USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1050 hydrogens (25 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 13 SER OG : rot 170:sc= 0.00479 USER MOD Set 1.2: A 138 FOP N4 :NH3+ 179:sc= 0 (180deg=-0.00254) USER MOD Set 2.1: A 122 SER OG : rot 5:sc= 0.73 USER MOD Set 2.2: A 125 THR OG1 : rot -140:sc= -0.0763 USER MOD Set 3.1: A 62 SER OG : rot -112:sc= 0.201 USER MOD Set 3.2: A 66 GLN : amide:sc= -0.281 K(o=-0.08,f=-8.1!) USER MOD Set 4.1: A 25 HIS : no HD1:sc= -0.197 X(o=-0.73,f=-0.77) USER MOD Set 4.2: A 29 ASN : amide:sc= -0.534 K(o=-0.73,f=-3) USER MOD Set 5.1: A 3 LYS NZ :NH3+ -151:sc= 0.727 (180deg=-0.477) USER MOD Set 5.2: A 5 THR OG1 : rot 159:sc= 0.311 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0587) USER MOD Single : A 4 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0306) USER MOD Single : A 15 CYS SG : rot 40:sc= 0.135 USER MOD Single : A 16 HIS : no HD1:sc= -0.118 X(o=-0.12,f=-0.13) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -168:sc=-0.00894 (180deg=-0.376) USER MOD Single : A 26 SER OG : rot 119:sc= 0.943 USER MOD Single : A 28 THR OG1 : rot -66:sc= 0.269 USER MOD Single : A 33 ASN :FLIP amide:sc=-0.00336 F(o=-0.93,f=-0.0034) USER MOD Single : A 36 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 41 SER OG : rot -27:sc= 0.293 USER MOD Single : A 42 SER OG : rot 118:sc= -1.68! USER MOD Single : A 43 GLN : amide:sc= -2.86 K(o=-2.9,f=-8.4!) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 22:sc= 1.2 USER MOD Single : A 54 LYS NZ :NH3+ -125:sc=-0.00175 (180deg=-0.264) USER MOD Single : A 59 CYS SG : rot -150:sc= 0.0771 USER MOD Single : A 61 SER OG : rot 68:sc= 1.22 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 CYS SG : rot -98:sc= 0.998 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ -168:sc= -0.557 (180deg=-0.928) USER MOD Single : A 78 CYS SG : rot 154:sc= -0.275 USER MOD Single : A 84 LYS NZ :NH3+ -161:sc= -0.216 (180deg=-0.856) USER MOD Single : A 87 LYS NZ :NH3+ -169:sc= 0.119 (180deg=0.013) USER MOD Single : A 93 ASN : amide:sc= -0.143 X(o=-0.14,f=-0.17) USER MOD Single : A 98 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0182) USER MOD Single : A 99 GLN : amide:sc= -0.825 K(o=-0.82,f=-3.6!) USER MOD Single : A 100 ASN : amide:sc=-0.00147 K(o=-0.0015,f=-2!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl -150:sc= 0 (180deg=-0.0222) USER MOD Single : A 117 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 121 THR OG1 : rot -60:sc= 0.496 USER MOD Single : A 126 THR OG1 : rot -56:sc= 0.151 USER MOD Single : A 130 MET CE :methyl -157:sc= -4.13 (180deg=-6.27!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot 170:sc= 0.505 USER MOD Single : A 139 DBI O5' : rot 180:sc= -0.138 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.793 8.600 12.954 1.00 0.00 N ATOM 2 CA MET A 1 -2.104 7.401 13.372 1.00 0.00 C ATOM 3 C MET A 1 -2.924 6.246 12.796 1.00 0.00 C ATOM 4 O MET A 1 -2.458 5.485 11.957 1.00 0.00 O ATOM 5 CB MET A 1 -1.983 7.346 14.909 1.00 0.00 C ATOM 6 CG MET A 1 -1.275 6.081 15.412 1.00 0.00 C ATOM 7 SD MET A 1 -1.239 6.028 17.213 1.00 0.00 S ATOM 8 CE MET A 1 -1.320 4.241 17.433 1.00 0.00 C ATOM 0 H1 MET A 1 -2.242 9.435 13.240 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.902 8.595 11.920 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.731 8.635 13.401 1.00 0.00 H new ATOM 0 HA MET A 1 -1.077 7.358 13.009 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.437 8.223 15.256 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.979 7.396 15.348 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.787 5.198 15.030 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.257 6.052 15.024 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.309 4.005 18.497 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.239 3.861 16.987 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.462 3.776 16.949 1.00 0.00 H new ATOM 20 N GLU A 2 -4.172 6.177 13.311 1.00 0.00 N ATOM 21 CA GLU A 2 -5.127 5.154 12.919 1.00 0.00 C ATOM 22 C GLU A 2 -6.158 5.853 12.017 1.00 0.00 C ATOM 23 O GLU A 2 -7.340 5.530 12.046 1.00 0.00 O ATOM 24 CB GLU A 2 -5.784 4.545 14.178 1.00 0.00 C ATOM 25 CG GLU A 2 -4.797 4.105 15.277 1.00 0.00 C ATOM 26 CD GLU A 2 -3.897 2.926 14.856 1.00 0.00 C ATOM 27 OE1 GLU A 2 -3.021 3.115 14.014 1.00 0.00 O ATOM 28 OE2 GLU A 2 -4.074 1.832 15.390 1.00 0.00 O ATOM 0 H GLU A 2 -4.530 6.832 14.006 1.00 0.00 H new ATOM 0 HA GLU A 2 -4.655 4.331 12.383 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -6.473 5.277 14.600 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.379 3.683 13.878 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -4.168 4.952 15.551 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -5.359 3.824 16.168 1.00 0.00 H new ATOM 35 N LYS A 3 -5.644 6.818 11.210 1.00 0.00 N ATOM 36 CA LYS A 3 -6.438 7.613 10.304 1.00 0.00 C ATOM 37 C LYS A 3 -7.140 6.675 9.317 1.00 0.00 C ATOM 38 O LYS A 3 -6.605 5.685 8.838 1.00 0.00 O ATOM 39 CB LYS A 3 -5.547 8.648 9.597 1.00 0.00 C ATOM 40 CG LYS A 3 -6.240 10.003 9.523 1.00 0.00 C ATOM 41 CD LYS A 3 -5.744 10.904 8.381 1.00 0.00 C ATOM 42 CE LYS A 3 -6.875 11.717 7.739 1.00 0.00 C ATOM 43 NZ LYS A 3 -7.915 10.905 7.119 1.00 0.00 N ATOM 0 H LYS A 3 -4.651 7.050 11.188 1.00 0.00 H new ATOM 0 HA LYS A 3 -7.202 8.171 10.846 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.603 8.747 10.132 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.308 8.302 8.591 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -7.312 9.844 9.406 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -6.097 10.524 10.470 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.984 11.585 8.764 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -5.266 10.289 7.619 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -7.330 12.351 8.500 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.449 12.380 6.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.343 11.431 6.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.498 10.022 6.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.647 10.681 7.823 1.00 0.00 H new ATOM 56 N LYS A 4 -8.388 7.104 9.065 1.00 0.00 N ATOM 57 CA LYS A 4 -9.329 6.415 8.207 1.00 0.00 C ATOM 58 C LYS A 4 -9.048 6.839 6.766 1.00 0.00 C ATOM 59 O LYS A 4 -9.529 7.865 6.305 1.00 0.00 O ATOM 60 CB LYS A 4 -10.748 6.788 8.680 1.00 0.00 C ATOM 61 CG LYS A 4 -11.075 8.293 8.720 1.00 0.00 C ATOM 62 CD LYS A 4 -12.422 8.558 9.402 1.00 0.00 C ATOM 63 CE LYS A 4 -12.804 10.041 9.400 1.00 0.00 C ATOM 64 NZ LYS A 4 -13.095 10.547 8.063 1.00 0.00 N ATOM 0 H LYS A 4 -8.766 7.961 9.468 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.235 5.330 8.254 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.468 6.298 8.025 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.895 6.378 9.679 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -10.286 8.824 9.253 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -11.096 8.689 7.705 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -13.200 7.986 8.896 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -12.381 8.199 10.430 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -13.676 10.188 10.037 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -11.990 10.622 9.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -13.429 11.530 8.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.232 10.513 7.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -13.832 9.960 7.622 1.00 0.00 H new ATOM 77 N THR A 5 -8.245 5.999 6.070 1.00 0.00 N ATOM 78 CA THR A 5 -7.921 6.319 4.685 1.00 0.00 C ATOM 79 C THR A 5 -7.078 5.142 4.167 1.00 0.00 C ATOM 80 O THR A 5 -5.940 4.948 4.583 1.00 0.00 O ATOM 81 CB THR A 5 -7.165 7.699 4.585 1.00 0.00 C ATOM 82 OG1 THR A 5 -6.975 8.471 5.813 1.00 0.00 O ATOM 83 CG2 THR A 5 -7.707 8.545 3.398 1.00 0.00 C ATOM 0 H THR A 5 -7.834 5.139 6.433 1.00 0.00 H new ATOM 0 HA THR A 5 -8.816 6.441 4.074 1.00 0.00 H new ATOM 0 HB THR A 5 -6.135 7.409 4.379 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.230 9.097 5.694 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.169 9.492 3.351 1.00 0.00 H new ATOM 0 HG22 THR A 5 -7.562 7.999 2.466 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.770 8.738 3.544 1.00 0.00 H new ATOM 91 N ILE A 6 -7.699 4.383 3.224 1.00 0.00 N ATOM 92 CA ILE A 6 -7.051 3.247 2.611 1.00 0.00 C ATOM 93 C ILE A 6 -7.374 3.314 1.113 1.00 0.00 C ATOM 94 O ILE A 6 -8.508 3.099 0.701 1.00 0.00 O ATOM 95 CB ILE A 6 -7.459 1.876 3.251 1.00 0.00 C ATOM 96 CG1 ILE A 6 -7.969 1.862 4.725 1.00 0.00 C ATOM 97 CG2 ILE A 6 -6.985 0.690 2.341 1.00 0.00 C ATOM 98 CD1 ILE A 6 -9.339 2.466 5.117 1.00 0.00 C ATOM 0 H ILE A 6 -8.646 4.557 2.889 1.00 0.00 H new ATOM 0 HA ILE A 6 -5.975 3.299 2.779 1.00 0.00 H new ATOM 0 HB ILE A 6 -8.434 1.423 3.432 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.980 0.820 5.046 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -7.215 2.372 5.325 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -7.275 -0.257 2.797 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -7.450 0.777 1.359 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -5.901 0.724 2.234 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -9.494 2.350 6.190 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.356 3.525 4.861 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.132 1.949 4.577 1.00 0.00 H new ATOM 110 N VAL A 7 -6.283 3.587 0.343 1.00 0.00 N ATOM 111 CA VAL A 7 -6.297 3.664 -1.114 1.00 0.00 C ATOM 112 C VAL A 7 -6.002 2.240 -1.608 1.00 0.00 C ATOM 113 O VAL A 7 -5.170 1.542 -1.041 1.00 0.00 O ATOM 114 CB VAL A 7 -5.269 4.694 -1.747 1.00 0.00 C ATOM 115 CG1 VAL A 7 -5.396 6.120 -2.417 1.00 0.00 C ATOM 116 CG2 VAL A 7 -3.857 4.495 -1.145 1.00 0.00 C ATOM 0 H VAL A 7 -5.361 3.760 0.743 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.268 4.042 -1.432 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.740 4.376 -2.677 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -4.408 6.470 -2.717 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.040 6.054 -3.294 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.828 6.821 -1.702 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.167 5.211 -1.592 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.895 4.653 -0.067 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -3.513 3.482 -1.351 1.00 0.00 H new ATOM 126 N LEU A 8 -6.749 1.846 -2.670 1.00 0.00 N ATOM 127 CA LEU A 8 -6.610 0.501 -3.213 1.00 0.00 C ATOM 128 C LEU A 8 -6.016 0.596 -4.621 1.00 0.00 C ATOM 129 O LEU A 8 -6.225 1.538 -5.372 1.00 0.00 O ATOM 130 CB LEU A 8 -7.988 -0.188 -3.255 1.00 0.00 C ATOM 131 CG LEU A 8 -7.892 -1.732 -3.449 1.00 0.00 C ATOM 132 CD1 LEU A 8 -7.312 -2.368 -2.156 1.00 0.00 C ATOM 133 CD2 LEU A 8 -8.747 -2.520 -4.466 1.00 0.00 C ATOM 0 H LEU A 8 -7.433 2.434 -3.147 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.948 -0.091 -2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.522 0.024 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.577 0.239 -4.067 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.217 -1.929 -4.282 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -7.241 -3.448 -2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.320 -1.959 -1.963 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.967 -2.143 -1.314 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.495 -3.579 -4.410 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -9.804 -2.386 -4.234 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.547 -2.152 -5.472 1.00 0.00 H new ATOM 145 N GLY A 9 -5.272 -0.493 -4.903 1.00 0.00 N ATOM 146 CA GLY A 9 -4.592 -0.743 -6.165 1.00 0.00 C ATOM 147 C GLY A 9 -4.740 -2.240 -6.452 1.00 0.00 C ATOM 148 O GLY A 9 -4.835 -3.029 -5.524 1.00 0.00 O ATOM 0 H GLY A 9 -5.131 -1.242 -4.225 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.032 -0.149 -6.966 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -3.541 -0.463 -6.101 1.00 0.00 H new ATOM 152 N VAL A 10 -4.774 -2.597 -7.756 1.00 0.00 N ATOM 153 CA VAL A 10 -4.933 -4.011 -8.104 1.00 0.00 C ATOM 154 C VAL A 10 -4.468 -4.268 -9.544 1.00 0.00 C ATOM 155 O VAL A 10 -5.195 -4.079 -10.510 1.00 0.00 O ATOM 156 CB VAL A 10 -6.456 -4.496 -8.062 1.00 0.00 C ATOM 157 CG1 VAL A 10 -7.337 -5.336 -7.053 1.00 0.00 C ATOM 158 CG2 VAL A 10 -7.333 -3.267 -8.378 1.00 0.00 C ATOM 0 H VAL A 10 -4.697 -1.955 -8.545 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.341 -4.552 -7.366 1.00 0.00 H new ATOM 0 HB VAL A 10 -6.194 -5.356 -8.678 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -8.352 -5.423 -7.441 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -6.907 -6.331 -6.936 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.360 -4.834 -6.086 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -8.384 -3.556 -8.359 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.156 -2.492 -7.632 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -7.079 -2.884 -9.366 1.00 0.00 H new ATOM 168 N ILE A 11 -3.212 -4.757 -9.598 1.00 0.00 N ATOM 169 CA ILE A 11 -2.573 -5.145 -10.856 1.00 0.00 C ATOM 170 C ILE A 11 -2.698 -6.676 -10.863 1.00 0.00 C ATOM 171 O ILE A 11 -2.837 -7.287 -9.808 1.00 0.00 O ATOM 172 CB ILE A 11 -1.104 -4.653 -10.954 1.00 0.00 C ATOM 173 CG1 ILE A 11 -0.953 -3.400 -11.914 1.00 0.00 C ATOM 174 CG2 ILE A 11 -0.324 -5.066 -9.653 1.00 0.00 C ATOM 175 CD1 ILE A 11 -1.925 -2.204 -11.716 1.00 0.00 C ATOM 0 H ILE A 11 -2.624 -4.890 -8.775 1.00 0.00 H new ATOM 0 HA ILE A 11 -3.044 -4.689 -11.727 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.333 -5.110 -11.574 1.00 0.00 H new ATOM 0 HG12 ILE A 11 0.065 -3.023 -11.812 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.062 -3.751 -12.940 1.00 0.00 H new ATOM 0 HG21 ILE A 11 0.707 -4.720 -9.722 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.801 -4.613 -8.784 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.337 -6.151 -9.550 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -1.698 -1.426 -12.445 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.952 -2.543 -11.855 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.808 -1.803 -10.709 1.00 0.00 H new ATOM 187 N GLY A 12 -2.647 -7.278 -12.080 1.00 0.00 N ATOM 188 CA GLY A 12 -2.811 -8.721 -12.073 1.00 0.00 C ATOM 189 C GLY A 12 -2.620 -9.363 -13.441 1.00 0.00 C ATOM 190 O GLY A 12 -2.442 -8.736 -14.478 1.00 0.00 O ATOM 0 H GLY A 12 -2.507 -6.827 -12.984 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.097 -9.156 -11.374 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.807 -8.963 -11.703 1.00 0.00 H new ATOM 194 N SER A 13 -2.694 -10.695 -13.293 1.00 0.00 N ATOM 195 CA SER A 13 -2.560 -11.691 -14.315 1.00 0.00 C ATOM 196 C SER A 13 -3.919 -12.393 -14.414 1.00 0.00 C ATOM 197 O SER A 13 -3.984 -13.529 -14.869 1.00 0.00 O ATOM 198 CB SER A 13 -1.516 -12.675 -13.718 1.00 0.00 C ATOM 199 OG SER A 13 -1.753 -13.197 -12.344 1.00 0.00 O ATOM 0 H SER A 13 -2.862 -11.114 -12.378 1.00 0.00 H new ATOM 0 HA SER A 13 -2.267 -11.315 -15.295 1.00 0.00 H new ATOM 0 HB2 SER A 13 -1.439 -13.529 -14.391 1.00 0.00 H new ATOM 0 HB3 SER A 13 -0.547 -12.177 -13.723 1.00 0.00 H new ATOM 0 HG SER A 13 -1.119 -13.919 -12.155 1.00 0.00 H new ATOM 205 N ASP A 14 -4.996 -11.698 -13.963 1.00 0.00 N ATOM 206 CA ASP A 14 -6.295 -12.334 -14.012 1.00 0.00 C ATOM 207 C ASP A 14 -7.323 -11.205 -13.892 1.00 0.00 C ATOM 208 O ASP A 14 -7.213 -10.338 -13.032 1.00 0.00 O ATOM 209 CB ASP A 14 -6.396 -13.369 -12.864 1.00 0.00 C ATOM 210 CG ASP A 14 -7.736 -14.130 -12.793 1.00 0.00 C ATOM 211 OD1 ASP A 14 -8.418 -14.248 -13.812 1.00 0.00 O ATOM 212 OD2 ASP A 14 -8.081 -14.602 -11.710 1.00 0.00 O ATOM 0 H ASP A 14 -4.976 -10.751 -13.585 1.00 0.00 H new ATOM 0 HA ASP A 14 -6.470 -12.885 -14.936 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -5.589 -14.093 -12.975 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -6.236 -12.856 -11.916 1.00 0.00 H new ATOM 217 N CYS A 15 -8.331 -11.275 -14.809 1.00 0.00 N ATOM 218 CA CYS A 15 -9.392 -10.278 -14.798 1.00 0.00 C ATOM 219 C CYS A 15 -10.335 -10.706 -13.662 1.00 0.00 C ATOM 220 O CYS A 15 -11.104 -11.649 -13.793 1.00 0.00 O ATOM 221 CB CYS A 15 -10.097 -10.240 -16.163 1.00 0.00 C ATOM 222 SG CYS A 15 -10.715 -11.849 -16.723 1.00 0.00 S ATOM 