USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 969 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 THR OG1 : rot -153:sc= 1.43 USER MOD Set 1.2: A 94 ASN : amide:sc= 0.322 X(o=1.8,f=1.4) USER MOD Set 1.3: A 98 HIS : no HD1:sc= 0 X(o=1.8,f=1.6) USER MOD Set 2.1: A 41 LYS NZ :NH3+ 138:sc= 1.93 (180deg=-0.229) USER MOD Set 2.2: A 78 SER OG : rot 151:sc= 1.62 USER MOD Set 3.1: A 36 THR OG1 : rot 115:sc= 0.418 USER MOD Set 3.2: A 38 SER OG : rot -143:sc= 1.47 USER MOD Single : A 1 LYS N :NH3+ -166:sc= -0.146 (180deg=-0.429) USER MOD Single : A 1 LYS NZ :NH3+ -172:sc=-6.63e-05 (180deg=-0.0801) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 ASN :FLIP amide:sc= -0.0619 F(o=-1.5,f=-0.062) USER MOD Single : A 25 GLN : amide:sc= -0.678 K(o=-0.68,f=-11!) USER MOD Single : A 30 LYS NZ :NH3+ 165:sc= -0.0303 (180deg=-0.288) USER MOD Single : A 34 CYS SG : rot 144:sc= 1.17 USER MOD Single : A 39 GLN : amide:sc= 0.317 X(o=0.32,f=-0.096) USER MOD Single : A 43 LYS NZ :NH3+ -151:sc= 1.23 (180deg=-0.336!) USER MOD Single : A 44 MET CE :methyl -175:sc= -4.3! (180deg=-4.54!) USER MOD Single : A 47 GLN : amide:sc= -4.05! C(o=-4.1!,f=-4.3!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -152:sc= 1.23 (180deg=1.16) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -1.04 K(o=-1,f=-4.6!) USER MOD Single : A 62 THR OG1 : rot -83:sc= 1.29 USER MOD Single : A 69 SER OG : rot -110:sc= -0.0946 USER MOD Single : A 74 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.015) USER MOD Single : A 84 SER OG : rot 49:sc= 0.649 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot -147:sc= -1.82! USER MOD Single : A 97 GLN : amide:sc= -2.63! C(o=-2.6!,f=-2.2!) USER MOD Single : A 99 TYR OH : rot 180:sc= -0.119 USER MOD Single : A 100 LYS NZ :NH3+ 174:sc= 0.839 (180deg=0.778) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot -22:sc= 1.18 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -174:sc= 0.907 (180deg=0.886) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 0.016 2.045 3.775 1.00 1.00 N ATOM 2 CA LYS A 1 0.047 0.693 3.189 1.00 1.00 C ATOM 3 C LYS A 1 -0.545 0.714 1.781 1.00 1.00 C ATOM 4 O LYS A 1 -0.311 -0.193 0.966 1.00 1.00 O ATOM 5 CB LYS A 1 -0.725 -0.301 4.077 1.00 1.00 C ATOM 6 CG LYS A 1 -0.579 -1.761 3.662 1.00 1.00 C ATOM 7 CD LYS A 1 -1.328 -2.681 4.601 1.00 1.00 C ATOM 8 CE LYS A 1 -1.145 -4.156 4.240 1.00 1.00 C ATOM 9 NZ LYS A 1 -1.642 -4.472 2.877 1.00 1.00 N ATOM 0 H1 LYS A 1 0.624 2.072 4.618 1.00 1.00 H new ATOM 0 H2 LYS A 1 0.362 2.734 3.077 1.00 1.00 H new ATOM 0 H3 LYS A 1 -0.960 2.284 4.044 1.00 1.00 H new ATOM 0 HA LYS A 1 1.085 0.367 3.129 1.00 1.00 H new ATOM 0 HB2 LYS A 1 -0.382 -0.192 5.106 1.00 1.00 H new ATOM 0 HB3 LYS A 1 -1.782 -0.036 4.064 1.00 1.00 H new ATOM 0 HG2 LYS A 1 -0.954 -1.891 2.647 1.00 1.00 H new ATOM 0 HG3 LYS A 1 0.476 -2.033 3.649 1.00 1.00 H new ATOM 0 HD2 LYS A 1 -0.983 -2.514 5.621 1.00 1.00 H new ATOM 0 HD3 LYS A 1 -2.389 -2.433 4.579 1.00 1.00 H new ATOM 0 HE2 LYS A 1 -0.088 -4.415 4.307 1.00 1.00 H new ATOM 0 HE3 LYS A 1 -1.672 -4.773 4.968 1.00 1.00 H new ATOM 0 HZ1 LYS A 1 -1.622 -5.501 2.730 1.00 1.00 H new ATOM 0 HZ2 LYS A 1 -2.618 -4.127 2.775 1.00 1.00 H new ATOM 0 HZ3 LYS A 1 -1.035 -4.009 2.170 1.00 1.00 H new ATOM 22 N LYS A 2 -1.315 1.733 1.511 1.00 1.00 N ATOM 23 CA LYS A 2 -1.925 1.930 0.210 1.00 1.00 C ATOM 24 C LYS A 2 -1.480 3.245 -0.361 1.00 1.00 C ATOM 25 O LYS A 2 -1.194 4.183 0.389 1.00 1.00 O ATOM 26 CB LYS A 2 -3.459 1.902 0.312 1.00 1.00 C ATOM 27 CG LYS A 2 -4.054 0.552 0.676 1.00 1.00 C ATOM 28 CD LYS A 2 -3.807 -0.456 -0.428 1.00 1.00 C ATOM 29 CE LYS A 2 -4.416 -1.803 -0.113 1.00 1.00 C ATOM 30 NZ LYS A 2 -4.200 -2.764 -1.209 1.00 1.00 N ATOM 0 H LYS A 2 -1.543 2.460 2.189 1.00 1.00 H new ATOM 0 HA LYS A 2 -1.610 1.118 -0.445 1.00 1.00 H new ATOM 0 HB2 LYS A 2 -3.772 2.633 1.058 1.00 1.00 H new ATOM 0 HB3 LYS A 2 -3.877 2.221 -0.643 1.00 1.00 H new ATOM 0 HG2 LYS A 2 -3.615 0.194 1.607 1.00 1.00 H new ATOM 0 HG3 LYS A 2 -5.125 0.655 0.848 1.00 1.00 H new ATOM 0 HD2 LYS A 2 -4.224 -0.080 -1.362 1.00 1.00 H new ATOM 0 HD3 LYS A 2 -2.734 -0.570 -0.581 1.00 1.00 H new ATOM 0 HE2 LYS A 2 -3.980 -2.194 0.806 1.00 1.00 H new ATOM 0 HE3 LYS A 2 -5.485 -1.687 0.065 1.00 1.00 H new ATOM 0 HZ1 LYS A 2 -4.630 -3.677 -0.960 1.00 1.00 H new ATOM 0 HZ2 LYS A 2 -4.637 -2.401 -2.080 1.00 1.00 H new ATOM 0 HZ3 LYS A 2 -3.179 -2.893 -1.362 1.00 1.00 H new ATOM 44 N ASP A 3 -1.418 3.325 -1.667 1.00 1.00 N ATOM 45 CA ASP A 3 -1.024 4.568 -2.349 1.00 1.00 C ATOM 46 C ASP A 3 -2.233 5.404 -2.653 1.00 1.00 C ATOM 47 O ASP A 3 -2.148 6.475 -3.238 1.00 1.00 O ATOM 48 CB ASP A 3 -0.204 4.303 -3.620 1.00 1.00 C ATOM 49 CG ASP A 3 -1.002 3.676 -4.748 1.00 1.00 C ATOM 50 OD1 ASP A 3 -1.193 2.423 -4.723 1.00 1.00 O ATOM 51 OD2 ASP A 3 -1.417 4.398 -5.683 1.00 1.00 O ATOM 0 H ASP A 3 -1.633 2.551 -2.295 1.00 1.00 H new ATOM 0 HA ASP A 3 -0.376 5.121 -1.668 1.00 1.00 H new ATOM 0 HB2 ASP A 3 0.221 5.244 -3.969 1.00 1.00 H new ATOM 0 HB3 ASP A 3 0.631 3.648 -3.372 1.00 1.00 H new ATOM 56 N VAL A 4 -3.348 4.913 -2.232 1.00 1.00 N ATOM 57 CA VAL A 4 -4.590 5.575 -2.386 1.00 1.00 C ATOM 58 C VAL A 4 -5.243 5.702 -1.017 1.00 1.00 C ATOM 59 O VAL A 4 -5.269 4.737 -0.231 1.00 1.00 O ATOM 60 CB VAL A 4 -5.541 4.826 -3.381 1.00 1.00 C ATOM 61 CG1 VAL A 4 -4.929 4.748 -4.764 1.00 1.00 C ATOM 62 CG2 VAL A 4 -5.916 3.432 -2.887 1.00 1.00 C ATOM 0 H VAL A 4 -3.419 4.013 -1.758 1.00 1.00 H new ATOM 0 HA VAL A 4 -4.408 6.561 -2.813 1.00 1.00 H new ATOM 0 HB VAL A 4 -6.459 5.411 -3.436 1.00 1.00 H new ATOM 0 HG11 VAL A 4 -5.610 4.223 -5.434 1.00 1.00 H new ATOM 0 HG12 VAL A 4 -4.753 5.755 -5.141 1.00 1.00 H new ATOM 0 HG13 VAL A 4 -3.983 4.209 -4.713 1.00 1.00 H new ATOM 0 HG21 VAL A 4 -6.576 2.955 -3.611 1.00 1.00 H new ATOM 0 HG22 VAL A 4 -5.013 2.833 -2.768 1.00 1.00 H new ATOM 0 HG23 VAL A 4 -6.427 3.511 -1.928 1.00 1.00 H new ATOM 72 N GLU A 5 -5.714 6.867 -0.694 1.00 1.00 N ATOM 73 CA GLU A 5 -6.386 7.052 0.562 1.00 1.00 C ATOM 74 C GLU A 5 -7.871 7.249 0.364 1.00 1.00 C ATOM 75 O GLU A 5 -8.396 8.363 0.372 1.00 1.00 O ATOM 76 CB GLU A 5 -5.737 8.125 1.462 1.00 1.00 C ATOM 77 CG GLU A 5 -5.555 9.500 0.842 1.00 1.00 C ATOM 78 CD GLU A 5 -4.963 10.482 1.828 1.00 1.00 C ATOM 79 OE1 GLU A 5 -5.644 10.832 2.824 1.00 1.00 O ATOM 80 OE2 GLU A 5 -3.807 10.911 1.639 1.00 1.00 O ATOM 0 H GLU A 5 -5.648 7.702 -1.276 1.00 1.00 H new ATOM 0 HA GLU A 5 -6.260 6.126 1.123 1.00 1.00 H new ATOM 0 HB2 GLU A 5 -6.345 8.232 2.360 1.00 1.00 H new ATOM 0 HB3 GLU A 5 -4.760 7.760 1.780 1.00 1.00 H new ATOM 0 HG2 GLU A 5 -4.906 9.423 -0.030 1.00 1.00 H new ATOM 0 HG3 GLU A 5 -6.518 9.872 0.491 1.00 1.00 H new ATOM 87 N TYR A 6 -8.536 6.150 0.145 1.00 1.00 N ATOM 88 CA TYR A 6 -9.926 6.116 -0.024 1.00 1.00 C ATOM 89 C TYR A 6 -10.411 5.090 0.933 1.00 1.00 C ATOM 90 O TYR A 6 -9.591 4.498 1.643 1.00 1.00 O ATOM 91 CB TYR A 6 -10.303 5.816 -1.466 1.00 1.00 C ATOM 92 CG TYR A 6 -9.738 6.833 -2.426 1.00 1.00 C ATOM 93 CD1 TYR A 6 -10.243 8.125 -2.481 1.00 1.00 C ATOM 94 CD2 TYR A 6 -8.681 6.510 -3.253 1.00 1.00 C ATOM 95 CE1 TYR A 6 -9.710 9.059 -3.338 1.00 1.00 C ATOM 96 CE2 TYR A 6 -8.140 7.440 -4.116 1.00 1.00 C ATOM 97 CZ TYR A 6 -8.659 8.712 -4.154 1.00 1.00 C ATOM 98 OH TYR A 6 -8.123 9.641 -5.006 1.00 1.00 O ATOM 0 H TYR A 6 -8.093 5.233 0.081 1.00 1.00 H new ATOM 0 HA TYR A 6 -10.392 7.080 0.180 1.00 1.00 H new ATOM 0 HB2 TYR A 6 -9.941 4.824 -1.736 1.00 1.00 H new ATOM 0 HB3 TYR A 6 -11.389 5.795 -1.559 