 0.987 -9.604 1.00 0.00 C ATOM 1777 CG GLU A 110 -11.687 0.496 -10.904 1.00 0.00 C ATOM 1778 CD GLU A 110 -12.377 1.163 -12.095 1.00 0.00 C ATOM 1779 OE1 GLU A 110 -12.556 2.369 -12.052 1.00 0.00 O ATOM 1780 OE2 GLU A 110 -12.715 0.456 -13.031 1.00 0.00 O ATOM 0 H GLU A 110 -13.184 1.321 -7.291 1.00 0.00 H new ATOM 0 HA GLU A 110 -13.013 -0.951 -8.967 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -13.333 1.353 -9.796 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -11.753 1.823 -9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -10.622 0.729 -10.910 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -11.777 -0.588 -10.979 1.00 0.00 H new ATOM 1787 N ILE A 111 -10.116 0.027 -7.702 1.00 0.00 N ATOM 1788 CA ILE A 111 -8.724 -0.452 -7.465 1.00 0.00 C ATOM 1789 C ILE A 111 -8.764 -1.866 -6.883 1.00 0.00 C ATOM 1790 O ILE A 111 -8.239 -2.799 -7.458 1.00 0.00 O ATOM 1791 CB ILE A 111 -8.024 0.485 -6.480 1.00 0.00 C ATOM 1792 CG1 ILE A 111 -8.005 1.905 -7.053 1.00 0.00 C ATOM 1793 CG2 ILE A 111 -6.589 0.008 -6.252 1.00 0.00 C ATOM 1794 CD1 ILE A 111 -7.015 1.973 -8.218 1.00 0.00 C ATOM 0 H ILE A 111 -10.337 0.938 -7.299 1.00 0.00 H new ATOM 0 HA ILE A 111 -8.177 -0.462 -8.408 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.562 0.482 -5.532 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.002 2.185 -7.393 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -7.721 2.617 -6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -6.091 0.676 -5.550 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -6.602 -1.003 -5.844 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -6.050 0.010 -7.199 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.002 2.984 -8.626 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.018 1.711 -7.864 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.319 1.272 -8.995 1.00 0.00 H new ATOM 1806 N ARG A 112 -9.381 -2.033 -5.747 1.00 0.00 N ATOM 1807 CA ARG A 112 -9.451 -3.387 -5.128 1.00 0.00 C ATOM 1808 C ARG A 112 -9.925 -4.402 -6.171 1.00 0.00 C ATOM 1809 O ARG A 112 -9.515 -5.545 -6.169 1.00 0.00 O ATOM 1810 CB ARG A 112 -10.438 -3.363 -3.958 1.00 0.00 C ATOM 1811 CG ARG A 112 -10.014 -2.290 -2.953 1.00 0.00 C ATOM 1812 CD ARG A 112 -11.002 -2.267 -1.786 1.00 0.00 C ATOM 1813 NE ARG A 112 -10.604 -1.205 -0.819 1.00 0.00 N ATOM 1814 CZ ARG A 112 -11.343 -0.963 0.231 1.00 0.00 C ATOM 1815 NH1 ARG A 112 -12.434 -1.651 0.440 1.00 0.00 N ATOM 1816 NH2 ARG A 112 -10.990 -0.032 1.075 1.00 0.00 N ATOM 0 H ARG A 112 -9.840 -1.290 -5.220 1.00 0.00 H new ATOM 0 HA ARG A 112 -8.463 -3.671 -4.766 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -11.445 -3.158 -4.322 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.467 -4.339 -3.473 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -9.008 -2.496 -2.588 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -9.984 -1.314 -3.438 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -12.011 -2.080 -2.153 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.018 -3.238 -1.290 1.00 0.00 H new ATOM 0 HE ARG A 112 -9.753 -0.666 -0.977 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -12.711 -2.380 -0.218 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -13.008 -1.459 1.261 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -10.138 0.506 0.914 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.566 0.158 1.895 1.00 0.00 H new ATOM 1830 N ASP A 113 -10.787 -3.994 -7.061 1.00 0.00 N ATOM 1831 CA ASP A 113 -11.289 -4.938 -8.101 1.00 0.00 C ATOM 1832 C ASP A 113 -10.148 -5.313 -9.049 1.00 0.00 C ATOM 1833 O ASP A 113 -9.618 -6.404 -8.996 1.00 0.00 O ATOM 1834 CB ASP A 113 -12.413 -4.269 -8.895 1.00 0.00 C ATOM 1835 CG ASP A 113 -13.715 -4.340 -8.096 1.00 0.00 C ATOM 1836 OD1 ASP A 113 -14.102 -5.436 -7.727 1.00 0.00 O ATOM 1837 OD2 ASP A 113 -14.305 -3.297 -7.866 1.00 0.00 O ATOM 0 H ASP A 113 -11.166 -3.048 -7.114 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.669 -5.839 -7.619 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -12.157 -3.230 -9.102 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -12.537 -4.765 -9.858 1.00 0.00 H new ATOM 1842 N ALA A 114 -9.769 -4.418 -9.920 1.00 0.00 N ATOM 1843 CA ALA A 114 -8.666 -4.725 -10.874 1.00 0.00 C ATOM 1844 C ALA A 114 -7.487 -5.339 -10.116 1.00 0.00 C ATOM 1845 O ALA A 114 -7.116 -6.473 -10.342 1.00 0.00 O ATOM 1846 CB ALA A 114 -8.213 -3.437 -11.562 1.00 0.00 C ATOM 0 H ALA A 114 -10.176 -3.487 -10.012 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.023 -5.432 -11.623 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.406 -3.662 -12.260 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.051 -3.000 -12.105 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.858 -2.730 -10.813 1.00 0.00 H new ATOM 1852 N VAL A 115 -6.894 -4.596 -9.223 1.00 0.00 N ATOM 1853 CA VAL A 115 -5.736 -5.132 -8.451 1.00 0.00 C ATOM 1854 C VAL A 115 -6.020 -6.573 -8.022 1.00 0.00 C ATOM 1855 O VAL A 115 -5.275 -7.481 -8.335 1.00 0.00 O ATOM 1856 CB VAL A 115 -5.512 -4.266 -7.209 1.00 0.00 C ATOM 1857 CG1 VAL A 115 -4.525 -4.963 -6.270 1.00 0.00 C ATOM 1858 CG2 VAL A 115 -4.942 -2.910 -7.630 1.00 0.00 C ATOM 0 H VAL A 115 -7.161 -3.639 -8.994 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.845 -5.114 -9.078 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.461 -4.119 -6.694 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.366 -4.346 -5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -4.929 -5.930 -5.970 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -3.576 -5.111 -6.785 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.782 -2.292 -6.746 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.993 -3.058 -8.146 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.644 -2.412 -8.299 1.00 0.00 H new ATOM 1868 N LYS A 116 -7.087 -6.792 -7.306 1.00 0.00 N ATOM 1869 CA LYS A 116 -7.414 -8.176 -6.855 1.00 0.00 C ATOM 1870 C LYS A 116 -7.251 -9.150 -8.025 1.00 0.00 C ATOM 1871 O LYS A 116 -6.689 -10.218 -7.882 1.00 0.00 O ATOM 1872 CB LYS A 116 -8.857 -8.220 -6.351 1.00 0.00 C ATOM 1873 CG LYS A 116 -8.891 -7.856 -4.865 1.00 0.00 C ATOM 1874 CD LYS A 116 -9.315 -9.078 -4.049 1.00 0.00 C ATOM 1875 CE LYS A 116 -10.830 -9.262 -4.153 1.00 0.00 C ATOM 1876 NZ LYS A 116 -11.419 -9.309 -2.785 1.00 0.00 N ATOM 0 H LYS A 116 -7.748 -6.073 -7.013 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.738 -8.463 -6.049 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -9.474 -7.525 -6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.276 -9.215 -6.502 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.908 -7.513 -4.541 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -9.587 -7.034 -4.697 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.804 -9.968 -4.416 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -9.024 -8.951 -3.006 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -11.269 -8.442 -4.722 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -11.059 -10.182 -4.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -12.449 -9.434 -2.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -11.008 -10.106 -2.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -11.211 -8.420 -2.287 1.00 0.00 H new ATOM 1890 N LYS A 117 -7.744 -8.794 -9.179 1.00 0.00 N ATOM 1891 CA LYS A 117 -7.620 -9.703 -10.354 1.00 0.00 C ATOM 1892 C LYS A 117 -6.142 -9.922 -10.683 1.00 0.00 C ATOM 1893 O LYS A 117 -5.725 -11.013 -11.018 1.00 0.00 O ATOM 1894 CB LYS A 117 -8.323 -9.075 -11.560 1.00 0.00 C ATOM 1895 CG LYS A 117 -8.142 -9.976 -12.784 1.00 0.00 C ATOM 1896 CD LYS A 117 -9.121 -11.148 -12.704 1.00 0.00 C ATOM 1897 CE LYS A 117 -10.046 -11.124 -13.922 1.00 0.00 C ATOM 1898 NZ LYS A 117 -9.249 -11.378 -15.155 1.00 0.00 N ATOM 0 H LYS A 117 -8.227 -7.914 -9.360 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.083 -10.661 -10.119 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.384 -8.942 -11.347 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -7.911 -8.086 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.314 -9.406 -13.697 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.118 -10.346 -12.828 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.574 -12.090 -12.668 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.707 -11.084 -11.787 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -10.824 -11.880 -13.816 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.547 -10.159 -13.