0 H CYS A 15 -8.414 -11.990 -15.531 1.00 0.00 H new ATOM 0 HA CYS A 15 -9.022 -9.267 -14.629 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -10.932 -9.541 -16.109 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.403 -9.851 -16.908 1.00 0.00 H new ATOM 0 HG CYS A 15 -11.211 -12.499 -15.712 1.00 0.00 H new ATOM 228 N HIS A 16 -10.196 -9.951 -12.541 1.00 0.00 N ATOM 229 CA HIS A 16 -10.955 -10.151 -11.310 1.00 0.00 C ATOM 230 C HIS A 16 -10.312 -11.361 -10.612 1.00 0.00 C ATOM 231 O HIS A 16 -9.763 -12.254 -11.246 1.00 0.00 O ATOM 232 CB HIS A 16 -12.477 -10.300 -11.537 1.00 0.00 C ATOM 233 CG HIS A 16 -13.210 -10.322 -10.213 1.00 0.00 C ATOM 234 ND1 HIS A 16 -13.437 -9.228 -9.453 1.00 0.00 N ATOM 235 CD2 HIS A 16 -13.753 -11.439 -9.554 1.00 0.00 C ATOM 236 CE1 HIS A 16 -14.097 -9.668 -8.368 1.00 0.00 C ATOM 237 NE2 HIS A 16 -14.301 -10.997 -8.400 1.00 0.00 N ATOM 0 H HIS A 16 -9.537 -9.175 -12.482 1.00 0.00 H new ATOM 0 HA HIS A 16 -10.900 -9.267 -10.675 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -12.842 -9.475 -12.148 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -12.681 -11.218 -12.088 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -13.736 -12.460 -9.905 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -14.426 -9.028 -7.563 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -14.775 -11.560 -7.694 1.00 0.00 H new ATOM 245 N ALA A 17 -10.408 -11.310 -9.262 1.00 0.00 N ATOM 246 CA ALA A 17 -9.875 -12.333 -8.373 1.00 0.00 C ATOM 247 C ALA A 17 -8.353 -12.182 -8.427 1.00 0.00 C ATOM 248 O ALA A 17 -7.634 -12.986 -9.008 1.00 0.00 O ATOM 249 CB ALA A 17 -10.361 -13.754 -8.719 1.00 0.00 C ATOM 0 H ALA A 17 -10.865 -10.543 -8.769 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.241 -12.192 -7.356 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -9.927 -14.468 -8.019 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.448 -13.794 -8.650 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.052 -14.007 -9.733 1.00 0.00 H new ATOM 255 N VAL A 18 -7.935 -11.084 -7.764 1.00 0.00 N ATOM 256 CA VAL A 18 -6.520 -10.725 -7.685 1.00 0.00 C ATOM 257 C VAL A 18 -6.250 -9.773 -6.496 1.00 0.00 C ATOM 258 O VAL A 18 -5.098 -9.557 -6.140 1.00 0.00 O ATOM 259 CB VAL A 18 -6.027 -10.038 -8.992 1.00 0.00 C ATOM 260 CG1 VAL A 18 -5.064 -11.054 -9.720 1.00 0.00 C ATOM 261 CG2 VAL A 18 -7.168 -9.055 -9.469 1.00 0.00 C ATOM 0 H VAL A 18 -8.560 -10.439 -7.281 1.00 0.00 H new ATOM 0 HA VAL A 18 -5.973 -11.657 -7.541 1.00 0.00 H new ATOM 0 HB VAL A 18 -5.292 -9.244 -9.123 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -4.696 -10.608 -10.644 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.222 -11.287 -9.069 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -5.608 -11.970 -9.951 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -6.857 -8.554 -10.386 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -8.081 -9.621 -9.656 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.355 -8.311 -8.694 1.00 0.00 H new ATOM 271 N GLY A 19 -7.331 -9.215 -5.901 1.00 0.00 N ATOM 272 CA GLY A 19 -7.152 -8.286 -4.780 1.00 0.00 C ATOM 273 C GLY A 19 -8.439 -7.538 -4.410 1.00 0.00 C ATOM 274 O GLY A 19 -8.632 -7.078 -3.281 1.00 0.00 O ATOM 0 H GLY A 19 -8.299 -9.388 -6.172 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.797 -8.839 -3.910 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.378 -7.562 -5.035 1.00 0.00 H new ATOM 278 N ASN A 20 -9.318 -7.473 -5.448 1.00 0.00 N ATOM 279 CA ASN A 20 -10.635 -6.840 -5.396 1.00 0.00 C ATOM 280 C ASN A 20 -11.224 -7.225 -4.037 1.00 0.00 C ATOM 281 O ASN A 20 -11.634 -6.359 -3.266 1.00 0.00 O ATOM 282 CB ASN A 20 -11.491 -7.296 -6.594 1.00 0.00 C ATOM 283 CG ASN A 20 -12.834 -6.551 -6.626 1.00 0.00 C ATOM 284 OD1 ASN A 20 -13.822 -6.980 -6.043 1.00 0.00 O ATOM 285 ND2 ASN A 20 -12.796 -5.413 -7.342 1.00 0.00 N ATOM 0 H ASN A 20 -9.109 -7.875 -6.362 1.00 0.00 H new ATOM 0 HA ASN A 20 -10.591 -5.754 -5.479 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -10.949 -7.116 -7.522 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -11.668 -8.370 -6.531 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -13.633 -4.837 -7.429 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -11.930 -5.126 -7.798 1.00 0.00 H new ATOM 292 N LYS A 21 -11.100 -8.590 -3.871 1.00 0.00 N ATOM 293 CA LYS A 21 -11.353 -9.630 -2.859 1.00 0.00 C ATOM 294 C LYS A 21 -11.614 -8.943 -1.553 1.00 0.00 C ATOM 295 O LYS A 21 -10.978 -9.102 -0.517 1.00 0.00 O ATOM 296 CB LYS A 21 -10.138 -10.563 -2.727 1.00 0.00 C ATOM 297 CG LYS A 21 -9.877 -11.379 -3.993 1.00 0.00 C ATOM 298 CD LYS A 21 -8.793 -12.434 -3.758 1.00 0.00 C ATOM 299 CE LYS A 21 -8.624 -13.367 -4.954 1.00 0.00 C ATOM 300 NZ LYS A 21 -9.806 -14.169 -5.245 1.00 0.00 N ATOM 0 H LYS A 21 -10.715 -9.080 -4.679 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.210 -10.236 -3.153 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.254 -9.970 -2.494 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.296 -11.242 -1.889 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.799 -11.866 -4.312 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.572 -10.714 -4.801 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.845 -11.938 -3.550 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.046 -13.021 -2.875 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.373 -12.774 -5.833 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.781 -14.033 -4.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -9.560 -14.915 -5.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.155 -14.604 -4.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.547 -13.561 -5.649 1.00 0.00 H new ATOM 313 N ILE A 22 -12.660 -8.162 -1.774 1.00 0.00 N ATOM 314 CA ILE A 22 -13.336 -7.239 -0.954 1.00 0.00 C ATOM 315 C ILE A 22 -12.349 -6.715 0.094 1.00 0.00 C ATOM 316 O ILE A 22 -12.549 -6.788 1.298 1.00 0.00 O ATOM 317 CB ILE A 22 -14.749 -7.749 -0.568 1.00 0.00 C ATOM 318 CG1 ILE A 22 -15.145 -9.193 -0.960 1.00 0.00 C ATOM 319 CG2 ILE A 22 -15.714 -6.517 -0.544 1.00 0.00 C ATOM 320 CD1 ILE A 22 -14.427 -10.413 -0.320 1.00 0.00 C ATOM 0 H ILE A 22 -13.104 -8.189 -2.692 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.641 -6.320 -1.455 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.830 -8.132 0.449 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -16.209 -9.302 -0.752 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -15.021 -9.278 -2.040 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -16.718 -6.846 -0.275 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -15.361 -5.792 0.190 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -15.737 -6.053 -1.530 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -14.846 -11.335 -0.724 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -13.362 -10.369 -0.547 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -14.569 -10.393 0.761 1.00 0.00 H new ATOM 332 N LEU A 23 -11.231 -6.197 -0.491 1.00 0.00 N ATOM 333 CA LEU A 23 -10.225 -5.512 0.310 1.00 0.00 C ATOM 334 C LEU A 23 -10.918 -4.153 0.626 1.00 0.00 C ATOM 335 O LEU A 23 -10.657 -3.504 1.632 1.00 0.00 O ATOM 336 CB LEU A 23 -8.929 -5.471 -0.511 1.00 0.00 C ATOM 337 CG LEU A 23 -7.594 -5.109 0.194 1.00 0.00 C ATOM 338 CD1 LEU A 23 -6.508 -5.695 -0.792 1.00 0.00 C ATOM 339 CD2 LEU A 23 -7.827 -3.717 0.887 1.00 0.00 C ATOM 0 H LEU A 23 -11.024 -6.248 -1.489 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.915 -5.969 1.250 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.801 -6.451 -0.971 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.076 -4.756 -1.320 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.138 -5.509 1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.512 -5.498 -0.395 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.652 -6.771 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.610 -5.221 -1.768 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.917 -3.410 1.402 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.086 -2.974 0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.640 -3.801 1.608 1.00 0.00 H new ATOM 351 N ASP A 24 -11.872 -3.774 -0.272 1.00 0.00 N ATOM 352 CA ASP A 24 -12.655 -2.580 0.015 1.00 0.00 C ATOM 353 C ASP A 24 -13.623 -2.940 1.183 1.00 0.00 C ATOM 354 O ASP A 24 -14.275 -2.077 1.749 1.00 0.00 O ATOM 355 CB ASP A 24 -13.403 -2.084 -1.233 1.00 0.00 C ATOM 356 CG ASP A 24 -12.414 -1.763 -2.370 1.00 0.00 C ATOM 357 OD1 ASP A 24 -11.683 -0.779 -2.256 1.00 0.00 O ATOM 358 OD2 ASP A 24 -12.383 -2.503 -3.353 1.00 0.00 O ATOM 0 H ASP A 24 -12.094 -4.256 -1.143 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.008 -1.754 0.310 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.111 -2.843 -1.564 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.982 -1.194 -0.986 1.00 0.00 H new ATOM 363 N HIS A 25 -13.696 -4.239 1.551 1.00 0.00 N ATOM 364 CA HIS A 25 -14.549 -4.628 2.671 1.00 0.00 C ATOM 365 C HIS A 25 -13.829 -4.179 3.946 1.00 0.00 C ATOM 366 O HIS A 25 -14.458 -3.862 4.939 1.00 0.00 O ATOM 367 CB HIS A 25 -14.828 -6.143 2.795 1.00 0.00 C ATOM 368 CG HIS A 25 -16.020 -6.435 3.687 1.00 0.00 C ATOM 369 ND1 HIS A 25 -16.167 -7.599 4.356 1.00 0.00 N ATOM 370 CD2 HIS A 25 -17.137 -5.625 3.969 1.00 0.00 C ATOM 371 CE1 HIS A 25 -17.332 -7.500 5.019 1.00 0.00 C ATOM 372 NE2 HIS A 25 -17.940 -6.320 4.805 1.00 0.00 N ATOM 0 H HIS A 25 -13.191 -5.003 1.102 1.00 0.00 H new ATOM 0 HA HIS A 25 -15.520 -4.160 2.509 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -15.007 -6.560 1.804 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -13.946 -6.642 3.196 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -17.319 -4.631 3.587 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -17.733 -8.279 5.651 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -18.830 -6.011 5.196 1.00 0.00 H new ATOM 380 N SER A 26 -12.481 -4.178 3.833 1.00 0.00 N ATOM 381 CA SER A 26 -11.529 -3.834 4.882 1.00 0.00 C ATOM 382 C SER A 26 -11.860 -2.459 5.472 1.00 0.00 C ATOM 383 O SER A 26 -11.869 -2.265 6.685 1.00 0.00 O ATOM 384 CB SER A 26 -10.065 -3.939 4.366 1.00 0.00 C ATOM 385 OG SER A 26 -9.352 -2.744 3.852 1.00 0.00 O ATOM 0 H SER A 26 -12.018 -4.431 2.960 1.00 0.00 H new ATOM 0 HA SER A 26 -11.617 -4.557 5.693 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.466 -4.342 5.183 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.059 -4.683 3.569 1.00 0.00 H new ATOM 0 HG SER A 26 -8.563 -2.570 4.406 1.00 0.00 H new ATOM 391 N PHE A 27 -12.152 -1.526 4.540 1.00 0.00 N ATOM 392 CA PHE A 27 -12.482 -0.154 4.955 1.00 0.00 C ATOM 393 C PHE A 27 -13.718 -0.193 5.853 1.00 0.00 C ATOM 394 O PHE A 27 -13.802 0.476 6.869 1.00 0.00 O ATOM 395 CB PHE A 27 -12.612 0.867 3.783 1.00 0.00 C ATOM 396 CG PHE A 27 -13.975 1.027 3.133 1.00 0.00 C ATOM 397 CD1 PHE A 27 -15.045 1.607 3.815 1.00 0.00 C ATOM 398 CD2 PHE A 27 -14.188 0.611 1.825 1.00 0.00 C ATOM 399 CE1 PHE A 27 -16.293 1.742 3.221 1.00 0.00 C ATOM 400 CE2 PHE A 27 -15.438 0.736 1.224 1.00 0.00 C ATOM 401 CZ PHE A 27 -16.493 1.306 1.921 1.00 0.00 C ATOM 0 H PHE A 27 -12.165 -1.691 3.534 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.634 0.232 5.521 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -12.300 1.844 4.153 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.902 0.579 3.007 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.900 1.958 4.826 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -13.370 0.183 1.264 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -17.108 2.187 3.772 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -15.586 0.388 0.212 1.00 0.00 H new ATOM 0 HZ PHE A 27 -17.462 1.409 1.455 1.00 0.00 H new ATOM 411 N THR A 28 -14.650 -1.036 5.408 1.00 0.00 N ATOM 412 CA THR A 28 -15.944 -1.210 6.038 1.00 0.00 C ATOM 413 C THR A 28 -15.861 -1.991 7.350 1.00 0.00 C ATOM 414 O THR A 28 -16.702 -1.874 8.232 1.00 0.00 O ATOM 415 CB THR A 28 -16.829 -1.881 4.943 1.00 0.00 C ATOM 416 OG1 THR A 28 -16.384 -1.797 3.545 1.00 0.00 O ATOM 417 CG2 THR A 28 -18.313 -1.483 5.108 1.00 0.00 C ATOM 0 H THR A 28 -14.517 -1.624 4.585 1.00 0.00 H new ATOM 0 HA THR A 28 -16.381 -0.264 6.359 1.00 0.00 H new ATOM 0 HB THR A 28 -16.700 -2.944 5.146 1.00 0.00 H new ATOM 0 HG1 THR A 28 -16.412 -0.863 3.248 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.907 -1.965 4.332 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.669 -1.802 6.088 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.411 -0.401 5.021 1.00 0.00 H new ATOM 425 N ASN A 29 -14.797 -2.775 7.399 1.00 0.00 N ATOM 426 CA ASN A 29 -14.446 -3.666 8.469 1.00 0.00 C ATOM 427 C ASN A 29 -13.753 -2.873 9.563 1.00 0.00 C ATOM 428 O ASN A 29 -13.396 -3.451 10.584 1.00 0.00 O ATOM 429 CB ASN A 29 -13.580 -4.864 8.016 1.00 0.00 C ATOM 430 CG ASN A 29 -14.335 -5.804 7.064 1.00 0.00 C ATOM 431 OD1 ASN A 29 -15.557 -5.880 7.064 1.00 0.00 O ATOM 432 ND2 ASN A 29 -13.521 -6.506 6.255 1.00 0.00 N ATOM 0 H ASN A 29 -14.118 -2.800 6.638 1.00 0.00 H new ATOM 0 HA ASN A 29 -15.368 -4.105 8.849 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -12.682 -4.494 7.521 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -13.253 -5.424 8.892 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -13.915 -7.160 5.578 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -12.510 -6.384 6.318 1.00 0.00 H new ATOM 439 N ALA A 30 -13.574 -1.549 9.341 1.00 0.00 N ATOM 440 CA ALA A 30 -12.945 -0.753 10.352 1.00 0.00 C ATOM 441 C ALA A 30 -13.699 0.576 10.445 1.00 0.00 C ATOM 442 O ALA A 30 -13.302 1.447 11.209 1.00 0.00 O ATOM 443 CB ALA A 30 -11.459 -0.604 10.033 1.00 0.00 C ATOM 0 H ALA A 30 -13.853 -1.050 8.496 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.993 -1.224 11.334 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.981 0.002 10.803 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.993 -1.589 10.004 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.342 -0.119 9.064 1.00 0.00 H new ATOM 449 N GLY A 31 -14.799 0.701 9.658 1.00 0.00 N ATOM 450 CA GLY A 31 -15.583 1.929 9.654 1.00 0.00 C ATOM 451 C GLY A 31 -14.732 3.145 9.250 1.00 0.00 C ATOM 452 O GLY A 31 -14.962 4.262 9.697 1.00 0.00 O ATOM 0 H GLY A 31 -15.145 -0.028 9.034 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.420 1.825 8.963 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -16.006 2.094 10.645 1.00 0.00 H new ATOM 456 N PHE A 32 -13.750 2.840 8.369 1.00 0.00 N ATOM 457 CA PHE A 32 -12.826 3.870 7.904 1.00 0.00 C ATOM 458 C PHE A 32 -13.307 4.333 6.519 1.00 0.00 C ATOM 459 O PHE A 32 -14.359 3.946 6.029 1.00 0.00 O ATOM 460 CB PHE A 32 -11.387 3.315 7.906 1.00 0.00 C ATOM 461 CG PHE A 32 -10.788 3.065 9.275 1.00 0.00 C ATOM 462 CD1 PHE A 32 -11.242 3.688 10.441 1.00 0.00 C ATOM 463 CD2 PHE A 32 -9.720 2.183 9.378 1.00 0.00 C ATOM 464 CE1 PHE A 32 -10.642 3.431 11.667 1.00 0.00 C ATOM 465 CE2 PHE A 32 -9.124 1.920 10.602 1.00 0.00 C ATOM 466 CZ PHE A 32 -9.580 2.546 11.750 1.00 0.00 C ATOM 0 H PHE A 32 -13.589 1.910 7.981 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.811 4.738 8.564 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.376 2.379 7.347 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.745 4.014 7.370 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -12.071 4.379 10.388 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.348 1.694 8.490 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -11.005 3.923 12.558 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -8.300 1.224 10.660 1.00 0.00 H new ATOM 0 HZ PHE A 32 -9.111 2.346 12.702 1.00 0.00 H new ATOM 476 N ASN A 33 -12.455 5.223 5.949 1.00 0.00 N ATOM 477 CA ASN A 33 -12.697 5.869 4.673 1.00 0.00 C ATOM 478 C ASN A 33 -12.179 4.950 3.564 1.00 0.00 C ATOM 479 O ASN A 33 -11.090 4.382 3.606 1.00 0.00 O ATOM 480 CB ASN A 33 -11.991 7.238 4.636 1.00 0.00 C ATOM 481 CG ASN A 33 -12.449 8.086 3.439 1.00 0.00 C ATOM 482 OD1 ASN A 33 -11.560 8.112 2.429 1.00 0.00 O flip ATOM 483 ND2 ASN A 33 -13.526 8.668 3.439 1.00 0.00 N flip ATOM 0 H ASN A 33 -11.575 5.502 6.383 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.763 6.043 4.528 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.194 7.777 5.562 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.912 7.089 4.584 