USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 513 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 46 THR OG1 : rot 121:sc= -2.41 USER MOD Set 1.2: A 48 SER OG : rot 180:sc= 0.0281 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 HIS : no HD1:sc=-0.00635 X(o=-0.0064,f=-0.012) USER MOD Single : A 9 HIS : no HE2:sc= -1.3 K(o=-1.3,f=-2.4!) USER MOD Single : A 10 MET CE :methyl 157:sc= -2.12 (180deg=-3.93!) USER MOD Single : A 11 ASN : amide:sc= -13! C(o=-13!,f=-16!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN :FLIP amide:sc= -0.85 F(o=-2.9!,f=-0.85) USER MOD Single : A 15 THR OG1 : rot 13:sc= 0.106 USER MOD Single : A 19 ASN : amide:sc= -3.01! C(o=-3!,f=-3.9!) USER MOD Single : A 21 TYR OH : rot 30:sc= -2.77! USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 110:sc= 1.24 USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.0483 K(o=-0.048,f=-0.61) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 CYS SG : rot -142:sc= -5.52! USER MOD Single : A 49 GLN : amide:sc= -0.0108 X(o=-0.011,f=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= -5.93! C(o=-5.9!,f=-8!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 43:sc= -2.59! USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -0.347 K(o=-0.35,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 13.452 -9.600 -22.757 1.00 15.00 N ATOM 2 CA SER A 1 12.618 -8.401 -23.038 1.00 15.00 C ATOM 3 C SER A 1 12.181 -7.717 -21.747 1.00 15.00 C ATOM 4 O SER A 1 11.091 -7.974 -21.235 1.00 15.00 O ATOM 5 CB SER A 1 11.394 -8.838 -23.845 1.00 15.00 C ATOM 6 OG SER A 1 11.083 -7.893 -24.854 1.00 15.00 O ATOM 0 H1 SER A 1 13.734 -10.044 -23.654 1.00 15.00 H new ATOM 0 H2 SER A 1 14.302 -9.316 -22.229 1.00 15.00 H new ATOM 0 H3 SER A 1 12.904 -10.279 -22.192 1.00 15.00 H new ATOM 0 HA SER A 1 13.207 -7.681 -23.607 1.00 15.00 H new ATOM 0 HB2 SER A 1 11.583 -9.811 -24.299 1.00 15.00 H new ATOM 0 HB3 SER A 1 10.539 -8.958 -23.179 1.00 15.00 H new ATOM 0 HG SER A 1 10.298 -8.197 -25.356 1.00 15.00 H new ATOM 14 N SER A 2 13.039 -6.847 -21.224 1.00 15.00 N ATOM 15 CA SER A 2 12.743 -6.126 -19.992 1.00 15.00 C ATOM 16 C SER A 2 12.198 -4.734 -20.294 1.00 15.00 C ATOM 17 O SER A 2 11.040 -4.434 -20.004 1.00 15.00 O ATOM 18 CB SER A 2 13.998 -6.020 -19.125 1.00 15.00 C ATOM 19 OG SER A 2 13.997 -7.004 -18.104 1.00 15.00 O ATOM 0 H SER A 2 13.946 -6.624 -21.635 1.00 15.00 H new ATOM 0 HA SER A 2 11.981 -6.683 -19.448 1.00 15.00 H new ATOM 0 HB2 SER A 2 14.885 -6.138 -19.747 1.00 15.00 H new ATOM 0 HB3 SER A 2 14.052 -5.027 -18.678 1.00 15.00 H new ATOM 0 HG SER A 2 14.810 -6.916 -17.564 1.00 15.00 H new ATOM 25 N GLY A 3 13.039 -3.887 -20.877 1.00 15.00 N ATOM 26 CA GLY A 3 12.623 -2.538 -21.208 1.00 15.00 C ATOM 27 C GLY A 3 13.777 -1.555 -21.198 1.00 15.00 C ATOM 28 O GLY A 3 13.906 -0.730 -22.103 1.00 15.00 O ATOM 0 H GLY A 3 14.002 -4.111 -21.126 1.00 15.00 H new ATOM 0 HA2 GLY A 3 12.157 -2.536 -22.194 1.00 15.00 H new ATOM 0 HA3 GLY A 3 11.865 -2.210 -20.497 1.00 15.00 H new ATOM 32 N HIS A 4 14.619 -1.643 -20.173 1.00 15.00 N ATOM 33 CA HIS A 4 15.768 -0.754 -20.051 1.00 15.00 C ATOM 34 C HIS A 4 15.322 0.703 -19.958 1.00 15.00 C ATOM 35 O HIS A 4 14.127 0.994 -19.926 1.00 15.00 O ATOM 36 CB HIS A 4 16.710 -0.940 -21.241 1.00 15.00 C ATOM 37 CG HIS A 4 17.472 -2.228 -21.202 1.00 15.00 C ATOM 38 ND1 HIS A 4 17.538 -3.097 -22.271 1.00 15.00 N ATOM 39 CD2 HIS A 4 18.204 -2.795 -20.213 1.00 15.00 C ATOM 40 CE1 HIS A 4 18.276 -4.143 -21.941 1.00 15.00 C ATOM 41 NE2 HIS A 4 18.692 -3.983 -20.699 1.00 15.00 N ATOM 0 H HIS A 4 14.527 -2.320 -19.416 1.00 15.00 H new ATOM 0 HA HIS A 4 16.299 -1.009 -19.134 1.00 15.00 H new ATOM 0 HB2 HIS A 4 16.131 -0.897 -22.163 1.00 15.00 H new ATOM 0 HB3 HIS A 4 17.416 -0.110 -21.269 1.00 15.00 H new ATOM 0 HD2 HIS A 4 18.372 -2.389 -19.227 1.00 15.00 H new ATOM 0 HE1 HIS A 4 18.500 -4.985 -22.579 1.00 15.00 H new ATOM 0 HE2 HIS A 4 19.281 -4.637 -20.183 1.00 15.00 H new ATOM 50 N ILE A 5 16.290 1.613 -19.913 1.00 15.00 N ATOM 51 CA ILE A 5 15.995 3.037 -19.822 1.00 15.00 C ATOM 52 C ILE A 5 15.292 3.367 -18.510 1.00 15.00 C ATOM 53 O ILE A 5 14.170 2.921 -18.268 1.00 15.00 O ATOM 54 CB ILE A 5 15.113 3.506 -20.995 1.00 15.00 C ATOM 55 CG1 ILE A 5 15.662 2.978 -22.321 1.00 15.00 C ATOM 56 CG2 ILE A 5 15.026 5.025 -21.018 1.00 15.00 C ATOM 57 CD1 ILE A 5 14.664 3.040 -23.457 1.00 15.00 C ATOM 0 H ILE A 5 17.285 1.389 -19.938 1.00 15.00 H new ATOM 0 HA ILE A 5 16.950 3.561 -19.864 1.00 15.00 H new ATOM 0 HB ILE A 5 14.109 3.106 -20.856 1.00 15.00 H new ATOM 0 HG12 ILE A 5 16.546 3.554 -22.594 1.00 15.00 H new ATOM 0 HG13 ILE A 5 15.983 1.945 -22.186 1.00 15.00 H new ATOM 0 HG21 ILE A 5 14.400 5.341 -21.852 1.00 15.00 H new ATOM 0 HG22 ILE A 5 14.591 5.379 -20.083 1.00 15.00 H new ATOM 0 HG23 ILE A 5 16.025 5.445 -21.135 1.00 15.00 H new ATOM 0 HD11 ILE A 5 15.122 2.649 -24.366 1.00 15.00 H new ATOM 0 HD12 ILE A 5 13.789 2.441 -23.206 1.00 15.00 H new ATOM 0 HD13 ILE A 5 14.361 4.074 -23.619 1.00 15.00 H new ATOM 69 N GLU A 6 15.959 4.145 -17.664 1.00 15.00 N ATOM 70 CA GLU A 6 15.397 4.528 -16.376 1.00 15.00 C ATOM 71 C GLU A 6 15.188 3.314 -15.493 1.00 15.00 C ATOM 72 O GLU A 6 16.049 2.936 -14.701 1.00 15.00 O ATOM 73 CB GLU A 6 14.080 5.291 -16.574 1.00 15.00 C ATOM 74 CG GLU A 6 14.225 6.799 -16.451 1.00 15.00 C ATOM 75 CD GLU A 6 13.542 7.351 -15.214 1.00 15.00 C ATOM 76 OE1 GLU A 6 13.268 6.562 -14.285 1.00 15.00 O ATOM 77 OE2 GLU A 6 13.280 8.571 -15.176 1.00 15.00 O ATOM 0 H GLU A 6 16.889 4.522 -17.848 1.00 15.00 H new ATOM 0 HA GLU A 6 16.106 5.187 -15.875 1.00 15.00 H new ATOM 0 HB2 GLU A 6 13.676 5.052 -17.558 1.00 15.00 H new ATOM 0 HB3 GLU A 6 13.354 4.943 -15.839 1.00 15.00 H new ATOM 0 HG2 GLU A 6 15.284 7.058 -16.423 1.00 15.00 H new ATOM 0 HG3 GLU A 6 13.804 7.274 -17.337 1.00 15.00 H new ATOM 84 N GLY A 7 14.036 2.723 -15.650 1.00 15.00 N ATOM 85 CA GLY A 7 13.674 1.545 -14.883 1.00 15.00 C ATOM 86 C GLY A 7 12.226 1.566 -14.435 1.00 15.00 C ATOM 87 O GLY A 7 11.915 1.196 -13.302 1.00 15.00 O ATOM 0 H GLY A 7 13.320 3.035 -16.306 1.00 15.00 H new ATOM 0 HA2 GLY A 7 13.852 0.654 -15.486 1.00 15.00 H new ATOM 0 HA3 GLY A 7 14.320 1.472 -14.008 1.00 15.00 H new ATOM 91 N ARG A 8 11.337 2.001 -15.324 1.00 15.00 N ATOM 92 CA ARG A 8 9.911 2.070 -15.016 1.00 15.00 C ATOM 93 C ARG A 8 9.622 3.189 -14.020 1.00 15.00 C ATOM 94 O ARG A 8 10.051 3.133 -12.867 1.00 15.00 O ATOM 95 CB ARG A 8 9.417 0.732 -14.458 1.00 15.00 C ATOM 96 CG ARG A 8 9.925 -0.475 -15.228 1.00 15.00 C ATOM 97 CD ARG A 8 8.806 -1.459 -15.534 1.00 15.00 C ATOM 98 NE ARG A 8 9.213 -2.842 -15.303 1.00 15.00 N ATOM 99 CZ ARG A 8 9.523 -3.333 -14.106 1.00 15.00 C ATOM 100 NH1 ARG A 8 9.472 -2.557 -13.030 1.00 15.00 N ATOM 101 NH2 ARG A 8 9.884 -4.603 -13.982 1.00 15.00 N ATOM 0 H ARG A 8 11.579 2.311 -16.265 1.00 15.00 H new ATOM 0 HA ARG A 8 9.378 2.285 -15.942 1.00 15.00 H new ATOM 0 HB2 ARG A 8 9.728 0.645 -13.417 1.00 15.00 H new ATOM 0 HB3 ARG A 8 8.327 0.725 -14.466 1.00 15.00 H new ATOM 0 HG2 ARG A 8 10.384 -0.145 -16.160 1.00 15.00 H new ATOM 0 HG3 ARG A 8 10.701 -0.975 -14.649 1.00 15.00 H new ATOM 0 HD2 ARG A 8 7.940 -1.228 -14.913 1.00 15.00 H new ATOM 0 HD3 ARG A 8 8.494 -1.342 -16.572 1.00 15.00 H new ATOM 0 HE ARG A 8 9.263 -3.468 -16.106 1.00 15.00 H new ATOM 0 HH11 ARG A 8 9.194 -1.580 -13.119 1.00 15.00 H new ATOM 0 HH12 ARG A 8 9.711 -2.938 -12.115 1.00 15.00 H new ATOM 0 HH21 ARG A 8 9.924 -5.204 -14.805 1.00 15.00 H new ATOM 0 HH22 ARG A 8 10.121 -4.978 -13.064 1.00 15.00 H new ATOM 115 N HIS A 9 8.891 4.204 -14.471 1.00 15.00 N ATOM 116 CA HIS A 9 8.542 5.333 -13.616 1.00 15.00 C ATOM 117 C HIS A 9 7.344 4.996 -12.735 1.00 15.00 C ATOM 118 O HIS A 9 6.218 4.881 -13.219 1.00 15.00 O ATOM 119 CB HIS A 9 8.234 6.569 -14.464 1.00 15.00 C ATOM 120 CG HIS A 9 7.294 6.299 -15.597 1.00 15.00 C ATOM 121 ND1 HIS A 9 5.923 6.282 -15.450 1.00 15.00 N ATOM 122 CD2 HIS A 9 7.534 6.034 -16.903 1.00 15.00 C ATOM 123 CE1 HIS A 9 5.360 6.017 -16.616 1.00 15.00 C ATOM 124 NE2 HIS A 9 6.315 5.863 -17.514 1.00 15.00 N ATOM 0 H HIS A 9 8.529 4.268 -15.423 1.00 15.00 H new ATOM 0 HA HIS A 9 9.396 5.547 -12.973 1.00 15.00 H new ATOM 0 HB2 HIS A 9 7.806 7.341 -13.824 1.00 15.00 H new ATOM 0 HB3 HIS A 9 9.167 6.967 -14.864 1.00 15.00 H new ATOM 0 HD1 HIS A 9 5.422 6.448 -14.577 1.00 15.00 H new ATOM 0 HD2 HIS A 9 8.503 5.969 -17.376 1.00 15.00 H new ATOM 0 HE1 HIS A 9 4.299 5.940 -16.802 1.00 15.00 H new ATOM 133 N MET A 10 7.597 4.832 -11.442 1.00 15.00 N ATOM 134 CA MET A 10 6.541 4.501 -10.492 1.00 15.00 C ATOM 135 C MET A 10 7.007 4.728 -9.059 1.00 15.00 C ATOM 136 O MET A 10 8.063 5.314 -8.821 1.00 15.00 O ATOM 137 CB MET A 10 6.105 3.045 -10.678 1.00 15.00 C ATOM 138 CG MET A 10 4.725 2.898 -11.296 1.00 15.00 C ATOM 139 SD MET A 10 3.402 3.028 -10.078 1.00 15.00 S ATOM 140 CE MET A 10 3.212 4.806 -9.974 1.00 15.00 C ATOM 0 H MET A 10 8.524 4.923 -11.027 1.00 15.00 H new ATOM 0 HA MET A 10 5.691 5.157 -10.683 1.00 15.00 H new ATOM 0 HB2 MET A 10 6.833 2.534 -11.309 1.00 15.00 H new ATOM 0 HB3 MET A 10 6.116 2.545 -9.710 1.00 15.00 H new ATOM 0 HG2 MET A 10 4.589 3.665 -12.058 1.00 15.00 H new ATOM 0 HG3 MET A 10 4.657 1.933 -11.799 1.00 15.00 H new ATOM 0 HE1 MET A 10 2.214 5.044 -9.607 1.00 15.00 H new ATOM 0 HE2 MET A 10 3.957 5.212 -9.289 1.00 15.00 H new ATOM 0 HE3 MET A 10 3.350 5.245 -10.962 1.00 15.00 H new ATOM 150 N ASN A 11 6.209 4.255 -8.112 1.00 15.00 N ATOM 151 CA ASN A 11 6.531 4.396 -6.694 1.00 15.00 C ATOM 152 C ASN A 11 7.369 3.215 -6.217 1.00 15.00 C ATOM 153 O ASN A 11 7.849 2.422 -7.026 1.00 15.00 O ATOM 154 CB ASN A 11 5.249 4.514 -5.855 1.00 15.00 C ATOM 155 CG ASN A 11 4.082 3.731 -6.432 1.00 15.00 C ATOM 156 OD1 ASN A 11 2.958 4.230 -6.494 1.00 15.00 O ATOM 157 ND2 ASN A 11 4.341 2.501 -6.860 1.00 15.00 N ATOM 0 H ASN A 11 5.332 3.769 -8.298 1.00 15.00 H new ATOM 0 HA ASN A 11 7.112 5.309 -6.565 1.00 15.00 H new ATOM 0 HB2 ASN A 11 5.451 4.161 -4.844 1.00 15.00 H new ATOM 0 HB3 ASN A 11 4.970 5.565 -5.776 1.00 15.00 H new ATOM 0 HD21 ASN A 11 3.594 1.932 -7.258 1.00 15.00 H new ATOM 0 HD22 ASN A 11 5.287 2.125 -6.790 1.00 15.00 H new ATOM 164 N LYS A 12 7.547 3.103 -4.903 1.00 15.00 N ATOM 165 CA LYS A 12 8.331 2.015 -4.331 1.00 15.00 C ATOM 166 C LYS A 12 7.732 0.653 -4.716 1.00 15.00 C ATOM 167 O LYS A 12 7.673 0.316 -5.898 1.00 15.00 O ATOM 168 CB LYS A 12 8.422 2.179 -2.810 1.00 15.00 C ATOM 169 CG LYS A 12 9.452 1.269 -2.159 1.00 15.00 C ATOM 170 CD LYS A 12 10.870 1.715 -2.475 1.00 15.00 C ATOM 171 CE LYS A 12 11.132 3.129 -1.981 1.00 15.00 C ATOM 172 NZ LYS A 12 12.589 3.424 -1.883 1.00 15.00 N ATOM 0 H LYS A 12 7.160 3.751 -4.217 1.00 15.00 H new ATOM 0 HA LYS A 12 9.341 2.053 -4.738 1.00 15.00 H new ATOM 0 HB2 LYS A 12 8.668 3.215 -2.579 1.00 15.00 H new ATOM 0 HB3 LYS A 12 7.444 1.978 -2.372 1.00 15.00 H new ATOM 0 HG2 LYS A 12 9.303 1.264 -1.079 1.00 15.00 H new ATOM 0 HG3 LYS A 12 9.306 0.246 -2.506 1.00 15.00 H new ATOM 0 HD2 LYS A 12 11.580 1.029 -2.012 1.00 15.00 H new ATOM 0 HD3 LYS A 12 11.036 1.668 -3.551 1.00 15.00 H new ATOM 0 HE2 LYS A 12 10.662 3.843 -2.658 1.00 15.00 H new ATOM 0 HE3 LYS A 12 10.668 3.264 -1.004 1.00 15.00 H new ATOM 0 HZ1 LYS A 12 12.724 4.397 -1.543 1.00 15.00 H new ATOM 0 HZ2 LYS A 12 13.034 2.760 -1.218 1.00 15.00 H new ATOM 0 HZ3 LYS A 12 13.028 3.321 -2.820 1.00 15.00 H new ATOM 186 N GLN A 13 7.289 -0.132 -3.733 1.00 15.00 N ATOM 187 CA GLN A 13 6.708 -1.436 -4.013 1.00 15.00 C ATOM 188 C GLN A 13 5.223 -1.324 -4.370 1.00 15.00 C ATOM 189 O GLN A 13 4.589 -2.317 -4.726 1.00 15.00 O ATOM 190 CB GLN A 13 6.940 -2.374 -2.823 1.00 15.00 C ATOM 191 CG GLN A 13 5.695 -2.688 -2.026 1.00 15.00 C ATOM 192 CD GLN A 13 5.443 -4.177 -1.901 1.00 15.00 C ATOM 193 OE1 GLN A 13 5.583 -4.893 -3.011 1.00 15.00 O flip ATOM 194 NE2 GLN A 13 5.127 -4.678 -0.821 1.00 15.00 N flip ATOM 0 H GLN A 13 7.323 0.114 -2.744 1.00 15.00 H new ATOM 0 HA GLN A 13 7.205 -1.860 -4.886 1.00 15.00 H new ATOM 0 HB2 GLN A 13 7.368 -3.307 -3.189 1.00 15.00 H new ATOM 0 HB3 GLN A 13 7.678 -1.924 -2.159 1.00 15.00 H new ATOM 0 HG2 GLN A 13 5.786 -2.254 -1.030 1.00 15.00 H new ATOM 0 HG3 GLN A 13 4.835 -2.216 -2.502 1.00 15.00 H new ATOM 0 HE21 GLN A 13 5.031 -4.089 0.006 1.00 15.00 H new ATOM 0 HE22 GLN A 13 4.961 -5.682 -0.754 1.00 15.00 H new ATOM 203 N ALA A 14 4.669 -0.115 -4.271 1.00 15.00 N ATOM 204 CA ALA A 14 3.259 0.109 -4.583 1.00 15.00 C ATOM 205 C ALA A 14 2.874 -0.556 -5.901 1.00 15.00 C ATOM 206 O ALA A 14 1.764 -1.057 -6.052 1.00 15.00 O ATOM 207 CB ALA A 14 2.960 1.602 -4.633 1.00 15.00 C ATOM 0 H ALA A 14 5.174 0.721 -3.978 1.00 15.00 H new ATOM 0 HA ALA A 14 2.661 -0.344 -3.792 1.00 15.00 H new ATOM 0 HB1 ALA A 14 1.906 1.754 -4.866 1.00 15.00 H new ATOM 0 HB2 ALA A 14 3.186 2.051 -3.666 1.00 15.00 H new ATOM 0 HB3 ALA A 14 3.573 2.070 -5.403 1.00 15.00 H new ATOM 213 N THR A 15 3.805 -0.569 -6.847 1.00 15.00 N ATOM 214 CA THR A 15 3.568 -1.188 -8.148 1.00 15.00 C ATOM 215 C THR A 15 3.054 -2.614 -7.971 1.00 15.00 C ATOM 216 O THR A 15 2.304 -3.124 -8.802 1.00 15.00 O ATOM 217 CB THR A 15 4.868 -1.190 -8.960 1.00 15.00 C ATOM 218 OG1 THR A 15 4.982 -0.005 -9.728 1.00 15.00 O ATOM 219 CG2 THR A 15 5.002 -2.365 -9.908 1.00 15.00 C ATOM 0 H THR A 15 4.732 -0.158 -6.739 1.00 15.00 H new ATOM 0 HA THR A 15 2.812 -0.614 -8.684 1.00 15.00 H new ATOM 0 HB THR A 15 5.661 -1.263 -8.216 1.00 15.00 H new ATOM 0 HG1 THR A 15 4.313 0.645 -9.428 1.00 15.00 H new ATOM 0 HG21 THR A 15 5.948 -2.293 -10.445 1.00 15.00 H new ATOM 0 HG22 THR A 15 4.977 -3.295 -9.340 1.00 15.00 H new ATOM 0 HG23 THR A 15 4.178 -2.353 -10.621 1.00 15.00 H new ATOM 227 N GLU A 16 3.449 -3.238 -6.869 1.00 15.00 N ATOM 228 CA GLU A 16 3.013 -4.594 -6.565 1.00 15.00 C ATOM 229 C GLU A 16 1.612 -4.540 -5.989 1.00 15.00 C ATOM 230 O GLU A 16 0.785 -5.420 -6.222 1.00 15.00 O ATOM 231 CB GLU A 16 3.972 -5.259 -5.579 1.00 15.00 C ATOM 232 CG GLU A 16 5.360 -5.499 -6.150 1.00 15.00 C ATOM 233 CD GLU A 16 5.919 -6.856 -5.771 1.00 15.00 C ATOM 234 OE1 GLU A 16 6.380 -7.008 -4.621 1.00 15.00 O ATOM 235 OE2 GLU A 16 5.898 -7.766 -6.626 1.00 15.00 O ATOM 0 H GLU A 16 4.070 -2.827 -6.172 1.00 15.00 H new ATOM 0 HA GLU A 16 3.010 -5.188 -7.479 1.00 15.00 H new ATOM 0 HB2 GLU A 16 4.057 -4.634 -4.690 1.00 15.00 H new ATOM 0 HB3 GLU A 16 3.549 -6.212 -5.260 1.00 15.00 H new ATOM 0 HG2 GLU A 16 5.321 -5.416 -7.236 1.00 15.00 H new ATOM 0 HG3 GLU A 16 6.035 -4.720 -5.795 1.00 15.00 H new ATOM 242 N ILE A 17 1.356 -3.462 -5.263 1.00 15.00 N ATOM 243 CA ILE A 17 0.061 -3.214 -4.666 1.00 15.00 C ATOM 244 C ILE A 17 -0.937 -2.888 -5.769 1.00 15.00 C ATOM 245 O ILE A 17 -2.044 -3.424 -5.817 1.00 15.00 O ATOM 246 CB ILE A 17 0.156 -2.025 -3.683 1.00 15.00 C ATOM 247 CG1 ILE A 17 0.761 -2.445 -2.333 1.00 15.00 C ATOM 248 CG2 ILE A 17 -1.206 -1.377 -3.477 1.00 15.00 C ATOM 249 CD1 ILE A 17 0.630 -3.919 -2.016 1.00 15.00 