1.00 1.00 H new ATOM 0 HD1 TYR A 6 -11.068 8.401 -1.840 1.00 1.00 H new ATOM 0 HD2 TYR A 6 -8.270 5.512 -3.224 1.00 1.00 H new ATOM 0 HE1 TYR A 6 -10.115 10.060 -3.370 1.00 1.00 H new ATOM 0 HE2 TYR A 6 -7.314 7.170 -4.758 1.00 1.00 H new ATOM 0 HH TYR A 6 -7.388 9.236 -5.511 1.00 1.00 H new ATOM 108 N ARG A 7 -11.656 4.826 0.976 1.00 1.00 N ATOM 109 CA ARG A 7 -12.145 4.031 2.077 1.00 1.00 C ATOM 110 C ARG A 7 -12.652 2.687 1.657 1.00 1.00 C ATOM 111 O ARG A 7 -13.592 2.593 0.884 1.00 1.00 O ATOM 112 CB ARG A 7 -13.198 4.794 2.884 1.00 1.00 C ATOM 113 CG ARG A 7 -12.703 6.122 3.460 1.00 1.00 C ATOM 114 CD ARG A 7 -11.470 5.952 4.341 1.00 1.00 C ATOM 115 NE ARG A 7 -10.954 7.241 4.793 1.00 1.00 N ATOM 116 CZ ARG A 7 -9.699 7.488 5.178 1.00 1.00 C ATOM 117 NH1 ARG A 7 -8.803 6.512 5.229 1.00 1.00 N ATOM 118 NH2 ARG A 7 -9.352 8.713 5.530 1.00 1.00 N ATOM 0 H ARG A 7 -12.353 5.127 0.295 1.00 1.00 H new ATOM 0 HA ARG A 7 -11.286 3.842 2.721 1.00 1.00 H new ATOM 0 HB2 ARG A 7 -14.060 4.986 2.246 1.00 1.00 H new ATOM 0 HB3 ARG A 7 -13.542 4.161 3.702 1.00 1.00 H new ATOM 0 HG2 ARG A 7 -12.471 6.805 2.643 1.00 1.00 H new ATOM 0 HG3 ARG A 7 -13.501 6.582 4.042 1.00 1.00 H new ATOM 0 HD2 ARG A 7 -11.721 5.336 5.205 1.00 1.00 H new ATOM 0 HD3 ARG A 7 -10.695 5.423 3.786 1.00 1.00 H new ATOM 0 HE ARG A 7 -11.610 8.022 4.817 1.00 1.00 H new ATOM 0 HH11 ARG A 7 -9.069 5.561 4.973 1.00 1.00 H new ATOM 0 HH12 ARG A 7 -7.847 6.712 5.524 1.00 1.00 H new ATOM 0 HH21 ARG A 7 -10.041 9.465 5.507 1.00 1.00 H new ATOM 0 HH22 ARG A 7 -8.395 8.907 5.825 1.00 1.00 H new ATOM 132 N PRO A 8 -11.974 1.621 2.101 1.00 1.00 N ATOM 133 CA PRO A 8 -12.457 0.261 1.915 1.00 1.00 C ATOM 134 C PRO A 8 -13.817 0.119 2.586 1.00 1.00 C ATOM 135 O PRO A 8 -13.970 0.394 3.787 1.00 1.00 O ATOM 136 CB PRO A 8 -11.409 -0.602 2.629 1.00 1.00 C ATOM 137 CG PRO A 8 -10.188 0.248 2.704 1.00 1.00 C ATOM 138 CD PRO A 8 -10.667 1.669 2.772 1.00 1.00 C ATOM 0 HA PRO A 8 -12.581 -0.021 0.869 1.00 1.00 H new ATOM 0 HB2 PRO A 8 -11.749 -0.892 3.623 1.00 1.00 H new ATOM 0 HB3 PRO A 8 -11.215 -1.522 2.078 1.00 1.00 H new ATOM 0 HG2 PRO A 8 -9.592 -0.004 3.581 1.00 1.00 H new ATOM 0 HG3 PRO A 8 -9.552 0.093 1.832 1.00 1.00 H new ATOM 0 HD2 PRO A 8 -10.757 2.014 3.802 1.00 1.00 H new ATOM 0 HD3 PRO A 8 -9.981 2.349 2.267 1.00 1.00 H new ATOM 146 N LEU A 9 -14.770 -0.307 1.834 1.00 1.00 N ATOM 147 CA LEU A 9 -16.126 -0.393 2.265 1.00 1.00 C ATOM 148 C LEU A 9 -16.615 -1.810 2.130 1.00 1.00 C ATOM 149 O LEU A 9 -16.018 -2.607 1.407 1.00 1.00 O ATOM 150 CB LEU A 9 -16.988 0.514 1.396 1.00 1.00 C ATOM 151 CG LEU A 9 -18.342 0.867 1.965 1.00 1.00 C ATOM 152 CD1 LEU A 9 -18.226 2.024 2.924 1.00 1.00 C ATOM 153 CD2 LEU A 9 -19.334 1.150 0.871 1.00 1.00 C ATOM 0 H LEU A 9 -14.626 -0.615 0.872 1.00 1.00 H new ATOM 0 HA LEU A 9 -16.192 -0.083 3.308 1.00 1.00 H new ATOM 0 HB2 LEU A 9 -16.440 1.438 1.210 1.00 1.00 H new ATOM 0 HB3 LEU A 9 -17.134 0.030 0.430 1.00 1.00 H new ATOM 0 HG LEU A 9 -18.715 0.008 2.522 1.00 1.00 H new ATOM 0 HD11 LEU A 9 -19.211 2.265 3.324 1.00 1.00 H new ATOM 0 HD12 LEU A 9 -17.558 1.753 3.742 1.00 1.00 H new ATOM 0 HD13 LEU A 9 -17.825 2.892 2.400 1.00 1.00 H new ATOM 0 HD21 LEU A 9 -20.299 1.401 1.311 1.00 1.00 H new ATOM 0 HD22 LEU A 9 -18.982 1.987 0.268 1.00 1.00 H new ATOM 0 HD23 LEU A 9 -19.441 0.268 0.240 1.00 1.00 H new ATOM 165 N THR A 10 -17.684 -2.118 2.812 1.00 1.00 N ATOM 166 CA THR A 10 -18.271 -3.428 2.742 1.00 1.00 C ATOM 167 C THR A 10 -19.605 -3.348 1.985 1.00 1.00 C ATOM 168 O THR A 10 -20.439 -2.482 2.269 1.00 1.00 O ATOM 169 CB THR A 10 -18.488 -4.015 4.158 1.00 1.00 C ATOM 170 OG1 THR A 10 -17.235 -4.019 4.870 1.00 1.00 O ATOM 171 CG2 THR A 10 -19.024 -5.443 4.082 1.00 1.00 C ATOM 0 H THR A 10 -18.172 -1.470 3.430 1.00 1.00 H new ATOM 0 HA THR A 10 -17.590 -4.091 2.208 1.00 1.00 H new ATOM 0 HB THR A 10 -19.218 -3.396 4.679 1.00 1.00 H new ATOM 0 HG1 THR A 10 -17.370 -4.389 5.768 1.00 1.00 H new ATOM 0 HG21 THR A 10 -19.168 -5.832 5.090 1.00 1.00 H new ATOM 0 HG22 THR A 10 -19.977 -5.446 3.553 1.00 1.00 H new ATOM 0 HG23 THR A 10 -18.311 -6.071 3.549 1.00 1.00 H new ATOM 179 N LEU A 11 -19.755 -4.191 1.000 1.00 1.00 N ATOM 180 CA LEU A 11 -20.945 -4.281 0.201 1.00 1.00 C ATOM 181 C LEU A 11 -21.465 -5.688 0.167 1.00 1.00 C ATOM 182 O LEU A 11 -20.704 -6.640 0.259 1.00 1.00 O ATOM 183 CB LEU A 11 -20.682 -3.833 -1.218 1.00 1.00 C ATOM 184 CG LEU A 11 -20.571 -2.358 -1.438 1.00 1.00 C ATOM 185 CD1 LEU A 11 -20.280 -2.080 -2.896 1.00 1.00 C ATOM 186 CD2 LEU A 11 -21.855 -1.697 -1.006 1.00 1.00 C ATOM 0 H LEU A 11 -19.030 -4.854 0.724 1.00 1.00 H new ATOM 0 HA LEU A 11 -21.687 -3.627 0.659 1.00 1.00 H new ATOM 0 HB2 LEU A 11 -19.758 -4.300 -1.558 1.00 1.00 H new ATOM 0 HB3 LEU A 11 -21.483 -4.214 -1.851 1.00 1.00 H new ATOM 0 HG LEU A 11 -19.751 -1.951 -0.846 1.00 1.00 H new ATOM 0 HD11 LEU A 11 -20.200 -1.004 -3.052 1.00 1.00 H new ATOM 0 HD12 LEU A 11 -19.342 -2.558 -3.177 1.00 1.00 H new ATOM 0 HD13 LEU A 11 -21.088 -2.477 -3.510 1.00 1.00 H new ATOM 0 HD21 LEU A 11 -21.781 -0.621 -1.164 1.00 1.00 H new ATOM 0 HD22 LEU A 11 -22.684 -2.094 -1.593 1.00 1.00 H new ATOM 0 HD23 LEU A 11 -22.030 -1.898 0.051 1.00 1.00 H new ATOM 198 N ASN A 12 -22.740 -5.819 0.034 1.00 1.00 N ATOM 199 CA ASN A 12 -23.348 -7.102 -0.076 1.00 1.00 C ATOM 200 C ASN A 12 -23.521 -7.445 -1.541 1.00 1.00 C ATOM 201 O ASN A 12 -24.260 -6.763 -2.256 1.00 1.00 O ATOM 202 CB ASN A 12 -24.692 -7.093 0.615 1.00 1.00 C ATOM 203 CG ASN A 12 -25.360 -8.448 0.585 1.00 1.00 C ATOM 204 OD1 ASN A 12 -26.107 -8.716 -0.450 1.00 1.00 O flip ATOM 205 ND2 ASN A 12 -25.190 -9.257 1.488 1.00 1.00 N flip ATOM 0 H ASN A 12 -23.394 -5.037 -0.002 1.00 1.00 H new ATOM 0 HA ASN A 12 -22.714 -7.850 0.400 1.00 1.00 H new ATOM 0 HB2 ASN A 12 -24.564 -6.776 1.650 1.00 1.00 H new ATOM 0 HB3 ASN A 12 -25.340 -6.360 0.135 1.00 1.00 H new ATOM 0 HD21 ASN A 12 -24.599 -9.016 2.284 1.00 1.00 H new ATOM 0 HD22 ASN A 12 -25.639 -10.172 1.444 1.00 1.00 H new ATOM 212 N ALA A 13 -22.846 -8.483 -1.988 1.00 1.00 N ATOM 213 CA ALA A 13 -22.921 -8.915 -3.371 1.00 1.00 C ATOM 214 C ALA A 13 -24.156 -9.721 -3.563 1.00 1.00 C ATOM 215 O ALA A 13 -24.338 -10.750 -2.899 1.00 1.00 O ATOM 216 CB ALA A 13 -21.713 -9.762 -3.744 1.00 1.00 C ATOM 0 H ALA A 13 -22.231 -9.051 -1.406 1.00 1.00 H new ATOM 0 HA ALA A 13 -22.938 -8.032 -4.010 1.00 1.00 H new ATOM 0 HB1 ALA A 13 -21.794 -10.073 -4.786 1.00 1.00 H new ATOM 0 HB2 ALA A 13 -20.803 -9.177 -3.610 1.00 1.00 H new ATOM 0 HB3 ALA A 13 -21.675 -10.644 -3.104 1.00 1.00 H new ATOM 222 N LEU A 14 -25.000 -9.276 -4.439 1.00 1.00 N ATOM 223 CA LEU A 14 -26.224 -9.948 -4.701 1.00 1.00 C ATOM 224 C LEU A 14 -26.631 -9.668 -6.139 1.00 1.00 C ATOM 225 O LEU A 14 -26.251 -8.644 -6.702 1.00 1.00 O ATOM 226 CB LEU A 14 -27.277 -9.429 -3.728 1.00 1.00 C ATOM 227 CG LEU A 14 -28.600 -10.160 -3.704 1.00 1.00 C ATOM 228 CD1 LEU A 14 -28.382 -11.622 -3.352 1.00 1.00 C ATOM 229 CD2 LEU A 14 -29.520 -9.498 -2.701 1.00 1.00 C ATOM 0 H LEU A 14 -24.855 -8.432 -4.993 1.00 1.00 H new ATOM 0 HA LEU A 14 -26.120 -11.025 -4.568 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -26.855 -9.457 -2.723 1.00 1.00 H new ATOM 0 HB3 LEU A 14 -27.471 -8.383 -3.963 1.00 1.00 H new ATOM 0 HG LEU A 14 -29.061 -10.114 -4.691 1.00 1.00 H new ATOM 0 HD11 LEU A 14 -29.341 -12.140 -3.337 1.00 1.00 H new ATOM 0 HD12 LEU A 14 -27.732 -12.083 -4.096 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -27.916 -11.694 -2.369 1.00 