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -14.144 8.597 4.247 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -13.805 9.224 2.631 1.00 0.00 H new ATOM 490 N VAL A 34 -13.049 4.941 2.534 1.00 0.00 N ATOM 491 CA VAL A 34 -12.851 4.156 1.330 1.00 0.00 C ATOM 492 C VAL A 34 -12.298 5.084 0.254 1.00 0.00 C ATOM 493 O VAL A 34 -12.833 6.140 -0.060 1.00 0.00 O ATOM 494 CB VAL A 34 -14.170 3.532 0.783 1.00 0.00 C ATOM 495 CG1 VAL A 34 -15.391 4.464 1.181 1.00 0.00 C ATOM 496 CG2 VAL A 34 -13.753 2.744 -0.536 1.00 0.00 C ATOM 0 H VAL A 34 -13.910 5.487 2.528 1.00 0.00 H new ATOM 0 HA VAL A 34 -12.174 3.338 1.578 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.748 2.692 1.169 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -16.317 4.033 0.801 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.448 4.546 2.266 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -15.248 5.455 0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -14.635 2.278 -0.976 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -13.315 3.439 -1.252 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -13.023 1.974 -0.285 1.00 0.00 H new ATOM 506 N VAL A 35 -11.180 4.562 -0.273 1.00 0.00 N ATOM 507 CA VAL A 35 -10.463 5.179 -1.360 1.00 0.00 C ATOM 508 C VAL A 35 -10.031 4.011 -2.252 1.00 0.00 C ATOM 509 O VAL A 35 -9.422 3.050 -1.799 1.00 0.00 O ATOM 510 CB VAL A 35 -9.267 6.016 -0.817 1.00 0.00 C ATOM 511 CG1 VAL A 35 -8.702 6.914 -1.958 1.00 0.00 C ATOM 512 CG2 VAL A 35 -8.952 6.272 0.683 1.00 0.00 C ATOM 0 H VAL A 35 -10.759 3.694 0.057 1.00 0.00 H new ATOM 0 HA VAL A 35 -11.064 5.890 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.554 5.299 -0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.865 7.500 -1.579 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.362 6.285 -2.781 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -9.484 7.585 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.058 6.889 0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -9.793 6.786 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.784 5.320 1.187 1.00 0.00 H new ATOM 522 N ASN A 36 -10.421 4.125 -3.528 1.00 0.00 N ATOM 523 CA ASN A 36 -10.059 3.081 -4.476 1.00 0.00 C ATOM 524 C ASN A 36 -9.755 3.800 -5.793 1.00 0.00 C ATOM 525 O ASN A 36 -10.532 4.608 -6.288 1.00 0.00 O ATOM 526 CB ASN A 36 -11.158 2.005 -4.583 1.00 0.00 C ATOM 527 CG ASN A 36 -12.540 2.593 -4.916 1.00 0.00 C ATOM 528 OD1 ASN A 36 -13.267 3.056 -4.046 1.00 0.00 O ATOM 529 ND2 ASN A 36 -12.847 2.533 -6.224 1.00 0.00 N ATOM 0 H ASN A 36 -10.965 4.899 -3.910 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.182 2.519 -4.156 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -10.880 1.284 -5.352 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -11.218 1.459 -3.641 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -13.744 2.890 -6.554 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -12.183 2.131 -6.886 1.00 0.00 H new ATOM 536 N ILE A 37 -8.558 3.443 -6.311 1.00 0.00 N ATOM 537 CA ILE A 37 -8.053 3.987 -7.561 1.00 0.00 C ATOM 538 C ILE A 37 -8.575 3.019 -8.634 1.00 0.00 C ATOM 539 O ILE A 37 -9.515 3.319 -9.358 1.00 0.00 O ATOM 540 CB ILE A 37 -6.488 4.098 -7.537 1.00 0.00 C ATOM 541 CG1 ILE A 37 -5.830 4.459 -6.183 1.00 0.00 C ATOM 542 CG2 ILE A 37 -5.957 4.377 -8.981 1.00 0.00 C ATOM 543 CD1 ILE A 37 -4.281 4.434 -6.112 1.00 0.00 C ATOM 0 H ILE A 37 -7.930 2.773 -5.867 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.391 5.005 -7.754 1.00 0.00 H new ATOM 0 HB ILE A 37 -5.881 3.208 -7.370 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.164 5.458 -5.902 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -6.213 3.771 -5.429 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -4.870 4.453 -8.960 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.251 3.561 -9.641 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.380 5.312 -9.350 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.958 4.707 -5.107 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.922 3.432 -6.349 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.872 5.145 -6.830 1.00 0.00 H new ATOM 555 N GLY A 38 -7.899 1.850 -8.678 1.00 0.00 N ATOM 556 CA GLY A 38 -8.246 0.802 -9.630 1.00 0.00 C ATOM 557 C GLY A 38 -6.987 0.026 -10.022 1.00 0.00 C ATOM 558 O GLY A 38 -6.037 -0.079 -9.256 1.00 0.00 O ATOM 0 H GLY A 38 -7.117 1.621 -8.065 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.980 0.126 -9.191 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.706 1.240 -10.516 1.00 0.00 H new ATOM 562 N VAL A 39 -7.047 -0.500 -11.269 1.00 0.00 N ATOM 563 CA VAL A 39 -5.946 -1.276 -11.842 1.00 0.00 C ATOM 564 C VAL A 39 -4.999 -0.252 -12.518 1.00 0.00 C ATOM 565 O VAL A 39 -5.063 -0.004 -13.716 1.00 0.00 O ATOM 566 CB VAL A 39 -6.523 -2.316 -12.898 1.00 0.00 C ATOM 567 CG1 VAL A 39 -5.898 -3.420 -13.848 1.00 0.00 C ATOM 568 CG2 VAL A 39 -7.740 -3.001 -12.233 1.00 0.00 C ATOM 0 H VAL A 39 -7.850 -0.395 -11.889 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.409 -1.849 -11.086 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.476 -1.553 -13.675 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.693 -3.906 -14.414 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.196 -2.951 -14.538 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.374 -4.163 -13.247 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.171 -3.726 -12.923 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.419 -3.511 -11.324 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.489 -2.249 -11.982 1.00 0.00 H new ATOM 578 N LEU A 40 -4.129 0.301 -11.650 1.00 0.00 N ATOM 579 CA LEU A 40 -3.168 1.299 -12.076 1.00 0.00 C ATOM 580 C LEU A 40 -2.131 1.311 -10.946 1.00 0.00 C ATOM 581 O LEU A 40 -2.429 1.624 -9.799 1.00 0.00 O ATOM 582 CB LEU A 40 -3.921 2.630 -12.310 1.00 0.00 C ATOM 583 CG LEU A 40 -3.076 3.899 -12.564 1.00 0.00 C ATOM 584 CD1 LEU A 40 -1.968 3.503 -13.611 1.00 0.00 C ATOM 585 CD2 LEU A 40 -4.149 5.054 -12.477 1.00 0.00 C ATOM 0 H LEU A 40 -4.083 0.066 -10.659 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.659 1.106 -13.021 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.586 2.494 -13.163 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.552 2.816 -11.441 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.333 4.384 -11.931 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.342 4.370 -13.824 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.351 2.702 -13.203 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.442 3.163 -14.531 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.663 6.015 -12.643 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.914 4.898 -13.238 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.612 5.047 -11.490 1.00 0.00 H new ATOM 597 N SER A 41 -0.897 0.938 -11.368 1.00 0.00 N ATOM 598 CA SER A 41 0.272 0.833 -10.503 1.00 0.00 C ATOM 599 C SER A 41 1.018 2.176 -10.578 1.00 0.00 C ATOM 600 O SER A 41 2.222 2.253 -10.790 1.00 0.00 O ATOM 601 CB SER A 41 1.125 -0.383 -10.990 1.00 0.00 C ATOM 602 OG SER A 41 2.537 -0.570 -10.583 1.00 0.00 O ATOM 0 H SER A 41 -0.698 0.700 -12.340 1.00 0.00 H new ATOM 0 HA SER A 41 0.021 0.650 -9.458 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.590 -1.283 -10.687 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.114 -0.357 -12.080 1.00 0.00 H new ATOM 0 HG SER A 41 2.940 0.302 -10.390 1.00 0.00 H new ATOM 608 N SER A 42 0.189 3.221 -10.413 1.00 0.00 N ATOM 609 CA SER A 42 0.567 4.615 -10.385 1.00 0.00 C ATOM 610 C SER A 42 0.840 4.888 -8.907 1.00 0.00 C ATOM 611 O SER A 42 -0.085 5.175 -8.158 1.00 0.00 O ATOM 612 CB SER A 42 -0.704 5.379 -10.836 1.00 0.00 C ATOM 613 OG SER A 42 -1.998 4.971 -10.224 1.00 0.00 O ATOM 0 H SER A 42 -0.815 3.091 -10.290 1.00 0.00 H new ATOM 0 HA SER A 42 1.419 4.892 -11.005 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.552 6.438 -10.629 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.794 5.275 -11.917 1.00 0.00 H new ATOM 0 HG SER A 42 -2.373 5.723 -9.719 1.00 0.00 H new ATOM 619 N GLN A 43 2.127 4.794 -8.510 1.00 0.00 N ATOM 620 CA GLN A 43 2.426 5.010 -7.102 1.00 0.00 C ATOM 621 C GLN A 43 2.710 6.496 -6.894 1.00 0.00 C ATOM 622 O GLN A 43 2.040 7.155 -6.116 1.00 0.00 O ATOM 623 CB GLN A 43 3.587 4.110 -6.641 1.00 0.00 C ATOM 624 CG GLN A 43 3.738 4.013 -5.111 1.00 0.00 C ATOM 625 CD GLN A 43 2.490 3.398 -4.460 1.00 0.00 C ATOM 626 OE1 GLN A 43 1.721 4.059 -3.775 1.00 0.00 O ATOM 627 NE2 GLN A 43 2.346 2.090 -4.728 1.00 0.00 N ATOM 0 H GLN A 43 2.923 4.583 -9.111 1.00 0.00 H new ATOM 0 HA GLN A 43 1.572 4.731 -6.484 1.00 0.00 H new ATOM 0 HB2 GLN A 43 3.439 3.109 -7.045 1.00 0.00 H new ATOM 0 HB3 GLN A 43 4.517 4.490 -7.064 1.00 0.00 H new ATOM 0 HG2 GLN A 43 4.612 3.408 -4.868 1.00 0.00 H new ATOM 0 HG3 GLN A 43 3.913 5.006 -4.698 1.00 0.00 H new ATOM 0 HE21 GLN A 43 3.033 1.610 -5.309 1.00 0.00 H new ATOM 0 HE22 GLN A 43 1.550 1.577 -4.350 1.00 0.00 H new ATOM 636 N GLU A 44 3.721 6.982 -7.643 1.00 0.00 N ATOM 637 CA GLU A 44 4.196 8.357 -7.559 1.00 0.00 C ATOM 638 C GLU A 44 3.099 9.357 -7.975 1.00 0.00 C ATOM 639 O GLU A 44 3.197 10.534 -7.651 1.00 0.00 O ATOM 640 CB GLU A 44 5.464 8.517 -8.421 1.00 0.00 C ATOM 641 CG GLU A 44 5.227 8.233 -9.917 1.00 0.00 C ATOM 642 CD GLU A 44 6.541 8.354 -10.707 1.00 0.00 C ATOM 643 OE1 GLU A 44 7.246 7.353 -10.835 1.00 0.00 O ATOM 644 OE2 GLU A 44 6.844 9.446 -11.187 1.00 0.00 O ATOM 0 H GLU A 44 4.227 6.418 -8.325 1.00 0.00 H new ATOM 0 HA GLU A 44 4.447 8.581 -6.522 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.846 9.532 -8.307 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.235 7.843 -8.048 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.813 7.232 -10.041 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.492 8.934 -10.314 1.00 0.00 H new ATOM 651 N ASP A 45 2.060 8.881 -8.693 1.00 0.00 N ATOM 652 CA ASP A 45 1.024 9.814 -9.120 1.00 0.00 C ATOM 653 C ASP A 45 -0.053 9.832 -8.044 1.00 0.00 C ATOM 654 O ASP A 45 -0.618 10.881 -7.759 1.00 0.00 O ATOM 655 CB ASP A 45 0.456 9.421 -10.496 1.00 0.00 C ATOM 656 CG ASP A 45 1.582 9.218 -11.526 1.00 0.00 C ATOM 657 OD1 ASP A 45 2.102 10.210 -12.035 1.00 0.00 O ATOM 658 OD2 ASP A 45 1.928 8.069 -11.804 1.00 0.00 O ATOM 0 H ASP A 45 1.927 7.909 -8.972 1.00 0.00 H new ATOM 0 HA ASP A 45 1.439 10.815 -9.240 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.126 8.504 -10.404 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.225 10.197 -10.846 1.00 0.00 H new ATOM 663 N PHE A 46 -0.312 8.640 -7.456 1.00 0.00 N ATOM 664 CA PHE A 46 -1.331 8.578 -6.421 1.00 0.00 C ATOM 665 C PHE A 46 -0.672 8.834 -5.057 1.00 0.00 C ATOM 666 O PHE A 46 -1.309 8.658 -4.027 1.00 0.00 O ATOM 667 CB PHE A 46 -2.206 7.320 -6.539 1.00 0.00 C ATOM 668 CG PHE A 46 -3.288 7.544 -7.566 1.00 0.00 C ATOM 669 CD1 PHE A 46 -2.979 7.587 -8.921 1.00 0.00 C ATOM 670 CD2 PHE A 46 -4.612 7.724 -7.174 1.00 0.00 C ATOM 671 CE1 PHE A 46 -3.970 7.792 -9.869 1.00 0.00 C ATOM 672 CE2 PHE A 46 -5.608 7.933 -8.119 1.00 0.00 C ATOM 673 CZ PHE A 46 -5.287 7.966 -9.469 1.00 0.00 C ATOM 0 H PHE A 46 0.152 7.759 -7.676 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.064 9.374 -6.551 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.593 6.465 -6.824 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -2.652 7.084 -5.573 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -1.955 7.459 -9.239 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -4.867 7.701 -6.125 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -3.717 7.816 -10.919 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.632 8.070 -7.804 1.00 0.00 H new ATOM 0 HZ PHE A 46 -6.060 8.127 -10.206 1.00 0.00 H new ATOM 683 N ILE A 47 0.616 9.265 -5.092 1.00 0.00 N ATOM 684 CA ILE A 47 1.320 9.651 -3.877 1.00 0.00 C ATOM 685 C ILE A 47 0.979 11.146 -3.773 1.00 0.00 C ATOM 686 O ILE A 47 0.801 11.689 -2.689 1.00 0.00 O ATOM 687 CB ILE A 47 2.852 9.310 -3.902 1.00 0.00 C ATOM 688 CG1 ILE A 47 3.308 8.192 -2.934 1.00 0.00 C ATOM 689 CG2 ILE A 47 3.692 10.493 -4.477 1.00 0.00 C ATOM 690 CD1 ILE A 47 2.467 6.898 -2.917 1.00 0.00 C ATOM 0 H ILE A 47 1.168 9.348 -5.946 1.00 0.00 H new ATOM 0 HA ILE A 47 1.013 9.096 -2.991 1.00 0.00 H new ATOM 0 HB ILE A 47 3.243 8.619 -4.648 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.335 7.926 -3.183 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.321 8.602 -1.924 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.748 10.222 -4.479 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.370 10.706 -5.496 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.546 11.378 -3.857 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.892 6.197 -2.198 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.442 7.134 -2.631 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.472 6.447 -3.910 1.00 0.00 H new ATOM 702 N ASN A 48 0.858 11.762 -4.987 1.00 0.00 N ATOM 703 CA ASN A 48 0.473 13.158 -5.067 1.00 0.00 C ATOM 704 C ASN A 48 -1.038 13.206 -4.722 1.00 0.00 C ATOM 705 O ASN A 48 -1.537 14.223 -4.256 1.00 0.00 O ATOM 706 CB ASN A 48 0.784 13.709 -6.471 1.00 0.00 C ATOM 707 CG ASN A 48 0.502 15.217 -6.558 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.486 15.655 -7.135 1.00 0.00 O ATOM 709 ND2 ASN A 48 1.434 15.970 -5.947 1.00 0.00 N ATOM 0 H ASN A 48 1.022 11.308 -5.886 1.00 0.00 H new ATOM 0 HA ASN A 48 1.029 13.787 -4.372 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.829 13.518 -6.715 1.00 0.00 H new ATOM 0 HB3 ASN A 48 0.183 13.182 -7.212 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.346 16.986 -5.942 1.00 0.00 H new ATOM 0 HD22 ASN A 48 2.229 15.525 -5.488 1.00 0.00 H new ATOM 716 N ALA A 49 -1.730 12.056 -4.960 1.00 0.00 N ATOM 717 CA ALA A 49 -3.150 11.957 -4.657 1.00 0.00 C ATOM 718 C ALA A 49 -3.294 11.404 -3.229 1.00 0.00 C ATOM 719 O ALA A 49 -4.410 11.260 -2.760 1.00 0.00 O ATOM 720 CB ALA A 49 -3.905 11.051 -5.641 1.00 0.00 C ATOM 0 H ALA A 49 -1.319 11.210 -5.354 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.590 12.950 -4.747 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.959 11.014 -5.366 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -3.807 11.449 -6.651 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.486 10.046 -5.605 1.00 0.00 H new ATOM 726 N ALA A 50 -2.160 11.078 -2.563 1.00 0.00 N ATOM 727 CA ALA A 50 -2.197 10.574 -1.193 1.00 0.00 C ATOM 728 C ALA A 50 -2.112 11.788 -0.268 1.00 0.00 C ATOM 729 O ALA A 50 -2.281 11.651 0.934 1.00 0.00 O ATOM 730 CB ALA A 50 -1.051 9.588 -0.925 1.00 0.00 C ATOM 0 H ALA A 50 -1.223 11.158 -2.958 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.119 10.020 -1.016 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.109 9.233 0.104 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.133 8.741 -1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.096 10.089 -1.082 1.00 0.00 H new ATOM 736 N ILE A 51 -1.828 12.969 -0.862 1.00 0.00 N ATOM 737 CA ILE A 51 -1.795 14.208 -0.099 1.00 0.00 C ATOM 738 C ILE A 51 -3.263 14.680 -0.102 1.00 0.00 C ATOM 739 O ILE A 51 -3.804 15.130 0.900 1.00 0.00 O ATOM 740 CB ILE A 51 -0.854 15.260 -0.774 1.00 0.00 C ATOM 741 CG1 ILE A 51 0.350 14.705 -1.561 1.00 0.00 C ATOM 742 CG2 ILE A 51 -0.979 16.622 -0.018 1.00 0.00 C ATOM 743 CD1 ILE A 51 1.304 15.748 -2.182 1.00 0.00 C ATOM 0 H ILE A 51 -1.623 13.076 -1.855 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.402 14.074 0.909 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.097 15.652 -1.762 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.929 14.067 -0.894 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -0.029 14.069 -2.361 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.325 17.359 -0.485 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.011 16.971 -0.065 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.689 16.488 1.024 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.109 15.236 -2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.752 16.374 -2.883 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.725 16.371 -1.393 1.00 0.00 H new ATOM 755 N GLU A 52 -3.851 14.512 -1.312 1.00 0.00 N ATOM 756 CA GLU A 52 -5.219 14.854 -1.647 1.00 0.00 C ATOM 757 C GLU A 52 -6.156 14.056 -0.731 1.00 0.00 C ATOM 758 O GLU