C ATOM 0 H ILE A 17 2.046 -2.735 -5.073 1.00 15.00 H new ATOM 0 HA ILE A 17 -0.267 -4.099 -4.120 1.00 15.00 H new ATOM 0 HB ILE A 17 0.826 -1.291 -4.132 1.00 15.00 H new ATOM 0 HG12 ILE A 17 1.818 -2.177 -2.324 1.00 15.00 H new ATOM 0 HG13 ILE A 17 0.280 -1.872 -1.540 1.00 15.00 H new ATOM 0 HG21 ILE A 17 -1.111 -0.543 -2.781 1.00 15.00 H new ATOM 0 HG22 ILE A 17 -1.583 -1.011 -4.432 1.00 15.00 H new ATOM 0 HG23 ILE A 17 -1.901 -2.112 -3.070 1.00 15.00 H new ATOM 0 HD11 ILE A 17 1.084 -4.124 -1.046 1.00 15.00 H new ATOM 0 HD12 ILE A 17 -0.425 -4.193 -1.988 1.00 15.00 H new ATOM 0 HD13 ILE A 17 1.137 -4.503 -2.785 1.00 15.00 H new ATOM 261 N LEU A 18 -0.507 -2.005 -6.657 1.00 15.00 N ATOM 262 CA LEU A 18 -1.305 -1.575 -7.790 1.00 15.00 C ATOM 263 C LEU A 18 -1.509 -2.728 -8.759 1.00 15.00 C ATOM 264 O LEU A 18 -2.620 -2.977 -9.224 1.00 15.00 O ATOM 265 CB LEU A 18 -0.581 -0.438 -8.497 1.00 15.00 C ATOM 266 CG LEU A 18 -0.263 0.777 -7.622 1.00 15.00 C ATOM 267 CD1 LEU A 18 0.509 1.820 -8.414 1.00 15.00 C ATOM 268 CD2 LEU A 18 -1.540 1.377 -7.050 1.00 15.00 C ATOM 0 H LEU A 18 0.412 -1.565 -6.610 1.00 15.00 H new ATOM 0 HA LEU A 18 -2.280 -1.238 -7.439 1.00 15.00 H new ATOM 0 HB2 LEU A 18 0.352 -0.823 -8.909 1.00 15.00 H new ATOM 0 HB3 LEU A 18 -1.190 -0.109 -9.339 1.00 15.00 H new ATOM 0 HG LEU A 18 0.361 0.445 -6.792 1.00 15.00 H new ATOM 0 HD11 LEU A 18 0.725 2.676 -7.774 1.00 15.00 H new ATOM 0 HD12 LEU A 18 1.444 1.388 -8.770 1.00 15.00 H new ATOM 0 HD13 LEU A 18 -0.088 2.145 -9.266 1.00 15.00 H new ATOM 0 HD21 LEU A 18 -1.291 2.239 -6.431 1.00 15.00 H new ATOM 0 HD22 LEU A 18 -2.191 1.691 -7.865 1.00 15.00 H new ATOM 0 HD23 LEU A 18 -2.053 0.631 -6.443 1.00 15.00 H new ATOM 280 N ASN A 19 -0.421 -3.430 -9.051 1.00 15.00 N ATOM 281 CA ASN A 19 -0.467 -4.567 -9.960 1.00 15.00 C ATOM 282 C ASN A 19 -1.319 -5.671 -9.356 1.00 15.00 C ATOM 283 O ASN A 19 -2.162 -6.262 -10.029 1.00 15.00 O ATOM 284 CB ASN A 19 0.944 -5.085 -10.246 1.00 15.00 C ATOM 285 CG ASN A 19 0.961 -6.145 -11.330 1.00 15.00 C ATOM 286 OD1 ASN A 19 0.078 -6.187 -12.187 1.00 15.00 O ATOM 287 ND2 ASN A 19 1.968 -7.010 -11.298 1.00 15.00 N ATOM 0 H ASN A 19 0.504 -3.231 -8.671 1.00 15.00 H new ATOM 0 HA ASN A 19 -0.911 -4.246 -10.902 1.00 15.00 H new ATOM 0 HB2 ASN A 19 1.580 -4.252 -10.546 1.00 15.00 H new ATOM 0 HB3 ASN A 19 1.369 -5.498 -9.331 1.00 15.00 H new ATOM 0 HD21 ASN A 19 2.031 -7.746 -12.002 1.00 15.00 H new ATOM 0 HD22 ASN A 19 2.679 -6.939 -10.570 1.00 15.00 H new ATOM 294 N GLU A 20 -1.106 -5.924 -8.071 1.00 15.00 N ATOM 295 CA GLU A 20 -1.867 -6.936 -7.361 1.00 15.00 C ATOM 296 C GLU A 20 -3.308 -6.474 -7.197 1.00 15.00 C ATOM 297 O GLU A 20 -4.232 -7.287 -7.168 1.00 15.00 O ATOM 298 CB GLU A 20 -1.245 -7.216 -5.991 1.00 15.00 C ATOM 299 CG GLU A 20 -1.881 -8.388 -5.261 1.00 15.00 C ATOM 300 CD GLU A 20 -1.038 -8.877 -4.099 1.00 15.00 C ATOM 301 OE1 GLU A 20 -0.957 -8.159 -3.080 1.00 15.00 O ATOM 302 OE2 GLU A 20 -0.459 -9.978 -4.208 1.00 15.00 O ATOM 0 H GLU A 20 -0.412 -5.440 -7.502 1.00 15.00 H new ATOM 0 HA GLU A 20 -1.849 -7.859 -7.941 1.00 15.00 H new ATOM 0 HB2 GLU A 20 -0.180 -7.413 -6.118 1.00 15.00 H new ATOM 0 HB3 GLU A 20 -1.333 -6.323 -5.372 1.00 15.00 H new ATOM 0 HG2 GLU A 20 -2.864 -8.092 -4.893 1.00 15.00 H new ATOM 0 HG3 GLU A 20 -2.036 -9.207 -5.963 1.00 15.00 H new ATOM 309 N TYR A 21 -3.494 -5.157 -7.103 1.00 15.00 N ATOM 310 CA TYR A 21 -4.829 -4.589 -6.957 1.00 15.00 C ATOM 311 C TYR A 21 -5.531 -4.516 -8.307 1.00 15.00 C ATOM 312 O TYR A 21 -6.756 -4.571 -8.389 1.00 15.00 O ATOM 313 CB TYR A 21 -4.755 -3.195 -6.339 1.00 15.00 C ATOM 314 CG TYR A 21 -6.110 -2.556 -6.144 1.00 15.00 C ATOM 315 CD1 TYR A 21 -7.071 -3.156 -5.340 1.00 15.00 C ATOM 316 CD2 TYR A 21 -6.432 -1.359 -6.771 1.00 15.00 C ATOM 317 CE1 TYR A 21 -8.314 -2.581 -5.165 1.00 15.00 C ATOM 318 CE2 TYR A 21 -7.673 -0.777 -6.599 1.00 15.00 C ATOM 319 CZ TYR A 21 -8.610 -1.391 -5.796 1.00 15.00 C ATOM 320 OH TYR A 21 -9.847 -0.815 -5.623 1.00 15.00 O ATOM 0 H TYR A 21 -2.741 -4.470 -7.125 1.00 15.00 H new ATOM 0 HA TYR A 21 -5.401 -5.239 -6.295 1.00 15.00 H new ATOM 0 HB2 TYR A 21 -4.249 -3.258 -5.376 1.00 15.00 H new ATOM 0 HB3 TYR A 21 -4.147 -2.554 -6.977 1.00 15.00 H new ATOM 0 HD1 TYR A 21 -6.842 -4.087 -4.844 1.00 15.00 H new ATOM 0 HD2 TYR A 21 -5.701 -0.876 -7.403 1.00 15.00 H new ATOM 0 HE1 TYR A 21 -9.051 -3.061 -4.537 1.00 15.00 H new ATOM 0 HE2 TYR A 21 -7.908 0.155 -7.092 1.00 15.00 H new ATOM 0 HH TYR A 21 -10.196 -1.049 -4.738 1.00 15.00 H new ATOM 330 N PHE A 22 -4.737 -4.378 -9.359 1.00 15.00 N ATOM 331 CA PHE A 22 -5.253 -4.281 -10.719 1.00 15.00 C ATOM 332 C PHE A 22 -5.513 -5.665 -11.308 1.00 15.00 C ATOM 333 O PHE A 22 -6.419 -5.845 -12.122 1.00 15.00 O ATOM 334 CB PHE A 22 -4.250 -3.522 -11.583 1.00 15.00 C ATOM 335 CG PHE A 22 -4.652 -3.383 -13.023 1.00 15.00 C ATOM 336 CD1 PHE A 22 -5.825 -2.732 -13.374 1.00 15.00 C ATOM 337 CD2 PHE A 22 -3.848 -3.896 -14.025 1.00 15.00 C ATOM 338 CE1 PHE A 22 -6.187 -2.598 -14.702 1.00 15.00 C ATOM 339 CE2 PHE A 22 -4.206 -3.765 -15.354 1.00 15.00 C ATOM 340 CZ PHE A 22 -5.376 -3.115 -15.692 1.00 15.00 C ATOM 0 H PHE A 22 -3.720 -4.330 -9.296 1.00 15.00 H new ATOM 0 HA PHE A 22 -6.201 -3.744 -10.697 1.00 15.00 H new ATOM 0 HB2 PHE A 22 -4.105 -2.527 -11.161 1.00 15.00 H new ATOM 0 HB3 PHE A 22 -3.288 -4.032 -11.535 1.00 15.00 H new ATOM 0 HD1 PHE A 22 -6.462 -2.326 -12.603 1.00 15.00 H new ATOM 0 HD2 PHE A 22 -2.931 -4.404 -13.766 1.00 15.00 H new ATOM 0 HE1 PHE A 22 -7.103 -2.090 -14.964 1.00 15.00 H new ATOM 0 HE2 PHE A 22 -3.571 -4.171 -16.127 1.00 15.00 H new ATOM 0 HZ PHE A 22 -5.656 -3.011 -16.730 1.00 15.00 H new ATOM 350 N TYR A 23 -4.707 -6.636 -10.896 1.00 15.00 N ATOM 351 CA TYR A 23 -4.839 -8.003 -11.382 1.00 15.00 C ATOM 352 C TYR A 23 -5.968 -8.741 -10.663 1.00 15.00 C ATOM 353 O TYR A 23 -6.987 -9.067 -11.265 1.00 15.00 O ATOM 354 CB TYR A 23 -3.524 -8.761 -11.188 1.00 15.00 C ATOM 355 CG TYR A 23 -2.628 -8.748 -12.408 1.00 15.00 C ATOM 356 CD1 TYR A 23 -2.197 -7.549 -12.962 1.00 15.00 C ATOM 357 CD2 TYR A 23 -2.213 -9.933 -13.000 1.00 15.00 C ATOM 358 CE1 TYR A 23 -1.376 -7.534 -14.074 1.00 15.00 C ATOM 359 CE2 TYR A 23 -1.392 -9.926 -14.112 1.00 15.00 C ATOM 360 CZ TYR A 23 -0.976 -8.723 -14.645 1.00 15.00 C ATOM 361 OH TYR A 23 -0.159 -8.711 -15.751 1.00 15.00 O ATOM 0 H TYR A 23 -3.952 -6.501 -10.224 1.00 15.00 H new ATOM 0 HA TYR A 23 -5.080 -7.958 -12.444 1.00 15.00 H new ATOM 0 HB2 TYR A 23 -2.984 -8.325 -10.347 1.00 15.00 H new ATOM 0 HB3 TYR A 23 -3.746 -9.795 -10.923 1.00 15.00 H new ATOM 0 HD1 TYR A 23 -2.508 -6.615 -12.517 1.00 15.00 H new ATOM 0 HD2 TYR A 23 -2.537 -10.876 -12.585 1.00 15.00 H new ATOM 0 HE1 TYR A 23 -1.049 -6.594 -14.494 1.00 15.00 H new ATOM 0 HE2 TYR A 23 -1.078 -10.857 -14.561 1.00 15.00 H new ATOM 0 HH TYR A 23 0.030 -9.632 -16.028 1.00 15.00 H new ATOM 371 N SER A 24 -5.776 -8.988 -9.366 1.00 15.00 N ATOM 372 CA SER A 24 -6.767 -9.664 -8.529 1.00 15.00 C ATOM 373 C SER A 24 -8.164 -9.217 -8.903 1.00 15.00 C ATOM 374 O SER A 24 -9.122 -9.991 -8.906 1.00 15.00 O ATOM 375 CB SER A 24 -6.504 -9.373 -7.050 1.00 15.00 C ATOM 376 OG SER A 24 -5.152 -9.625 -6.712 1.00 15.00 O ATOM 0 H SER A 24 -4.927 -8.724 -8.866 1.00 15.00 H new ATOM 0 HA SER A 24 -6.684 -10.738 -8.696 1.00 15.00 H new ATOM 0 HB2 SER A 24 -6.749 -8.333 -6.832 1.00 15.00 H new ATOM 0 HB3 SER A 24 -7.157 -9.990 -6.433 1.00 15.00 H new ATOM 0 HG SER A 24 -4.695 -8.776 -6.537 1.00 15.00 H new ATOM 382 N HIS A 25 -8.245 -7.932 -9.185 1.00 15.00 N ATOM 383 CA HIS A 25 -9.478 -7.274 -9.533 1.00 15.00 C ATOM 384 C HIS A 25 -9.516 -6.924 -11.014 1.00 15.00 C ATOM 385 O HIS A 25 -10.039 -5.881 -11.407 1.00 15.00 O ATOM 386 CB HIS A 25 -9.572 -6.016 -8.696 1.00 15.00 C ATOM 387 CG HIS A 25 -9.913 -6.286 -7.269 1.00 15.00 C ATOM 388 ND1 HIS A 25 -11.069 -6.923 -6.880 1.00 15.00 N ATOM 389 CD2 HIS A 25 -9.226 -6.028 -6.132 1.00 15.00 C ATOM 390 CE1 HIS A 25 -11.079 -7.045 -5.566 1.00 15.00 C ATOM 391 NE2 HIS A 25 -9.972 -6.510 -5.087 1.00 15.00 N ATOM 0 H HIS A 25 -7.438 -7.309 -9.177 1.00 15.00 H new ATOM 0 HA HIS A 25 -10.321 -7.936 -9.337 1.00 15.00 H new ATOM 0 HB2 HIS A 25 -8.621 -5.485 -8.742 1.00 15.00 H new ATOM 0 HB3 HIS A 25 -10.327 -5.357 -9.125 1.00 15.00 H new ATOM 0 HD2 HIS A 25 -8.268 -5.534 -6.061 1.00 15.00 H new ATOM 0 HE1 HIS A 25 -11.862 -7.505 -4.981 1.00 15.00 H new ATOM 0 HE2 HIS A 25 -9.714 -6.463 -4.101 1.00 15.00 H new ATOM 400 N LEU A 26 -8.946 -7.798 -11.825 1.00 15.00 N ATOM 401 CA LEU A 26 -8.890 -7.594 -13.261 1.00 15.00 C ATOM 402 C LEU A 26 -10.274 -7.723 -13.896 1.00 15.00 C ATOM 403 O LEU A 26 -10.517 -7.194 -14.980 1.00 15.00 O ATOM 404 CB LEU A 26 -7.907 -8.591 -13.877 1.00 15.00 C ATOM 405 CG LEU A 26 -7.987 -8.751 -15.394 1.00 15.00 C ATOM 406 CD1 LEU A 26 -7.882 -7.399 -16.084 1.00 15.00 C ATOM 407 CD2 LEU A 26 -6.888 -9.683 -15.872 1.00 15.00 C ATOM 0 H LEU A 26 -8.511 -8.665 -11.508 1.00 15.00 H new ATOM 0 HA LEU A 26 -8.541 -6.580 -13.459 1.00 15.00 H new ATOM 0 HB2 LEU A 26 -6.895 -8.283 -13.616 1.00 15.00 H new ATOM 0 HB3 LEU A 26 -8.072 -9.566 -13.418 1.00 15.00 H new ATOM 0 HG LEU A 26 -8.953 -9.185 -15.651 1.00 15.00 H new ATOM 0 HD11 LEU A 26 -7.941 -7.536 -17.164 1.00 15.00 H new ATOM 0 HD12 LEU A 26 -8.699 -6.758 -15.754 1.00 15.00 H new ATOM 0 HD13 LEU A 26 -6.930 -6.933 -15.829 1.00 15.00 H new ATOM 0 HD21 LEU A 26 -6.950 -9.793 -16.955 1.00 15.00 H new ATOM 0 HD22 LEU A 26 -5.917 -9.267 -15.605 1.00 15.00 H new ATOM 0 HD23 LEU A 26 -7.007 -10.658 -15.400 1.00 15.00 H new ATOM 419 N SER A 27 -11.184 -8.413 -13.212 1.00 15.00 N ATOM 420 CA SER A 27 -12.543 -8.583 -13.717 1.00 15.00 C ATOM 421 C SER A 27 -13.236 -7.228 -13.823 1.00 15.00 C ATOM 422 O SER A 27 -14.099 -7.020 -14.676 1.00 15.00 O ATOM 423 CB SER A 27 -13.344 -9.511 -12.801 1.00 15.00 C ATOM 424 OG SER A 27 -13.421 -8.990 -11.487 1.00 15.00 O ATOM 0 H SER A 27 -11.006 -8.860 -12.313 1.00 15.00 H new ATOM 0 HA SER A 27 -12.490 -9.034 -14.708 1.00 15.00 H new ATOM 0 HB2 SER A 27 -14.349 -9.644 -13.202 1.00 15.00 H new ATOM 0 HB3 SER A 27 -12.877 -10.496 -12.778 1.00 15.00 H new ATOM 0 HG SER A 27 -13.939 -9.601 -10.923 1.00 15.00 H new ATOM 430 N ASN A 28 -12.833 -6.309 -12.953 1.00 15.00 N ATOM 431 CA ASN A 28 -13.385 -4.961 -12.932 1.00 15.00 C ATOM 432 C ASN A 28 -12.302 -3.970 -12.520 1.00 15.00 C ATOM 433 O ASN A 28 -12.312 -3.448 -11.406 1.00 15.00 O ATOM 434 CB ASN A 28 -14.570 -4.880 -11.966 1.00 15.00 C ATOM 435 CG ASN A 28 -15.478 -3.703 -12.264 1.00 15.00 C ATOM 436 OD1 ASN A 28 -15.777 -3.411 -13.422 1.00 15.00 O ATOM 437 ND2 ASN A 28 -15.922 -3.019 -11.215 1.00 15.00 N ATOM 0 H ASN A 28 -12.118 -6.477 -12.246 1.00 15.00 H new ATOM 0 HA ASN A 28 -13.740 -4.710 -13.932 1.00 15.00 H new ATOM 0 HB2 ASN A 28 -15.146 -5.804 -12.023 1.00 15.00 H new ATOM 0 HB3 ASN A 28 -14.198 -4.799 -10.945 1.00 15.00 H new ATOM 0 HD21 ASN A 28 -16.536 -2.216 -11.352 1.00 15.00 H new ATOM 0 HD22 ASN A 28 -15.649 -3.297 -10.272 1.00 15.00 H new ATOM 444 N PRO A 29 -11.334 -3.719 -13.417 1.00 15.00 N ATOM 445 CA PRO A 29 -10.216 -2.813 -13.158 1.00 15.00 C ATOM 446 C PRO A 29 -10.601 -1.342 -13.287 1.00 15.00 C ATOM 447 O PRO A 29 -9.950 -0.581 -14.003 1.00 15.00 O ATOM 448 CB PRO A 29 -9.180 -3.191 -14.232 1.00 15.00 C ATOM 449 CG PRO A 29 -9.757 -4.352 -14.982 1.00 15.00 C ATOM 450 CD PRO A 29 -11.238 -4.315 -14.752 1.00 15.00 C ATOM 0 HA PRO A 29 -9.850 -2.918 -12.137 1.00 15.00 H new ATOM 0 HB2 PRO A 29 -8.990 -2.352 -14.901 1.00 15.00 H new ATOM 0 HB3 PRO A 29 -8.227 -3.458 -13.776 1.00 15.00 H new ATOM 0 HG2 PRO A 29 -9.528 -4.279 -16.045 1.00 15.00 H new ATOM 0 HG3 PRO A 29 -9.333 -5.292 -14.628 1.00 15.00 H new ATOM 0 HD2 PRO A 29 -11.751 -3.714 -15.503 1.00 15.00 H new ATOM 0 HD3 PRO A 29 -11.679 -5.311 -14.785 1.00 15.00 H new ATOM 458 N TYR A 30 -11.654 -0.945 -12.584 1.00 15.00 N ATOM 459 CA TYR A 30 -12.116 0.437 -12.617 1.00 15.00 C ATOM 460 C TYR A 30 -12.258 0.989 -11.202 1.00 15.00 C ATOM 461 O TYR A 30 -13.350 1.357 -10.772 1.00 15.00 O ATOM 462 CB TYR A 30 -13.446 0.533 -13.367 1.00 15.00 C ATOM 463 CG TYR A 30 -13.413 -0.128 -14.728 1.00 15.00 C ATOM 464 CD1 TYR A 30 -12.280 -0.052 -15.529 1.00 15.00 C ATOM 465 CD2 TYR A 30 -14.510 -0.832 -15.208 1.00 15.00 C ATOM 466 CE1 TYR A 30 -12.240 -0.658 -16.769 1.00 15.00 C ATOM 467 CE2 TYR A 30 -14.478 -1.442 -16.449 1.00 15.00 C ATOM 468 CZ TYR A 30 -13.341 -1.353 -17.224 1.00 15.00 C ATOM 469 OH TYR A 30 -13.305 -1.958 -18.459 1.00 15.00 O ATOM 0 H TYR A 30 -12.204 -1.560 -11.984 1.00 15.00 H new ATOM 0 HA TYR A 30 -11.375 1.038 -13.145 1.00 15.00 H new ATOM 0 HB2 TYR A 30 -14.229 0.072 -12.765 1.00 15.00 H new ATOM 0 HB3 TYR A 30 -13.713 1.583 -13.487 1.00 15.00 H new ATOM 0 HD1 TYR A 30 -11.416 0.491 -15.175 1.00 15.00 H new ATOM 0 HD2 TYR A 30 -15.402 -0.904 -14.603 1.00 15.00 H new ATOM 0 HE1 TYR A 30 -11.352 -0.588 -17.379 1.00 15.00 H new ATOM 0 HE2 TYR A 30 -15.339 -1.985 -16.809 1.00 15.00 H new ATOM 0 HH TYR A 30 -14.160 -2.407 -18.629 1.00 15.00 H new ATOM 479 N PRO A 31 -11.139 1.050 -10.457 1.00 15.00 N ATOM 480 CA PRO A 31 -11.125 1.555 -9.080 1.00 15.00 C ATOM 481 C PRO A 31 -11.663 2.976 -8.980 1.00 15.00 C ATOM 482 O PRO A 31 -11.044 3.921 -9.469 1.00 15.00 O ATOM 483 CB PRO A 31 -9.642 1.517 -8.688 1.00 15.00 C ATOM 484 CG PRO A 31 -8.895 1.386 -9.972 1.00 15.00 C ATOM 485 CD PRO A 31 -9.801 0.631 -10.898 1.00 15.00 C ATOM 0 HA PRO A 31 -11.763 0.959 -8.427 1.00 15.00 H new ATOM 0 HB2 PRO A 31 -9.353 2.424 -8.156 1.00 15.00 H new ATOM 0 HB3 PRO A 31 -9.433 0.678 -8.025 1.00 15.00 H new ATOM 0 HG2 PRO A 31 -8.646 2.365 -10.381 1.00 15.00 H new ATOM 0 HG3 PRO A 31 -7.955 0.854 -9.825 1.00 15.00 H new ATOM 0 HD2 PRO A 31 -9.620 0.889 -11.941 1.00 15.00 H new ATOM 0 HD3 PRO A 31 -9.664 -0.447 -10.808 1.00 15.00 H new ATOM 493 N SER A 32 -12.818 3.122 -8.340 1.00 15.00 N ATOM 494 CA SER A 32 -13.437 4.430 -8.171 1.00 15.00 C ATOM 495 C SER A 32 -12.487 5.388 -7.461 1.00 15.00 C ATOM 496 O SER A 32 -11.313 5.078 -7.259 1.00 15.00 O ATOM 497 CB SER A 32 -14.739 4.303 -7.380 1.00 15.00 C ATOM 498 OG SER A 32 -15.755 5.125 -7.929 1.00 15.00 O ATOM 0 H SER A 32 -13.344 2.350 -7.930 1.00 15.00 H new ATOM 0 HA SER A 32 -13.661 4.832 -9.159 1.00 15.00 H new ATOM 0 HB2 SER A 32 -15.068 3.264 -7.381 1.00 15.00 H new ATOM 0 HB3 SER A 32 -14.565 4.581 -6.341 1.00 15.00 H new ATOM 0 HG SER A 32 -16.577 5.023 -7.405 1.00 15.00 H new ATOM 504 N GLU A 33 -13.002 6.553 -7.082 1.00 15.00 N ATOM 505 CA GLU A 33 -12.196 7.552 -6.393 1.00 15.00 C ATOM 506 C GLU A 33 -11.624 6.987 -5.095 1.00 15.00 C ATOM 507 O GLU A 33 -10.468 7.234 -4.756 1.00 15.00 O ATOM 508 CB GLU A 33 -13.033 8.798 -6.097 1.00 15.00 C ATOM 509 CG GLU A 33 -14.371 8.493 -5.444 1.00 15.00 C ATOM 510 CD GLU A 33 -15.519 9.251 -6.081 1.00 15.00 C ATOM 511 OE1 GLU A 33 -15.260 10.297 -6.713 1.00 15.00 O ATOM 512 OE2 GLU A 33 -16.676 8.800 -5.948 1.00 15.00 O ATOM 0 H GLU A 33 -13.972 6.827 -7.240 1.00 15.00 H new ATOM 0 HA GLU A 33 -11.367 7.828 -7.045 1.00 15.00 H new ATOM 0 HB2 GLU A 33 -12.464 9.461 -5.446 1.00 15.00 H new ATOM 0 HB3 GLU A 33 -13.207 9.338 -7.028 1.00 15.00 H new ATOM 0 HG2 GLU A 33 -14.567 7.423 -5.509 1.00 15.00 H new ATOM 0 HG3 GLU A 33 -14.319 8.743 -4.384 1.00 15.00 H new ATOM 519 N GLU A 34 -12.446 6.231 -4.374 1.00 15.00 N ATOM 520 CA GLU A 34 -12.026 5.632 -3.111 1.00 15.00 C ATOM 521 C GLU A 34 -10.805 4.737 -3.302 1.00 15.00 C ATOM 522 O GLU A 34 -9.775 4.932 -2.658 1.00 15.00 O ATOM 523 CB GLU A 34 -13.174 4.823 -2.504 1.00 15.00 C ATOM 524 CG GLU A 34 -13.244 4.910 -0.988 1.00 15.00 C ATOM 525 CD GLU A 34 -14.223 5.964 -0.510 1.00 15.00 C ATOM 526 OE1 GLU A 34 -14.256 7.059 -1.107 1.00 15.00 O ATOM 527 OE2 GLU A 34 -14.958 5.692 0.463 1.00 15.00 O ATOM 0 H GLU A 34 -13.407 6.018 -4.642 1.00 15.00 H new ATOM 0 HA GLU A 34 -11.754 6.439 -2.431 1.00 15.00 H new ATOM 0 HB2 GLU A 34 -14.117 5.174 -2.924 1.00 15.00 H new ATOM 0 HB3 GLU A 34 -13.065 3.778 -2.795 1.00 15.00 H new ATOM 0 HG2 GLU A 34 -13.535 3.940 -0.585 1.00 15.00 H new ATOM 0 HG3 GLU A 34 -12.253 5.135 -0.594 1.00 15.00 H new ATOM 534 N ALA A 35 -10.927 3.754 -4.190 1.00 15.00 N ATOM 535 CA ALA A 35 -9.833 2.827 -4.462 1.00 15.00 C ATOM 536 C ALA A 35 -8.550 3.577 -4.805 1.00 15.00 C ATOM 537 O ALA A 35 -7.520 3.395 -4.157 1.00 15.00 O ATOM 538 CB ALA A 35 -10.211 1.884 -5.594 1.00 15.00 C ATOM 0 H ALA A 35 -11.772 3.579 -4.733 1.00 15.00 H new ATOM 0 HA ALA A 35 -9.652 2.243 -3.560 1.00 15.00 H new ATOM 0 HB1 ALA A 35 -9.386 1.198 -5.787 1.00 15.00 H new ATOM 0 HB2 ALA A 35 -11.098 1.316 -5.313 1.00 15.00 H new ATOM 0 HB3 ALA A 35 -10.420 2.462 -6.494 1.00 15.00 H new ATOM 544 N LYS A 36 -8.625 4.426 -5.824 1.00 15.00 N ATOM 545 CA LYS A 36 -7.475 5.213 -6.257 1.00 15.00 C ATOM 546 C LYS A 36 -6.872 5.972 -5.075 1.00 15.00 C ATOM 547 O LYS A 36 -5.715 5.756 -4.715 1.00 15.00 O ATOM 548 CB LYS A 36 -7.904 6.170 -7.383 1.00 15.00 C ATOM 549 CG LYS A 36 -7.169 7.501 -7.407 1.00 15.00 C ATOM 550 CD LYS A 36 -7.921 8.565 -6.620 1.00 15.00 C ATOM 551 CE LYS A 36 -8.161 9.818 -7.449 1.00 15.00 C ATOM 552 NZ LYS A 36 -9.605 10.173 -7.511 1.00 15.00 N ATOM 0 H LYS A 36 -9.473 4.587 -6.368 1.00 15.00 H new ATOM 0 HA LYS A 36 -6.703 4.548 -6.645 1.00 15.00 H new ATOM 0 HB2 LYS A 36 -7.754 5.671 -8.341 1.00 15.00 H new ATOM 0 HB3 LYS A 36 -8.973 6.363 -7.288 1.00 15.00 H new ATOM 0 HG2 LYS A 36 -6.170 7.375 -6.989 1.00 15.00 H new ATOM 0 HG3 LYS A 36 -7.043 7.830 -8.438 1.00 15.00 H new ATOM 0 HD2 LYS A 36 -8.877 8.162 -6.286 1.00 15.00 H new ATOM 0 HD3 LYS A 36 -7.354 8.824 -5.726 1.00 15.00 H new ATOM 0 HE2 LYS A 36 -7.601 10.649 -7.021 1.00 15.00 H new ATOM 0 HE3 LYS A 36 -7.781 9.664 -8.459 1.00 15.00 H new ATOM 0 HZ1 LYS A 36 -9.727 11.032 -8.085 1.00 15.00 H new ATOM 0 HZ2 LYS A 36 -10.137 9.390 -7.942 1.00 15.00 H new ATOM 0 HZ3 LYS A 36 -9.962 10.345 -6.549 1.00 15.00 H new ATOM 566 N GLU A 37 -7.664 6.852 -4.467 1.00 15.00 N ATOM 567 CA GLU A 37 -7.200 7.623 -3.319 1.00 15.00 C ATOM 568 C GLU A 37 -6.652 6.693 -2.241 1.00 15.00 C ATOM 569 O GLU A 37 -5.610 6.961 -1.646 1.00 15.00 O ATOM 570 CB GLU A 37 -8.337 8.476 -2.748 1.00 15.00 C ATOM 571 CG GLU A 37 -8.050 9.968 -2.770 1.00 15.00 C ATOM 572 CD GLU A 37 -8.314 10.634 -1.434 1.00 15.00 C ATOM 573 OE1 GLU A 37 -7.681 10.234 -0.434 1.00 15.00 O ATOM 574 OE2 GLU A 37 -9.154 11.557 -1.386 1.00 15.00 O ATOM 0 H GLU A 37 -8.625 7.048 -4.749 1.00 15.00 H new ATOM 0 HA GLU A 37 -6.401 8.285 -3.652 1.00 15.00 H new ATOM 0 HB2 GLU A 37 -9.246 8.281 -3.316 1.00 15.00 H new ATOM 0 HB3 GLU A 37 -8.531 8.167 -1.721 1.00 15.00 H new ATOM 0 HG2 GLU A 37 -7.010 10.130 -3.053 1.00 15.00 H new ATOM 0 HG3 GLU A 37 -8.666 10.441 -3.535 1.00 15.00 H new ATOM 581 N GLU A 38 -7.360 5.591 -2.006 1.00 15.00 N ATOM 582 CA GLU A 38 -6.944 4.612 -1.008 1.00 15.00 C ATOM 583 C GLU A 38 -5.503 4.179 -1.251 1.00 15.00 C ATOM 584 O GLU A 38 -4.642 4.334 -0.384 1.00 15.00 O ATOM 585 CB GLU A 38 -7.868 3.393 -1.043 1.00 15.00 C ATOM 586 CG GLU A 38 -9.014 3.469 -0.048 1.00 15.00 C ATOM 587 CD GLU A 38 -8.835 2.520 1.121 1.00 15.00 C ATOM 588 OE1 GLU A 38 -8.949 1.294 0.913 1.00 15.00 O ATOM 589 OE2 GLU A 38 -8.580 3.003 2.244 1.00 15.00 O ATOM 0 H GLU A 38 -8.224 5.355 -2.494 1.00 15.00 H new ATOM 0 HA GLU A 38 -7.008 5.077 -0.024 1.00 15.00 H new ATOM 0 HB2 GLU A 38 -8.277 3.286 -2.048 1.00 15.00 H new ATOM 0 HB3 GLU A 38 -7.281 2.497 -0.841 1.00 15.00 H new ATOM 0 HG2 GLU A 38 -9.098 4.489 0.327 1.00 15.00 H new ATOM 0 HG3 GLU A 38 -9.949 3.239 -0.558 1.00 15.00 H new ATOM 596 N LEU A 39 -5.242 3.648 -2.443 1.00 15.00 N ATOM 597 CA LEU A 39 -3.899 3.210 -2.802 1.00 15.00 C ATOM 598 C LEU A 39 -2.935 4.387 -2.755 1.00 15.00 C ATOM 599 O LEU A 39 -1.798 4.260 -2.302 1.00 15.00 O ATOM 600 CB LEU A 39 -3.893 2.599 -4.203 1.00 15.00 C ATOM 601 CG LEU A 39 -4.953 1.524 -4.447 1.00 15.00 C ATOM 602 CD1 LEU A 39 -5.051 1.198 -5.929 1.00 15.00 C ATOM 603 CD2 LEU A 39 -4.635 0.273 -3.644 1.00 15.00 C ATOM 0 H LEU A 39 -5.941 3.512 -3.173 1.00 15.00 H new ATOM 0 HA LEU A 39 -3.580 2.454 -2.085 1.00 15.00 H new ATOM 0 HB2 LEU A 39 -4.034 3.398 -4.931 1.00 15.00 H new ATOM 0 HB3 LEU A 39 -2.910 2.167 -4.390 1.00 15.00 H new ATOM 0 HG LEU A 39 -5.918 1.909 -4.117 1.00 15.00 H new ATOM 0 HD11 LEU A 39 -5.810 0.431 -6.083 1.00 15.00 H new ATOM 0 HD12 LEU A 39 -5.325 2.097 -6.482 1.00 15.00 H new ATOM 0 HD13 LEU A 39 -4.088 0.832 -6.286 1.00 15.00 H new ATOM 0 HD21 LEU A 39 -5.399 -0.482 -3.829 1.00 15.00 H new ATOM 0 HD22 LEU A 39 -3.662 -0.115 -3.944 1.00 15.00 H new ATOM 0 HD23 LEU A 39 -4.616 0.517 -2.582 1.00 15.00 H new ATOM 615 N ALA A 40 -3.404 5.534 -3.233 1.00 15.00 N ATOM 616 CA ALA A 40 -2.593 6.741 -3.254 1.00 15.00 C ATOM 617 C ALA A 40 -2.047 7.065 -1.865 1.00 15.00 C ATOM 618 O ALA A 40 -0.857 7.332 -1.701 1.00 15.00 O ATOM 619 CB ALA A 40 -3.405 7.909 -3.786 1.00 15.00 C ATOM 0 H ALA A 40 -4.344 5.651 -3.611 1.00 15.00 H new ATOM 0 HA ALA A 40 -1.745 6.566 -3.916 1.00 15.00 H new ATOM 0 HB1 ALA A 40 -2.787 8.807 -3.797 1.00 15.00 H new ATOM 0 HB2 ALA A 40 -3.741 7.687 -4.799 1.00 15.00 H new ATOM 0 HB3 ALA A 40 -4.271 8.072 -3.144 1.00 15.00 H new ATOM 625 N LYS A 41 -2.929 7.043 -0.868 1.00 15.00 N ATOM 626 CA LYS A 41 -2.538 7.339 0.505 1.00 15.00 C ATOM 627 C LYS A 41 -1.622 6.254 1.066 1.00 15.00 C ATOM 628 O LYS A 41 -0.764 6.529 1.903 1.00 15.00 O ATOM 629 CB LYS A 41 -3.778 7.479 1.395 1.00 15.00 C ATOM 630 CG LYS A 41 -4.757 8.554 0.937 1.00 15.00 C ATOM 631 CD LYS A 41 -4.043 9.784 0.394 1.00 15.00 C ATOM 632 CE LYS A 41 -3.105 10.387 1.426 1.00 15.00 C ATOM 633 NZ LYS A 41 -3.758 11.481 2.198 1.00 15.00 N ATOM 0 H LYS A 41 -3.918 6.823 -0.987 1.00 15.00 H new ATOM 0 HA LYS A 41 -1.991 8.282 0.498 1.00 15.00 H new ATOM 0 HB2 LYS A 41 -4.297 6.521 1.429 1.00 15.00 H new ATOM 0 HB3 LYS A 41 -3.458 7.704 2.412 1.00 15.00 H new ATOM 0 HG2 LYS A 41 -5.410 8.145 0.166 1.00 15.00 H new ATOM 0 HG3 LYS A 41 -5.393 8.844 1.773 1.00 15.00 H new ATOM 0 HD2 LYS A 41 -3.478 9.513 -0.498 1.00 15.00 H new ATOM 0 HD3 LYS A 41 -4.779 10.529 0.091 1.00 15.00 H new ATOM 0 HE2 LYS A 41 -2.771 9.608 2.112 1.00 15.00 H new ATOM 0 HE3 LYS A 41 -2.217 10.775 0.927 1.00 15.00 H new ATOM 0 HZ1 LYS A 41 -3.085 11.866 2.891 1.00 15.00 H new ATOM 0 HZ2 LYS A 41 -4.054 12.236 1.547 1.00 15.00 H new ATOM 0 HZ3 LYS A 41 -4.591 