1.00 H new ATOM 0 HD21 LEU A 14 -30.475 -10.023 -2.681 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -29.065 -9.535 -1.711 1.00 1.00 H new ATOM 0 HD23 LEU A 14 -29.683 -8.459 -2.987 1.00 1.00 H new ATOM 241 N LEU A 15 -27.357 -10.562 -6.746 1.00 1.00 N ATOM 242 CA LEU A 15 -27.812 -10.339 -8.090 1.00 1.00 C ATOM 243 C LEU A 15 -29.324 -10.404 -8.162 1.00 1.00 C ATOM 244 O LEU A 15 -29.957 -11.179 -7.446 1.00 1.00 O ATOM 245 CB LEU A 15 -27.099 -11.257 -9.123 1.00 1.00 C ATOM 246 CG LEU A 15 -27.745 -12.601 -9.473 1.00 1.00 C ATOM 247 CD1 LEU A 15 -27.039 -13.218 -10.669 1.00 1.00 C ATOM 248 CD2 LEU A 15 -27.680 -13.551 -8.301 1.00 1.00 C ATOM 0 H LEU A 15 -27.646 -11.449 -6.335 1.00 1.00 H new ATOM 0 HA LEU A 15 -27.526 -9.327 -8.377 1.00 1.00 H new ATOM 0 HB2 LEU A 15 -26.988 -10.691 -10.048 1.00 1.00 H new ATOM 0 HB3 LEU A 15 -26.095 -11.459 -8.750 1.00 1.00 H new ATOM 0 HG LEU A 15 -28.792 -12.423 -9.718 1.00 1.00 H new ATOM 0 HD11 LEU A 15 -27.503 -14.174 -10.913 1.00 1.00 H new ATOM 0 HD12 LEU A 15 -27.119 -12.547 -11.524 1.00 1.00 H new ATOM 0 HD13 LEU A 15 -25.988 -13.376 -10.429 1.00 1.00 H new ATOM 0 HD21 LEU A 15 -28.145 -14.498 -8.574 1.00 1.00 H new ATOM 0 HD22 LEU A 15 -26.638 -13.723 -8.029 1.00 1.00 H new ATOM 0 HD23 LEU A 15 -28.210 -13.118 -7.452 1.00 1.00 H new ATOM 260 N ALA A 16 -29.898 -9.564 -8.984 1.00 1.00 N ATOM 261 CA ALA A 16 -31.324 -9.494 -9.134 1.00 1.00 C ATOM 262 C ALA A 16 -31.725 -9.859 -10.554 1.00 1.00 C ATOM 263 O ALA A 16 -32.711 -9.360 -11.078 1.00 1.00 O ATOM 264 CB ALA A 16 -31.798 -8.103 -8.769 1.00 1.00 C ATOM 0 H ALA A 16 -29.384 -8.906 -9.570 1.00 1.00 H new ATOM 0 HA ALA A 16 -31.798 -10.211 -8.464 1.00 1.00 H new ATOM 0 HB1 ALA A 16 -32.881 -8.046 -8.882 1.00 1.00 H new ATOM 0 HB2 ALA A 16 -31.529 -7.887 -7.735 1.00 1.00 H new ATOM 0 HB3 ALA A 16 -31.326 -7.373 -9.427 1.00 1.00 H new ATOM 270 N VAL A 17 -30.959 -10.751 -11.156 1.00 1.00 N ATOM 271 CA VAL A 17 -31.157 -11.179 -12.486 1.00 1.00 C ATOM 272 C VAL A 17 -32.487 -11.938 -12.651 1.00 1.00 C ATOM 273 O VAL A 17 -33.244 -11.675 -13.593 1.00 1.00 O ATOM 274 CB VAL A 17 -29.956 -12.036 -12.912 1.00 1.00 C ATOM 275 CG1 VAL A 17 -30.255 -12.784 -14.149 1.00 1.00 C ATOM 276 CG2 VAL A 17 -28.731 -11.161 -13.113 1.00 1.00 C ATOM 0 H VAL A 17 -30.164 -11.198 -10.699 1.00 1.00 H new ATOM 0 HA VAL A 17 -31.226 -10.307 -13.137 1.00 1.00 H new ATOM 0 HB VAL A 17 -29.752 -12.755 -12.118 1.00 1.00 H new ATOM 0 HG11 VAL A 17 -29.389 -13.383 -14.430 1.00 1.00 H new ATOM 0 HG12 VAL A 17 -31.110 -13.439 -13.981 1.00 1.00 H new ATOM 0 HG13 VAL A 17 -30.487 -12.083 -14.951 1.00 1.00 H new ATOM 0 HG21 VAL A 17 -27.887 -11.781 -13.415 1.00 1.00 H new ATOM 0 HG22 VAL A 17 -28.935 -10.423 -13.889 1.00 1.00 H new ATOM 0 HG23 VAL A 17 -28.491 -10.651 -12.180 1.00 1.00 H new ATOM 286 N GLY A 18 -32.772 -12.841 -11.740 1.00 1.00 N ATOM 287 CA GLY A 18 -34.007 -13.579 -11.838 1.00 1.00 C ATOM 288 C GLY A 18 -34.152 -14.653 -10.784 1.00 1.00 C ATOM 289 O GLY A 18 -34.676 -14.391 -9.706 1.00 1.00 O ATOM 0 H GLY A 18 -32.181 -13.077 -10.943 1.00 1.00 H new ATOM 0 HA2 GLY A 18 -34.843 -12.885 -11.756 1.00 1.00 H new ATOM 0 HA3 GLY A 18 -34.070 -14.038 -12.825 1.00 1.00 H new ATOM 293 N PRO A 19 -33.651 -15.871 -11.053 1.00 1.00 N ATOM 294 CA PRO A 19 -33.828 -17.032 -10.151 1.00 1.00 C ATOM 295 C PRO A 19 -33.211 -16.820 -8.771 1.00 1.00 C ATOM 296 O PRO A 19 -33.698 -17.332 -7.771 1.00 1.00 O ATOM 297 CB PRO A 19 -33.099 -18.163 -10.884 1.00 1.00 C ATOM 298 CG PRO A 19 -32.152 -17.472 -11.797 1.00 1.00 C ATOM 299 CD PRO A 19 -32.859 -16.232 -12.245 1.00 1.00 C ATOM 0 HA PRO A 19 -34.883 -17.227 -9.957 1.00 1.00 H new ATOM 0 HB2 PRO A 19 -32.572 -18.813 -10.185 1.00 1.00 H new ATOM 0 HB3 PRO A 19 -33.797 -18.790 -11.438 1.00 1.00 H new ATOM 0 HG2 PRO A 19 -31.221 -17.229 -11.285 1.00 1.00 H new ATOM 0 HG3 PRO A 19 -31.894 -18.105 -12.646 1.00 1.00 H new ATOM 0 HD2 PRO A 19 -32.160 -15.443 -12.522 1.00 1.00 H new ATOM 0 HD3 PRO A 19 -33.492 -16.416 -13.113 1.00 1.00 H new ATOM 307 N GLY A 20 -32.159 -16.054 -8.727 1.00 1.00 N ATOM 308 CA GLY A 20 -31.495 -15.798 -7.489 1.00 1.00 C ATOM 309 C GLY A 20 -31.644 -14.366 -7.070 1.00 1.00 C ATOM 310 O GLY A 20 -30.818 -13.843 -6.319 1.00 1.00 O ATOM 0 H GLY A 20 -31.744 -15.596 -9.539 1.00 1.00 H new ATOM 0 HA2 GLY A 20 -31.903 -16.449 -6.715 1.00 1.00 H new ATOM 0 HA3 GLY A 20 -30.437 -16.042 -7.585 1.00 1.00 H new ATOM 314 N ALA A 21 -32.718 -13.728 -7.525 1.00 1.00 N ATOM 315 CA ALA A 21 -32.933 -12.308 -7.273 1.00 1.00 C ATOM 316 C ALA A 21 -33.247 -12.001 -5.815 1.00 1.00 C ATOM 317 O ALA A 21 -34.407 -11.903 -5.412 1.00 1.00 O ATOM 318 CB ALA A 21 -33.998 -11.729 -8.184 1.00 1.00 C ATOM 0 H ALA A 21 -33.455 -14.174 -8.072 1.00 1.00 H new ATOM 0 HA ALA A 21 -31.985 -11.822 -7.502 1.00 1.00 H new ATOM 0 HB1 ALA A 21 -34.128 -10.669 -7.964 1.00 1.00 H new ATOM 0 HB2 ALA A 21 -33.692 -11.849 -9.223 1.00 1.00 H new ATOM 0 HB3 ALA A 21 -34.940 -12.252 -8.020 1.00 1.00 H new ATOM 324 N GLY A 22 -32.207 -11.903 -5.034 1.00 1.00 N ATOM 325 CA GLY A 22 -32.325 -11.508 -3.658 1.00 1.00 C ATOM 326 C GLY A 22 -32.204 -12.690 -2.776 1.00 1.00 C ATOM 327 O GLY A 22 -32.231 -12.586 -1.558 1.00 1.00 O ATOM 0 H GLY A 22 -31.251 -12.095 -5.335 1.00 1.00 H new ATOM 0 HA2 GLY A 22 -31.551 -10.781 -3.413 1.00 1.00 H new ATOM 0 HA3 GLY A 22 -33.285 -11.019 -3.493 1.00 1.00 H new ATOM 331 N GLU A 23 -32.018 -13.818 -3.401 1.00 1.00 N ATOM 332 CA GLU A 23 -31.993 -15.068 -2.719 1.00 1.00 C ATOM 333 C GLU A 23 -30.821 -15.931 -3.187 1.00 1.00 C ATOM 334 O GLU A 23 -30.829 -17.151 -3.040 1.00 1.00 O ATOM 335 CB GLU A 23 -33.307 -15.767 -2.998 1.00 1.00 C ATOM 336 CG GLU A 23 -33.640 -15.900 -4.476 1.00 1.00 C ATOM 337 CD GLU A 23 -34.992 -16.521 -4.720 1.00 1.00 C ATOM 338 OE1 GLU A 23 -35.192 -17.698 -4.358 1.00 1.00 O ATOM 339 OE2 GLU A 23 -35.872 -15.841 -5.279 1.00 1.00 O ATOM 0 H GLU A 23 -31.879 -13.890 -4.409 1.00 1.00 H new ATOM 0 HA GLU A 23 -31.862 -14.904 -1.649 1.00 1.00 H new ATOM 0 HB2 GLU A 23 -33.279 -16.761 -2.552 1.00 1.00 H new ATOM 0 HB3 GLU A 23 -34.109 -15.219 -2.504 1.00 1.00 H new ATOM 0 HG2 GLU A 23 -33.610 -14.914 -4.940 1.00 1.00 H new ATOM 0 HG3 GLU A 23 -32.875 -16.505 -4.962 1.00 1.00 H new ATOM 346 N ALA A 24 -29.820 -15.295 -3.739 1.00 1.00 N ATOM 347 CA ALA A 24 -28.692 -16.019 -4.291 1.00 1.00 C ATOM 348 C ALA A 24 -27.695 -16.420 -3.225 1.00 1.00 C ATOM 349 O ALA A 24 -27.556 -17.603 -2.903 1.00 1.00 O ATOM 350 CB ALA A 24 -28.012 -15.209 -5.365 1.00 1.00 C ATOM 0 H ALA A 24 -29.758 -14.280 -3.821 1.00 1.00 H new ATOM 0 HA ALA A 24 -29.085 -16.935 -4.733 1.00 1.00 H new ATOM 0 HB1 ALA A 24 -27.168 -15.771 -5.765 1.00 1.00 H new ATOM 0 HB2 ALA A 24 -28.721 -14.999 -6.166 1.00 1.00 H new ATOM 0 HB3 ALA A 24 -27.654 -14.271 -4.941 1.00 1.00 H new ATOM 356 N GLN A 25 -27.011 -15.439 -2.672 1.00 1.00 N ATOM 357 CA GLN A 25 -25.981 -15.692 -1.684 1.00 1.00 C ATOM 358 C GLN A 25 -25.880 -14.560 -0.675 1.00 1.00 C ATOM 359 O GLN A 25 -25.925 -14.800 0.525 1.00 1.00 O ATOM 360 CB GLN A 25 -24.600 -15.958 -2.348 1.00 1.00 C ATOM 361 CG GLN A 25 -24.435 -15.420 -3.785 1.00 1.00 C ATOM 362 CD GLN A 25 -24.420 -13.914 -3.873 1.00 1.00 C ATOM 363 OE1 GLN A 25 -25.469 -13.278 -3.969 1.00 1.00 O ATOM 364 NE2 GLN A 25 -23.257 -13.335 -3.855 1.00 1.00 N ATOM 0 H GLN A 25 -27.151 -14.453 -2.892 1.00 1.00 H new ATOM 0 HA GLN A 25 -26.275 -16.594 -1.148 1.00 1.00 H new ATOM 0 HB2 GLN A 25 -23.825 -15.515 -1.722 1.00 