A 52 -6.954 14.629 0.001 1.00 0.00 O ATOM 759 CB GLU A 52 -5.464 14.531 -3.134 1.00 0.00 C ATOM 760 CG GLU A 52 -6.921 14.710 -3.586 1.00 0.00 C ATOM 761 CD GLU A 52 -7.052 14.435 -5.095 1.00 0.00 C ATOM 762 OE1 GLU A 52 -7.058 13.266 -5.481 1.00 0.00 O ATOM 763 OE2 GLU A 52 -7.145 15.390 -5.866 1.00 0.00 O ATOM 0 H GLU A 52 -3.345 14.115 -2.104 1.00 0.00 H new ATOM 0 HA GLU A 52 -5.411 15.916 -1.497 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.825 15.171 -3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.160 13.502 -3.325 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.567 14.032 -3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.255 15.723 -3.364 1.00 0.00 H new ATOM 770 N THR A 53 -6.016 12.710 -0.816 1.00 0.00 N ATOM 771 CA THR A 53 -6.847 11.812 -0.043 1.00 0.00 C ATOM 772 C THR A 53 -6.511 12.017 1.430 1.00 0.00 C ATOM 773 O THR A 53 -7.364 12.302 2.261 1.00 0.00 O ATOM 774 CB THR A 53 -6.692 10.281 -0.402 1.00 0.00 C ATOM 775 OG1 THR A 53 -6.241 9.816 -1.713 1.00 0.00 O ATOM 776 CG2 THR A 53 -7.982 9.539 0.009 1.00 0.00 C ATOM 0 H THR A 53 -5.334 12.244 -1.414 1.00 0.00 H new ATOM 0 HA THR A 53 -7.882 12.060 -0.280 1.00 0.00 H new ATOM 0 HB THR A 53 -5.799 10.038 0.174 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.745 10.532 -2.161 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.886 8.481 -0.234 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.141 9.652 1.081 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.831 9.960 -0.530 1.00 0.00 H new ATOM 784 N LYS A 54 -5.196 11.827 1.641 1.00 0.00 N ATOM 785 CA LYS A 54 -4.530 11.875 2.934 1.00 0.00 C ATOM 786 C LYS A 54 -4.486 10.396 3.347 1.00 0.00 C ATOM 787 O LYS A 54 -4.827 10.016 4.461 1.00 0.00 O ATOM 788 CB LYS A 54 -5.188 12.813 3.968 1.00 0.00 C ATOM 789 CG LYS A 54 -4.289 13.083 5.181 1.00 0.00 C ATOM 790 CD LYS A 54 -4.719 14.332 5.962 1.00 0.00 C ATOM 791 CE LYS A 54 -3.909 14.529 7.247 1.00 0.00 C ATOM 792 NZ LYS A 54 -2.512 14.858 6.988 1.00 0.00 N ATOM 0 H LYS A 54 -4.551 11.628 0.876 1.00 0.00 H new ATOM 0 HA LYS A 54 -3.539 12.325 2.876 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -5.436 13.759 3.487 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -6.125 12.372 4.307 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -4.309 12.218 5.844 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -3.259 13.204 4.846 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -4.606 15.210 5.327 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -5.777 14.254 6.212 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -4.362 15.325 7.838 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -3.959 13.620 7.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.898 14.180 7.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.328 14.809 5.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.313 15.820 7.330 1.00 0.00 H new ATOM 805 N ALA A 55 -4.041 9.600 2.335 1.00 0.00 N ATOM 806 CA ALA A 55 -3.918 8.159 2.411 1.00 0.00 C ATOM 807 C ALA A 55 -2.934 7.858 3.542 1.00 0.00 C ATOM 808 O ALA A 55 -1.768 8.230 3.513 1.00 0.00 O ATOM 809 CB ALA A 55 -3.469 7.568 1.068 1.00 0.00 C ATOM 0 H ALA A 55 -3.757 9.976 1.430 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.880 7.692 2.623 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.386 6.485 1.157 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -4.202 7.814 0.299 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -2.500 7.985 0.793 1.00 0.00 H new ATOM 815 N ASP A 56 -3.516 7.157 4.536 1.00 0.00 N ATOM 816 CA ASP A 56 -2.813 6.769 5.739 1.00 0.00 C ATOM 817 C ASP A 56 -1.995 5.523 5.384 1.00 0.00 C ATOM 818 O ASP A 56 -0.878 5.348 5.856 1.00 0.00 O ATOM 819 CB ASP A 56 -3.862 6.552 6.846 1.00 0.00 C ATOM 820 CG ASP A 56 -3.249 6.447 8.254 1.00 0.00 C ATOM 821 OD1 ASP A 56 -2.373 7.245 8.588 1.00 0.00 O ATOM 822 OD2 ASP A 56 -3.666 5.575 9.011 1.00 0.00 O ATOM 0 H ASP A 56 -4.489 6.852 4.511 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.119 7.520 6.117 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.575 7.377 6.828 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.422 5.642 6.632 1.00 0.00 H new ATOM 827 N LEU A 57 -2.610 4.684 4.518 1.00 0.00 N ATOM 828 CA LEU A 57 -1.934 3.480 4.076 1.00 0.00 C ATOM 829 C LEU A 57 -2.466 3.199 2.675 1.00 0.00 C ATOM 830 O LEU A 57 -3.536 3.647 2.280 1.00 0.00 O ATOM 831 CB LEU A 57 -2.142 2.301 5.045 1.00 0.00 C ATOM 832 CG LEU A 57 -3.637 1.915 5.244 1.00 0.00 C ATOM 833 CD1 LEU A 57 -4.020 0.740 4.297 1.00 0.00 C ATOM 834 CD2 LEU A 57 -4.363 2.250 6.560 1.00 0.00 C ATOM 0 H LEU A 57 -3.543 4.826 4.132 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.853 3.616 4.059 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.598 1.434 4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.709 2.556 6.012 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.306 2.711 4.917 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.068 0.479 4.446 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.865 1.042 3.261 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.396 -0.125 4.520 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.394 1.902 6.505 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.857 1.757 7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.352 3.329 6.717 1.00 0.00 H new ATOM 846 N ILE A 58 -1.622 2.417 1.965 1.00 0.00 N ATOM 847 CA ILE A 58 -1.910 2.023 0.592 1.00 0.00 C ATOM 848 C ILE A 58 -1.729 0.496 0.571 1.00 0.00 C ATOM 849 O ILE A 58 -0.836 -0.056 1.202 1.00 0.00 O ATOM 850 CB ILE A 58 -1.027 2.842 -0.414 1.00 0.00 C ATOM 851 CG1 ILE A 58 -0.596 4.264 0.137 1.00 0.00 C ATOM 852 CG2 ILE A 58 -0.375 1.900 -1.497 1.00 0.00 C ATOM 853 CD1 ILE A 58 0.140 5.167 -0.874 1.00 0.00 C ATOM 0 H ILE A 58 -0.742 2.054 2.330 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.922 2.254 0.261 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.367 3.456 -1.248 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.488 4.786 0.484 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.047 4.119 1.005 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.231 2.496 -2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.255 1.160 -1.004 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.160 1.392 -2.057 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.391 6.116 -0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 58 1.054 4.674 -1.204 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.504 5.351 -1.734 1.00 0.00 H new ATOM 865 N CYS A 59 -2.645 -0.139 -0.196 1.00 0.00 N ATOM 866 CA CYS A 59 -2.645 -1.585 -0.353 1.00 0.00 C ATOM 867 C CYS A 59 -2.769 -1.828 -1.858 1.00 0.00 C ATOM 868 O CYS A 59 -3.810 -1.601 -2.460 1.00 0.00 O ATOM 869 CB CYS A 59 -3.815 -2.225 0.417 1.00 0.00 C ATOM 870 SG CYS A 59 -3.731 -1.897 2.194 1.00 0.00 S ATOM 0 H CYS A 59 -3.386 0.339 -0.709 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.740 -2.037 0.052 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -4.757 -1.843 0.024 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.812 -3.302 0.248 1.00 0.00 H new ATOM 0 HG CYS A 59 -4.270 -2.886 2.844 1.00 0.00 H new ATOM 876 N VAL A 60 -1.630 -2.305 -2.412 1.00 0.00 N ATOM 877 CA VAL A 60 -1.523 -2.636 -3.830 1.00 0.00 C ATOM 878 C VAL A 60 -1.627 -4.174 -3.838 1.00 0.00 C ATOM 879 O VAL A 60 -0.991 -4.861 -3.045 1.00 0.00 O ATOM 880 CB VAL A 60 -0.138 -2.126 -4.417 1.00 0.00 C ATOM 881 CG1 VAL A 60 0.593 -2.210 -5.822 1.00 0.00 C ATOM 882 CG2 VAL A 60 -0.034 -0.643 -4.001 1.00 0.00 C ATOM 0 H VAL A 60 -0.773 -2.466 -1.884 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.285 -2.167 -4.452 1.00 0.00 H new ATOM 0 HB VAL A 60 0.380 -3.010 -4.045 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.557 -1.704 -5.762 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.748 -3.255 -6.090 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.023 -1.729 -6.582 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.901 -0.225 -4.374 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.873 -0.088 -4.421 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.057 -0.568 -2.914 1.00 0.00 H new ATOM 892 N SER A 61 -2.475 -4.645 -4.773 1.00 0.00 N ATOM 893 CA SER A 61 -2.702 -6.065 -4.908 1.00 0.00 C ATOM 894 C SER A 61 -1.847 -6.441 -6.093 1.00 0.00 C ATOM 895 O SER A 61 -2.069 -5.965 -7.196 1.00 0.00 O ATOM 896 CB SER A 61 -4.218 -6.296 -5.135 1.00 0.00 C ATOM 897 OG SER A 61 -5.169 -5.399 -4.431 1.00 0.00 O ATOM 0 H SER A 61 -2.997 -4.062 -5.427 1.00 0.00 H new ATOM 0 HA SER A 61 -2.439 -6.670 -4.040 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.412 -6.216 -6.205 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.448 -7.321 -4.845 1.00 0.00 H new ATOM 0 HG SER A 61 -5.092 -4.492 -4.794 1.00 0.00 H new ATOM 903 N SER A 62 -0.862 -7.317 -5.813 1.00 0.00 N ATOM 904 CA SER A 62 0.027 -7.635 -6.915 1.00 0.00 C ATOM 905 C SER A 62 0.682 -8.978 -6.623 1.00 0.00 C ATOM 906 O SER A 62 0.490 -9.596 -5.586 1.00 0.00 O ATOM 907 CB SER A 62 1.111 -6.512 -6.950 1.00 0.00 C ATOM 908 OG SER A 62 2.324 -6.643 -7.787 1.00 0.00 O ATOM 0 H SER A 62 -0.680 -7.773 -4.919 1.00 0.00 H new ATOM 0 HA SER A 62 -0.498 -7.693 -7.868 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.609 -5.595 -7.258 1.00 0.00 H new ATOM 0 HB3 SER A 62 1.447 -6.362 -5.924 1.00 0.00 H new ATOM 0 HG SER A 62 3.111 -6.736 -7.210 1.00 0.00 H new ATOM 914 N LEU A 63 1.494 -9.363 -7.637 1.00 0.00 N ATOM 915 CA LEU A 63 2.228 -10.600 -7.648 1.00 0.00 C ATOM 916 C LEU A 63 3.478 -10.373 -8.521 1.00 0.00 C ATOM 917 O LEU A 63 3.822 -11.186 -9.371 1.00 0.00 O ATOM 918 CB LEU A 63 1.329 -11.737 -8.173 1.00 0.00 C ATOM 919 CG LEU A 63 0.831 -11.540 -9.649 1.00 0.00 C ATOM 920 CD1 LEU A 63 1.031 -12.868 -10.440 1.00 0.00 C ATOM 921 CD2 LEU A 63 -0.136 -10.415 -10.100 1.00 0.00 C ATOM 0 H LEU A 63 1.643 -8.796 -8.472 1.00 0.00 H new ATOM 0 HA LEU A 63 2.542 -10.900 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.878 -12.677 -8.110 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.462 -11.830 -7.519 1.00 0.00 H new ATOM 0 HG LEU A 63 1.403 -10.731 -10.104 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.687 -12.736 -11.466 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.088 -13.134 -10.444 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.458 -13.664 -9.965 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.321 -10.502 -11.171 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.078 -10.507 -9.560 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.311 -9.444 -9.887 1.00 0.00 H new ATOM 933 N TYR A 64 4.131 -9.220 -8.250 1.00 0.00 N ATOM 934 CA TYR A 64 5.347 -8.765 -8.918 1.00 0.00 C ATOM 935 C TYR A 64 4.929 -8.206 -10.297 1.00 0.00 C ATOM 936 O TYR A 64 5.677 -8.262 -11.265 1.00 0.00 O ATOM 937 CB TYR A 64 6.441 -9.856 -8.974 1.00 0.00 C ATOM 938 CG TYR A 64 7.861 -9.333 -8.918 1.00 0.00 C ATOM 939 CD1 TYR A 64 8.214 -8.060 -9.363 1.00 0.00 C ATOM 940 CD2 TYR A 64 8.861 -10.148 -8.401 1.00 0.00 C ATOM 941 CE1 TYR A 64 9.525 -7.612 -9.293 1.00 0.00 C ATOM 942 CE2 TYR A 64 10.178 -9.716 -8.323 1.00 0.00 C ATOM 943 CZ TYR A 64 10.525 -8.431 -8.757 1.00 0.00 C ATOM 944 OH TYR A 64 11.840 -7.983 -8.674 1.00 0.00 O ATOM 0 H TYR A 64 3.806 -8.568 -7.536 1.00 0.00 H new ATOM 0 HA TYR A 64 5.827 -7.970 -8.347 1.00 0.00 H new ATOM 0 HB2 TYR A 64 6.290 -10.546 -8.144 1.00 0.00 H new ATOM 0 HB3 TYR A 64 6.316 -10.430 -9.892 1.00 0.00 H new ATOM 0 HD1 TYR A 64 7.453 -7.411 -9.770 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.608 -11.138 -8.053 1.00 0.00 H new ATOM 0 HE1 TYR A 64 9.775 -6.625 -9.654 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.937 -10.373 -7.926 1.00 0.00 H new ATOM 0 HH TYR A 64 12.399 -8.682 -8.275 1.00 0.00 H new ATOM 954 N GLY A 65 3.685 -7.675 -10.316 1.00 0.00 N ATOM 955 CA GLY A 65 3.088 -7.057 -11.492 1.00 0.00 C ATOM 956 C GLY A 65 2.929 -5.541 -11.270 1.00 0.00 C ATOM 957 O GLY A 65 2.480 -4.820 -12.153 1.00 0.00 O ATOM 0 H GLY A 65 3.072 -7.670 -9.500 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.713 -7.241 -12.366 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.116 -7.507 -11.695 1.00 0.00 H new ATOM 961 N GLN A 66 3.324 -5.107 -10.044 1.00 0.00 N ATOM 962 CA GLN A 66 3.260 -3.705 -9.664 1.00 0.00 C ATOM 963 C GLN A 66 4.617 -3.074 -10.007 1.00 0.00 C ATOM 964 O GLN A 66 4.780 -1.866 -9.912 1.00 0.00 O ATOM 965 CB GLN A 66 2.945 -3.537 -8.159 1.00 0.00 C ATOM 966 CG GLN A 66 4.098 -3.936 -7.215 1.00 0.00 C ATOM 967 CD GLN A 66 3.706 -3.825 -5.733 1.00 0.00 C ATOM 968 OE1 GLN A 66 2.826 -4.522 -5.247 1.00 0.00 O ATOM 969 NE2 GLN A 66 4.420 -2.912 -5.049 1.00 0.00 N ATOM 0 H GLN A 66 3.687 -5.722 -9.315 1.00 0.00 H new ATOM 0 HA GLN A 66 2.455 -3.210 -10.207 1.00 0.00 H new ATOM 0 HB2 GLN A 66 2.681 -2.496 -7.970 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.068 -4.137 -7.915 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.404 -4.960 -7.432 1.00 0.00 H new ATOM 0 HG3 GLN A 66 4.960 -3.298 -7.409 1.00 0.00 H new ATOM 0 HE21 GLN A 66 5.140 -2.367 -5.524 1.00 0.00 H new ATOM 0 HE22 GLN A 66 4.242 -2.765 -4.056 1.00 0.00 H new ATOM 978 N GLY A 67 5.580 -3.952 -10.378 1.00 0.00 N ATOM 979 CA GLY A 67 6.928 -3.526 -10.717 1.00 0.00 C ATOM 980 C GLY A 67 7.657 -3.006 -9.473 1.00 0.00 C ATOM 981 O GLY A 67 7.101 -2.932 -8.384 1.00 0.00 O ATOM 0 H GLY A 67 5.431 -4.959 -10.445 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.482 -4.360 -11.148 1.00 0.00 H new ATOM 0 HA3 GLY A 67 6.888 -2.744 -11.476 1.00 0.00 H new ATOM 985 N GLU A 68 8.937 -2.644 -9.703 1.00 0.00 N ATOM 986 CA GLU A 68 9.741 -2.109 -8.612 1.00 0.00 C ATOM 987 C GLU A 68 9.564 -0.569 -8.596 1.00 0.00 C ATOM 988 O GLU A 68 10.430 0.157 -8.123 1.00 0.00 O ATOM 989 CB GLU A 68 11.202 -2.579 -8.725 1.00 0.00 C ATOM 990 CG GLU A 68 11.320 -4.102 -8.534 1.00 0.00 C ATOM 991 CD GLU A 68 12.788 -4.560 -8.552 1.00 0.00 C ATOM 992 OE1 GLU A 68 13.486 -4.339 -7.562 1.00 0.00 O ATOM 993 OE2 GLU A 68 13.217 -5.135 -9.552 1.00 0.00 O ATOM 0 H GLU A 68 9.412 -2.713 -10.603 1.00 0.00 H new ATOM 0 HA GLU A 68 9.404 -2.490 -7.648 1.00 0.00 H new ATOM 0 HB2 GLU A 68 11.600 -2.302 -9.701 1.00 0.00 H new ATOM 0 HB3 GLU A 68 11.808 -2.069 -7.976 1.00 0.00 H new ATOM 0 HG2 GLU A 68 10.860 -4.388 -7.588 1.00 0.00 H new ATOM 0 HG3 GLU A 68 10.769 -4.613 -9.324 1.00 0.00 H new ATOM 1000 N ILE A 69 8.401 -0.121 -9.132 1.00 0.00 N ATOM 1001 CA ILE A 69 8.017 1.281 -9.212 1.00 0.00 C ATOM 1002 C ILE A 69 7.265 1.544 -7.905 1.00 0.00 C ATOM 1003 O ILE A 69 7.583 2.451 -7.148 1.00 0.00 O ATOM 1004 CB ILE A 69 7.132 1.599 -10.471 1.00 0.00 C ATOM 1005 CG1 ILE A 69 6.785 0.345 -11.380 1.00 0.00 C ATOM 1006 CG2 ILE A 69 6.369 2.959 -10.232 1.00 0.00 C ATOM 1007 CD1 ILE A 69 7.994 -0.051 -12.237 1.00 0.00 C ATOM 0 H ILE A 69 7.700 -0.750 -9.524 1.00 0.00 H new ATOM 0 HA ILE A 69 8.886 1.928 -9.330 1.00 0.00 H new ATOM 0 HB ILE A 69 7.489 1.933 -11.445 1.00 0.00 H new ATOM 0 HG12 ILE A 69 6.487 -0.495 -10.752 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.937 0.579 -12.024 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.752 3.188 -11.101 1.00 0.00 H new ATOM 0 HG22 ILE A 69 5.735 2.870 -9.350 1.00 0.00 H new ATOM 0 HG23 ILE A 69 7.092 3.760 -10.080 1.00 0.00 H new ATOM 0 HD11 ILE A 69 7.737 -0.912 -12.853 1.00 0.00 H new ATOM 0 HD12 ILE A 69 8.274 0.784 -12.879 1.00 0.00 H new ATOM 0 HD13 ILE A 69 8.832 -0.306 -11.588 1.00 0.00 H new ATOM 1019 N ASP A 70 6.248 0.677 -7.705 1.00 0.00 N ATOM 1020 CA ASP A 70 5.380 0.746 -6.541 1.00 0.00 C ATOM 1021 C ASP A 70 6.182 0.275 -5.326 1.00 0.00 C ATOM 1022 O ASP A 70 5.901 0.679 -4.202 1.00 0.00 O ATOM 1023 CB ASP A 70 4.120 -0.117 -6.764 1.00 0.00 C ATOM 1024 CG ASP A 70 3.140 0.518 -7.764 1.00 0.00 C ATOM 1025 OD1 ASP A 70 3.571 1.307 -8.603 1.00 0.00 O ATOM 1026 OD2 ASP A 70 1.948 0.223 -7.687 1.00 0.00 O ATOM 0 H ASP A 70 6.019 -0.080 -8.349 1.00 0.00 H new ATOM 0 HA ASP A 70 5.039 1.768 -6.372 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.417 -1.101 -7.127 1.00 0.00 H new ATOM 0 HB3 ASP A 70 3.614 -0.268 -5.811 1.00 0.00 H new ATOM 1031 N CYS A 71 7.198 -0.579 -5.602 1.00 0.00 N ATOM 1032 CA CYS A 71 8.032 -1.092 -4.534 1.00 0.00 C ATOM 1033 C CYS A 71 8.852 0.091 -4.008 1.00 0.00 C ATOM 1034 O CYS A 71 8.744 0.445 -2.844 1.00 0.00 O ATOM 1035 CB CYS A 71 8.935 -2.234 -5.026 1.00 0.00 C ATOM 1036 SG CYS A 71 9.780 -3.105 -3.685 1.00 0.00 S ATOM 0 H CYS A 71 7.441 -0.909 -6.536 1.00 0.00 H new ATOM 0 HA CYS A 71 7.422 -1.519 -3.738 1.00 0.00 H new ATOM 0 HB2 CYS A 71 8.333 -2.946 -5.590 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.679 -1.830 -5.713 1.00 0.00 H new ATOM 0 HG CYS A 71 10.987 -2.640 -3.558 1.00 0.00 H new ATOM 1042 N LYS A 72 9.633 0.705 -4.935 1.00 0.00 N ATOM 1043 CA LYS A 72 10.497 1.825 -4.575 1.00 0.00 C ATOM 1044 C LYS A 72 9.743 3.146 -4.739 1.00 0.00 C ATOM 1045 O LYS A 72 10.337 4.190 -4.973 1.00 0.00 O ATOM 1046 CB LYS A 72 11.785 1.804 -5.421 1.00 0.00 C ATOM 1047 CG LYS A 72 12.582 0.508 -5.248 1.00 0.00 C ATOM 1048 CD LYS A 72 13.930 0.526 -5.980 1.00 0.00 C ATOM 1049 CE LYS A 72 13.786 0.509 -7.506 1.00 0.00 C ATOM 1050 NZ LYS A 72 15.075 0.463 -8.184 1.00 0.00 N ATOM 0 H LYS A 72 9.672 0.438 -5.919 1.00 0.00 H new ATOM 0 HA LYS A 72 10.786 1.729 -3.528 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.527 1.930 -6.472 1.00 0.00 H new ATOM 0 HB3 LYS A 72 12.412 2.651 -5.143 1.00 0.00 H new ATOM 0 HG2 LYS A 72 12.755 0.334 -4.186 1.00 0.00 H new ATOM 0 HG3 LYS A 72 11.987 -0.328 -5.615 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.486 1.415 -5.683 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.518 -0.337 -5.667 1.00 0.00 H new ATOM 0 HE2 LYS A 72 13.191 -0.355 -7.803 1.00 0.00 H new ATOM 0 HE3 LYS A 72 13.241 1.397 -7.