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -9.866 -11.776 -15.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.838 -10.484 -15.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -8.485 -12.051 -14.942 1.00 0.00 H new ATOM 1912 N TYR A 118 -5.345 -8.893 -10.593 1.00 0.00 N ATOM 1913 CA TYR A 118 -3.896 -9.043 -10.903 1.00 0.00 C ATOM 1914 C TYR A 118 -3.233 -9.929 -9.847 1.00 0.00 C ATOM 1915 O TYR A 118 -2.839 -11.045 -10.117 1.00 0.00 O ATOM 1916 CB TYR A 118 -3.229 -7.666 -10.904 1.00 0.00 C ATOM 1917 CG TYR A 118 -3.710 -6.875 -12.098 1.00 0.00 C ATOM 1918 CD1 TYR A 118 -3.475 -7.351 -13.394 1.00 0.00 C ATOM 1919 CD2 TYR A 118 -4.389 -5.667 -11.909 1.00 0.00 C ATOM 1920 CE1 TYR A 118 -3.921 -6.619 -14.500 1.00 0.00 C ATOM 1921 CE2 TYR A 118 -4.835 -4.933 -13.016 1.00 0.00 C ATOM 1922 CZ TYR A 118 -4.599 -5.409 -14.311 1.00 0.00 C ATOM 1923 OH TYR A 118 -5.039 -4.687 -15.402 1.00 0.00 O ATOM 0 H TYR A 118 -5.635 -7.955 -10.318 1.00 0.00 H new ATOM 0 HA TYR A 118 -3.783 -9.504 -11.884 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.466 -7.134 -9.982 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.145 -7.775 -10.939 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -2.949 -8.283 -13.540 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.570 -5.300 -10.910 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -3.742 -6.988 -15.499 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.360 -4.001 -12.870 1.00 0.00 H new ATOM 0 HH TYR A 118 -5.491 -3.873 -15.095 1.00 0.00 H new ATOM 1933 N LEU A 119 -3.104 -9.439 -8.643 1.00 0.00 N ATOM 1934 CA LEU A 119 -2.465 -10.251 -7.570 1.00 0.00 C ATOM 1935 C LEU A 119 -3.538 -11.071 -6.841 1.00 0.00 C ATOM 1936 O LEU A 119 -4.376 -10.514 -6.159 1.00 0.00 O ATOM 1937 CB LEU A 119 -1.777 -9.317 -6.573 1.00 0.00 C ATOM 1938 CG LEU A 119 -0.750 -10.107 -5.758 1.00 0.00 C ATOM 1939 CD1 LEU A 119 -1.467 -11.180 -4.935 1.00 0.00 C ATOM 1940 CD2 LEU A 119 0.247 -10.774 -6.707 1.00 0.00 C ATOM 0 H LEU A 119 -3.414 -8.510 -8.357 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.730 -10.924 -8.011 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.286 -8.500 -7.103 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.516 -8.868 -5.909 1.00 0.00 H new ATOM 0 HG LEU A 119 -0.219 -9.431 -5.088 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -0.736 -11.743 -4.355 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.179 -10.705 -4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -1.998 -11.857 -5.604 1.00 0.00 H new ATOM 0 HD21 LEU A 119 0.979 -11.337 -6.128 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -0.284 -11.450 -7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 119 0.758 -10.010 -7.294 1.00 0.00 H new ATOM 1952 N PRO A 120 -3.482 -12.372 -7.002 1.00 0.00 N ATOM 1953 CA PRO A 120 -4.443 -13.287 -6.362 1.00 0.00 C ATOM 1954 C PRO A 120 -4.084 -13.493 -4.888 1.00 0.00 C ATOM 1955 O PRO A 120 -2.927 -13.574 -4.526 1.00 0.00 O ATOM 1956 CB PRO A 120 -4.278 -14.590 -7.150 1.00 0.00 C ATOM 1957 CG PRO A 120 -2.872 -14.534 -7.794 1.00 0.00 C ATOM 1958 CD PRO A 120 -2.464 -13.049 -7.829 1.00 0.00 C ATOM 0 HA PRO A 120 -5.466 -12.912 -6.376 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.371 -15.455 -6.494 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.051 -14.684 -7.912 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.157 -15.119 -7.215 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -2.889 -14.955 -8.799 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.462 -12.902 -7.426 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.458 -12.662 -8.848 1.00 0.00 H new ATOM 1966 N LEU A 121 -5.067 -13.577 -4.033 1.00 0.00 N ATOM 1967 CA LEU A 121 -4.780 -13.776 -2.585 1.00 0.00 C ATOM 1968 C LEU A 121 -5.904 -14.599 -1.950 1.00 0.00 C ATOM 