1.00 H new ATOM 0 HB3 GLN A 25 -24.424 -17.034 -2.360 1.00 1.00 H new ATOM 0 HG2 GLN A 25 -23.507 -15.808 -4.204 1.00 1.00 H new ATOM 0 HG3 GLN A 25 -25.248 -15.803 -4.402 1.00 1.00 H new ATOM 0 HE21 GLN A 25 -22.409 -13.896 -3.774 1.00 1.00 H new ATOM 0 HE22 GLN A 25 -23.192 -12.319 -3.922 1.00 1.00 H new ATOM 373 N GLY A 26 -25.757 -13.333 -1.162 1.00 1.00 N ATOM 374 CA GLY A 26 -25.596 -12.203 -0.276 1.00 1.00 C ATOM 375 C GLY A 26 -24.255 -12.263 0.421 1.00 1.00 C ATOM 376 O GLY A 26 -24.174 -12.480 1.629 1.00 1.00 O ATOM 0 H GLY A 26 -25.766 -13.102 -2.156 1.00 1.00 H new ATOM 0 HA2 GLY A 26 -25.677 -11.275 -0.842 1.00 1.00 H new ATOM 0 HA3 GLY A 26 -26.397 -12.196 0.463 1.00 1.00 H new ATOM 380 N VAL A 27 -23.201 -12.083 -0.339 1.00 1.00 N ATOM 381 CA VAL A 27 -21.851 -12.217 0.202 1.00 1.00 C ATOM 382 C VAL A 27 -21.251 -10.853 0.419 1.00 1.00 C ATOM 383 O VAL A 27 -21.259 -10.033 -0.486 1.00 1.00 O ATOM 384 CB VAL A 27 -20.938 -13.035 -0.748 1.00 1.00 C ATOM 385 CG1 VAL A 27 -19.585 -13.332 -0.106 1.00 1.00 C ATOM 386 CG2 VAL A 27 -21.624 -14.313 -1.151 1.00 1.00 C ATOM 0 H VAL A 27 -23.241 -11.844 -1.330 1.00 1.00 H new ATOM 0 HA VAL A 27 -21.922 -12.749 1.151 1.00 1.00 H new ATOM 0 HB VAL A 27 -20.754 -12.434 -1.639 1.00 1.00 H new ATOM 0 HG11 VAL A 27 -18.971 -13.907 -0.800 1.00 1.00 H new ATOM 0 HG12 VAL A 27 -19.082 -12.395 0.133 1.00 1.00 H new ATOM 0 HG13 VAL A 27 -19.734 -13.907 0.808 1.00 1.00 H new ATOM 0 HG21 VAL A 27 -20.975 -14.880 -1.818 1.00 1.00 H new ATOM 0 HG22 VAL A 27 -21.839 -14.907 -0.262 1.00 1.00 H new ATOM 0 HG23 VAL A 27 -22.556 -14.079 -1.665 1.00 1.00 H new ATOM 396 N PRO A 28 -20.751 -10.571 1.614 1.00 1.00 N ATOM 397 CA PRO A 28 -20.132 -9.301 1.893 1.00 1.00 C ATOM 398 C PRO A 28 -18.733 -9.202 1.263 1.00 1.00 C ATOM 399 O PRO A 28 -17.775 -9.852 1.703 1.00 1.00 O ATOM 400 CB PRO A 28 -20.058 -9.256 3.417 1.00 1.00 C ATOM 401 CG PRO A 28 -20.035 -10.684 3.850 1.00 1.00 C ATOM 402 CD PRO A 28 -20.770 -11.464 2.796 1.00 1.00 C ATOM 0 HA PRO A 28 -20.693 -8.465 1.474 1.00 1.00 H new ATOM 0 HB2 PRO A 28 -19.165 -8.728 3.752 1.00 1.00 H new ATOM 0 HB3 PRO A 28 -20.916 -8.731 3.838 1.00 1.00 H new ATOM 0 HG2 PRO A 28 -19.010 -11.041 3.953 1.00 1.00 H new ATOM 0 HG3 PRO A 28 -20.513 -10.802 4.823 1.00 1.00 H new ATOM 0 HD2 PRO A 28 -20.279 -12.414 2.587 1.00 1.00 H new ATOM 0 HD3 PRO A 28 -21.789 -11.694 3.107 1.00 1.00 H new ATOM 410 N VAL A 29 -18.645 -8.399 0.245 1.00 1.00 N ATOM 411 CA VAL A 29 -17.414 -8.148 -0.482 1.00 1.00 C ATOM 412 C VAL A 29 -16.903 -6.753 -0.116 1.00 1.00 C ATOM 413 O VAL A 29 -17.687 -5.893 0.297 1.00 1.00 O ATOM 414 CB VAL A 29 -17.670 -8.210 -2.026 1.00 1.00 C ATOM 415 CG1 VAL A 29 -16.385 -8.047 -2.828 1.00 1.00 C ATOM 416 CG2 VAL A 29 -18.379 -9.501 -2.407 1.00 1.00 C ATOM 0 H VAL A 29 -19.444 -7.881 -0.121 1.00 1.00 H new ATOM 0 HA VAL A 29 -16.679 -8.907 -0.215 1.00 1.00 H new ATOM 0 HB VAL A 29 -18.318 -7.370 -2.276 1.00 1.00 H new ATOM 0 HG11 VAL A 29 -16.612 -8.097 -3.893 1.00 1.00 H new ATOM 0 HG12 VAL A 29 -15.932 -7.082 -2.598 1.00 1.00 H new ATOM 0 HG13 VAL A 29 -15.690 -8.845 -2.568 1.00 1.00 H new ATOM 0 HG21 VAL A 29 -18.546 -9.520 -3.484 1.00 1.00 H new ATOM 0 HG22 VAL A 29 -17.763 -10.353 -2.120 1.00 1.00 H new ATOM 0 HG23 VAL A 29 -19.337 -9.556 -1.891 1.00 1.00 H new ATOM 426 N LYS A 30 -15.612 -6.533 -0.242 1.00 1.00 N ATOM 427 CA LYS A 30 -15.054 -5.234 0.038 1.00 1.00 C ATOM 428 C LYS A 30 -14.664 -4.539 -1.230 1.00 1.00 C ATOM 429 O LYS A 30 -14.184 -5.165 -2.187 1.00 1.00 O ATOM 430 CB LYS A 30 -13.879 -5.270 1.013 1.00 1.00 C ATOM 431 CG LYS A 30 -14.260 -5.649 2.418 1.00 1.00 C ATOM 432 CD LYS A 30 -13.059 -5.587 3.334 1.00 1.00 C ATOM 433 CE LYS A 30 -13.419 -5.986 4.758 1.00 1.00 C ATOM 434 NZ LYS A 30 -14.005 -7.345 4.828 1.00 1.00 N ATOM 0 H LYS A 30 -14.934 -7.236 -0.536 1.00 1.00 H new ATOM 0 HA LYS A 30 -15.843 -4.668 0.532 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -13.137 -5.979 0.645 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -13.403 -4.289 1.029 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -15.037 -4.977 2.783 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -14.679 -6.655 2.427 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -12.279 -6.248 2.957 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -12.650 -4.577 3.331 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -12.526 -5.945 5.382 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -14.127 -5.265 5.167 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -13.999 -7.675 5.814 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -14.984 -7.320 4.477 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -13.444 -7.996 4.242 1.00 1.00 H new ATOM 448 N VAL A 31 -14.854 -3.271 -1.223 1.00 1.00 N ATOM 449 CA VAL A 31 -14.628 -2.420 -2.357 1.00 1.00 C ATOM 450 C VAL A 31 -14.018 -1.108 -1.835 1.00 1.00 C ATOM 451 O VAL A 31 -13.995 -0.898 -0.632 1.00 1.00 O ATOM 452 CB VAL A 31 -15.992 -2.170 -3.063 1.00 1.00 C ATOM 453 CG1 VAL A 31 -16.921 -1.338 -2.204 1.00 1.00 C ATOM 454 CG2 VAL A 31 -15.834 -1.572 -4.439 1.00 1.00 C ATOM 0 H VAL A 31 -15.184 -2.767 -0.400 1.00 1.00 H new ATOM 0 HA VAL A 31 -13.947 -2.870 -3.079 1.00 1.00 H new ATOM 0 HB VAL A 31 -16.451 -3.149 -3.199 1.00 1.00 H new ATOM 0 HG11 VAL A 31 -17.863 -1.184 -2.730 1.00 1.00 H new ATOM 0 HG12 VAL A 31 -17.111 -1.857 -1.265 1.00 1.00 H new ATOM 0 HG13 VAL A 31 -16.459 -0.373 -1.998 1.00 1.00 H new ATOM 0 HG21 VAL A 31 -16.817 -1.419 -4.884 1.00 1.00 H new ATOM 0 HG22 VAL A 31 -15.317 -0.615 -4.363 1.00 1.00 H new ATOM 0 HG23 VAL A 31 -15.253 -2.249 -5.065 1.00 1.00 H new ATOM 464 N LEU A 32 -13.488 -0.279 -2.689 1.00 1.00 N ATOM 465 CA LEU A 32 -12.955 1.004 -2.250 1.00 1.00 C ATOM 466 C LEU A 32 -13.974 2.074 -2.555 1.00 1.00 C ATOM 467 O LEU A 32 -14.787 1.920 -3.458 1.00 1.00 O ATOM 468 CB LEU A 32 -11.669 1.361 -2.994 1.00 1.00 C ATOM 469 CG LEU A 32 -10.697 2.317 -2.298 1.00 1.00 C ATOM 470 CD1 LEU A 32 -10.126 1.698 -1.035 1.00 1.00 C ATOM 471 CD2 LEU A 32 -9.582 2.707 -3.251 1.00 1.00 C ATOM 0 H LEU A 32 -13.408 -0.456 -3.690 1.00 1.00 H new ATOM 0 HA LEU A 32 -12.740 0.937 -1.184 1.00 1.00 H new ATOM 0 HB2 LEU A 32 -11.136 0.435 -3.209 1.00 1.00 H new ATOM 0 HB3 LEU A 32 -11.945 1.800 -3.953 1.00 1.00 H new ATOM 0 HG LEU A 32 -11.247 3.213 -2.009 1.00 1.00 H new ATOM 0 HD11 LEU A 32 -9.439 2.401 -0.564 1.00 1.00 H new ATOM 0 HD12 LEU A 32 -10.937 1.465 -0.345 1.00 1.00 H new ATOM 0 HD13 LEU A 32 -9.591 0.783 -1.288 1.00 1.00 H new ATOM 0 HD21 LEU A 32 -8.895 3.387 -2.748 1.00 1.00 H new ATOM 0 HD22 LEU A 32 -9.043 1.813 -3.565 1.00 1.00 H new ATOM 0 HD23 LEU A 32 -10.007 3.201 -4.125 1.00 1.00 H new ATOM 483 N ASP A 33 -13.895 3.170 -1.838 1.00 1.00 N ATOM 484 CA ASP A 33 -14.799 4.325 -2.027 1.00 1.00 C ATOM 485 C ASP A 33 -14.620 4.890 -3.432 1.00 1.00 C ATOM 486 O ASP A 33 -15.593 5.388 -4.074 1.00 1.00 O ATOM 487 CB ASP A 33 -14.475 5.381 -0.954 1.00 1.00 C ATOM 488 CG ASP A 33 -15.298 6.661 -1.022 1.00 1.00 C ATOM 489 OD1 ASP A 33 -16.490 6.657 -0.652 1.00 1.00 O ATOM 490 OD2 ASP A 33 -14.732 7.702 -1.389 1.00 1.00 O ATOM 0 H ASP A 33 -13.205 3.305 -1.099 1.00 1.00 H new ATOM 0 HA ASP A 33 -15.840 4.020 -1.920 1.00 1.00 H new ATOM 0 HB2 ASP A 33 -14.617 4.931 0.028 1.00 1.00 H new ATOM 0 HB3 ASP A 33 -13.420 5.644 -1.035 1.00 1.00 H new ATOM 495 N CYS A 34 -13.378 4.733 -3.932 1.00 1.00 N ATOM 496 CA CYS A 34 -12.955 5.246 -5.219 1.00 1.00 C ATOM 497 C CYS A 34 -13.163 