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.926 0.453 -9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 15.634 1.300 -7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.586 -0.397 -7.900 1.00 0.00 H new ATOM 1063 N GLY A 73 8.419 3.049 -4.584 1.00 0.00 N ATOM 1064 CA GLY A 73 7.528 4.195 -4.679 1.00 0.00 C ATOM 1065 C GLY A 73 7.109 4.626 -3.273 1.00 0.00 C ATOM 1066 O GLY A 73 6.855 5.792 -3.004 1.00 0.00 O ATOM 0 H GLY A 73 7.940 2.170 -4.389 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.028 5.018 -5.190 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.649 3.939 -5.271 1.00 0.00 H new ATOM 1070 N LEU A 74 7.072 3.588 -2.407 1.00 0.00 N ATOM 1071 CA LEU A 74 6.712 3.735 -1.011 1.00 0.00 C ATOM 1072 C LEU A 74 7.999 4.011 -0.231 1.00 0.00 C ATOM 1073 O LEU A 74 7.980 4.658 0.809 1.00 0.00 O ATOM 1074 CB LEU A 74 6.020 2.447 -0.536 1.00 0.00 C ATOM 1075 CG LEU A 74 4.801 2.054 -1.465 1.00 0.00 C ATOM 1076 CD1 LEU A 74 3.885 0.780 -1.639 1.00 0.00 C ATOM 1077 CD2 LEU A 74 3.836 3.259 -1.410 1.00 0.00 C ATOM 0 H LEU A 74 7.295 2.629 -2.675 1.00 0.00 H new ATOM 0 HA LEU A 74 6.017 4.560 -0.854 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.743 1.631 -0.521 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.668 2.580 0.487 1.00 0.00 H new ATOM 0 HG LEU A 74 5.470 1.713 -2.255 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.151 0.964 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.501 -0.077 -1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.369 0.572 -0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.965 3.056 -2.033 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.516 3.422 -0.381 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.345 4.150 -1.777 1.00 0.00 H new ATOM 1089 N ARG A 75 9.118 3.489 -0.780 1.00 0.00 N ATOM 1090 CA ARG A 75 10.409 3.708 -0.147 1.00 0.00 C ATOM 1091 C ARG A 75 10.784 5.158 -0.484 1.00 0.00 C ATOM 1092 O ARG A 75 11.450 5.831 0.288 1.00 0.00 O ATOM 1093 CB ARG A 75 11.453 2.686 -0.632 1.00 0.00 C ATOM 1094 CG ARG A 75 10.945 1.240 -0.552 1.00 0.00 C ATOM 1095 CD ARG A 75 10.690 0.690 0.869 1.00 0.00 C ATOM 1096 NE ARG A 75 9.415 -0.026 0.977 1.00 0.00 N ATOM 1097 CZ ARG A 75 8.992 -0.972 0.100 1.00 0.00 C ATOM 1098 NH1 ARG A 75 9.784 -1.447 -0.856 1.00 0.00 N ATOM 1099 NH2 ARG A 75 7.758 -1.450 0.195 1.00 0.00 N ATOM 0 H ARG A 75 9.142 2.932 -1.634 1.00 0.00 H new ATOM 0 HA ARG A 75 10.370 3.563 0.933 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.728 2.914 -1.662 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.357 2.783 -0.031 1.00 0.00 H new ATOM 0 HG2 ARG A 75 10.017 1.170 -1.119 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.670 0.593 -1.046 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.503 0.019 1.146 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.700 1.515 1.581 1.00 0.00 H new ATOM 0 HE ARG A 75 8.806 0.202 1.763 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.739 -1.101 -0.946 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.437 -2.158 -1.500 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.133 -1.107 0.924 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.435 -2.161 -0.461 1.00 0.00 H new ATOM 1113 N GLU A 76 10.286 5.600 -1.666 1.00 0.00 N ATOM 1114 CA GLU A 76 10.503 6.953 -2.137 1.00 0.00 C ATOM 1115 C GLU A 76 9.566 7.878 -1.336 1.00 0.00 C ATOM 1116 O GLU A 76 9.892 9.039 -1.147 1.00 0.00 O ATOM 1117 CB GLU A 76 10.220 7.018 -3.649 1.00 0.00 C ATOM 1118 CG GLU A 76 10.299 8.432 -4.247 1.00 0.00 C ATOM 1119 CD GLU A 76 10.024 8.390 -5.760 1.00 0.00 C ATOM 1120 OE1 GLU A 76 8.855 8.390 -6.147 1.00 0.00 O ATOM 1121 OE2 GLU A 76 10.979 8.357 -6.535 1.00 0.00 O ATOM 0 H GLU A 76 9.732 5.022 -2.298 1.00 0.00 H new ATOM 0 HA GLU A 76 11.534 7.272 -1.987 1.00 0.00 H new ATOM 0 HB2 GLU A 76 10.932 6.376 -4.168 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.227 6.611 -3.839 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.574 9.082 -3.757 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.285 8.858 -4.062 1.00 0.00 H new ATOM 1128 N LYS A 77 8.414 7.327 -0.867 1.00 0.00 N ATOM 1129 CA LYS A 77 7.427 8.081 -0.108 1.00 0.00 C ATOM 1130 C LYS A 77 7.959 8.342 1.324 1.00 0.00 C ATOM 1131 O LYS A 77 7.472 9.222 2.023 1.00 0.00 O ATOM 1132 CB LYS A 77 6.120 7.259 -0.063 1.00 0.00 C ATOM 1133 CG LYS A 77 4.903 7.979 0.528 1.00 0.00 C ATOM 1134 CD LYS A 77 3.724 7.019 0.735 1.00 0.00 C ATOM 1135 CE LYS A 77 2.483 7.713 1.301 1.00 0.00 C ATOM 1136 NZ LYS A 77 1.814 8.572 0.334 1.00 0.00 N ATOM 0 H LYS A 77 8.161 6.350 -1.014 1.00 0.00 H new ATOM 0 HA LYS A 77 7.236 9.045 -0.580 1.00 0.00 H new ATOM 0 HB2 LYS A 77 5.875 6.944 -1.077 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.301 6.354 0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.175 8.433 1.481 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.601 8.789 -0.136 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.471 6.552 -0.217 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.027 6.220 1.411 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.781 6.957 1.653 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.771 8.308 2.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.113 9.164 0.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.516 9.181 -0.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.335 7.985 -0.379 1.00 0.00 H new ATOM 1149 N CYS A 78 8.958 7.525 1.726 1.00 0.00 N ATOM 1150 CA CYS A 78 9.558 7.584 3.054 1.00 0.00 C ATOM 1151 C CYS A 78 10.715 8.541 2.996 1.00 0.00 C ATOM 1152 O CYS A 78 10.907 9.429 3.818 1.00 0.00 O ATOM 1153 CB CYS A 78 9.940 6.185 3.554 1.00 0.00 C ATOM 1154 SG CYS A 78 10.782 6.210 5.157 1.00 0.00 S ATOM 0 H CYS A 78 9.364 6.807 1.126 1.00 0.00 H new ATOM 0 HA CYS A 78 8.843 7.956 3.788 1.00 0.00 H new ATOM 0 HB2 CYS A 78 9.040 5.575 3.632 1.00 0.00 H new ATOM 0 HB3 CYS A 78 10.586 5.706 2.818 1.00 0.00 H new ATOM 0 HG CYS A 78 10.591 5.077 5.765 1.00 0.00 H new ATOM 1160 N ASP A 79 11.441 8.270 1.916 1.00 0.00 N ATOM 1161 CA ASP A 79 12.619 8.994 1.519 1.00 0.00 C ATOM 1162 C ASP A 79 12.205 10.356 0.951 1.00 0.00 C ATOM 1163 O ASP A 79 13.039 11.157 0.550 1.00 0.00 O ATOM 1164 CB ASP A 79 13.558 8.180 0.602 1.00 0.00 C ATOM 1165 CG ASP A 79 14.055 6.868 1.251 1.00 0.00 C ATOM 1166 OD1 ASP A 79 14.163 6.802 2.476 1.00 0.00 O ATOM 1167 OD2 ASP A 79 14.333 5.919 0.517 1.00 0.00 O ATOM 0 H ASP A 79 11.207 7.510 1.277 1.00 0.00 H new ATOM 0 HA ASP A 79 13.235 9.175 2.400 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.035 7.944 -0.325 1.00 0.00 H new ATOM 0 HB3 ASP A 79 14.418 8.795 0.336 1.00 0.00 H new ATOM 1172 N GLU A 80 10.879 10.572 0.969 1.00 0.00 N ATOM 1173 CA GLU A 80 10.271 11.810 0.553 1.00 0.00 C ATOM 1174 C GLU A 80 10.349 12.698 1.787 1.00 0.00 C ATOM 1175 O GLU A 80 10.882 13.800 1.774 1.00 0.00 O ATOM 1176 CB GLU A 80 8.808 11.691 0.081 1.00 0.00 C ATOM 1177 CG GLU A 80 8.204 13.050 -0.318 1.00 0.00 C ATOM 1178 CD GLU A 80 8.862 13.609 -1.589 1.00 0.00 C ATOM 1179 OE1 GLU A 80 8.491 13.179 -2.681 1.00 0.00 O ATOM 1180 OE2 GLU A 80 9.736 14.469 -1.475 1.00 0.00 O ATOM 0 H GLU A 80 10.206 9.872 1.280 1.00 0.00 H new ATOM 0 HA GLU A 80 10.795 12.199 -0.320 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.758 11.011 -0.770 1.00 0.00 H new ATOM 0 HB3 GLU A 80 8.208 11.250 0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.132 12.939 -0.481 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.330 13.759 0.500 1.00 0.00 H new ATOM 1187 N ALA A 81 9.749 12.103 2.844 1.00 0.00 N ATOM 1188 CA ALA A 81 9.641 12.711 4.163 1.00 0.00 C ATOM 1189 C ALA A 81 8.790 13.982 3.990 1.00 0.00 C ATOM 1190 O ALA A 81 9.114 15.052 4.491 1.00 0.00 O ATOM 1191 CB ALA A 81 11.023 12.982 4.785 1.00 0.00 C ATOM 0 H ALA A 81 9.326 11.177 2.790 1.00 0.00 H new ATOM 0 HA ALA A 81 9.158 12.037 4.871 1.00 0.00 H new ATOM 0 HB1 ALA A 81 10.897 13.436 5.768 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.567 12.043 4.886 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.585 13.660 4.142 1.00 0.00 H new ATOM 1197 N GLY A 82 7.687 13.774 3.237 1.00 0.00 N ATOM 1198 CA GLY A 82 6.741 14.838 2.929 1.00 0.00 C ATOM 1199 C GLY A 82 5.348 14.244 2.696 1.00 0.00 C ATOM 1200 O GLY A 82 4.343 14.771 3.157 1.00 0.00 O ATOM 0 H GLY A 82 7.441 12.869 2.835 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.708 15.556 3.749 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.067 15.382 2.042 1.00 0.00 H new ATOM 1204 N LEU A 83 5.363 13.108 1.960 1.00 0.00 N ATOM 1205 CA LEU A 83 4.132 12.393 1.657 1.00 0.00 C ATOM 1206 C LEU A 83 3.807 11.613 2.936 1.00 0.00 C ATOM 1207 O LEU A 83 4.606 10.818 3.418 1.00 0.00 O ATOM 1208 CB LEU A 83 4.348 11.431 0.481 1.00 0.00 C ATOM 1209 CG LEU A 83 4.601 12.143 -0.885 1.00 0.00 C ATOM 1210 CD1 LEU A 83 5.487 11.222 -1.775 1.00 0.00 C ATOM 1211 CD2 LEU A 83 3.709 13.272 -1.451 1.00 0.00 C ATOM 0 H LEU A 83 6.208 12.684 1.577 1.00 0.00 H new ATOM 0 HA LEU A 83 3.324 13.065 1.369 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.197 10.785 0.705 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.474 10.787 0.387 1.00 0.00 H new ATOM 0 HG LEU A 83 5.108 13.090 -0.699 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.671 11.709 -2.733 1.00 0.00 H new ATOM 0 HD12 LEU A 83 6.437 11.037 -1.274 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.974 10.275 -1.942 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.101 13.596 -2.415 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.691 12.903 -1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.705 14.114 -0.759 1.00 0.00 H new ATOM 1223 N LYS A 84 2.586 11.896 3.446 1.00 0.00 N ATOM 1224 CA LYS A 84 2.127 11.257 4.669 1.00 0.00 C ATOM 1225 C LYS A 84 1.651 9.856 4.273 1.00 0.00 C ATOM 1226 O LYS A 84 0.943 9.665 3.291 1.00 0.00 O ATOM 1227 CB LYS A 84 1.057 12.111 5.382 1.00 0.00 C ATOM 1228 CG LYS A 84 -0.337 12.139 4.723 1.00 0.00 C ATOM 1229 CD LYS A 84 -1.285 11.022 5.193 1.00 0.00 C ATOM 1230 CE LYS A 84 -1.712 11.151 6.660 1.00 0.00 C ATOM 1231 NZ LYS A 84 -2.685 10.136 7.037 1.00 0.00 N ATOM 0 H LYS A 84 1.924 12.551 3.029 1.00 0.00 H new ATOM 0 HA LYS A 84 2.924 11.167 5.407 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.947 11.742 6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.425 13.135 5.451 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.802 13.103 4.927 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.216 12.065 3.642 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.175 11.024 4.564 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.796 10.059 5.050 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.835 11.068 7.301 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.137 12.141 6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.182 10.435 7.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.373 10.012 6.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.196 9.235 7.214 1.00 0.00 H new ATOM 1244 N GLY A 85 2.109 8.905 5.113 1.00 0.00 N ATOM 1245 CA GLY A 85 1.807 7.492 4.946 1.00 0.00 C ATOM 1246 C GLY A 85 3.126 6.719 4.857 1.00 0.00 C ATOM 1247 O GLY A 85 3.929 6.923 3.955 1.00 0.00 O ATOM 0 H GLY A 85 2.697 9.108 5.921 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.212 7.130 5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.215 7.335 4.044 1.00 0.00 H new ATOM 1251 N ILE A 86 3.292 5.831 5.858 1.00 0.00 N ATOM 1252 CA ILE A 86 4.485 5.001 5.940 1.00 0.00 C ATOM 1253 C ILE A 86 4.017 3.643 6.466 1.00 0.00 C ATOM 1254 O ILE A 86 4.659 3.010 7.295 1.00 0.00 O ATOM 1255 CB ILE A 86 5.573 5.643 6.855 1.00 0.00 C ATOM 1256 CG1 ILE A 86 7.040 5.280 6.519 1.00 0.00 C ATOM 1257 CG2 ILE A 86 4.932 6.193 8.171 1.00 0.00 C ATOM 1258 CD1 ILE A 86 8.113 5.812 7.493 1.00 0.00 C ATOM 0 H ILE A 86 2.617 5.680 6.607 1.00 0.00 H new ATOM 0 HA ILE A 86 4.962 4.896 4.966 1.00 0.00 H new ATOM 0 HB ILE A 86 6.090 6.595 6.732 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.123 4.194 6.477 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.266 5.656 5.521 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.707 6.637 8.796 1.00 0.00 H new ATOM 0 HG22 ILE A 86 4.187 6.950 7.924 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.454 5.376 8.712 1.00 0.00 H new ATOM 0 HD11 ILE A 86 9.100 5.495 7.156 1.00 0.00 H new ATOM 0 HD12 ILE A 86 8.071 6.901 7.521 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.926 5.416 8.491 1.00 0.00 H new ATOM 1270 N LYS A 87 2.847 3.252 5.920 1.00 0.00 N ATOM 1271 CA LYS A 87 2.198 1.998 6.245 1.00 0.00 C ATOM 1272 C LYS A 87 1.663 1.542 4.894 1.00 0.00 C ATOM 1273 O LYS A 87 0.841 2.207 4.278 1.00 0.00 O ATOM 1274 CB LYS A 87 1.051 2.212 7.240 1.00 0.00 C ATOM 1275 CG LYS A 87 1.523 2.713 8.615 1.00 0.00 C ATOM 1276 CD LYS A 87 0.373 3.060 9.575 1.00 0.00 C ATOM 1277 CE LYS A 87 -0.508 4.221 9.094 1.00 0.00 C ATOM 1278 NZ LYS A 87 0.246 5.440 8.823 1.00 0.00 N ATOM 0 H LYS A 87 2.335 3.813 5.238 1.00 0.00 H new ATOM 0 HA LYS A 87 2.864 1.276 6.718 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.346 2.930 6.822 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.511 1.274 7.369 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.150 1.949 9.075 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.147 3.596 8.476 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -0.250 2.177 9.714 1.00 0.00 H new ATOM 0 HD3 LYS A 87 0.790 3.313 10.550 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -1.035 3.918 8.189 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -1.266 4.430 9.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.413 6.232 8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 0.872 5.647 9.