11.106 2.695 1.00 15.00 H new ATOM 647 N LYS A 42 -1.811 5.021 0.601 1.00 15.00 N ATOM 648 CA LYS A 42 -0.999 3.898 1.064 1.00 15.00 C ATOM 649 C LYS A 42 0.489 4.227 0.992 1.00 15.00 C ATOM 650 O LYS A 42 1.195 4.176 2.000 1.00 15.00 O ATOM 651 CB LYS A 42 -1.298 2.649 0.231 1.00 15.00 C ATOM 652 CG LYS A 42 -1.951 1.529 1.025 1.00 15.00 C ATOM 653 CD LYS A 42 -3.324 1.185 0.475 1.00 15.00 C ATOM 654 CE LYS A 42 -4.176 0.473 1.513 1.00 15.00 C ATOM 655 NZ LYS A 42 -3.785 -0.956 1.668 1.00 15.00 N ATOM 0 H LYS A 42 -2.516 4.775 -0.093 1.00 15.00 H new ATOM 0 HA LYS A 42 -1.256 3.705 2.105 1.00 15.00 H new ATOM 0 HB2 LYS A 42 -1.950 2.923 -0.598 1.00 15.00 H new ATOM 0 HB3 LYS A 42 -0.368 2.281 -0.203 1.00 15.00 H new ATOM 0 HG2 LYS A 42 -1.315 0.644 0.999 1.00 15.00 H new ATOM 0 HG3 LYS A 42 -2.040 1.826 2.070 1.00 15.00 H new ATOM 0 HD2 LYS A 42 -3.827 2.097 0.153 1.00 15.00 H new ATOM 0 HD3 LYS A 42 -3.216 0.552 -0.406 1.00 15.00 H new ATOM 0 HE2 LYS A 42 -4.080 0.982 2.472 1.00 15.00 H new ATOM 0 HE3 LYS A 42 -5.225 0.533 1.224 1.00 15.00 H new ATOM 0 HZ1 LYS A 42 -4.390 -1.406 2.385 1.00 15.00 H new ATOM 0 HZ2 LYS A 42 -3.901 -1.448 0.759 1.00 15.00 H new ATOM 0 HZ3 LYS A 42 -2.791 -1.013 1.968 1.00 15.00 H new ATOM 669 N CYS A 43 0.958 4.560 -0.204 1.00 15.00 N ATOM 670 CA CYS A 43 2.366 4.892 -0.405 1.00 15.00 C ATOM 671 C CYS A 43 2.610 6.397 -0.290 1.00 15.00 C ATOM 672 O CYS A 43 3.720 6.870 -0.535 1.00 15.00 O ATOM 673 CB CYS A 43 2.835 4.393 -1.773 1.00 15.00 C ATOM 674 SG CYS A 43 3.640 2.774 -1.729 1.00 15.00 S ATOM 0 H CYS A 43 0.387 4.608 -1.048 1.00 15.00 H new ATOM 0 HA CYS A 43 2.939 4.396 0.379 1.00 15.00 H new ATOM 0 HB2 CYS A 43 1.977 4.343 -2.444 1.00 15.00 H new ATOM 0 HB3 CYS A 43 3.528 5.121 -2.196 1.00 15.00 H new ATOM 0 HG CYS A 43 4.632 2.760 -2.569 1.00 15.00 H new ATOM 680 N GLY A 44 1.575 7.150 0.083 1.00 15.00 N ATOM 681 CA GLY A 44 1.716 8.591 0.216 1.00 15.00 C ATOM 682 C GLY A 44 2.379 9.220 -0.996 1.00 15.00 C ATOM 683 O GLY A 44 3.318 10.005 -0.863 1.00 15.00 O ATOM 0 H GLY A 44 0.645 6.789 0.295 1.00 15.00 H new ATOM 0 HA2 GLY A 44 0.733 9.038 0.362 1.00 15.00 H new ATOM 0 HA3 GLY A 44 2.304 8.816 1.106 1.00 15.00 H new ATOM 687 N ILE A 45 1.892 8.862 -2.178 1.00 15.00 N ATOM 688 CA ILE A 45 2.438 9.376 -3.425 1.00 15.00 C ATOM 689 C ILE A 45 1.547 10.477 -4.008 1.00 15.00 C ATOM 690 O ILE A 45 1.265 11.480 -3.351 1.00 15.00 O ATOM 691 CB ILE A 45 2.631 8.220 -4.437 1.00 15.00 C ATOM 692 CG1 ILE A 45 1.355 7.380 -4.541 1.00 15.00 C ATOM 693 CG2 ILE A 45 3.801 7.344 -4.023 1.00 15.00 C ATOM 694 CD1 ILE A 45 1.355 6.419 -5.709 1.00 15.00 C ATOM 0 H ILE A 45 1.114 8.213 -2.298 1.00 15.00 H new ATOM 0 HA ILE A 45 3.411 9.821 -3.218 1.00 15.00 H new ATOM 0 HB ILE A 45 2.845 8.651 -5.415 1.00 15.00 H new ATOM 0 HG12 ILE A 45 1.225 6.816 -3.617 1.00 15.00 H new ATOM 0 HG13 ILE A 45 0.497 8.047 -4.630 1.00 15.00 H new ATOM 0 HG21 ILE A 45 3.924 6.536 -4.744 1.00 15.00 H new ATOM 0 HG22 ILE A 45 4.711 7.943 -3.991 1.00 15.00 H new ATOM 0 HG23 ILE A 45 3.609 6.923 -3.036 1.00 15.00 H new ATOM 0 HD11 ILE A 45 0.420 5.858 -5.719 1.00 15.00 H new ATOM 0 HD12 ILE A 45 1.453 6.978 -6.640 1.00 15.00 H new ATOM 0 HD13 ILE A 45 2.192 5.728 -5.611 1.00 15.00 H new ATOM 706 N THR A 46 1.093 10.263 -5.226 1.00 15.00 N ATOM 707 CA THR A 46 0.220 11.171 -5.927 1.00 15.00 C ATOM 708 C THR A 46 -0.681 10.332 -6.779 1.00 15.00 C ATOM 709 O THR A 46 -0.235 9.412 -7.462 1.00 15.00 O ATOM 710 CB THR A 46 0.981 12.162 -6.795 1.00 15.00 C ATOM 711 OG1 THR A 46 1.820 11.489 -7.715 1.00 15.00 O ATOM 712 CG2 THR A 46 1.839 13.127 -6.005 1.00 15.00 C ATOM 0 H THR A 46 1.329 9.431 -5.766 1.00 15.00 H new ATOM 0 HA THR A 46 -0.337 11.767 -5.204 1.00 15.00 H new ATOM 0 HB THR A 46 0.210 12.734 -7.312 1.00 15.00 H new ATOM 0 HG1 THR A 46 1.571 11.740 -8.629 1.00 15.00 H new ATOM 0 HG21 THR A 46 2.351 13.803 -6.690 1.00 15.00 H new ATOM 0 HG22 THR A 46 1.209 13.705 -5.329 1.00 15.00 H new ATOM 0 HG23 THR A 46 2.576 12.569 -5.427 1.00 15.00 H new ATOM 720 N VAL A 47 -1.948 10.609 -6.695 1.00 15.00 N ATOM 721 CA VAL A 47 -2.918 9.851 -7.401 1.00 15.00 C ATOM 722 C VAL A 47 -2.594 9.677 -8.858 1.00 15.00 C ATOM 723 O VAL A 47 -2.831 8.614 -9.402 1.00 15.00 O ATOM 724 CB VAL A 47 -4.292 10.456 -7.188 1.00 15.00 C ATOM 725 CG1 VAL A 47 -5.127 10.462 -8.447 1.00 15.00 C ATOM 726 CG2 VAL A 47 -4.919 9.658 -6.101 1.00 15.00 C ATOM 0 H VAL A 47 -2.331 11.369 -6.133 1.00 15.00 H new ATOM 0 HA VAL A 47 -2.909 8.841 -6.991 1.00 15.00 H new ATOM 0 HB VAL A 47 -4.215 11.508 -6.914 1.00 15.00 H new ATOM 0 HG11 VAL A 47 -6.100 10.906 -8.236 1.00 15.00 H new ATOM 0 HG12 VAL A 47 -4.621 11.045 -9.216 1.00 15.00 H new ATOM 0 HG13 VAL A 47 -5.263 9.439 -8.798 1.00 15.00 H new ATOM 0 HG21 VAL A 47 -5.918 10.044 -5.896 1.00 15.00 H new ATOM 0 HG22 VAL A 47 -4.989 8.615 -6.409 1.00 15.00 H new ATOM 0 HG23 VAL A 47 -4.310 9.730 -5.200 1.00 15.00 H new ATOM 736 N SER A 48 -2.040 10.679 -9.497 1.00 15.00 N ATOM 737 CA SER A 48 -1.708 10.509 -10.900 1.00 15.00 C ATOM 738 C SER A 48 -0.797 9.299 -11.050 1.00 15.00 C ATOM 739 O SER A 48 -0.858 8.586 -12.052 1.00 15.00 O ATOM 740 CB SER A 48 -1.062 11.766 -11.486 1.00 15.00 C ATOM 741 OG SER A 48 -0.368 12.496 -10.489 1.00 15.00 O ATOM 0 H SER A 48 -1.815 11.588 -9.093 1.00 15.00 H new ATOM 0 HA SER A 48 -2.627 10.342 -11.462 1.00 15.00 H new ATOM 0 HB2 SER A 48 -0.372 11.486 -12.282 1.00 15.00 H new ATOM 0 HB3 SER A 48 -1.829 12.397 -11.935 1.00 15.00 H new ATOM 0 HG SER A 48 0.037 13.293 -10.890 1.00 15.00 H new ATOM 747 N GLN A 49 -0.006 9.021 -10.011 1.00 15.00 N ATOM 748 CA GLN A 49 0.839 7.836 -10.018 1.00 15.00 C ATOM 749 C GLN A 49 -0.092 6.643 -10.156 1.00 15.00 C ATOM 750 O GLN A 49 0.144 5.729 -10.941 1.00 15.00 O ATOM 751 CB GLN A 49 1.658 7.734 -8.730 1.00 15.00 C ATOM 752 CG GLN A 49 2.513 8.959 -8.452 1.00 15.00 C ATOM 753 CD GLN A 49 3.984 8.715 -8.719 1.00 15.00 C ATOM 754 OE1 GLN A 49 4.562 9.282 -9.647 1.00 15.00 O ATOM 755 NE2 GLN A 49 4.601 7.865 -7.906 1.00 15.00 N ATOM 0 H GLN A 49 0.064 9.593 -9.169 1.00 15.00 H new ATOM 0 HA GLN A 49 1.554 7.877 -10.840 1.00 15.00 H new ATOM 0 HB2 GLN A 49 0.981 7.576 -7.891 1.00 15.00 H new ATOM 0 HB3 GLN A 49 2.303 6.857 -8.788 1.00 15.00 H new ATOM 0 HG2 GLN A 49 2.168 9.787 -9.071 1.00 15.00 H new ATOM 0 HG3 GLN A 49 2.381 9.261 -7.413 1.00 15.00 H new ATOM 0 HE21 GLN A 49 4.084 7.417 -7.149 1.00 15.00 H new ATOM 0 HE22 GLN A 49 5.591 7.660 -8.038 1.00 15.00 H new ATOM 764 N VAL A 50 -1.193 6.724 -9.412 1.00 15.00 N ATOM 765 CA VAL A 50 -2.244 5.727 -9.451 1.00 15.00 C ATOM 766 C VAL A 50 -3.175 6.056 -10.617 1.00 15.00 C ATOM 767 O VAL A 50 -3.314 5.273 -11.553 1.00 15.00 O ATOM 768 CB VAL A 50 -3.046 5.719 -8.131 1.00 15.00 C ATOM 769 CG1 VAL A 50 -4.177 4.703 -8.179 1.00 15.00 C ATOM 770 CG2 VAL A 50 -2.125 5.448 -6.949 1.00 15.00 C ATOM 0 H VAL A 50 -1.376 7.490 -8.764 1.00 15.00 H new ATOM 0 HA VAL A 50 -1.801 4.740 -9.581 1.00 15.00 H new ATOM 0 HB VAL A 50 -3.492 6.705 -8.002 1.00 15.00 H new ATOM 0 HG11 VAL A 50 -4.723 4.721 -7.236 1.00 15.00 H new ATOM 0 HG12 VAL A 50 -4.855 4.952 -8.995 1.00 15.00 H new ATOM 0 HG13 VAL A 50 -3.765 3.707 -8.340 1.00 15.00 H new ATOM 0 HG21 VAL A 50 -2.707 5.446 -6.027 1.00 15.00 H new ATOM 0 HG22 VAL A 50 -1.645 4.478 -7.077 1.00 15.00 H new ATOM 0 HG23 VAL A 50 -1.363 6.226 -6.895 1.00 15.00 H new ATOM 780 N SER A 51 -3.786 7.244 -10.560 1.00 15.00 N ATOM 781 