4.252 -6.327 1.00 1.00 C ATOM 498 O CYS A 34 -12.810 4.524 -7.466 1.00 1.00 O ATOM 499 CB CYS A 34 -11.494 5.644 -5.165 1.00 1.00 C ATOM 500 SG CYS A 34 -11.076 7.110 -6.122 1.00 1.00 S ATOM 0 H CYS A 34 -12.640 4.236 -3.433 1.00 1.00 H new ATOM 0 HA CYS A 34 -13.573 6.117 -5.435 1.00 1.00 H new ATOM 0 HB2 CYS A 34 -11.217 5.815 -4.125 1.00 1.00 H new ATOM 0 HB3 CYS A 34 -10.891 4.809 -5.523 1.00 1.00 H new ATOM 0 HG CYS A 34 -10.161 7.790 -5.497 1.00 1.00 H new ATOM 506 N ASP A 35 -13.710 3.099 -6.015 1.00 1.00 N ATOM 507 CA ASP A 35 -13.988 2.150 -7.045 1.00 1.00 C ATOM 508 C ASP A 35 -15.135 2.631 -7.847 1.00 1.00 C ATOM 509 O ASP A 35 -16.139 3.134 -7.302 1.00 1.00 O ATOM 510 CB ASP A 35 -14.277 0.746 -6.512 1.00 1.00 C ATOM 511 CG ASP A 35 -13.035 -0.101 -6.334 1.00 1.00 C ATOM 512 OD1 ASP A 35 -12.247 -0.231 -7.286 1.00 1.00 O ATOM 513 OD2 ASP A 35 -12.829 -0.661 -5.249 1.00 1.00 O ATOM 0 H ASP A 35 -13.964 2.808 -5.071 1.00 1.00 H new ATOM 0 HA ASP A 35 -13.092 2.067 -7.660 1.00 1.00 H new ATOM 0 HB2 ASP A 35 -14.791 0.828 -5.554 1.00 1.00 H new ATOM 0 HB3 ASP A 35 -14.957 0.239 -7.196 1.00 1.00 H new ATOM 518 N THR A 36 -15.000 2.510 -9.105 1.00 1.00 N ATOM 519 CA THR A 36 -16.000 2.918 -10.005 1.00 1.00 C ATOM 520 C THR A 36 -17.022 1.817 -10.095 1.00 1.00 C ATOM 521 O THR A 36 -16.785 0.720 -9.604 1.00 1.00 O ATOM 522 CB THR A 36 -15.402 3.212 -11.393 1.00 1.00 C ATOM 523 OG1 THR A 36 -14.777 2.033 -11.895 1.00 1.00 O ATOM 524 CG2 THR A 36 -14.368 4.328 -11.301 1.00 1.00 C ATOM 0 H THR A 36 -14.172 2.115 -9.551 1.00 1.00 H new ATOM 0 HA THR A 36 -16.465 3.837 -9.650 1.00 1.00 H new ATOM 0 HB THR A 36 -16.202 3.526 -12.063 1.00 1.00 H new ATOM 0 HG1 THR A 36 -15.257 1.722 -12.691 1.00 1.00 H new ATOM 0 HG21 THR A 36 -13.955 4.524 -12.290 1.00 1.00 H new ATOM 0 HG22 THR A 36 -14.842 5.233 -10.920 1.00 1.00 H new ATOM 0 HG23 THR A 36 -13.567 4.027 -10.626 1.00 1.00 H new ATOM 532 N ILE A 37 -18.137 2.087 -10.701 1.00 1.00 N ATOM 533 CA ILE A 37 -19.163 1.097 -10.823 1.00 1.00 C ATOM 534 C ILE A 37 -18.659 -0.096 -11.619 1.00 1.00 C ATOM 535 O ILE A 37 -18.915 -1.232 -11.254 1.00 1.00 O ATOM 536 CB ILE A 37 -20.442 1.652 -11.451 1.00 1.00 C ATOM 537 CG1 ILE A 37 -20.907 2.899 -10.702 1.00 1.00 C ATOM 538 CG2 ILE A 37 -21.538 0.590 -11.409 1.00 1.00 C ATOM 539 CD1 ILE A 37 -21.199 2.667 -9.259 1.00 1.00 C ATOM 0 H ILE A 37 -18.361 2.989 -11.121 1.00 1.00 H new ATOM 0 HA ILE A 37 -19.415 0.776 -9.813 1.00 1.00 H new ATOM 0 HB ILE A 37 -20.235 1.922 -12.487 1.00 1.00 H new ATOM 0 HG12 ILE A 37 -20.140 3.669 -10.788 1.00 1.00 H new ATOM 0 HG13 ILE A 37 -21.803 3.287 -11.185 1.00 1.00 H new ATOM 0 HG21 ILE A 37 -22.448 0.989 -11.857 1.00 1.00 H new ATOM 0 HG22 ILE A 37 -21.214 -0.289 -11.966 1.00 1.00 H new ATOM 0 HG23 ILE A 37 -21.735 0.311 -10.374 1.00 1.00 H new ATOM 0 HD11 ILE A 37 -21.523 3.600 -8.799 1.00 1.00 H new ATOM 0 HD12 ILE A 37 -21.989 1.922 -9.163 1.00 1.00 H new ATOM 0 HD13 ILE A 37 -20.299 2.309 -8.759 1.00 1.00 H new ATOM 551 N SER A 38 -17.934 0.159 -12.694 1.00 1.00 N ATOM 552 CA SER A 38 -17.365 -0.908 -13.479 1.00 1.00 C ATOM 553 C SER A 38 -16.389 -1.726 -12.642 1.00 1.00 C ATOM 554 O SER A 38 -16.447 -2.952 -12.650 1.00 1.00 O ATOM 555 CB SER A 38 -16.678 -0.330 -14.699 1.00 1.00 C ATOM 556 OG SER A 38 -16.242 0.996 -14.420 1.00 1.00 O ATOM 0 H SER A 38 -17.729 1.097 -13.038 1.00 1.00 H new ATOM 0 HA SER A 38 -18.162 -1.575 -13.808 1.00 1.00 H new ATOM 0 HB2 SER A 38 -15.827 -0.952 -14.978 1.00 1.00 H new ATOM 0 HB3 SER A 38 -17.363 -0.327 -15.547 1.00 1.00 H new ATOM 0 HG SER A 38 -16.355 1.552 -15.219 1.00 1.00 H new ATOM 562 N GLN A 39 -15.549 -1.033 -11.867 1.00 1.00 N ATOM 563 CA GLN A 39 -14.573 -1.702 -11.016 1.00 1.00 C ATOM 564 C GLN A 39 -15.249 -2.466 -9.906 1.00 1.00 C ATOM 565 O GLN A 39 -14.825 -3.577 -9.541 1.00 1.00 O ATOM 566 CB GLN A 39 -13.585 -0.713 -10.441 1.00 1.00 C ATOM 567 CG GLN A 39 -12.576 -0.206 -11.445 1.00 1.00 C ATOM 568 CD GLN A 39 -11.732 0.920 -10.901 1.00 1.00 C ATOM 569 OE1 GLN A 39 -11.233 1.750 -11.650 1.00 1.00 O ATOM 570 NE2 GLN A 39 -11.568 0.976 -9.605 1.00 1.00 N ATOM 0 H GLN A 39 -15.529 -0.015 -11.815 1.00 1.00 H new ATOM 0 HA GLN A 39 -14.029 -2.412 -11.640 1.00 1.00 H new ATOM 0 HB2 GLN A 39 -14.132 0.135 -10.029 1.00 1.00 H new ATOM 0 HB3 GLN A 39 -13.055 -1.183 -9.613 1.00 1.00 H new ATOM 0 HG2 GLN A 39 -11.927 -1.027 -11.749 1.00 1.00 H new ATOM 0 HG3 GLN A 39 -13.098 0.135 -12.339 1.00 1.00 H new ATOM 0 HE21 GLN A 39 -11.996 0.270 -9.006 1.00 1.00 H new ATOM 0 HE22 GLN A 39 -11.012 1.726 -9.193 1.00 1.00 H new ATOM 579 N ALA A 40 -16.288 -1.874 -9.361 1.00 1.00 N ATOM 580 CA ALA A 40 -17.065 -2.511 -8.320 1.00 1.00 C ATOM 581 C ALA A 40 -17.771 -3.732 -8.842 1.00 1.00 C ATOM 582 O ALA A 40 -17.806 -4.745 -8.164 1.00 1.00 O ATOM 583 CB ALA A 40 -18.031 -1.547 -7.644 1.00 1.00 C ATOM 0 H ALA A 40 -16.617 -0.945 -9.624 1.00 1.00 H new ATOM 0 HA ALA A 40 -16.364 -2.834 -7.550 1.00 1.00 H new ATOM 0 HB1 ALA A 40 -18.590 -2.074 -6.871 1.00 1.00 H new ATOM 0 HB2 ALA A 40 -17.471 -0.728 -7.192 1.00 1.00 H new ATOM 0 HB3 ALA A 40 -18.724 -1.148 -8.384 1.00 1.00 H new ATOM 589 N LYS A 41 -18.288 -3.660 -10.078 1.00 1.00 N ATOM 590 CA LYS A 41 -18.930 -4.820 -10.694 1.00 1.00 C ATOM 591 C LYS A 41 -17.939 -5.968 -10.717 1.00 1.00 C ATOM 592 O LYS A 41 -18.286 -7.096 -10.388 1.00 1.00 O ATOM 593 CB LYS A 41 -19.399 -4.532 -12.156 1.00 1.00 C ATOM 594 CG LYS A 41 -20.916 -4.302 -12.372 1.00 1.00 C ATOM 595 CD LYS A 41 -21.314 -2.833 -12.307 1.00 1.00 C ATOM 596 CE LYS A 41 -22.763 -2.605 -12.777 1.00 1.00 C ATOM 597 NZ LYS A 41 -22.849 -2.098 -14.184 1.00 1.00 N ATOM 0 H LYS A 41 -18.273 -2.822 -10.659 1.00 1.00 H new ATOM 0 HA LYS A 41 -19.813 -5.066 -10.104 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -18.868 -3.651 -12.516 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -19.090 -5.369 -12.783 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -21.204 -4.708 -13.342 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -21.472 -4.857 -11.616 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -21.204 -2.473 -11.284 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -20.636 -2.246 -12.926 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -23.316 -3.541 -12.700 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -23.248 -1.892 -12.110 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -23.621 -2.585 -14.682 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -23.035 -1.075 -14.174 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -21.951 -2.282 -14.675 1.00 1.00 H new ATOM 611 N GLU A 42 -16.689 -5.641 -11.019 1.00 1.00 N ATOM 612 CA GLU A 42 -15.636 -6.629 -11.153 1.00 1.00 C ATOM 613 C GLU A 42 -15.368 -7.294 -9.829 1.00 1.00 C ATOM 614 O GLU A 42 -15.426 -8.503 -9.722 1.00 1.00 O ATOM 615 CB GLU A 42 -14.341 -5.977 -11.609 1.00 1.00 C ATOM 616 CG GLU A 42 -14.424 -5.227 -12.905 1.00 1.00 C ATOM 617 CD GLU A 42 -13.081 -4.667 -13.296 1.00 1.00 C ATOM 618 OE1 GLU A 42 -12.737 -3.542 -12.865 1.00 1.00 O ATOM 619 OE2 GLU A 42 -12.342 -5.341 -13.999 1.00 1.00 O ATOM 0 H GLU A 42 -16.380 -4.682 -11.177 1.00 1.00 H new ATOM 0 HA GLU A 42 -15.969 -7.361 -11.889 1.00 1.00 H new ATOM 0 HB2 GLU A 42 -14.005 -5.291 -10.832 1.00 1.00 H new ATOM 0 HB3 GLU A 42 -13.578 -6.750 -11.703 1.00 1.00 H new ATOM 0 HG2 GLU A 42 -14.787 -5.891 -13.690 1.00 1.00 H new ATOM 0 HG3 GLU A 42 -15.147 -4.416 -12.814 1.00 1.00 H new ATOM 626 N LYS A 43 -15.108 -6.480 -8.821 1.00 1.00 N ATOM 627 CA LYS A 43 -14.733 -6.962 -7.498 1.00 1.00 C ATOM 628 C LYS A 43 -15.829 -7.757 -6.816 1.00 1.00 C ATOM 629 O LYS A 43 -15.548 -8.780 -6.175 1.00 1.00 O ATOM 630 CB LYS A 43 -14.265 -5.812 -6.603 1.00 1.00 C ATOM 631 CG LYS A 43 -12.953 -5.185 -7.044 1.00 1.00 C ATOM 632 CD LYS A 43 -12.537 -4.051 -6.123 1.00 1.00 C ATOM 633 CE LYS A 43 -11.220 -3.440 -6.577 1.00 1.00 C ATOM 634 NZ LYS A 43 -10.801 -2.323 -5.707 1.00 1.00 N ATOM 0 H LYS A 43 -15.150 -5.464 -8.894 1.00 1.00 H new ATOM 0 HA LYS A 43 -13.902 -7.649 -7.654 1.00 1.00 H new ATOM 0 HB2 LYS A 43 -15.036 -5.042 -6.584 1.00 1.00 H new ATOM 0 HB3 LYS A 43 -14.156 -6.180 -5.583 1.00 1.00 H new ATOM 0 HG2 LYS A 43 -12.173 -5.946 -7.060 1.00 1.00 H new ATOM 0 HG3 LYS A 43 -13.053 -4.809 -8.062 1.00 1.00 H new ATOM 0 HD2 LYS A 43 -13.312 -3.285 -6.109 1.00 1.00 H new ATOM 0 HD3 LYS A 43 -12.438 -4.423 -5.103 1.00 1.00 H new ATOM 0 HE2 LYS A 43 -10.446 -4.207 -6.580 1.00 1.00 H new ATOM 0 HE3 LYS A 43 -11.320 -3.084 -7.602 1.00 1.00 H new ATOM 0 HZ1 LYS A 43 -10.237 -1.646 -6.259 1.00 1.00 H new ATOM 0 HZ2 LYS A 43 -11.643 -1.844 -5.327 1.00 1.00 H new ATOM 0 HZ3 LYS A 43 -10.228 -2.691 -4.921 1.00 1.00 H new ATOM 648 N MET A 44 -17.065 -7.294 -6.947 1.00 1.00 N ATOM 649 CA MET A 44 -18.197 -7.933 -6.283 1.00 1.00 C ATOM 650 C MET A 44 -18.399 -9.353 -6.820 1.00 1.00 C ATOM 651 O MET A 44 -18.571 -10.301 -6.056 1.00 1.00 O ATOM 652 CB MET A 44 -19.487 -7.125 -6.513 1.00 1.00 C ATOM 653 CG MET A 44 -19.460 -5.696 -5.966 1.00 1.00 C ATOM 654 SD MET A 44 -18.982 -5.570 -4.235 1.00 1.00 S ATOM 655 CE MET A 44 -20.289 -6.481 -3.459 1.00 1.00 C ATOM 0 H MET A 44 -17.311 -6.478 -7.507 1.00 1.00 H new ATOM 0 HA MET A 44 -17.980 -7.973 -5.216 1.00 1.00 H new ATOM 0 HB2 MET A 44 -19.687 -7.085 -7.584 1.00 1.00 H new ATOM 0 HB3 MET A 44 -20.319 -7.658 -6.053 1.00 1.00 H new ATOM 0 HG2 MET A 44 -18.768 -5.104 -6.565 1.00 1.00 H new ATOM 0 HG3 MET A 44 -20.449 -5.254 -6.090 1.00 1.00 H new ATOM 0 HE1 MET A 44 -20.183 -6.418 -2.376 1.00 1.00 H new ATOM 0 HE2 MET A 44 -21.250 -6.061 -3.754 1.00 1.00 H new ATOM 0 HE3 MET A 44 -20.239 -7.525 -3.769 1.00 1.00 H new ATOM 665 N LEU A 45 -18.368 -9.499 -8.143 1.00 1.00 N ATOM 666 CA LEU A 45 -18.533 -10.808 -8.772 1.00 1.00 C ATOM 667 C LEU A 45 -17.266 -11.661 -8.673 1.00 1.00 C ATOM 668 O LEU A 45 -17.325 -12.885 -8.700 1.00 1.00 O ATOM 669 CB LEU A 45 -19.102 -10.716 -10.221 1.00 1.00 C ATOM 670 CG LEU A 45 -18.299 -9.925 -11.266 1.00 1.00 C ATOM 671 CD1 LEU A 45 -17.187 -10.760 -11.867 1.00 1.00 C ATOM 672 CD2 LEU A 45 -19.218 -9.402 -12.359 1.00 1.00 C ATOM 0 H LEU A 45 -18.231 -8.730 -8.799 1.00 1.00 H new ATOM 0 HA LEU A 45 -19.295 -11.334 -8.197 1.00 1.00 H new ATOM 0 HB2 LEU A 45 -19.226 -11.732 -10.595 1.00 1.00 H new ATOM 0 HB3 LEU A 45 -20.097 -10.275 -10.161 1.00 1.00 H new ATOM 0 HG LEU A 45 -17.839 -9.079 -10.756 1.00 1.00 H new ATOM 0 HD11 LEU A 45 -16.642 -10.166 -12.601 1.00 1.00 H new ATOM 0 HD12 LEU A 45 -16.504 -11.078 -11.079 1.00 1.00 H new ATOM 0 HD13 LEU A 45 -17.613 -11.637 -12.354 1.00 1.00 H new ATOM 0 HD21 LEU A 45 -18.633 -8.844 -13.090 1.00 1.00 H new ATOM 0 HD22 LEU A 45 -19.711 -10.240 -12.852 1.00 1.00 H new ATOM 0 HD23 LEU A 45 -19.970 -8.746 -11.920 1.00 1.00 H new ATOM 684 N ASP A 46 -16.125 -10.986 -8.546 1.00 1.00 N ATOM 685 CA ASP A 46 -14.779 -11.609 -8.526 1.00 1.00 C ATOM 686 C ASP A 46 -14.647 -12.681 -7.462 1.00 1.00 C ATOM 687 O ASP A 46 -13.893 -13.613 -7.614 1.00 1.00 O ATOM 688 CB ASP A 46 -13.705 -10.534 -8.299 1.00 1.00 C ATOM 689 CG ASP A 46 -12.306 -11.086 -8.163 1.00 1.00 C ATOM 690 OD1 ASP A 46 -11.692 -11.447 -9.182 1.00 1.00 O ATOM 691 OD2 ASP A 46 -11.788 -11.140 -7.027 1.00 1.00 O ATOM 0 H ASP A 46 -16.097 -9.971 -8.452 1.00 1.00 H new ATOM 0 HA ASP A 46 -14.638 -12.087 -9.495 1.00 1.00 H new ATOM 0 HB2 ASP A 46 -13.728 -9.830 -9.131 1.00 1.00 H new ATOM 0 HB3 ASP A 46 -13.952 -9.972 -7.399 1.00 1.00 H new ATOM 696 N GLN A 47 -15.373 -12.542 -6.390 1.00 1.00 N ATOM 697 CA GLN A 47 -15.312 -13.515 -5.320 1.00 1.00 C ATOM 698 C GLN A 47 -15.928 -14.845 -5.744 1.00 1.00 C ATOM 699 O GLN A 47 -15.498 -15.910 -5.297 1.00 1.00 O ATOM 700 CB GLN A 47 -15.970 -12.994 -4.057 1.00 1.00 C ATOM 701 CG GLN A 47 -15.408 -11.670 -3.603 1.00 1.00 C ATOM 702 CD GLN A 47 -15.547 -11.447 -2.121 1.00 1.00 C ATOM 703 OE1 GLN A 47 -16.419 -12.014 -1.466 1.00 1.00 O ATOM 704 NE2 GLN A 47 -14.709 -10.609 -1.587 1.00 1.00 N ATOM 0 H GLN A 47 -16.016 -11.767 -6.227 1.00 1.00 H new ATOM 0 HA GLN A 47 -14.259 -13.688 -5.099 1.00 1.00 H new ATOM 0 HB2 GLN A 47 -17.041 -12.888 -4.229 1.00 1.00 H new ATOM 0 HB3 GLN A 47 -15.846 -13.727 -3.260 1.00 1.00 H new ATOM 0 HG2 GLN A 47 -14.354 -11.617 -3.875 1.00 1.00 H new ATOM 0 HG3 GLN A 47 -15.915 -10.865 -4.135 1.00 1.00 H new ATOM 0 HE21 GLN A 47 -13.999 -10.159 -2.165 1.00 1.00 H new ATOM 0 HE22 GLN A 47 -14.761 -10.401 -0.590 1.00 1.00 H new ATOM 713 N LEU A 48 -16.917 -14.778 -6.613 1.00 1.00 N ATOM 714 CA LEU A 48 -17.617 -15.960 -7.084 1.00 1.00 C ATOM 715 C LEU A 48 -16.951 -16.445 -8.355 1.00 1.00 C ATOM 716 O LEU A 48 -16.742 -17.638 -8.565 1.00 1.00 O ATOM 717 CB LEU A 48 -19.108 -15.635 -7.356 1.00 1.00 C ATOM 718 CG LEU A 48 -20.000 -15.288 -6.135 1.00 1.00 C ATOM 719 CD1 LEU A 48 -19.657 -16.150 -4.927 1.00 1.00 C ATOM 720 CD2 LEU A 48 -19.916 -13.804 -5.794 1.00 1.00 C ATOM 0 H LEU A 48 -17.259 -13.904 -7.013 1.00 1.00 H new ATOM 0 HA LEU A 48 -17.573 -16.737 -6.321 1.00 1.00 H new ATOM 0 HB2 LEU A 48 -19.148 -14.796 -8.051 1.00 1.00 H new ATOM 0 HB3 LEU A 48 -19.552 -16.491 -7.864 1.00 1.00 H new ATOM 0 HG LEU A 48 -21.031 -15.509 -6.412 1.00 1.00 H new ATOM 0 HD11 LEU A 48 -20.302 -15.878 -4.091 1.00 1.00 H new ATOM 0 HD12 LEU A 48 -19.808 -17.201 -5.175 1.00 1.00 H new ATOM 0 HD13 LEU A 48 -18.616 -15.989 -4.649 1.00 1.00 H new ATOM 0 HD21 LEU A 48 -20.552 -13.592 -4.934 1.00 1.00 H new ATOM 0 HD22 LEU A 48 -18.885 -13.543 -5.556 1.00 1.00 H new ATOM 0 HD23 LEU A 48 -20.251 -13.215 -6.648 1.00 1.00 H new ATOM 732 N TYR A 49 -16.583 -15.493 -9.171 1.00 1.00 N ATOM 733 CA TYR A 49 -15.953 -15.718 -10.455 1.00 1.00 C ATOM 734 C TYR A 49 -14.439 -15.662 -10.327 1.00 1.00 C ATOM 735 O TYR A 49 -13.735 -15.293 -11.263 1.00 1.00 O ATOM 736 CB TYR A 49 -16.443 -14.680 -11.461 1.00 1.00 C ATOM 737 CG TYR A 49 -17.899 -14.833 -11.860 1.00 1.00 C ATOM 738 CD1 TYR A 49 -18.912 -14.248 -11.108 1.00 1.00 C ATOM 739 CD2 TYR A 49 -18.258 -15.563 -12.984 1.00 1.00 C ATOM 740 CE1 TYR A 49 -20.237 -14.379 -11.466 1.00 1.00 C ATOM 741 CE2 TYR A 49 -19.586 -15.703 -13.348 1.00 1.00 C ATOM 742 CZ TYR A 49 -20.569 -15.105 -12.588 1.00 1.00 C ATOM 743 OH TYR A 49 -21.890 -15.244 -12.943 1.00 1.00 O ATOM 0 H TYR A 49 -16.716 -14.505 -8.957 1.00 1.00 H new ATOM 0 HA TYR A 49 -16.226 -16.712 -10.810 1.00 1.00 H new ATOM 0 HB2 TYR A 49 -16.297 -13.686 -11.039 1.00 1.00 H new ATOM 0 HB3 TYR A 49 -15.825 -14.740 -12.357 1.00 1.00 H new ATOM 0 HD1 TYR A 49 -18.656 -13.680 -10.226 1.00 1.00 H new ATOM 0 HD2 TYR A 49 -17.490 -16.029 -13.584 1.00 1.00 H new ATOM 0 HE1 TYR A 49 -21.009 -13.915 -10.870 1.00 1.00 H new ATOM 0 HE2 TYR A 49 -19.851 -16.278 -14.223 1.00 1.00 H new ATOM 0 HH TYR A 49 -21.955 -15.784 -13.759 1.00 1.00 H new ATOM 753 N LYS A 50 -13.960 -16.000 -9.154 1.00 1.00 N ATOM 754 CA LYS A 50 -12.540 -16.034 -8.868 1.00 1.00 C ATOM 755 C LYS A 50 -11.835 -17.009 -9.799 1.00 1.00 C ATOM 756 O LYS A 50 -12.232 -18.170 -9.919 1.00 1.00 O ATOM 757 CB LYS