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.818 5.311 7.964 1.00 0.00 H new ATOM 1291 N LEU A 88 2.190 0.386 4.460 1.00 0.00 N ATOM 1292 CA LEU A 88 1.777 -0.134 3.169 1.00 0.00 C ATOM 1293 C LEU A 88 1.645 -1.629 3.359 1.00 0.00 C ATOM 1294 O LEU A 88 2.632 -2.339 3.487 1.00 0.00 O ATOM 1295 CB LEU A 88 2.819 0.190 2.087 1.00 0.00 C ATOM 1296 CG LEU A 88 3.223 1.688 2.078 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.123 2.542 1.387 1.00 0.00 C ATOM 1298 CD2 LEU A 88 4.490 2.211 2.819 1.00 0.00 C ATOM 0 H LEU A 88 2.873 -0.178 4.966 1.00 0.00 H new ATOM 0 HA LEU A 88 0.841 0.314 2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.707 -0.421 2.248 1.00 0.00 H new ATOM 0 HB3 LEU A 88 2.419 -0.081 1.110 1.00 0.00 H new ATOM 0 HG LEU A 88 4.169 2.180 1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 88 2.422 3.590 1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.992 2.204 0.359 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.183 2.431 1.928 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.576 3.288 2.677 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.406 1.991 3.883 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.376 1.720 2.416 1.00 0.00 H new ATOM 1310 N PHE A 89 0.368 -2.067 3.360 1.00 0.00 N ATOM 1311 CA PHE A 89 0.104 -3.486 3.520 1.00 0.00 C ATOM 1312 C PHE A 89 -0.155 -3.927 2.077 1.00 0.00 C ATOM 1313 O PHE A 89 -1.276 -3.989 1.584 1.00 0.00 O ATOM 1314 CB PHE A 89 -1.045 -3.702 4.527 1.00 0.00 C ATOM 1315 CG PHE A 89 -1.117 -5.068 5.180 1.00 0.00 C ATOM 1316 CD1 PHE A 89 -0.129 -6.041 5.036 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -2.228 -5.379 5.956 1.00 0.00 C ATOM 1318 CE1 PHE A 89 -0.261 -7.288 5.633 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -2.364 -6.627 6.551 1.00 0.00 C ATOM 1320 CZ PHE A 89 -1.381 -7.586 6.388 1.00 0.00 C ATOM 0 H PHE A 89 -0.456 -1.475 3.255 1.00 0.00 H new ATOM 0 HA PHE A 89 0.903 -4.085 3.957 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.957 -2.951 5.312 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.989 -3.518 4.014 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.752 -5.822 4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.999 -4.637 6.099 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.515 -8.029 5.507 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.240 -6.849 7.143 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.487 -8.558 6.846 1.00 0.00 H new ATOM 1330 N VAL A 90 0.994 -4.247 1.448 1.00 0.00 N ATOM 1331 CA VAL A 90 0.993 -4.622 0.049 1.00 0.00 C ATOM 1332 C VAL A 90 0.795 -6.130 -0.078 1.00 0.00 C ATOM 1333 O VAL A 90 1.691 -6.963 0.008 1.00 0.00 O ATOM 1334 CB VAL A 90 2.330 -4.165 -0.622 1.00 0.00 C ATOM 1335 CG1 VAL A 90 2.176 -4.277 -2.172 1.00 0.00 C ATOM 1336 CG2 VAL A 90 3.345 -3.199 0.043 1.00 0.00 C ATOM 0 H VAL A 90 1.913 -4.249 1.891 1.00 0.00 H new ATOM 0 HA VAL A 90 0.170 -4.126 -0.466 1.00 0.00 H new ATOM 0 HB VAL A 90 3.110 -4.840 -0.270 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.102 -3.961 -2.653 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.961 -5.311 -2.442 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.358 -3.637 -2.504 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.190 -3.040 -0.628 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.859 -2.245 0.247 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.701 -3.632 0.978 1.00 0.00 H new ATOM 1346 N GLY A 91 -0.502 -6.389 -0.290 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.961 -7.753 -0.496 1.00 0.00 C ATOM 1348 C GLY A 91 -0.307 -8.394 -1.721 1.00 0.00 C ATOM 1349 O GLY A 91 -0.286 -7.842 -2.814 1.00 0.00 O ATOM 0 H GLY A 91 -1.235 -5.680 -0.322 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.738 -8.349 0.389 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.044 -7.757 -0.618 1.00 0.00 H new ATOM 1353 N GLY A 92 0.240 -9.594 -1.421 1.00 0.00 N ATOM 1354 CA GLY A 92 0.958 -10.385 -2.401 1.00 0.00 C ATOM 1355 C GLY A 92 2.384 -9.833 -2.478 1.00 0.00 C ATOM 1356 O GLY A 92 3.299 -10.339 -1.840 1.00 0.00 O ATOM 0 H GLY A 92 0.188 -10.023 -0.497 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.968 -11.436 -2.113 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.470 -10.326 -3.374 1.00 0.00 H new ATOM 1360 N ASN A 93 2.480 -8.754 -3.296 1.00 0.00 N ATOM 1361 CA ASN A 93 3.698 -7.993 -3.539 1.00 0.00 C ATOM 1362 C ASN A 93 4.615 -8.882 -4.386 1.00 0.00 C ATOM 1363 O ASN A 93 4.603 -8.814 -5.605 1.00 0.00 O ATOM 1364 CB ASN A 93 4.318 -7.455 -2.224 1.00 0.00 C ATOM 1365 CG ASN A 93 5.599 -6.639 -2.462 1.00 0.00 C ATOM 1366 OD1 ASN A 93 6.684 -7.012 -2.034 1.00 0.00 O ATOM 1367 ND2 ASN A 93 5.399 -5.513 -3.168 1.00 0.00 N ATOM 0 H ASN A 93 1.679 -8.392 -3.813 1.00 0.00 H new ATOM 0 HA ASN A 93 3.502 -7.079 -4.099 1.00 0.00 H new ATOM 0 HB2 ASN A 93 3.586 -6.832 -1.710 1.00 0.00 H new ATOM 0 HB3 ASN A 93 4.543 -8.293 -1.564 1.00 0.00 H new ATOM 0 HD21 ASN A 93 6.185 -4.899 -3.382 1.00 0.00 H new ATOM 0 HD22 ASN A 93 4.461 -5.272 -3.489 1.00 0.00 H new ATOM 1374 N ILE A 94 5.418 -9.695 -3.670 1.00 0.00 N ATOM 1375 CA ILE A 94 6.356 -10.612 -4.292 1.00 0.00 C ATOM 1376 C ILE A 94 6.169 -11.920 -3.510 1.00 0.00 C ATOM 1377 O ILE A 94 5.817 -11.926 -2.337 1.00 0.00 O ATOM 1378 CB ILE A 94 7.788 -9.973 -4.284 1.00 0.00 C ATOM 1379 CG1 ILE A 94 7.901 -8.585 -4.968 1.00 0.00 C ATOM 1380 CG2 ILE A 94 8.903 -11.029 -3.987 1.00 0.00 C ATOM 1381 CD1 ILE A 94 9.331 -8.033 -5.120 1.00 0.00 C ATOM 0 H ILE A 94 5.424 -9.724 -2.650 1.00 0.00 H new ATOM 0 HA ILE A 94 6.193 -10.822 -5.349 1.00 0.00 H new ATOM 0 HB ILE A 94 8.194 -9.374 -3.469 1.00 0.00 H new ATOM 0 HG12 ILE A 94 7.448 -8.650 -5.958 1.00 0.00 H new ATOM 0 HG13 ILE A 94 7.313 -7.868 -4.395 1.00 0.00 H new ATOM 0 HG21 ILE A 94 9.877 -10.540 -3.992 1.00 0.00 H new ATOM 0 HG22 ILE A 94 8.727 -11.479 -3.010 1.00 0.00 H new ATOM 0 HG23 ILE A 94 8.883 -11.805 -4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.295 -7.060 -5.610 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.787 -7.927 -4.136 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.924 -8.721 -5.723 1.00 0.00 H new ATOM 1393 N VAL A 95 6.409 -13.017 -4.259 1.00 0.00 N ATOM 1394 CA VAL A 95 6.283 -14.370 -3.741 1.00 0.00 C ATOM 1395 C VAL A 95 7.617 -14.782 -3.097 1.00 0.00 C ATOM 1396 O VAL A 95 8.561 -14.008 -2.996 1.00 0.00 O ATOM 1397 CB VAL A 95 5.888 -15.295 -4.940 1.00 0.00 C ATOM 1398 CG1 VAL A 95 4.369 -15.629 -4.857 1.00 0.00 C ATOM 1399 CG2 VAL A 95 6.747 -15.374 -6.226 1.00 0.00 C ATOM 0 H VAL A 95 6.695 -12.976 -5.237 1.00 0.00 H new ATOM 0 HA VAL A 95 5.515 -14.448 -2.971 1.00 0.00 H new ATOM 0 HB VAL A 95 6.388 -16.263 -4.907 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.092 -16.273 -5.691 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.160 -16.141 -3.918 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.791 -14.706 -4.903 1.00 0.00 H new ATOM 0 HG21 VAL A 95 6.291 -16.074 -6.926 1.00 0.00 H new ATOM 0 HG22 VAL A 95 6.805 -14.388 -6.686 1.00 0.00 H new ATOM 0 HG23 VAL A 95 7.751 -15.716 -5.973 1.00 0.00 H new ATOM 1409 N VAL A 96 7.600 -16.068 -2.673 1.00 0.00 N ATOM 1410 CA VAL A 96 8.690 -16.781 -2.020 1.00 0.00 C ATOM 1411 C VAL A 96 9.354 -15.953 -0.904 1.00 0.00 C ATOM 1412 O VAL A 96 10.365 -15.287 -1.090 1.00 0.00 O ATOM 1413 CB VAL A 96 9.685 -17.402 -3.057 1.00 0.00 C ATOM 1414 CG1 VAL A 96 10.317 -16.329 -3.999 1.00 0.00 C ATOM 1415 CG2 VAL A 96 10.217 -18.868 -3.034 1.00 0.00 C ATOM 0 H VAL A 96 6.774 -16.655 -2.790 1.00 0.00 H new ATOM 0 HA VAL A 96 8.259 -17.635 -1.497 1.00 0.00 H new ATOM 0 HB VAL A 96 9.071 -18.203 -3.468 1.00 0.00 H new ATOM 0 HG11 VAL A 96 10.999 -16.814 -4.698 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.528 -15.822 -4.555 1.00 0.00 H new ATOM 0 HG13 VAL A 96 10.867 -15.600 -3.403 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.893 -19.023 -3.875 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.751 -19.047 -2.101 1.00 0.00 H new ATOM 0 HG23 VAL A 96 9.379 -19.561 -3.110 1.00 0.00 H new ATOM 1425 N GLY A 97 8.702 -16.066 0.273 1.00 0.00 N ATOM 1426 CA GLY A 97 9.168 -15.374 1.465 1.00 0.00 C ATOM 1427 C GLY A 97 7.998 -15.065 2.400 1.00 0.00 C ATOM 1428 O GLY A 97 6.846 -15.398 2.148 1.00 0.00 O ATOM 0 H GLY A 97 7.861 -16.627 0.410 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.903 -15.988 1.985 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.669 -14.448 1.182 1.00 0.00 H new ATOM 1432 N LYS A 98 8.404 -14.394 3.494 1.00 0.00 N ATOM 1433 CA LYS A 98 7.487 -13.971 4.545 1.00 0.00 C ATOM 1434 C LYS A 98 8.222 -12.840 5.276 1.00 0.00 C ATOM 1435 O LYS A 98 7.665 -11.792 5.581 1.00 0.00 O ATOM 1436 CB LYS A 98 7.136 -15.148 5.474 1.00 0.00 C ATOM 1437 CG LYS A 98 6.104 -14.774 6.546 1.00 0.00 C ATOM 1438 CD LYS A 98 5.685 -15.979 7.398 1.00 0.00 C ATOM 1439 CE LYS A 98 4.646 -15.620 8.466 1.00 0.00 C ATOM 1440 NZ LYS A 98 3.360 -15.231 7.898 1.00 0.00 N ATOM 0 H LYS A 98 9.376 -14.135 3.665 1.00 0.00 H new ATOM 0 HA LYS A 98 6.530 -13.626 4.155 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.749 -15.973 4.876 1.00 0.00 H new ATOM 0 HB3 LYS A 98 8.044 -15.505 5.960 1.00 0.00 H new ATOM 0 HG2 LYS A 98 6.520 -14.002 7.193 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.223 -14.348 6.066 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.278 -16.754 6.748 1.00 0.00 H new ATOM 0 HD3 LYS A 98 6.566 -16.400 7.882 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.502 -16.474 9.127 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.029 -14.804 9.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.678 -15.065 8.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.475 -14.359 7.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.009 -15.991 7.281 1.00 0.00 H new ATOM 1453 N GLN A 99 9.513 -13.144 5.517 1.00 0.00 N ATOM 1454 CA GLN A 99 10.462 -12.260 6.169 1.00 0.00 C ATOM 1455 C GLN A 99 11.745 -12.378 5.327 1.00 0.00 C ATOM 1456 O GLN A 99 12.460 -11.407 5.110 1.00 0.00 O ATOM 1457 CB GLN A 99 10.640 -12.696 7.637 1.00 0.00 C ATOM 1458 CG GLN A 99 11.550 -11.783 8.480 1.00 0.00 C ATOM 1459 CD GLN A 99 13.041 -11.939 8.138 1.00 0.00 C ATOM 1460 OE1 GLN A 99 13.699 -11.009 7.690 1.00 0.00 O ATOM 1461 NE2 GLN A 99 13.523 -13.171 8.384 1.00 0.00 N ATOM 0 H GLN A 99 9.922 -14.040 5.251 1.00 0.00 H new ATOM 0 HA GLN A 99 10.144 -11.218 6.216 1.00 0.00 H new ATOM 0 HB2 GLN A 99 9.658 -12.741 8.109 1.00 0.00 H new ATOM 0 HB3 GLN A 99 11.048 -13.706 7.653 1.00 0.00 H new ATOM 0 HG2 GLN A 99 11.255 -10.745 8.328 1.00 0.00 H new ATOM 0 HG3 GLN A 99 11.400 -12.006 9.536 1.00 0.00 H new ATOM 0 HE21 GLN A 99 12.908 -13.894 8.759 1.00 0.00 H new ATOM 0 HE22 GLN A 99 14.503 -13.382 8.196 1.00 0.00 H new ATOM 1470 N ASN A 100 11.978 -13.627 4.861 1.00 0.00 N ATOM 1471 CA ASN A 100 13.126 -13.964 4.040 1.00 0.00 C ATOM 1472 C ASN A 100 12.699 -13.682 2.591 1.00 0.00 C ATOM 1473 O ASN A 100 12.177 -14.534 1.884 1.00 0.00 O ATOM 1474 CB ASN A 100 13.554 -15.429 4.290 1.00 0.00 C ATOM 1475 CG ASN A 100 12.407 -16.448 4.114 1.00 0.00 C ATOM 1476 OD1 ASN A 100 11.473 -16.513 4.905 1.00 0.00 O ATOM 1477 ND2 ASN A 100 12.549 -17.239 3.035 1.00 0.00 N ATOM 0 H ASN A 100 11.364 -14.419 5.053 1.00 0.00 H new ATOM 0 HA ASN A 100 14.009 -13.372 4.280 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.363 -15.684 3.606 1.00 0.00 H new ATOM 0 HB3 ASN A 100 13.953 -15.515 5.301 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.850 -17.953 2.831 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.356 -17.125 2.421 1.00 0.00 H new ATOM 1484 N TRP A 101 12.970 -12.416 2.208 1.00 0.00 N ATOM 1485 CA TRP A 101 12.649 -11.928 0.877 1.00 0.00 C ATOM 1486 C TRP A 101 13.981 -11.940 0.117 1.00 0.00 C ATOM 1487 O TRP A 101 15.033 -12.122 0.721 1.00 0.00 O ATOM 1488 CB TRP A 101 12.072 -10.505 0.990 1.00 0.00 C ATOM 1489 CG TRP A 101 10.758 -10.550 1.736 1.00 0.00 C ATOM 1490 CD1 TRP A 101 10.508 -10.016 3.002 1.00 0.00 C ATOM 1491 CD2 TRP A 101 9.527 -11.156 1.295 1.00 0.00 C ATOM 1492 NE1 TRP A 101 9.223 -10.264 3.345 1.00 0.00 N ATOM 1493 CE2 TRP A 101 8.584 -10.961 2.328 1.00 0.00 C ATOM 1494 CE3 TRP A 101 9.168 -11.823 0.154 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 7.311 -11.440 2.187 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 7.872 -12.312 0.010 1.00 0.00 C ATOM 1497 CH2 TRP A 101 6.939 -12.120 1.028 1.00 0.00 C ATOM 0 H TRP A 101 13.411 -11.723 2.813 1.00 0.00 H new ATOM 0 HA TRP A 101 11.903 -12.534 0.362 1.00 0.00 H new ATOM 0 HB2 TRP A 101 12.776 -9.856 1.511 1.00 0.00 H new ATOM 0 HB3 TRP A 101 11.924 -10.082 -0.003 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.227 -9.488 3.611 1.00 0.00 H new ATOM 0 HE1 TRP A 101 8.787 -9.980 4.223 1.00 0.00 H new ATOM 0 HE3 TRP A 101 9.891 -11.970 -0.635 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.590 -11.291 2.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 7.590 -12.839 -0.889 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.933 -12.496 0.919 1.00 0.00 H new ATOM 1508 N PRO A 102 13.921 -11.738 -1.238 1.00 0.00 N ATOM 1509 CA PRO A 102 15.129 -11.720 -2.060 1.00 0.00 C ATOM 1510 C PRO A 102 15.933 -10.446 -1.705 1.00 0.00 C ATOM 1511 O PRO A 102 15.833 -9.897 -0.614 1.00 0.00 O ATOM 1512 CB PRO A 102 14.612 -11.753 -3.522 1.00 0.00 C ATOM 1513 CG PRO A 102 13.127 -12.105 -3.434 1.00 0.00 C ATOM 1514 CD PRO A 102 12.690 -11.686 -2.032 1.00 0.00 C ATOM 0 HA PRO A 102 15.808 -12.557 -1.900 1.00 0.00 H new ATOM 0 HB2 PRO A 102 14.757 -10.789 -4.009 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.154 -12.492 -4.111 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.553 -11.579 -4.197 1.00 0.00 H new ATOM 0 HG3 PRO A 102 12.966 -13.171 -3.593 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.259 -10.685 -2.032 1.00 0.00 H new ATOM 0 HD3 PRO A 102 11.931 -12.360 -1.634 1.00 0.00 H new ATOM 1522 N ASP A 103 16.699 -9.982 -2.717 1.00 0.00 N ATOM 1523 CA ASP A 103 17.550 -8.811 -2.566 1.00 0.00 C ATOM 1524 C ASP A 103 16.655 -7.566 -2.492 1.00 0.00 C ATOM 1525 O ASP A 103 17.047 -6.548 -1.933 1.00 0.00 O ATOM 1526 CB ASP A 103 18.572 -8.733 -3.721 1.00 0.00 C ATOM 1527 CG ASP A 103 17.899 -8.671 -5.109 1.00 0.00 C ATOM 1528 OD1 ASP A 103 17.648 -9.726 -5.692 1.00 0.00 O ATOM 1529 OD2 ASP A 103 17.636 -7.569 -5.590 1.00 0.00 O ATOM 0 H ASP A 103 16.736 -10.410 -3.642 1.00 0.00 H new ATOM 0 HA ASP A 103 18.130 -8.876 -1.645 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.200 -7.852 -3.586 1.00 0.00 H new ATOM 0 HB3 ASP A 103 19.229 -9.602 -3.679 1.00 0.00 H new ATOM 1534 N VAL A 104 15.438 -7.710 -3.071 1.00 0.00 N ATOM 1535 CA VAL A 104 14.474 -6.623 -3.093 1.00 0.00 C ATOM 1536 C VAL A 104 14.159 -6.124 -1.684 1.00 0.00 C ATOM 1537 O VAL A 104 14.615 -5.052 -1.308 1.00 0.00 O ATOM 1538 CB VAL A 104 13.168 -6.951 -3.890 1.00 0.00 C ATOM 1539 CG1 VAL A 104 12.626 -8.386 -3.581 1.00 0.00 C ATOM 1540 CG2 VAL A 104 12.287 -5.810 -4.458 1.00 0.00 C ATOM 0 H VAL A 104 15.118 -8.568 -3.521 1.00 0.00 H new ATOM 0 HA VAL A 104 14.957 -5.815 -3.641 1.00 0.00 H new ATOM 0 HB VAL A 104 13.418 -7.041 -4.947 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.719 -8.565 -4.159 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.380 -9.126 -3.851 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.401 -8.469 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 104 11.429 -6.237 -4.977 1.00 0.00 H new ATOM 0 HG22 VAL A 104 11.939 -5.178 -3.641 1.00 0.00 H new ATOM 0 HG23 VAL A 104 12.872 -5.212 -5.156 1.00 0.00 H new ATOM 1550 N GLU A 105 13.399 -6.939 -0.910 1.00 0.00 N ATOM 1551 CA GLU A 105 13.047 -6.474 0.421 1.00 0.00 C ATOM 1552 C GLU A 105 14.123 -6.896 1.419 1.00 0.00 C ATOM 1553 O GLU A 105 13.824 -7.043 2.592 1.00 0.00 O ATOM 1554 CB GLU A 105 11.624 -6.849 0.874 1.00 0.00 C ATOM 1555 CG GLU A 105 10.550 -6.531 -0.179 1.00 0.00 C ATOM 1556 CD GLU A 105 9.154 -6.949 0.319 1.00 0.00 C ATOM 1557 OE1 GLU A 105 8.490 -6.138 0.965 1.00 0.00 O ATOM 1558 OE2 GLU A 105 8.745 -8.079 0.052 1.00 0.00 O ATOM 0 H GLU A 105 13.046 -7.859 -1.175 1.00 0.00 H new ATOM 0 HA GLU A 105 13.018 -5.385 0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 105 11.592 -7.914 1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 105 11.390 -6.315 1.795 1.00 0.00 H new ATOM 0 HG2 GLU A 105 10.557 -5.464 -0.401 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.780 -7.052 -1.108 1.00 0.00 H new ATOM 1565 N GLN A 106 15.377 -7.089 0.943 1.00 0.00 N ATOM 1566 CA GLN A 106 16.457 -7.376 1.883 1.00 0.00 C ATOM 1567 C GLN A 106 16.760 -5.994 2.500 1.00 0.00 C ATOM 1568 O GLN A 106 16.880 -5.816 3.707 1.00 0.00 O ATOM 1569 CB GLN A 106 17.693 -7.934 1.154 1.00 0.00 C ATOM 1570 CG GLN A 106 18.903 -8.148 2.075 1.00 0.00 C ATOM 1571 CD GLN A 106 20.087 -8.723 1.287 1.00 0.00 C ATOM 1572 OE1 GLN A 106 21.037 -8.027 0.952 1.00 0.00 O ATOM 1573 NE2 GLN A 106 19.962 -10.036 1.018 1.00 0.00 N ATOM 0 H GLN A 106 15.646 -7.052 -0.040 1.00 0.00 H new ATOM 0 HA GLN A 106 16.189 -8.129 2.624 1.00 0.00 H new ATOM 0 HB2 GLN A 106 17.431 -8.883 0.685 1.00 0.00 H new ATOM 0 HB3 GLN A 106 17.973 -7.249 0.353 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.190 -7.202 2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 106 18.635 -8.826 2.885 1.00 