1969 O LEU A 121 -6.753 -14.077 -1.256 1.00 0.00 O ATOM 1970 CB LEU A 121 -4.690 -12.416 -1.891 1.00 0.00 C ATOM 1971 CG LEU A 121 -3.683 -12.495 -0.743 1.00 0.00 C ATOM 1972 CD1 LEU A 121 -2.570 -11.469 -0.969 1.00 0.00 C ATOM 1973 CD2 LEU A 121 -4.393 -12.192 0.578 1.00 0.00 C ATOM 0 H LEU A 121 -6.056 -13.516 -4.275 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.834 -14.305 -2.472 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.384 -11.651 -2.605 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.669 -12.124 -1.511 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.253 -13.496 -0.705 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.852 -11.525 -0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.064 -11.682 -1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.000 -10.468 -1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.676 -12.248 1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.822 -11.191 0.539 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.187 -12.921 0.740 1.00 0.00 H new ATOM 1985 N LYS A 122 -5.916 -15.883 -2.183 1.00 0.00 N ATOM 1986 CA LYS A 122 -6.983 -16.738 -1.592 1.00 0.00 C ATOM 1987 C LYS A 122 -6.345 -17.925 -0.868 1.00 0.00 C ATOM 1988 O LYS A 122 -5.397 -18.518 -1.344 1.00 0.00 O ATOM 1989 CB LYS A 122 -7.900 -17.252 -2.706 1.00 0.00 C ATOM 1990 CG LYS A 122 -7.133 -18.246 -3.580 1.00 0.00 C ATOM 1991 CD LYS A 122 -7.450 -17.980 -5.053 1.00 0.00 C ATOM 1992 CE LYS A 122 -6.720 -19.004 -5.924 1.00 0.00 C ATOM 1993 NZ LYS A 122 -7.505 -20.270 -5.966 1.00 0.00 N ATOM 0 H LYS A 122 -5.233 -16.377 -2.757 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.566 -16.152 -0.882 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -8.779 -17.732 -2.276 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.257 -16.419 -3.311 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.062 -18.150 -3.404 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -7.409 -19.267 -3.316 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -8.525 -18.043 -5.222 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.143 -16.970 -5.326 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -6.588 -18.612 -6.932 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.724 -19.194 -5.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.009 -20.967 -6.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.609 -20.646 -5.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.446 -20.082 -6.367 1.00 0.00 H new ATOM 2007 N SER A 123 -6.857 -18.276 0.280 1.00 0.00 N ATOM 2008 CA SER A 123 -6.279 -19.425 1.032 1.00 0.00 C ATOM 2009 C SER A 123 -4.770 -19.223 1.190 1.00 0.00 C ATOM 2010 O SER A 123 -3.987 -19.653 0.366 1.00 0.00 O ATOM 2011 CB SER A 123 -6.542 -20.721 0.266 1.00 0.00 C ATOM 2012 OG SER A 123 -5.772 -21.770 0.838 1.00 0.00 O ATOM 0 H SER A 123 -7.650 -17.817 0.729 1.00 0.00 H new ATOM 0 HA SER A 123 -6.743 -19.485 2.016 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.602 -20.970 0.304 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.282 -20.595 -0.785 1.00 0.00 H new ATOM 0 HG SER A 123 -5.940 -22.603 0.350 1.00 0.00 H new ATOM 2018 N ASN A 124 -4.355 -18.574 2.243 1.00 0.00 N ATOM 2019 CA ASN A 124 -2.898 -18.347 2.452 1.00 0.00 C ATOM 2020 C ASN A 124 -2.602 -18.278 3.952 1.00 0.00 C ATOM 2021 O ASN A 124 -1.837 -17.413 4.346 1.00 0.00 O ATOM 2022 CB ASN A 124 -2.487 -17.029 1.790 1.00 0.00 C ATOM 2023 CG ASN A 124 -3.421 -15.910 2.256 1.00 0.00 C ATOM 2024 OD1 ASN A 124 -4.626 -16.029 2.159 1.00 0.00 O ATOM 2025 ND2 ASN A 124 -2.913 -14.820 2.762 1.00 0.00 N ATOM 2026 OXT ASN A 124 -3.146 -19.092 4.680 1.00 0.00 O ATOM 0 H ASN A 124 -4.962 -18.191 2.968 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.335 -19.168 2.008 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -1.456 -16.787 2.047 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -2.531 -17.126 0.705 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -3.528 -14.069 3.076 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -1.901 -14.719 2.844 1.00 0.00 H new TER 2033 ASN A 124