CA SER A 51 -4.683 7.715 -11.612 1.00 15.00 C ATOM 782 C SER A 51 -4.195 7.303 -13.002 1.00 15.00 C ATOM 783 O SER A 51 -4.958 6.774 -13.811 1.00 15.00 O ATOM 784 CB SER A 51 -4.814 9.238 -11.547 1.00 15.00 C ATOM 785 OG SER A 51 -6.176 9.632 -11.555 1.00 15.00 O ATOM 0 H SER A 51 -3.672 7.900 -9.787 1.00 15.00 H new ATOM 0 HA SER A 51 -5.655 7.252 -11.445 1.00 15.00 H new ATOM 0 HB2 SER A 51 -4.330 9.610 -10.644 1.00 15.00 H new ATOM 0 HB3 SER A 51 -4.297 9.688 -12.395 1.00 15.00 H new ATOM 0 HG SER A 51 -6.234 10.609 -11.511 1.00 15.00 H new ATOM 791 N ASN A 52 -2.923 7.565 -13.270 1.00 15.00 N ATOM 792 CA ASN A 52 -2.328 7.241 -14.566 1.00 15.00 C ATOM 793 C ASN A 52 -2.026 5.748 -14.716 1.00 15.00 C ATOM 794 O ASN A 52 -2.300 5.157 -15.761 1.00 15.00 O ATOM 795 CB ASN A 52 -1.047 8.050 -14.775 1.00 15.00 C ATOM 796 CG ASN A 52 -0.826 8.415 -16.229 1.00 15.00 C ATOM 797 OD1 ASN A 52 0.080 7.895 -16.882 1.00 15.00 O ATOM 798 ND2 ASN A 52 -1.657 9.314 -16.746 1.00 15.00 N ATOM 0 H ASN A 52 -2.280 8.001 -12.609 1.00 15.00 H new ATOM 0 HA ASN A 52 -3.062 7.504 -15.328 1.00 15.00 H new ATOM 0 HB2 ASN A 52 -1.094 8.960 -14.178 1.00 15.00 H new ATOM 0 HB3 ASN A 52 -0.194 7.475 -14.414 1.00 15.00 H new ATOM 0 HD21 ASN A 52 -1.558 9.599 -17.720 1.00 15.00 H new ATOM 0 HD22 ASN A 52 -2.394 9.719 -16.168 1.00 15.00 H new ATOM 805 N TRP A 53 -1.438 5.149 -13.684 1.00 15.00 N ATOM 806 CA TRP A 53 -1.074 3.730 -13.718 1.00 15.00 C ATOM 807 C TRP A 53 -2.199 2.857 -14.254 1.00 15.00 C ATOM 808 O TRP A 53 -1.989 2.035 -15.145 1.00 15.00 O ATOM 809 CB TRP A 53 -0.706 3.234 -12.324 1.00 15.00 C ATOM 810 CG TRP A 53 -0.127 1.852 -12.332 1.00 15.00 C ATOM 811 CD1 TRP A 53 1.194 1.512 -12.276 1.00 15.00 C ATOM 812 CD2 TRP A 53 -0.856 0.625 -12.406 1.00 15.00 C ATOM 813 NE1 TRP A 53 1.328 0.144 -12.311 1.00 15.00 N ATOM 814 CE2 TRP A 53 0.082 -0.422 -12.390 1.00 15.00 C ATOM 815 CE3 TRP A 53 -2.215 0.313 -12.483 1.00 15.00 C ATOM 816 CZ2 TRP A 53 -0.298 -1.762 -12.450 1.00 15.00 C ATOM 817 CZ3 TRP A 53 -2.591 -1.013 -12.543 1.00 15.00 C ATOM 818 CH2 TRP A 53 -1.636 -2.037 -12.526 1.00 15.00 C ATOM 0 H TRP A 53 -1.202 5.622 -12.812 1.00 15.00 H new ATOM 0 HA TRP A 53 -0.218 3.651 -14.389 1.00 15.00 H new ATOM 0 HB2 TRP A 53 0.012 3.921 -11.877 1.00 15.00 H new ATOM 0 HB3 TRP A 53 -1.595 3.247 -11.693 1.00 15.00 H new ATOM 0 HD1 TRP A 53 2.013 2.214 -12.213 1.00 15.00 H new ATOM 0 HE1 TRP A 53 2.211 -0.366 -12.283 1.00 15.00 H new ATOM 0 HE3 TRP A 53 -2.959 1.096 -12.495 1.00 15.00 H new ATOM 0 HZ2 TRP A 53 0.437 -2.554 -12.437 1.00 15.00 H new ATOM 0 HZ3 TRP A 53 -3.639 -1.265 -12.604 1.00 15.00 H new ATOM 0 HH2 TRP A 53 -1.963 -3.065 -12.574 1.00 15.00 H new ATOM 829 N PHE A 54 -3.383 3.016 -13.684 1.00 15.00 N ATOM 830 CA PHE A 54 -4.528 2.212 -14.082 1.00 15.00 C ATOM 831 C PHE A 54 -5.056 2.636 -15.445 1.00 15.00 C ATOM 832 O PHE A 54 -5.569 1.816 -16.206 1.00 15.00 O ATOM 833 CB PHE A 54 -5.640 2.304 -13.033 1.00 15.00 C ATOM 834 CG PHE A 54 -5.205 1.860 -11.665 1.00 15.00 C ATOM 835 CD1 PHE A 54 -4.247 2.574 -10.970 1.00 15.00 C ATOM 836 CD2 PHE A 54 -5.750 0.732 -11.076 1.00 15.00 C ATOM 837 CE1 PHE A 54 -3.836 2.181 -9.717 1.00 15.00 C ATOM 838 CE2 PHE A 54 -5.343 0.328 -9.818 1.00 15.00 C ATOM 839 CZ PHE A 54 -4.383 1.053 -9.137 1.00 15.00 C ATOM 0 H PHE A 54 -3.576 3.693 -12.946 1.00 15.00 H new ATOM 0 HA PHE A 54 -4.196 1.176 -14.155 1.00 15.00 H new ATOM 0 HB2 PHE A 54 -5.994 3.334 -12.978 1.00 15.00 H new ATOM 0 HB3 PHE A 54 -6.484 1.694 -13.354 1.00 15.00 H new ATOM 0 HD1 PHE A 54 -3.813 3.456 -11.418 1.00 15.00 H new ATOM 0 HD2 PHE A 54 -6.500 0.162 -11.604 1.00 15.00 H new ATOM 0 HE1 PHE A 54 -3.088 2.753 -9.188 1.00 15.00 H new ATOM 0 HE2 PHE A 54 -5.775 -0.554 -9.368 1.00 15.00 H new ATOM 0 HZ PHE A 54 -4.062 0.739 -8.155 1.00 15.00 H new ATOM 849 N GLY A 55 -4.934 3.921 -15.745 1.00 15.00 N ATOM 850 CA GLY A 55 -5.413 4.432 -17.016 1.00 15.00 C ATOM 851 C GLY A 55 -4.519 4.055 -18.186 1.00 15.00 C ATOM 852 O GLY A 55 -4.972 4.021 -19.330 1.00 15.00 O ATOM 0 H GLY A 55 -4.513 4.619 -15.133 1.00 15.00 H new ATOM 0 HA2 GLY A 55 -6.418 4.052 -17.198 1.00 15.00 H new ATOM 0 HA3 GLY A 55 -5.488 5.518 -16.959 1.00 15.00 H new ATOM 856 N ASN A 56 -3.249 3.772 -17.907 1.00 15.00 N ATOM 857 CA ASN A 56 -2.306 3.399 -18.946 1.00 15.00 C ATOM 858 C ASN A 56 -2.161 1.889 -19.029 1.00 15.00 C ATOM 859 O ASN A 56 -2.270 1.317 -20.102 1.00 15.00 O ATOM 860 CB ASN A 56 -0.944 4.063 -18.714 1.00 15.00 C ATOM 861 CG ASN A 56 -0.187 3.473 -17.542 1.00 15.00 C ATOM 862 OD1 ASN A 56 -0.215 4.014 -16.437 1.00 15.00 O ATOM 863 ND2 ASN A 56 0.501 2.362 -17.779 1.00 15.00 N ATOM 0 H ASN A 56 -2.853 3.795 -16.967 1.00 15.00 H new ATOM 0 HA ASN A 56 -2.698 3.755 -19.899 1.00 15.00 H new ATOM 0 HB2 ASN A 56 -0.340 3.964 -19.616 1.00 15.00 H new ATOM 0 HB3 ASN A 56 -1.091 5.130 -18.544 1.00 15.00 H new ATOM 0 HD21 ASN A 56 1.035 1.923 -17.029 1.00 15.00 H new ATOM 0 HD22 ASN A 56 0.496 1.948 -18.711 1.00 15.00 H new ATOM 870 N LYS A 57 -1.919 1.243 -17.884 1.00 15.00 N ATOM 871 CA LYS A 57 -1.759 -0.210 -17.845 1.00 15.00 C ATOM 872 C LYS A 57 -2.909 -0.900 -18.557 1.00 15.00 C ATOM 873 O LYS A 57 -2.759 -2.015 -19.057 1.00 15.00 O ATOM 874 CB LYS A 57 -1.657 -0.702 -16.400 1.00 15.00 C ATOM 875 CG LYS A 57 -0.752 -1.910 -16.232 1.00 15.00 C ATOM 876 CD LYS A 57 0.641 -1.502 -15.782 1.00 15.00 C ATOM 877 CE LYS A 57 1.713 -2.358 -16.438 1.00 15.00 C ATOM 878 NZ LYS A 57 2.617 -1.548 -17.301 1.00 15.00 N ATOM 0 H LYS A 57 -1.830 1.702 -16.978 1.00 15.00 H new ATOM 0 HA LYS A 57 -0.834 -0.462 -18.364 1.00 15.00 H new ATOM 0 HB2 LYS A 57 -1.286 0.109 -15.774 1.00 15.00 H new ATOM 0 HB3 LYS A 57 -2.654 -0.953 -16.039 1.00 15.00 H new ATOM 0 HG2 LYS A 57 -1.186 -2.593 -15.502 1.00 15.00 H new ATOM 0 HG3 LYS A 57 -0.687 -2.452 -17.176 1.00 15.00 H new ATOM 0 HD2 LYS A 57 0.811 -0.454 -16.027 1.00 15.00 H new ATOM 0 HD3 LYS A 57 0.715 -1.592 -14.698 1.00 15.00 H new ATOM 0 HE2 LYS A 57 2.299 -2.860 -15.668 1.00 15.00 H new ATOM 0 HE3 LYS A 57 1.240 -3.137 -17.037 1.00 15.00 H new ATOM 0 HZ1 LYS A 57 3.334 -2.167 -17.730 1.00 15.00 H new ATOM 0 HZ2 LYS A 57 2.062 -1.089 -18.051 1.00 15.00 H new ATOM 0 HZ3 LYS A 57 3.088 -0.821 -16.725 1.00 15.00 H new ATOM 892 N ARG A 58 -4.045 -0.216 -18.649 1.00 15.00 N ATOM 893 CA ARG A 58 -5.189 -0.762 -19.359 1.00 15.00 C ATOM 894 C ARG A 58 -4.826 -0.950 -20.832 1.00 15.00 C ATOM 895 O ARG A 58 -5.583 -1.541 -21.603 1.00 15.00 O ATOM 896 CB ARG A 58 -6.395 0.170 -19.227 1.00 15.00 C ATOM 897 CG ARG A 58 -7.714 -0.564 -19.044 1.00 15.00 C ATOM 898 CD ARG A 58 -8.827 0.071 -19.862 1.00 15.00 C ATOM 899 NE ARG A 58 -9.610 1.023 -19.078 1.00 15.00 N ATOM 900 CZ ARG A 58 -9.351 2.328 -19.012 1.00 15.00 C ATOM 901 NH1 ARG A 58 -8.328 2.847 -19.681 1.00 15.00 N ATOM 902 NH2 ARG A 58 -10.118 3.118 -18.274 1.00 15.00 N ATOM 0 H ARG A 58 -4.195 0.708 -18.244 1.00 15.00 H new ATOM 0 HA ARG A 58 -5.454 -1.726 -18.924 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -6.238 0.835 -18.378 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -6.458 0.797 -20.116 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -7.595 -1.607 -19.339 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -7.990 -0.561 -17.989 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -8.397 0.579 -20.725 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -9.484 -0.709 -20.246 1.00 15.00 H new ATOM 0 HE ARG A 58 -10.405 