0.00 H new ATOM 0 HE21 GLN A 106 19.136 -10.545 1.334 1.00 0.00 H new ATOM 0 HE22 GLN A 106 20.693 -10.522 0.498 1.00 0.00 H new ATOM 1582 N ARG A 107 16.837 -5.034 1.550 1.00 0.00 N ATOM 1583 CA ARG A 107 17.096 -3.642 1.855 1.00 0.00 C ATOM 1584 C ARG A 107 15.767 -3.014 2.320 1.00 0.00 C ATOM 1585 O ARG A 107 15.789 -2.085 3.118 1.00 0.00 O ATOM 1586 CB ARG A 107 17.712 -2.923 0.636 1.00 0.00 C ATOM 1587 CG ARG A 107 16.950 -3.160 -0.679 1.00 0.00 C ATOM 1588 CD ARG A 107 17.527 -2.399 -1.877 1.00 0.00 C ATOM 1589 NE ARG A 107 17.422 -0.960 -1.666 1.00 0.00 N ATOM 1590 CZ ARG A 107 17.546 -0.066 -2.673 1.00 0.00 C ATOM 1591 NH1 ARG A 107 17.789 -0.458 -3.922 1.00 0.00 N ATOM 1592 NH2 ARG A 107 17.420 1.231 -2.410 1.00 0.00 N ATOM 0 H ARG A 107 16.719 -5.222 0.554 1.00 0.00 H new ATOM 0 HA ARG A 107 17.830 -3.541 2.654 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.745 -1.852 0.837 1.00 0.00 H new ATOM 0 HB3 ARG A 107 18.742 -3.256 0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 107 16.954 -4.227 -0.903 1.00 0.00 H new ATOM 0 HG3 ARG A 107 15.909 -2.867 -0.542 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.571 -2.676 -2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 107 16.993 -2.679 -2.785 1.00 0.00 H new ATOM 0 HE ARG A 107 17.248 -0.614 -0.722 1.00 0.00 H new ATOM 0 HH11 ARG A 107 17.885 -1.451 -4.135 1.00 0.00 H new ATOM 0 HH12 ARG A 107 17.879 0.234 -4.666 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.232 1.542 -1.457 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.511 1.915 -3.161 1.00 0.00 H new ATOM 1606 N PHE A 108 14.618 -3.550 1.817 1.00 0.00 N ATOM 1607 CA PHE A 108 13.331 -2.988 2.231 1.00 0.00 C ATOM 1608 C PHE A 108 12.810 -3.777 3.443 1.00 0.00 C ATOM 1609 O PHE A 108 11.638 -3.663 3.775 1.00 0.00 O ATOM 1610 CB PHE A 108 12.282 -2.886 1.101 1.00 0.00 C ATOM 1611 CG PHE A 108 12.858 -2.348 -0.184 1.00 0.00 C ATOM 1612 CD1 PHE A 108 13.657 -1.208 -0.187 1.00 0.00 C ATOM 1613 CD2 PHE A 108 12.603 -2.991 -1.392 1.00 0.00 C ATOM 1614 CE1 PHE A 108 14.204 -0.731 -1.369 1.00 0.00 C ATOM 1615 CE2 PHE A 108 13.153 -2.520 -2.576 1.00 0.00 C ATOM 1616 CZ PHE A 108 13.960 -1.393 -2.562 1.00 0.00 C ATOM 0 H PHE A 108 14.569 -4.329 1.160 1.00 0.00 H new ATOM 0 HA PHE A 108 13.504 -1.949 2.513 1.00 0.00 H new ATOM 0 HB2 PHE A 108 11.855 -3.872 0.918 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.466 -2.241 1.426 1.00 0.00 H new ATOM 0 HD1 PHE A 108 13.853 -0.690 0.740 1.00 0.00 H new ATOM 0 HD2 PHE A 108 11.970 -3.866 -1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 108 14.820 0.156 -1.360 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.953 -3.031 -3.506 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.398 -1.031 -3.480 1.00 0.00 H new ATOM 1626 N LYS A 109 13.688 -4.610 4.058 1.00 0.00 N ATOM 1627 CA LYS A 109 13.326 -5.321 5.285 1.00 0.00 C ATOM 1628 C LYS A 109 13.761 -4.355 6.395 1.00 0.00 C ATOM 1629 O LYS A 109 13.103 -4.209 7.418 1.00 0.00 O ATOM 1630 CB LYS A 109 14.006 -6.699 5.450 1.00 0.00 C ATOM 1631 CG LYS A 109 13.050 -7.884 5.209 1.00 0.00 C ATOM 1632 CD LYS A 109 12.284 -8.335 6.464 1.00 0.00 C ATOM 1633 CE LYS A 109 11.227 -7.337 6.944 1.00 0.00 C ATOM 1634 NZ LYS A 109 10.423 -7.875 8.034 1.00 0.00 N ATOM 0 H LYS A 109 14.633 -4.796 3.722 1.00 0.00 H new ATOM 0 HA LYS A 109 12.264 -5.566 5.294 1.00 0.00 H new ATOM 0 HB2 LYS A 109 14.843 -6.769 4.755 1.00 0.00 H new ATOM 0 HB3 LYS A 109 14.420 -6.774 6.456 1.00 0.00 H new ATOM 0 HG2 LYS A 109 12.332 -7.607 4.437 1.00 0.00 H new ATOM 0 HG3 LYS A 109 13.623 -8.727 4.823 1.00 0.00 H new ATOM 0 HD2 LYS A 109 11.800 -9.289 6.257 1.00 0.00 H new ATOM 0 HD3 LYS A 109 12.998 -8.507 7.270 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.717 -6.420 7.273 1.00 0.00 H new ATOM 0 HE3 LYS A 109 10.576 -7.070 6.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 9.720 -7.168 8.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 9.935 -8.735 7.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 11.040 -8.106 8.839 1.00 0.00 H new ATOM 1647 N ALA A 110 14.916 -3.698 6.101 1.00 0.00 N ATOM 1648 CA ALA A 110 15.520 -2.718 6.990 1.00 0.00 C ATOM 1649 C ALA A 110 14.536 -1.546 7.122 1.00 0.00 C ATOM 1650 O ALA A 110 14.446 -0.919 8.171 1.00 0.00 O ATOM 1651 CB ALA A 110 16.883 -2.267 6.445 1.00 0.00 C ATOM 0 H ALA A 110 15.439 -3.846 5.238 1.00 0.00 H new ATOM 0 HA ALA A 110 15.708 -3.146 7.974 1.00 0.00 H new ATOM 0 HB1 ALA A 110 17.321 -1.534 7.122 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.546 -3.129 6.365 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.751 -1.818 5.461 1.00 0.00 H new ATOM 1657 N MET A 111 13.806 -1.291 6.009 1.00 0.00 N ATOM 1658 CA MET A 111 12.800 -0.245 5.996 1.00 0.00 C ATOM 1659 C MET A 111 11.601 -0.917 6.680 1.00 0.00 C ATOM 1660 O MET A 111 11.151 -0.500 7.740 1.00 0.00 O ATOM 1661 CB MET A 111 12.535 0.215 4.550 1.00 0.00 C ATOM 1662 CG MET A 111 13.767 0.890 3.932 1.00 0.00 C ATOM 1663 SD MET A 111 13.417 1.598 2.311 1.00 0.00 S ATOM 1664 CE MET A 111 13.107 3.308 2.791 1.00 0.00 C ATOM 0 H MET A 111 13.906 -1.797 5.129 1.00 0.00 H new ATOM 0 HA MET A 111 13.078 0.673 6.513 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.248 -0.643 3.942 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.695 0.910 4.538 1.00 0.00 H new ATOM 0 HG2 MET A 111 14.122 1.675 4.600 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.572 0.160 3.841 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.396 3.757 2.097 1.00 0.00 H new ATOM 0 HE2 MET A 111 12.695 3.334 3.800 1.00 0.00 H new ATOM 0 HE3 MET A 111 14.042 3.868 2.766 1.00 0.00 H new ATOM 1674 N GLY A 112 11.169 -2.003 5.995 1.00 0.00 N ATOM 1675 CA GLY A 112 10.091 -2.921 6.355 1.00 0.00 C ATOM 1676 C GLY A 112 8.931 -2.366 7.196 1.00 0.00 C ATOM 1677 O GLY A 112 8.410 -3.044 8.073 1.00 0.00 O ATOM 0 H GLY A 112 11.605 -2.269 5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.673 -3.326 5.433 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.530 -3.757 6.900 1.00 0.00 H new ATOM 1681 N PHE A 113 8.556 -1.112 6.868 1.00 0.00 N ATOM 1682 CA PHE A 113 7.432 -0.468 7.543 1.00 0.00 C ATOM 1683 C PHE A 113 6.147 -0.918 6.811 1.00 0.00 C ATOM 1684 O PHE A 113 5.035 -0.627 7.234 1.00 0.00 O ATOM 1685 CB PHE A 113 7.595 1.065 7.582 1.00 0.00 C ATOM 1686 CG PHE A 113 8.163 1.658 6.315 1.00 0.00 C ATOM 1687 CD1 PHE A 113 7.460 1.624 5.112 1.00 0.00 C ATOM 1688 CD2 PHE A 113 9.415 2.266 6.342 1.00 0.00 C ATOM 1689 CE1 PHE A 113 8.005 2.179 3.960 1.00 0.00 C ATOM 1690 CE2 PHE A 113 9.954 2.829 5.196 1.00 0.00 C ATOM 1691 CZ PHE A 113 9.252 2.782 4.002 1.00 0.00 C ATOM 0 H PHE A 113 9.010 -0.543 6.154 1.00 0.00 H new ATOM 0 HA PHE A 113 7.382 -0.769 8.589 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.623 1.518 7.778 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.244 1.329 8.417 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.484 1.163 5.075 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.973 2.299 7.266 1.00 0.00 H new ATOM 0 HE1 PHE A 113 7.456 2.140 3.031 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.923 3.305 5.234 1.00 0.00 H new ATOM 0 HZ PHE A 113 9.675 3.214 3.107 1.00 0.00 H new ATOM 1701 N ASP A 114 6.384 -1.636 5.692 1.00 0.00 N ATOM 1702 CA ASP A 114 5.378 -2.186 4.820 1.00 0.00 C ATOM 1703 C ASP A 114 5.364 -3.690 5.120 1.00 0.00 C ATOM 1704 O ASP A 114 6.404 -4.323 5.257 1.00 0.00 O ATOM 1705 CB ASP A 114 5.786 -1.898 3.358 1.00 0.00 C ATOM 1706 CG ASP A 114 7.198 -2.436 3.024 1.00 0.00 C ATOM 1707 OD1 ASP A 114 8.180 -1.750 3.311 1.00 0.00 O ATOM 1708 OD2 ASP A 114 7.296 -3.536 2.480 1.00 0.00 O ATOM 0 H ASP A 114 7.331 -1.845 5.377 1.00 0.00 H new ATOM 0 HA ASP A 114 4.387 -1.757 4.971 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.059 -2.351 2.684 1.00 0.00 H new ATOM 0 HB3 ASP A 114 5.758 -0.823 3.181 1.00 0.00 H new ATOM 1713 N ARG A 115 4.125 -4.210 5.228 1.00 0.00 N ATOM 1714 CA ARG A 115 3.888 -5.621 5.464 1.00 0.00 C ATOM 1715 C ARG A 115 3.300 -6.086 4.130 1.00 0.00 C ATOM 1716 O ARG A 115 3.006 -5.274 3.261 1.00 0.00 O ATOM 1717 CB ARG A 115 2.954 -5.849 6.677 1.00 0.00 C ATOM 1718 CG ARG A 115 2.107 -4.635 7.117 1.00 0.00 C ATOM 1719 CD ARG A 115 2.881 -3.685 8.045 1.00 0.00 C ATOM 1720 NE ARG A 115 1.990 -2.675 8.606 1.00 0.00 N ATOM 1721 CZ ARG A 115 2.442 -1.747 9.481 1.00 0.00 C ATOM 1722 NH1 ARG A 115 3.724 -1.703 9.839 1.00 0.00 N ATOM 1723 NH2 ARG A 115 1.596 -0.864 9.999 1.00 0.00 N ATOM 0 H ARG A 115 3.273 -3.654 5.152 1.00 0.00 H new ATOM 0 HA ARG A 115 4.780 -6.186 5.735 1.00 0.00 H new ATOM 0 HB2 ARG A 115 2.279 -6.671 6.441 1.00 0.00 H new ATOM 0 HB3 ARG A 115 3.562 -6.169 7.523 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.777 -4.087 6.235 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.211 -4.987 7.628 1.00 0.00 H new ATOM 0 HD2 ARG A 115 3.347 -4.254 8.850 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.685 -3.201 7.490 1.00 0.00 H new ATOM 0 HE ARG A 115 1.007 -2.668 8.333 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.385 -2.377 9.452 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.045 -0.996 10.500 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.611 -0.887 9.737 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.932 -0.162 10.659 1.00 0.00 H new ATOM 1737 N VAL A 116 3.167 -7.422 3.995 1.00 0.00 N ATOM 1738 CA VAL A 116 2.594 -7.972 2.769 1.00 0.00 C ATOM 1739 C VAL A 116 1.679 -9.138 3.152 1.00 0.00 C ATOM 1740 O VAL A 116 1.768 -9.687 4.244 1.00 0.00 O ATOM 1741 CB VAL A 116 3.716 -8.409 1.762 1.00 0.00 C ATOM 1742 CG1 VAL A 116 4.587 -7.172 1.376 1.00 0.00 C ATOM 1743 CG2 VAL A 116 4.239 -9.857 1.603 1.00 0.00 C ATOM 0 H VAL A 116 3.440 -8.110 4.696 1.00 0.00 H new ATOM 0 HA VAL A 116 2.009 -7.210 2.254 1.00 0.00 H new ATOM 0 HB VAL A 116 3.181 -8.808 0.900 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.365 -7.479 0.677 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.957 -6.415 0.909 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.048 -6.757 2.273 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.015 -9.882 0.838 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.653 -10.200 2.551 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.418 -10.510 1.308 1.00 0.00 H new ATOM 1753 N TYR A 117 0.818 -9.495 2.169 1.00 0.00 N ATOM 1754 CA TYR A 117 -0.125 -10.597 2.387 1.00 0.00 C ATOM 1755 C TYR A 117 0.561 -11.787 1.680 1.00 0.00 C ATOM 1756 O TYR A 117 1.336 -11.595 0.750 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.528 -10.348 1.784 1.00 0.00 C ATOM 1758 CG TYR A 117 -2.348 -9.199 2.350 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.851 -7.908 2.510 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -3.693 -9.402 2.635 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -2.682 -6.850 2.836 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -4.538 -8.362 2.980 1.00 0.00 C ATOM 1763 CZ TYR A 117 -4.045 -7.061 3.048 1.00 0.00 C ATOM 1764 OH TYR A 117 -4.904 -6.005 3.314 1.00 0.00 O ATOM 0 H TYR A 117 0.762 -9.050 1.253 1.00 0.00 H new ATOM 0 HA TYR A 117 -0.317 -10.748 3.449 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -1.408 -10.179 0.714 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -2.109 -11.263 1.899 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.794 -7.728 2.377 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -4.092 -10.404 2.586 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -2.273 -5.855 2.927 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.578 -8.559 3.196 1.00 0.00 H new ATOM 0 HH TYR A 117 -5.815 -6.346 3.432 1.00 0.00 H new ATOM 1774 N PRO A 118 0.257 -13.034 2.146 1.00 0.00 N ATOM 1775 CA PRO A 118 0.883 -14.234 1.599 1.00 0.00 C ATOM 1776 C PRO A 118 0.195 -14.565 0.270 1.00 0.00 C ATOM 1777 O PRO A 118 -0.874 -14.051 -0.025 1.00 0.00 O ATOM 1778 CB PRO A 118 0.550 -15.317 2.642 1.00 0.00 C ATOM 1779 CG PRO A 118 -0.778 -14.856 3.249 1.00 0.00 C ATOM 1780 CD PRO A 118 -0.701 -13.331 3.218 1.00 0.00 C ATOM 0 HA PRO A 118 1.954 -14.139 1.418 1.00 0.00 H new ATOM 0 HB2 PRO A 118 0.457 -16.300 2.180 1.00 0.00 H new ATOM 0 HB3 PRO A 118 1.330 -15.393 3.400 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -1.627 -15.223 2.672 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -0.900 -15.227 4.267 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.676 -12.888 3.013 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -0.364 -12.931 4.174 1.00 0.00 H new ATOM 1788 N PRO A 119 0.855 -15.456 -0.530 1.00 0.00 N ATOM 1789 CA PRO A 119 0.305 -15.921 -1.799 1.00 0.00 C ATOM 1790 C PRO A 119 -0.711 -16.985 -1.348 1.00 0.00 C ATOM 1791 O PRO A 119 -0.357 -17.981 -0.727 1.00 0.00 O ATOM 1792 CB PRO A 119 1.505 -16.533 -2.532 1.00 0.00 C ATOM 1793 CG PRO A 119 2.478 -16.943 -1.421 1.00 0.00 C ATOM 1794 CD PRO A 119 2.196 -15.981 -0.264 1.00 0.00 C ATOM 0 HA PRO A 119 -0.170 -15.187 -2.450 1.00 0.00 H new ATOM 0 HB2 PRO A 119 1.205 -17.392 -3.132 1.00 0.00 H new ATOM 0 HB3 PRO A 119 1.962 -15.814 -3.212 1.00 0.00 H new ATOM 0 HG2 PRO A 119 2.318 -17.978 -1.120 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.513 -16.864 -1.755 1.00 0.00 H new ATOM 0 HD2 PRO A 119 2.236 -16.495 0.696 1.00 0.00 H new ATOM 0 HD3 PRO A 119 2.934 -15.180 -0.227 1.00 0.00 H new ATOM 1802 N GLY A 120 -1.985 -16.702 -1.684 1.00 0.00 N ATOM 1803 CA GLY A 120 -3.075 -17.584 -1.285 1.00 0.00 C ATOM 1804 C GLY A 120 -3.635 -17.046 0.034 1.00 0.00 C ATOM 1805 O GLY A 120 -3.483 -17.605 1.113 1.00 0.00 O ATOM 0 H GLY A 120 -2.271 -15.883 -2.221 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.850 -17.608 -2.051 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.717 -18.606 -1.162 1.00 0.00 H new ATOM 1809 N THR A 121 -4.258 -15.880 -0.187 1.00 0.00 N ATOM 1810 CA THR A 121 -4.882 -15.029 0.798 1.00 0.00 C ATOM 1811 C THR A 121 -6.343 -15.466 0.918 1.00 0.00 C ATOM 1812 O THR A 121 -6.742 -16.575 0.580 1.00 0.00 O ATOM 1813 CB THR A 121 -4.616 -13.590 0.232 1.00 0.00 C ATOM 1814 OG1 THR A 121 -3.498 -13.431 -0.706 1.00 0.00 O ATOM 1815 CG2 THR A 121 -4.535 -12.513 1.333 1.00 0.00 C ATOM 0 H THR A 121 -4.337 -15.493 -1.128 1.00 0.00 H new ATOM 0 HA THR A 121 -4.507 -15.073 1.821 1.00 0.00 H new ATOM 0 HB THR A 121 -5.510 -13.437 -0.372 1.00 0.00 H new ATOM 0 HG1 THR A 121 -2.664 -13.702 -0.269 1.00 0.00 H new ATOM 0 HG21 THR A 121 -4.350 -11.540 0.878 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.476 -12.483 1.882 1.00 0.00 H new ATOM 0 HG23 THR A 121 -3.722 -12.754 2.018 1.00 0.00 H new ATOM 1823 N SER A 122 -7.091 -14.471 1.423 1.00 0.00 N ATOM 1824 CA SER A 122 -8.496 -14.536 1.700 1.00 0.00 C ATOM 1825 C SER A 122 -8.859 -13.099 2.114 1.00 0.00 C ATOM 1826 O SER A 122 -7.991 -12.294 2.432 1.00 0.00 O ATOM 1827 CB SER A 122 -8.650 -15.496 2.919 1.00 0.00 C ATOM 1828 OG SER A 122 -7.736 -15.300 4.073 1.00 0.00 O ATOM 0 H SER A 122 -6.691 -13.562 1.653 1.00 0.00 H new ATOM 0 HA SER A 122 -9.117 -14.886 0.875 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.674 -15.412 3.284 1.00 0.00 H new ATOM 0 HB3 SER A 122 -8.522 -16.517 2.560 1.00 0.00 H new ATOM 0 HG SER A 122 -7.185 -14.504 3.922 1.00 0.00 H new ATOM 1834 N PRO A 123 -10.187 -12.785 2.114 1.00 0.00 N ATOM 1835 CA PRO A 123 -10.655 -11.469 2.533 1.00 0.00 C ATOM 1836 C PRO A 123 -10.610 -11.425 4.077 1.00 0.00 C ATOM 1837 O PRO A 123 -10.853 -10.385 4.676 1.00 0.00 O ATOM 1838 CB PRO A 123 -12.090 -11.388 2.007 1.00 0.00 C ATOM 1839 CG PRO A 123 -12.541 -12.848 1.903 1.00 0.00 C ATOM 1840 CD PRO A 123 -11.263 -13.649 1.633 1.00 0.00 C ATOM 0 HA PRO A 123 -10.059 -10.636 2.160 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -12.730 -10.822 2.684 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -12.131 -10.890 1.038 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -13.024 -13.177 2.823 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -13.265 -12.980 1.099 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -11.273 -14.603 2.160 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -11.150 -13.872 0.572 1.00 0.00 H new ATOM 1848 N GLU A 124 -10.277 -12.601 4.674 1.00 0.00 N ATOM 1849 CA GLU A 124 -10.140 -12.793 6.106 1.00 0.00 C ATOM 1850 C GLU A 124 -8.852 -12.061 6.523 1.00 0.00 C ATOM 1851 O GLU