0.666 -18.548 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -7.733 2.245 -20.251 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -8.137 3.847 -19.625 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -10.906 2.726 -17.757 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -9.921 4.117 -18.223 1.00 15.00 H new ATOM 916 N ILE A 59 -3.651 -0.435 -21.210 1.00 15.00 N ATOM 917 CA ILE A 59 -3.164 -0.532 -22.579 1.00 15.00 C ATOM 918 C ILE A 59 -3.061 -1.984 -23.031 1.00 15.00 C ATOM 919 O ILE A 59 -3.928 -2.497 -23.736 1.00 15.00 O ATOM 920 CB ILE A 59 -1.775 0.141 -22.751 1.00 15.00 C ATOM 921 CG1 ILE A 59 -0.881 -0.141 -21.537 1.00 15.00 C ATOM 922 CG2 ILE A 59 -1.939 1.640 -22.957 1.00 15.00 C ATOM 923 CD1 ILE A 59 0.313 -1.037 -21.811 1.00 15.00 C ATOM 0 H ILE A 59 -3.020 0.056 -20.577 1.00 15.00 H new ATOM 0 HA ILE A 59 -3.892 -0.007 -23.197 1.00 15.00 H new ATOM 0 HB ILE A 59 -1.293 -0.282 -23.633 1.00 15.00 H new ATOM 0 HG12 ILE A 59 -0.520 0.809 -21.143 1.00 15.00 H new ATOM 0 HG13 ILE A 59 -1.488 -0.600 -20.757 1.00 15.00 H new ATOM 0 HG21 ILE A 59 -0.958 2.100 -23.076 1.00 15.00 H new ATOM 0 HG22 ILE A 59 -2.536 1.821 -23.851 1.00 15.00 H new ATOM 0 HG23 ILE A 59 -2.440 2.073 -22.092 1.00 15.00 H new ATOM 0 HD11 ILE A 59 0.882 -1.176 -20.892 1.00 15.00 H new ATOM 0 HD12 ILE A 59 -0.034 -2.005 -22.173 1.00 15.00 H new ATOM 0 HD13 ILE A 59 0.950 -0.574 -22.565 1.00 15.00 H new ATOM 935 N ARG A 60 -1.992 -2.628 -22.594 1.00 15.00 N ATOM 936 CA ARG A 60 -1.708 -4.023 -22.903 1.00 15.00 C ATOM 937 C ARG A 60 -0.686 -4.538 -21.907 1.00 15.00 C ATOM 938 O ARG A 60 0.464 -4.805 -22.258 1.00 15.00 O ATOM 939 CB ARG A 60 -1.154 -4.195 -24.320 1.00 15.00 C ATOM 940 CG ARG A 60 -1.887 -3.411 -25.394 1.00 15.00 C ATOM 941 CD ARG A 60 -1.412 -1.969 -25.447 1.00 15.00 C ATOM 942 NE ARG A 60 -2.507 -1.038 -25.711 1.00 15.00 N ATOM 943 CZ ARG A 60 -3.204 -1.018 -26.845 1.00 15.00 C ATOM 944 NH1 ARG A 60 -2.917 -1.868 -27.824 1.00 15.00 N ATOM 945 NH2 ARG A 60 -4.189 -0.145 -27.002 1.00 15.00 N ATOM 0 H ARG A 60 -1.284 -2.190 -22.004 1.00 15.00 H new ATOM 0 HA ARG A 60 -2.640 -4.584 -22.840 1.00 15.00 H new ATOM 0 HB2 ARG A 60 -0.106 -3.895 -24.323 1.00 15.00 H new ATOM 0 HB3 ARG A 60 -1.183 -5.253 -24.580 1.00 15.00 H new ATOM 0 HG2 ARG A 60 -1.730 -3.884 -26.363 1.00 15.00 H new ATOM 0 HG3 ARG A 60 -2.959 -3.436 -25.198 1.00 15.00 H new ATOM 0 HD2 ARG A 60 -0.937 -1.710 -24.501 1.00 15.00 H new ATOM 0 HD3 ARG A 60 -0.654 -1.866 -26.224 1.00 15.00 H new ATOM 0 HE ARG A 60 -2.751 -0.365 -24.985 1.00 15.00 H new ATOM 0 HH11 ARG A 60 -2.159 -2.541 -27.709 1.00 15.00 H new ATOM 0 HH12 ARG A 60 -3.455 -1.848 -28.691 1.00 15.00 H new ATOM 0 HH21 ARG A 60 -4.413 0.511 -26.254 1.00 15.00 H new ATOM 0 HH22 ARG A 60 -4.723 -0.130 -27.871 1.00 15.00 H new ATOM 959 N TYR A 61 -1.103 -4.650 -20.663 1.00 15.00 N ATOM 960 CA TYR A 61 -0.228 -5.102 -19.594 1.00 15.00 C ATOM 961 C TYR A 61 0.202 -6.564 -19.756 1.00 15.00 C ATOM 962 O TYR A 61 0.639 -7.197 -18.795 1.00 15.00 O ATOM 963 CB TYR A 61 -0.925 -4.902 -18.254 1.00 15.00 C ATOM 964 CG TYR A 61 -2.037 -5.900 -18.041 1.00 15.00 C ATOM 965 CD1 TYR A 61 -2.596 -6.525 -19.136 1.00 15.00 C ATOM 966 CD2 TYR A 61 -2.521 -6.216 -16.779 1.00 15.00 C ATOM 967 CE1 TYR A 61 -3.612 -7.444 -18.998 1.00 15.00 C ATOM 968 CE2 TYR A 61 -3.542 -7.136 -16.625 1.00 15.00 C ATOM 969 CZ TYR A 61 -4.085 -7.747 -17.739 1.00 15.00 C ATOM 970 OH TYR A 61 -5.100 -8.662 -17.593 1.00 15.00 O ATOM 0 H TYR A 61 -2.053 -4.432 -20.362 1.00 15.00 H new ATOM 0 HA TYR A 61 0.682 -4.504 -19.639 1.00 15.00 H new ATOM 0 HB2 TYR A 61 -0.196 -4.994 -17.449 1.00 15.00 H new ATOM 0 HB3 TYR A 61 -1.330 -3.891 -18.203 1.00 15.00 H new ATOM 0 HD1 TYR A 61 -2.229 -6.288 -20.124 1.00 15.00 H new ATOM 0 HD2 TYR A 61 -2.096 -5.739 -15.909 1.00 15.00 H new ATOM 0 HE1 TYR A 61 -4.035 -7.923 -19.869 1.00 15.00 H new ATOM 0 HE2 TYR A 61 -3.913 -7.376 -15.639 1.00 15.00 H new ATOM 0 HH TYR A 61 -4.932 -9.432 -18.175 1.00 15.00 H new ATOM 980 N LYS A 62 0.079 -7.094 -20.967 1.00 15.00 N ATOM 981 CA LYS A 62 0.457 -8.477 -21.245 1.00 15.00 C ATOM 982 C LYS A 62 -0.532 -9.450 -20.612 1.00 15.00 C ATOM 983 O LYS A 62 -0.899 -9.309 -19.445 1.00 15.00 O ATOM 984 CB LYS A 62 1.873 -8.759 -20.732 1.00 15.00 C ATOM 985 CG LYS A 62 2.840 -9.187 -21.824 1.00 15.00 C ATOM 986 CD LYS A 62 3.906 -8.130 -22.078 1.00 15.00 C ATOM 987 CE LYS A 62 3.796 -7.552 -23.481 1.00 15.00 C ATOM 988 NZ LYS A 62 4.565 -8.353 -24.473 1.00 15.00 N ATOM 0 H LYS A 62 -0.281 -6.586 -21.775 1.00 15.00 H new ATOM 0 HA LYS A 62 0.438 -8.620 -22.325 1.00 15.00 H new ATOM 0 HB2 LYS A 62 2.260 -7.863 -20.246 1.00 15.00 H new ATOM 0 HB3 LYS A 62 1.827 -9.539 -19.972 1.00 15.00 H new ATOM 0 HG2 LYS A 62 3.318 -10.125 -21.540 1.00 15.00 H new ATOM 0 HG3 LYS A 62 2.288 -9.376 -22.745 1.00 15.00 H new ATOM 0 HD2 LYS A 62 3.808 -7.329 -21.345 1.00 15.00 H new ATOM 0 HD3 LYS A 62 4.894 -8.568 -21.941 1.00 15.00 H new ATOM 0 HE2 LYS A 62 2.748 -7.516 -23.778 1.00 15.00 H new ATOM 0 HE3 LYS A 62 4.163 -6.526 -23.481 1.00 15.00 H new ATOM 0 HZ1 LYS A 62 4.465 -7.927 -25.416 1.00 15.00 H new ATOM 0 HZ2 LYS A 62 5.570 -8.367 -24.204 1.00 15.00 H new ATOM 0 HZ3 LYS A 62 4.199 -9.326 -24.492 1.00 15.00 H new ATOM 1002 N LYS A 63 -0.957 -10.438 -21.392 1.00 15.00 N ATOM 1003 CA LYS A 63 -1.904 -11.442 -20.916 1.00 15.00 C ATOM 1004 C LYS A 63 -3.272 -10.821 -20.655 1.00 15.00 C ATOM 1005 O LYS A 63 -3.467 -10.115 -19.665 1.00 15.00 O ATOM 1006 CB LYS A 63 -1.375 -12.109 -19.644 1.00 15.00 C ATOM 1007 CG LYS A 63 -1.317 -13.625 -19.732 1.00 15.00 C ATOM 1008 CD LYS A 63 -2.640 -14.260 -19.334 1.00 15.00 C ATOM 1009 CE LYS A 63 -2.444 -15.347 -18.288 1.00 15.00 C ATOM 1010 NZ LYS A 63 -1.952 -16.618 -18.889 1.00 15.00 N ATOM 0 H LYS A 63 -0.660 -10.566 -22.359 1.00 15.00 H new ATOM 0 HA LYS A 63 -2.016 -12.199 -21.692 1.00 15.00 H new ATOM 0 HB2 LYS A 63 -0.376 -11.727 -19.432 1.00 15.00 H new ATOM 0 HB3 LYS A 63 -2.010 -11.826 -18.804 1.00 15.00 H new ATOM 0 HG2 LYS A 63 -1.062 -13.921 -20.749 1.00 15.00 H new ATOM 0 HG3 LYS A 63 -0.524 -13.998 -19.083 1.00 15.00 H new ATOM 0 HD2 LYS A 63 -3.310 -13.494 -18.943 1.00 15.00 H new ATOM 0 HD3 LYS A 63 -3.121 -14.684 -20.215 1.00 15.00 H new ATOM 0 HE2 LYS A 63 -1.734 -15.003 -17.536 1.00 15.00 H new ATOM 0 HE3 LYS A 63 -3.388 -15.530 -17.775 1.00 15.00 H new ATOM 0 HZ1 LYS A 63 -1.832 -17.332 -18.142 1.00 15.00 H new ATOM 0 HZ2 LYS A 63 -2.641 -16.961 -19.588 1.00 15.00 H new ATOM 0 HZ3 LYS A 63 -1.039 -16.450 -19.357 1.00 15.00 H new ATOM 1024 N ASN A 64 -4.216 -11.087 -21.550 1.00 15.00 N ATOM 1025 CA ASN A 64 -5.568 -10.555 -21.420 1.00 15.00 C ATOM 1026 C ASN A 64 -6.583 -11.479 -22.085 1.00 15.00 C ATOM 1027 O ASN A 64 -6.162 -12.510 -22.649 1.00 15.00 O ATOM 1028 CB ASN A 64 -5.650 -9.158 -22.037 1.00 15.00 C ATOM 1029 CG ASN A 64 -5.353 -9.165 -23.525 1.00 15.00 C ATOM 1030 OD1 ASN A 64 -4.501 -9.919 -23.995 1.00 15.00 O ATOM 1031 ND2 ASN A 64 -6.056 -8.322 -24.272 1.00 15.00 N ATOM 1032 OXT ASN A 64 -7.790 -11.163 -22.036 1.00 15.00 O ATOM 0 H ASN A 64 -4.070 -11.669 -22.375 1.00 15.00 H new ATOM 0 HA ASN A 64 -5.806 -10.490 -20.358 1.00 15.00 H new ATOM 0 HB2 ASN A 64 -6.646 -8.748 -21.870 1.00 15.00 H new ATOM 0 HB3 ASN A 64 -4.945 -8.498 -21.531 1.00 15.00 H new ATOM 0 HD21 ASN A 64 -5.900 -8.281 -25.279 1.00 15.00 H new ATOM 0 HD22 ASN A 64 -6.752 -7.715 -23.839 1.00 15.00 H new TER 1039 ASN A 64