A 124 -8.732 -11.573 7.641 1.00 0.00 O ATOM 1852 CB GLU A 124 -10.122 -14.310 6.415 1.00 0.00 C ATOM 1853 CG GLU A 124 -9.171 -14.746 7.546 1.00 0.00 C ATOM 1854 CD GLU A 124 -9.272 -16.260 7.795 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -8.619 -17.019 7.079 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -9.999 -16.665 8.702 1.00 0.00 O ATOM 0 H GLU A 124 -10.096 -13.451 4.140 1.00 0.00 H new ATOM 0 HA GLU A 124 -10.973 -12.382 6.676 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -11.134 -14.622 6.674 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.846 -14.845 5.506 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.146 -14.484 7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.416 -14.206 8.461 1.00 0.00 H new ATOM 1863 N THR A 125 -7.907 -12.005 5.555 1.00 0.00 N ATOM 1864 CA THR A 125 -6.633 -11.363 5.769 1.00 0.00 C ATOM 1865 C THR A 125 -6.860 -9.842 5.703 1.00 0.00 C ATOM 1866 O THR A 125 -6.044 -9.087 6.216 1.00 0.00 O ATOM 1867 CB THR A 125 -5.632 -11.841 4.664 1.00 0.00 C ATOM 1868 OG1 THR A 125 -5.823 -13.149 4.036 1.00 0.00 O ATOM 1869 CG2 THR A 125 -4.166 -11.625 5.113 1.00 0.00 C ATOM 0 H THR A 125 -8.024 -12.404 4.624 1.00 0.00 H new ATOM 0 HA THR A 125 -6.209 -11.620 6.740 1.00 0.00 H new ATOM 0 HB THR A 125 -5.891 -11.183 3.834 1.00 0.00 H new ATOM 0 HG1 THR A 125 -4.953 -13.581 3.909 1.00 0.00 H new ATOM 0 HG21 THR A 125 -3.491 -11.965 4.328 1.00 0.00 H new ATOM 0 HG22 THR A 125 -3.996 -10.565 5.304 1.00 0.00 H new ATOM 0 HG23 THR A 125 -3.977 -12.192 6.024 1.00 0.00 H new ATOM 1877 N THR A 126 -7.981 -9.414 5.060 1.00 0.00 N ATOM 1878 CA THR A 126 -8.223 -7.992 4.955 1.00 0.00 C ATOM 1879 C THR A 126 -8.931 -7.488 6.208 1.00 0.00 C ATOM 1880 O THR A 126 -8.993 -6.288 6.457 1.00 0.00 O ATOM 1881 CB THR A 126 -9.000 -7.510 3.722 1.00 0.00 C ATOM 1882 OG1 THR A 126 -10.459 -7.414 3.814 1.00 0.00 O ATOM 1883 CG2 THR A 126 -8.477 -8.177 2.420 1.00 0.00 C ATOM 0 H THR A 126 -8.685 -10.017 4.634 1.00 0.00 H new ATOM 0 HA THR A 126 -7.224 -7.571 4.842 1.00 0.00 H new ATOM 0 HB THR A 126 -8.760 -6.448 3.678 1.00 0.00 H new ATOM 0 HG1 THR A 126 -10.827 -8.281 4.085 1.00 0.00 H new ATOM 0 HG21 THR A 126 -9.051 -7.812 1.568 1.00 0.00 H new ATOM 0 HG22 THR A 126 -7.425 -7.929 2.282 1.00 0.00 H new ATOM 0 HG23 THR A 126 -8.588 -9.259 2.495 1.00 0.00 H new ATOM 1891 N ILE A 127 -9.469 -8.430 7.004 1.00 0.00 N ATOM 1892 CA ILE A 127 -10.053 -7.988 8.262 1.00 0.00 C ATOM 1893 C ILE A 127 -8.817 -7.556 9.093 1.00 0.00 C ATOM 1894 O ILE A 127 -8.870 -6.657 9.926 1.00 0.00 O ATOM 1895 CB ILE A 127 -10.866 -9.146 8.911 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -11.730 -9.969 7.940 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -11.132 -8.829 10.418 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -12.530 -11.133 8.561 1.00 0.00 C ATOM 0 H ILE A 127 -9.508 -9.431 6.811 1.00 0.00 H new ATOM 0 HA ILE A 127 -10.770 -7.172 8.168 1.00 0.00 H new ATOM 0 HB ILE A 127 -10.380 -10.102 9.106 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -12.431 -9.294 7.449 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -11.081 -10.375 7.163 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -11.701 -9.643 10.866 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -10.181 -8.720 10.940 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.699 -7.902 10.500 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -13.100 -11.639 7.782 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -11.843 -11.840 9.025 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -13.214 -10.743 9.315 1.00 0.00 H new ATOM 1910 N ALA A 128 -7.693 -8.244 8.748 1.00 0.00 N ATOM 1911 CA ALA A 128 -6.423 -7.983 9.363 1.00 0.00 C ATOM 1912 C ALA A 128 -5.751 -6.816 8.619 1.00 0.00 C ATOM 1913 O ALA A 128 -4.679 -6.393 9.026 1.00 0.00 O ATOM 1914 CB ALA A 128 -5.547 -9.246 9.419 1.00 0.00 C ATOM 0 H ALA A 128 -7.673 -8.980 8.042 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.567 -7.692 10.404 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.594 -9.007 9.891 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -6.056 -10.017 9.998 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -5.369 -9.611 8.407 1.00 0.00 H new ATOM 1920 N ASP A 129 -6.394 -6.290 7.540 1.00 0.00 N ATOM 1921 CA ASP A 129 -5.827 -5.170 6.806 1.00 0.00 C ATOM 1922 C ASP A 129 -5.715 -3.984 7.772 1.00 0.00 C ATOM 1923 O ASP A 129 -4.641 -3.486 8.069 1.00 0.00 O ATOM 1924 CB ASP A 129 -6.699 -4.723 5.609 1.00 0.00 C ATOM 1925 CG ASP A 129 -5.974 -3.790 4.613 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -4.800 -3.473 4.808 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -6.600 -3.384 3.641 1.00 0.00 O ATOM 0 H ASP A 129 -7.286 -6.629 7.180 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.863 -5.490 6.411 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.045 -5.608 5.075 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.584 -4.213 5.989 1.00 0.00 H new ATOM 1932 N MET A 130 -6.916 -3.585 8.232 1.00 0.00 N ATOM 1933 CA MET A 130 -7.054 -2.427 9.100 1.00 0.00 C ATOM 1934 C MET A 130 -6.755 -2.810 10.557 1.00 0.00 C ATOM 1935 O MET A 130 -6.684 -1.916 11.388 1.00 0.00 O ATOM 1936 CB MET A 130 -8.466 -1.823 8.939 1.00 0.00 C ATOM 1937 CG MET A 130 -8.623 -0.917 7.707 1.00 0.00 C ATOM 1938 SD MET A 130 -8.147 -1.718 6.174 1.00 0.00 S ATOM 1939 CE MET A 130 -6.487 -1.046 5.985 1.00 0.00 C ATOM 0 H MET A 130 -7.795 -4.053 8.011 1.00 0.00 H new ATOM 0 HA MET A 130 -6.328 -1.666 8.813 1.00 0.00 H new ATOM 0 HB2 MET A 130 -9.192 -2.634 8.875 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.708 -1.248 9.833 1.00 0.00 H new ATOM 0 HG2 MET A 130 -9.661 -0.593 7.633 1.00 0.00 H new ATOM 0 HG3 MET A 130 -8.018 -0.021 7.844 1.00 0.00 H new ATOM 0 HE1 MET A 130 -6.194 -1.089 4.936 1.00 0.00 H new ATOM 0 HE2 MET A 130 -6.473 -0.010 6.323 1.00 0.00 H new ATOM 0 HE3 MET A 130 -5.787 -1.632 6.581 1.00 0.00 H new ATOM 1949 N LYS A 131 -6.577 -4.116 10.868 1.00 0.00 N ATOM 1950 CA LYS A 131 -6.306 -4.453 12.263 1.00 0.00 C ATOM 1951 C LYS A 131 -4.784 -4.431 12.482 1.00 0.00 C ATOM 1952 O LYS A 131 -4.284 -3.746 13.362 1.00 0.00 O ATOM 1953 CB LYS A 131 -6.915 -5.817 12.620 1.00 0.00 C ATOM 1954 CG LYS A 131 -6.836 -6.149 14.116 1.00 0.00 C ATOM 1955 CD LYS A 131 -7.613 -7.422 14.480 1.00 0.00 C ATOM 1956 CE LYS A 131 -7.081 -8.680 13.783 1.00 0.00 C ATOM 1957 NZ LYS A 131 -7.787 -9.884 14.204 1.00 0.00 N ATOM 0 H LYS A 131 -6.614 -4.898 10.214 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.770 -3.721 12.924 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -7.959 -5.833 12.307 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -6.401 -6.595 12.056 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -5.791 -6.271 14.403 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -7.229 -5.311 14.692 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -7.571 -7.568 15.559 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -8.662 -7.286 14.217 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -7.177 -8.563 12.704 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -6.018 -8.790 13.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -7.394 -10.709 13.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.674 -10.012 15.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.797 -9.792 13.976 1.00 0.00 H new ATOM 1970 N GLU A 132 -4.079 -5.209 11.633 1.00 0.00 N ATOM 1971 CA GLU A 132 -2.631 -5.372 11.708 1.00 0.00 C ATOM 1972 C GLU A 132 -1.929 -4.016 11.638 1.00 0.00 C ATOM 1973 O GLU A 132 -0.945 -3.779 12.327 1.00 0.00 O ATOM 1974 CB GLU A 132 -2.122 -6.327 10.610 1.00 0.00 C ATOM 1975 CG GLU A 132 -0.635 -6.688 10.775 1.00 0.00 C ATOM 1976 CD GLU A 132 -0.163 -7.666 9.683 1.00 0.00 C ATOM 1977 OE1 GLU A 132 -0.714 -8.764 9.597 1.00 0.00 O ATOM 1978 OE2 GLU A 132 0.751 -7.322 8.934 1.00 0.00 O ATOM 0 H GLU A 132 -4.511 -5.740 10.876 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.390 -5.823 12.670 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -2.717 -7.240 10.625 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -2.273 -5.865 9.634 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -0.033 -5.780 10.735 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.475 -7.134 11.757 1.00 0.00 H new ATOM 1985 N VAL A 133 -2.486 -3.163 10.768 1.00 0.00 N ATOM 1986 CA VAL A 133 -1.945 -1.827 10.537 1.00 0.00 C ATOM 1987 C VAL A 133 -2.568 -0.784 11.490 1.00 0.00 C ATOM 1988 O VAL A 133 -1.890 -0.255 12.363 1.00 0.00 O ATOM 1989 CB VAL A 133 -2.079 -1.503 9.008 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.645 -0.036 8.715 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -1.921 -2.556 7.891 1.00 0.00 C ATOM 0 H VAL A 133 -3.314 -3.380 10.213 1.00 0.00 H new ATOM 0 HA VAL A 133 -0.884 -1.786 10.783 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.152 -1.625 8.864 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -1.746 0.167 7.649 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -2.279 0.650 9.277 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.606 0.103 9.014 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.060 -2.080 6.920 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.924 -2.993 7.942 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -2.668 -3.339 8.021 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.873 -0.508 11.264 1.00 0.00 N ATOM 2002 CA LEU A 134 -4.592 0.481 12.062 1.00 0.00 C ATOM 2003 C LEU A 134 -5.235 -0.202 13.279 1.00 0.00 C ATOM 2004 O LEU A 134 -6.431 -0.070 13.512 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.623 1.224 11.197 1.00 0.00 C ATOM 2006 CG LEU A 134 -4.978 2.122 10.097 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -6.125 2.770 9.271 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -3.556 2.737 10.122 1.00 0.00 C ATOM 0 H LEU A 134 -4.435 -0.957 10.541 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.892 1.230 12.434 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -6.280 0.495 10.722 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -6.247 1.843 11.841 1.00 0.00 H new ATOM 0 HG LEU A 134 -4.315 1.446 9.557 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.700 3.404 8.493 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.729 1.988 8.811 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.751 3.373 9.929 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -3.394 3.315 9.212 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -3.457 3.389 10.989 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -2.816 1.939 10.182 1.00 0.00 H new ATOM 2020 N GLY A 135 -4.392 -0.913 14.050 1.00 0.00 N ATOM 2021 CA GLY A 135 -4.885 -1.573 15.256 1.00 0.00 C ATOM 2022 C GLY A 135 -3.725 -1.945 16.183 1.00 0.00 C ATOM 2023 O GLY A 135 -3.825 -1.856 17.401 1.00 0.00 O ATOM 0 H GLY A 135 -3.397 -1.039 13.862 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -5.578 -0.914 15.779 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.441 -2.470 14.984 1.00 0.00 H new ATOM 2027 N VAL A 136 -2.623 -2.354 15.520 1.00 0.00 N ATOM 2028 CA VAL A 136 -1.399 -2.740 16.205 1.00 0.00 C ATOM 2029 C VAL A 136 -0.229 -2.253 15.341 1.00 0.00 C ATOM 2030 O VAL A 136 -0.389 -1.938 14.169 1.00 0.00 O ATOM 2031 CB VAL A 136 -1.371 -4.292 16.406 1.00 0.00 C ATOM 2032 CG1 VAL A 136 -0.523 -4.655 17.662 1.00 0.00 C ATOM 2033 CG2 VAL A 136 -2.396 -5.266 15.767 1.00 0.00 C ATOM 0 H VAL A 136 -2.569 -2.421 14.504 1.00 0.00 H new ATOM 0 HA VAL A 136 -1.333 -2.293 17.197 1.00 0.00 H new ATOM 0 HB VAL A 136 -0.921 -4.731 15.515 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.510 -5.737 17.792 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.497 -4.294 17.529 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.961 -4.189 18.544 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.158 -6.288 16.060 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -3.400 -5.014 16.110 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.351 -5.180 14.681 1.00 0.00 H new ATOM 2043 N GLU A 137 0.943 -2.190 16.011 1.00 0.00 N ATOM 2044 CA GLU A 137 2.200 -1.775 15.411 1.00 0.00 C ATOM 2045 C GLU A 137 2.030 -0.309 14.959 1.00 0.00 C ATOM 2046 O GLU A 137 1.912 -0.058 13.759 1.00 0.00 O ATOM 2047 CB GLU A 137 2.624 -2.761 14.299 1.00 0.00 C ATOM 2048 CG GLU A 137 2.666 -4.235 14.743 1.00 0.00 C ATOM 2049 CD GLU A 137 3.655 -4.460 15.902 1.00 0.00 C ATOM 2050 OE1 GLU A 137 4.859 -4.487 15.651 1.00 0.00 O ATOM 2051 OE2 GLU A 137 3.210 -4.607 17.040 1.00 0.00 O ATOM 2052 OXT GLU A 137 2.019 0.570 15.820 1.00 0.00 O ATOM 0 H GLU A 137 1.028 -2.433 16.998 1.00 0.00 H new ATOM 0 HA GLU A 137 3.028 -1.806 16.119 1.00 0.00 H new ATOM 0 HB2 GLU A 137 1.933 -2.665 13.462 1.00 0.00 H new ATOM 0 HB3 GLU A 137 3.610 -2.476 13.933 1.00 0.00 H new ATOM 0 HG2 GLU A 137 1.669 -4.549 15.051 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.950 -4.861 13.897 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 -3.776 -16.416 -11.422 1.00 0.00 N HETATM 2061 C5 FOP A 138 -3.716 -16.379 -9.961 1.00 0.00 C HETATM 2062 C6 FOP A 138 -5.072 -16.554 -9.258 1.00 0.00 C HETATM 2063 C7 FOP A 138 -5.647 -17.958 -9.499 1.00 0.00 C HETATM 2064 O7 FOP A 138 -4.948 -16.304 -7.871 1.00 0.00 O HETATM 0 H73 FOP A 138 -5.788 -18.115 -10.568 1.00 0.00 H new HETATM 0 H72 FOP A 138 -4.956 -18.706 -9.111 1.00 0.00 H new HETATM 0 H71 FOP A 138 -6.606 -18.051 -8.989 1.00 0.00 H new HETATM 0 H6 FOP A 138 -5.765 -15.828 -9.684 1.00 0.00 H new HETATM 0 H52 FOP A 138 -3.041 -17.163 -9.619 1.00 0.00 H new HETATM 0 H51 FOP A 138 -3.282 -15.428 -9.653 1.00 0.00 H new HETATM 0 H43 FOP A 138 -2.841 -16.276 -11.805 1.00 0.00 H new HETATM 0 H42 FOP A 138 -4.135 -17.321 -11.725 1.00 0.00 H new HETATM 0 H41 FOP A 138 -4.394 -15.676 -11.756 1.00 0.00 H new HETATM 2074 P DBI A 139 -6.307 -16.347 -7.056 1.00 0.00 P HETATM 2075 O1P DBI A 139 -7.520 -15.913 -7.973 1.00 0.00 O HETATM 2076 O2P DBI A 139 -6.555 -17.812 -6.518 1.00 0.00 O HETATM 2077 O3' DBI A 139 -6.239 -15.349 -5.831 1.00 0.00 O HETATM 2078 O5' DBI A 139 -7.560 -15.854 -3.148 1.00 0.00 O HETATM 2079 C5' DBI A 139 -6.283 -15.579 -2.633 1.00 0.00 C HETATM 2080 C4' DBI A 139 -5.403 -14.830 -3.634 1.00 0.00 C HETATM 2081 O4' DBI A 139 -4.115 -14.638 -3.093 1.00 0.00 O HETATM 2082 C1' DBI A 139 -3.240 -14.342 -4.163 1.00 0.00 C HETATM 2083 N1 DBI A 139 -2.950 -12.916 -4.268 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.497 -11.810 -3.611 1.00 0.00 C HETATM 2085 C7 DBI A 139 -4.512 -11.625 -2.707 1.00 0.00 C HETATM 2086 C6 DBI A 139 -4.792 -10.365 -2.167 1.00 0.00 C HETATM 2087 C11 DBI A 139 -5.886 -10.211 -1.144 1.00 0.00 C HETATM 2088 C10 DBI A 139 -4.339 -7.876 -2.055 1.00 0.00 C HETATM 2089 C5 DBI A 139 -4.053 -9.256 -2.594 1.00 0.00 C HETATM 2090 C4 DBI A 139 -3.035 -9.446 -3.528 1.00 0.00 C HETATM 2091 C9 DBI A 139 -2.746 -10.680 -4.027 1.00 0.00 C HETATM 2092 N3 DBI A 139 -1.794 -11.112 -4.928 1.00 0.00 N HETATM 2093 C2 DBI A 139 -1.942 -12.443 -5.016 1.00 0.00 C HETATM 2094 C2' DBI A 139 -3.858 -14.971 -5.428 1.00 0.00 C HETATM 2095 O2' DBI A 139 -4.076 -14.039 -6.467 1.00 0.00 O HETATM 2096 C3' DBI A 139 -5.166 -15.563 -4.943 1.00 0.00 C HETATM 0 HO21 DBI A 139 -4.309 -14.516 -7.291 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -6.380 -14.986 -1.723 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.797 -16.514 -2.354 1.00 0.00 H new HETATM 0 H113 DBI A 139 -6.835 -10.529 -1.575 1.00 0.00 H new HETATM 0 H112 DBI A 139 -5.659 -10.826 -0.273 1.00 0.00 H new HETATM 0 H111 DBI A 139 -5.957 -9.166 -0.842 1.00 0.00 H new HETATM 0 H103 DBI A 139 -5.367 -7.600 -2.289 1.00 0.00 H new HETATM 0 H102 DBI A 139 -4.199 -7.871 -0.974 1.00 0.00 H new HETATM 0 H101 DBI A 139 -3.657 -7.158 -2.512 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -8.087 -16.335 -2.476 1.00 0.00 H new HETATM 0 H7 DBI A 139 -5.115 -12.480 -2.402 1.00 0.00 H new HETATM 0 H4' DBI A 139 -5.948 -13.907 -3.829 1.00 0.00 H new HETATM 0 H4 DBI A 139 -2.457 -8.586 -3.867 1.00 0.00 H new HETATM 0 H3' DBI A 139 -5.108 -16.647 -4.850 1.00 0.00 H new HETATM 0 H2' DBI A 139 -3.187 -15.708 -5.869 1.00 0.00 H new HETATM 0 H2 DBI A 139 -1.306 -13.077 -5.634 1.00 0.00 H new HETATM 0 H1' DBI A 139 -2.253 -14.775 -4.000 1.00 0.00 H new