A 50 -12.323 -16.463 -7.414 1.00 1.00 C ATOM 758 CG LYS A 50 -10.893 -16.288 -6.915 1.00 1.00 C ATOM 759 CD LYS A 50 -10.548 -14.819 -6.692 1.00 1.00 C ATOM 760 CE LYS A 50 -11.374 -14.224 -5.566 1.00 1.00 C ATOM 761 NZ LYS A 50 -10.925 -12.867 -5.205 1.00 1.00 N ATOM 0 H LYS A 50 -14.547 -16.262 -8.362 1.00 1.00 H new ATOM 0 HA LYS A 50 -12.124 -15.038 -9.023 1.00 1.00 H new ATOM 0 HB2 LYS A 50 -12.992 -15.887 -6.774 1.00 1.00 H new ATOM 0 HB3 LYS A 50 -12.606 -17.511 -7.310 1.00 1.00 H new ATOM 0 HG2 LYS A 50 -10.763 -16.838 -5.983 1.00 1.00 H new ATOM 0 HG3 LYS A 50 -10.200 -16.719 -7.638 1.00 1.00 H new ATOM 0 HD2 LYS A 50 -9.488 -14.724 -6.458 1.00 1.00 H new ATOM 0 HD3 LYS A 50 -10.723 -14.258 -7.610 1.00 1.00 H new ATOM 0 HE2 LYS A 50 -12.422 -14.191 -5.864 1.00 1.00 H new ATOM 0 HE3 LYS A 50 -11.312 -14.871 -4.691 1.00 1.00 H new ATOM 0 HZ1 LYS A 50 -11.143 -12.684 -4.205 1.00 1.00 H new ATOM 0 HZ2 LYS A 50 -9.899 -12.789 -5.355 1.00 1.00 H new ATOM 0 HZ3 LYS A 50 -11.416 -12.169 -5.800 1.00 1.00 H new ATOM 775 N GLY A 51 -10.814 -16.532 -10.461 1.00 1.00 N ATOM 776 CA GLY A 51 -10.061 -17.363 -11.361 1.00 1.00 C ATOM 777 C GLY A 51 -10.438 -17.083 -12.784 1.00 1.00 C ATOM 778 O GLY A 51 -9.773 -17.526 -13.722 1.00 1.00 O ATOM 0 H GLY A 51 -10.484 -15.569 -10.393 1.00 1.00 H new ATOM 0 HA2 GLY A 51 -8.995 -17.186 -11.221 1.00 1.00 H new ATOM 0 HA3 GLY A 51 -10.242 -18.413 -11.132 1.00 1.00 H new ATOM 782 N VAL A 52 -11.501 -16.350 -12.946 1.00 1.00 N ATOM 783 CA VAL A 52 -11.974 -15.956 -14.234 1.00 1.00 C ATOM 784 C VAL A 52 -11.470 -14.550 -14.519 1.00 1.00 C ATOM 785 O VAL A 52 -11.806 -13.617 -13.796 1.00 1.00 O ATOM 786 CB VAL A 52 -13.528 -15.972 -14.286 1.00 1.00 C ATOM 787 CG1 VAL A 52 -14.045 -15.482 -15.619 1.00 1.00 C ATOM 788 CG2 VAL A 52 -14.056 -17.365 -13.988 1.00 1.00 C ATOM 0 H VAL A 52 -12.070 -16.006 -12.173 1.00 1.00 H new ATOM 0 HA VAL A 52 -11.604 -16.657 -14.982 1.00 1.00 H new ATOM 0 HB VAL A 52 -13.892 -15.288 -13.520 1.00 1.00 H new ATOM 0 HG11 VAL A 52 -15.135 -15.507 -15.618 1.00 1.00 H new ATOM 0 HG12 VAL A 52 -13.706 -14.460 -15.787 1.00 1.00 H new ATOM 0 HG13 VAL A 52 -13.668 -16.125 -16.414 1.00 1.00 H new ATOM 0 HG21 VAL A 52 -15.145 -17.358 -14.029 1.00 1.00 H new ATOM 0 HG22 VAL A 52 -13.670 -18.066 -14.728 1.00 1.00 H new ATOM 0 HG23 VAL A 52 -13.732 -17.672 -12.993 1.00 1.00 H new ATOM 798 N PRO A 53 -10.641 -14.376 -15.548 1.00 1.00 N ATOM 799 CA PRO A 53 -10.105 -13.064 -15.914 1.00 1.00 C ATOM 800 C PRO A 53 -11.209 -12.150 -16.457 1.00 1.00 C ATOM 801 O PRO A 53 -12.269 -12.634 -16.882 1.00 1.00 O ATOM 802 CB PRO A 53 -9.070 -13.394 -16.990 1.00 1.00 C ATOM 803 CG PRO A 53 -9.555 -14.658 -17.587 1.00 1.00 C ATOM 804 CD PRO A 53 -10.161 -15.436 -16.458 1.00 1.00 C ATOM 0 HA PRO A 53 -9.677 -12.525 -15.069 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -9.004 -12.601 -17.735 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -8.075 -13.512 -16.562 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -10.290 -14.465 -18.368 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -8.737 -15.211 -18.049 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -10.975 -16.075 -16.799 1.00 1.00 H new ATOM 0 HD3 PRO A 53 -9.429 -16.083 -15.974 1.00 1.00 H new ATOM 812 N LEU A 54 -10.966 -10.848 -16.464 1.00 1.00 N ATOM 813 CA LEU A 54 -11.977 -9.877 -16.878 1.00 1.00 C ATOM 814 C LEU A 54 -12.398 -10.095 -18.321 1.00 1.00 C ATOM 815 O LEU A 54 -13.578 -9.989 -18.650 1.00 1.00 O ATOM 816 CB LEU A 54 -11.511 -8.433 -16.665 1.00 1.00 C ATOM 817 CG LEU A 54 -12.510 -7.354 -17.107 1.00 1.00 C ATOM 818 CD1 LEU A 54 -13.743 -7.354 -16.213 1.00 1.00 C ATOM 819 CD2 LEU A 54 -11.858 -5.985 -17.136 1.00 1.00 C ATOM 0 H LEU A 54 -10.075 -10.435 -16.187 1.00 1.00 H new ATOM 0 HA LEU A 54 -12.846 -10.040 -16.240 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -11.291 -8.291 -15.607 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -10.577 -8.285 -17.207 1.00 1.00 H new ATOM 0 HG LEU A 54 -12.831 -7.591 -18.121 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -14.435 -6.581 -16.547 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -14.232 -8.327 -16.268 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -13.446 -7.155 -15.183 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -12.589 -5.241 -17.452 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -11.493 -5.735 -16.140 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -11.023 -5.994 -17.837 1.00 1.00 H new ATOM 831 N THR A 55 -11.448 -10.414 -19.158 1.00 1.00 N ATOM 832 CA THR A 55 -11.706 -10.668 -20.554 1.00 1.00 C ATOM 833 C THR A 55 -12.642 -11.902 -20.752 1.00 1.00 C ATOM 834 O THR A 55 -13.378 -11.990 -21.740 1.00 1.00 O ATOM 835 CB THR A 55 -10.369 -10.844 -21.344 1.00 1.00 C ATOM 836 OG1 THR A 55 -10.610 -10.923 -22.752 1.00 1.00 O ATOM 837 CG2 THR A 55 -9.606 -12.084 -20.885 1.00 1.00 C ATOM 0 H THR A 55 -10.468 -10.506 -18.892 1.00 1.00 H new ATOM 0 HA THR A 55 -12.226 -9.798 -20.956 1.00 1.00 H new ATOM 0 HB THR A 55 -9.759 -9.965 -21.137 1.00 1.00 H new ATOM 0 HG1 THR A 55 -9.758 -11.031 -23.224 1.00 1.00 H new ATOM 0 HG21 THR A 55 -8.682 -12.175 -21.456 1.00 1.00 H new ATOM 0 HG22 THR A 55 -9.370 -11.994 -19.825 1.00 1.00 H new ATOM 0 HG23 THR A 55 -10.220 -12.970 -21.046 1.00 1.00 H new ATOM 845 N GLN A 56 -12.623 -12.829 -19.786 1.00 1.00 N ATOM 846 CA GLN A 56 -13.450 -14.023 -19.847 1.00 1.00 C ATOM 847 C GLN A 56 -14.843 -13.725 -19.269 1.00 1.00 C ATOM 848 O GLN A 56 -15.817 -14.443 -19.525 1.00 1.00 O ATOM 849 CB GLN A 56 -12.763 -15.162 -19.092 1.00 1.00 C ATOM 850 CG GLN A 56 -13.429 -16.516 -19.210 1.00 1.00 C ATOM 851 CD GLN A 56 -12.607 -17.612 -18.570 1.00 1.00 C ATOM 852 OE1 GLN A 56 -12.737 -17.904 -17.377 1.00 1.00 O ATOM 853 NE2 GLN A 56 -11.757 -18.219 -19.337 1.00 1.00 N ATOM 0 H GLN A 56 -12.038 -12.767 -18.952 1.00 1.00 H new ATOM 0 HA GLN A 56 -13.577 -14.331 -20.885 1.00 1.00 H new ATOM 0 HB2 GLN A 56 -11.738 -15.248 -19.453 1.00 1.00 H new ATOM 0 HB3 GLN A 56 -12.708 -14.894 -18.037 1.00 1.00 H new ATOM 0 HG2 GLN A 56 -14.411 -16.478 -18.739 1.00 1.00 H new ATOM 0 HG3 GLN A 56 -13.588 -16.751 -20.262 1.00 1.00 H new ATOM 0 HE21 GLN A 56 -11.675 -17.953 -20.318 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -11.170 -18.963 -18.959 1.00 1.00 H new ATOM 862 N ARG A 57 -14.922 -12.660 -18.493 1.00 1.00 N ATOM 863 CA ARG A 57 -16.180 -12.199 -17.932 1.00 1.00 C ATOM 864 C ARG A 57 -16.885 -11.329 -18.965 1.00 1.00 C ATOM 865 O ARG A 57 -16.227 -10.753 -19.832 1.00 1.00 O ATOM 866 CB ARG A 57 -15.926 -11.347 -16.676 1.00 1.00 C ATOM 867 CG ARG A 57 -15.075 -12.015 -15.629 1.00 1.00 C ATOM 868 CD ARG A 57 -14.690 -11.046 -14.532 1.00 1.00 C ATOM 869 NE ARG A 57 -13.649 -11.596 -13.668 1.00 1.00 N ATOM 870 CZ ARG A 57 -13.312 -11.132 -12.450 1.00 1.00 C ATOM 871 NH1 ARG A 57 -13.882 -10.035 -11.968 1.00 1.00 N ATOM 872 NH2 ARG A 57 -12.390 -11.767 -11.739 1.00 1.00 N ATOM 0 H ARG A 57 -14.117 -12.090 -18.234 1.00 1.00 H new ATOM 0 HA ARG A 57 -16.789 -13.063 -17.666 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -15.446 -10.415 -16.976 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -16.886 -11.083 -16.232 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -15.618 -12.857 -15.199 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -14.175 -12.419 -16.092 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -14.340 -10.114 -14.976 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -15.569 -10.804 -13.935 1.00 1.00 H new ATOM 0 HE ARG A 57 -13.132 -12.402 -14.018 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -14.580 -9.538 -12.521 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -13.622 -9.689 -11.044 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -11.941 -12.602 -12.116 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -12.130 -11.421 -10.815 1.00 1.00 H new ATOM 886 N PRO A 58 -18.213 -11.221 -18.910 1.00 1.00 N ATOM 887 CA PRO A 58 -18.958 -10.329 -19.801 1.00 1.00 C ATOM 888 C PRO A 58 -18.687 -8.863 -19.450 1.00 1.00 C ATOM 889 O PRO A 58 -18.176 -8.560 -18.354 1.00 1.00 O ATOM 890 CB PRO A 58 -20.424 -10.692 -19.522 1.00 1.00 C ATOM 891 CG PRO A 58 -20.415 -11.225 -18.131 1.00 1.00 C ATOM 892 CD PRO A 58 -19.110 -11.958 -17.990 1.00 1.00 C ATOM 0 HA PRO A 58 -18.682 -10.444 -20.849 1.00 1.00 H new ATOM 0 HB2 PRO A 58 -21.073 -9.820 -19.609 1.00 1.00 H new ATOM 0 HB3 PRO A 58 -20.791 -11.435 -20.230 1.00 1.00 H new ATOM 0 HG2 PRO A 58 -20.493 -10.419 -17.401 1.00 1.00 H new ATOM 0 HG3 PRO A 58 -21.260 -11.892 -17.961 1.00 1.00 H new ATOM 0 HD2 PRO A 58 -18.743 -11.935 -16.964 1.00 1.00 H new ATOM 0 HD3 PRO A 58 -19.204 -13.007 -18.272 1.00 1.00 H new ATOM 900 N ASP A 59 -18.978 -7.971 -20.371 1.00 1.00 N ATOM 901 CA ASP A 59 -18.800 -6.538 -20.137 1.00 1.00 C ATOM 902 C ASP A 59 -19.735 -6.083 -19.018 1.00 1.00 C ATOM 903 O ASP A 59 -20.930 -6.352 -19.058 1.00 1.00 O ATOM 904 CB ASP A 59 -19.073 -5.742 -21.415 1.00 1.00 C ATOM 905 CG ASP A 59 -19.173 -4.251 -21.168 1.00 1.00 C ATOM 906 OD1 ASP A 59 -18.136 -3.558 -21.166 1.00 1.00 O ATOM 907 OD2 ASP A 59 -20.282 -3.753 -20.979 1.00 1.00 O ATOM 0 H ASP A 59 -19.341 -8.205 -21.295 1.00 1.00 H new ATOM 0 HA ASP A 59 -17.767 -6.355 -19.840 1.00 1.00 H new ATOM 0 HB2 ASP A 59 -18.277 -5.934 -22.134 1.00 1.00 H new ATOM 0 HB3 ASP A 59 -20.001 -6.094 -21.866 1.00 1.00 H new ATOM 912 N PRO A 60 -19.216 -5.388 -18.005 1.00 1.00 N ATOM 913 CA PRO A 60 -20.003 -4.996 -16.844 1.00 1.00 C ATOM 914 C PRO A 60 -21.001 -3.868 -17.101 1.00 1.00 C ATOM 915 O PRO A 60 -21.740 -3.501 -16.197 1.00 1.00 O ATOM 916 CB PRO A 60 -18.955 -4.588 -15.815 1.00 1.00 C ATOM 917 CG PRO A 60 -17.793 -4.123 -16.626 1.00 1.00 C ATOM 918 CD PRO A 60 -17.804 -4.948 -17.892 1.00 1.00 C ATOM 0 HA PRO A 60 -20.643 -5.817 -16.521 1.00 1.00 H new ATOM 0 HB2 PRO A 60 -19.326 -3.797 -15.164 1.00 1.00 H new ATOM 0 HB3 PRO A 60 -18.681 -5.426 -15.174 1.00 1.00 H new ATOM 0 HG2 PRO A 60 -17.878 -3.060 -16.853 1.00 1.00 H new ATOM 0 HG3 PRO A 60 -16.859 -4.259 -16.081 1.00 1.00 H new ATOM 0 HD2 PRO A 60 -17.496 -4.360 -18.757 1.00 1.00 H new ATOM 0 HD3 PRO A 60 -17.123 -5.797 -17.824 1.00 1.00 H new ATOM 926 N ARG A 61 -20.993 -3.288 -18.290 1.00 1.00 N ATOM 927 CA ARG A 61 -21.969 -2.275 -18.629 1.00 1.00 C ATOM 928 C ARG A 61 -23.167 -2.882 -19.353 1.00 1.00 C ATOM 929 O ARG A 61 -24.147 -2.203 -19.609 1.00 1.00 O ATOM 930 CB ARG A 61 -21.354 -1.161 -19.448 1.00 1.00 C ATOM 931 CG ARG A 61 -20.378 -0.307 -18.679 1.00 1.00 C ATOM 932 CD ARG A 61 -19.757 0.726 -19.576 1.00 1.00 C ATOM 933 NE ARG A 61 -18.812 1.585 -18.866 1.00 1.00 N ATOM 934 CZ ARG A 61 -18.042 2.520 -19.439 1.00 1.00 C ATOM 935 NH1 ARG A 61 -18.135 2.768 -20.730 1.00 1.00 N ATOM 936 NH2 ARG A 61 -17.195 3.209 -18.702 1.00 1.00 N ATOM 0 H ARG A 61 -20.324 -3.502 -19.030 1.00 1.00 H new ATOM 0 HA ARG A 61 -22.323 -1.842 -17.693 1.00 1.00 H new ATOM 0 HB2 ARG A 61 -20.844 -1.594 -20.308 1.00 1.00 H new ATOM 0 HB3 ARG A 61 -22.150 -0.526 -19.836 1.00 1.00 H new ATOM 0 HG2 ARG A 61 -20.890 0.183 -17.851 1.00 1.00 H new ATOM 0 HG3 ARG A 61 -19.600 -0.935 -18.246 1.00 1.00 H new ATOM 0 HD2 ARG A 61 -19.244 0.228 -20.398 1.00 1.00 H new ATOM 0 HD3 ARG A 61 -20.542 1.340 -20.016 1.00 1.00 H new ATOM 0 HE ARG A 61 -18.732 1.464 -17.856 1.00 1.00 H new ATOM 0 HH11 ARG A 61 -18.798 2.246 -21.303 1.00 1.00 H new ATOM 0 HH12 ARG A 61 -17.544 3.482 -21.156 1.00 1.00 H new ATOM 0 HH21 ARG A 61 -17.128 3.030 -17.700 1.00 1.00 H new ATOM 0 HH22 ARG A 61 -16.607 3.922 -19.133 1.00 1.00 H new ATOM 950 N THR A 62 -23.082 -4.171 -19.684 1.00 1.00 N ATOM 951 CA THR A 62 -24.221 -4.866 -20.303 1.00 1.00 C ATOM 952 C THR A 62 -25.271 -5.083 -19.243 1.00 1.00 C ATOM 953 O THR A 62 -26.464 -5.259 -19.520 1.00 1.00 O ATOM 954 CB THR A 62 -23.816 -6.237 -20.890 1.00 1.00 C ATOM 955 OG1 THR A 62 -23.311 -7.093 -19.852 1.00 1.00 O ATOM 956 CG2 THR A 62 -22.753 -6.055 -21.928 1.00 1.00 C ATOM 0 H THR A 62 -22.255 -4.750 -19.539 1.00 1.00 H new ATOM 0 HA THR A 62 -24.595 -4.251 -21.122 1.00 1.00 H new ATOM 0 HB THR A 62 -24.698 -6.693 -21.341 1.00 1.00 H new ATOM 0 HG1 THR A 62 -22.366 -6.890 -19.692 1.00 1.00 H new ATOM 0 HG21 THR A 62 -22.473 -7.026 -22.337 1.00 1.00 H new ATOM 0 HG22 THR A 62 -23.131 -5.420 -22.729 1.00 1.00 H new ATOM 0 HG23 THR A 62 -21.879 -5.586 -21.476 1.00 1.00 H new ATOM 964 N LEU A 63 -24.802 -5.089 -18.036 1.00 1.00 N ATOM 965 CA LEU A 63 -25.619 -5.243 -16.898 1.00 1.00 C ATOM 966 C LEU A 63 -25.518 -3.994 -16.028 1.00 1.00 C ATOM 967 O LEU A 63 -24.480 -3.341 -15.991 1.00 1.00 O ATOM 968 CB LEU A 63 -25.184 -6.502 -16.127 1.00 1.00 C ATOM 969 CG LEU A 63 -23.862 -6.407 -15.360 1.00 1.00 C ATOM 970 CD1 LEU A 63 -24.124 -6.120 -13.888 1.00 1.00 C ATOM 971 CD2 LEU A 63 -23.051 -7.683 -15.531 1.00 1.00 C ATOM 0 H LEU A 63 -23.811 -4.983 -17.820 1.00 1.00 H new ATOM 0 HA LEU A 63 -26.661 -5.366 -17.194 1.00 1.00 H new ATOM 0 HB2 LEU A 63 -25.972 -6.759 -15.419 1.00 1.00 H new ATOM 0 HB3 LEU A 63 -25.110 -7.328 -16.835 1.00 1.00 H new ATOM 0 HG LEU A 63 -23.280 -5.582 -15.770 1.00 1.00 H new ATOM 0 HD11 LEU A 63 -23.175 -6.055 -13.355 1.00 1.00 H new ATOM 0 HD12 LEU A 63 -24.660 -5.176 -13.791 1.00 1.00 H new ATOM 0 HD13 LEU A 63 -24.725 -6.923 -13.462 1.00 1.00 H new ATOM 0 HD21 LEU A 63 -22.115 -7.596 -14.979 1.00 1.00 H new ATOM 0 HD22 LEU A 63 -23.621 -8.530 -15.149 1.00 1.00 H new ATOM 0 HD23 LEU A 63 -22.835 -7.838 -16.588 1.00 1.00 H new ATOM 983 N ASP A 64 -26.571 -3.665 -15.341 1.00 1.00 N ATOM 984 CA ASP A 64 -26.553 -2.536 -14.444 1.00 1.00 C ATOM 985 C ASP A 64 -26.682 -3.043 -13.051 1.00 1.00 C ATOM 986 O ASP A 64 -26.950 -4.229 -12.840 1.00 1.00 O ATOM 987 CB ASP A 64 -27.663 -1.533 -14.749 1.00 1.00 C ATOM 988 CG ASP A 64 -27.392 -0.700 -15.981 1.00 1.00 C ATOM 989 OD1 ASP A 64 -26.260 -0.243 -16.157 1.00 1.00 O ATOM 990 OD2 ASP A 64 -28.309 -0.504 -16.777 1.00 1.00 O ATOM 0 H ASP A 64 -27.461 -4.162 -15.381 1.00 1.00 H new ATOM 0 HA ASP A 64 -25.611 -2.004 -14.574 1.00 1.00 H new ATOM 0 HB2 ASP A 64 -28.602 -2.070 -14.881 1.00 1.00 H new ATOM 0 HB3 ASP A 64 -27.791 -0.871 -13.892 1.00 1.00 H new ATOM 995 N VAL A 65 -26.479 -2.206 -12.103 1.00 1.00 N ATOM 996 CA VAL A 65 -26.612 -2.626 -10.746 1.00 1.00 C ATOM 997 C VAL A 65 -27.658 -1.772 -10.068 1.00 1.00 C ATOM 998 O VAL A 65 -27.620 -0.546 -10.179 1.00 1.00 O ATOM 999 CB VAL A 65 -25.226 -2.570 -9.975 1.00 1.00 C ATOM 1000 CG1 VAL A 65 -24.681 -1.153 -9.825 1.00 1.00 C ATOM 1001 CG2 VAL A 65 -25.309 -3.240 -8.623 1.00 1.00 C ATOM 0 H VAL A 65 -26.221 -1.228 -12.233 1.00 1.00 H new ATOM 0 HA VAL A 65 -26.931 -3.668 -10.727 1.00 1.00 H new ATOM 0 HB VAL A 65 -24.524 -3.123 -10.599 1.00 1.00 H new ATOM 0 HG11 VAL A 65 -23.732 -1.183 -9.290 1.00 1.00 H new ATOM 0 HG12 VAL A 65 -24.527 -0.716 -10.812 1.00 1.00 H new ATOM 0 HG13 VAL A 65 -25.394 -0.546 -9.266 1.00 1.00 H new ATOM 0 HG21 VAL A 65 -24.340 -3.180 -8.127 1.00 1.00 H new ATOM 0 HG22 VAL A 65 -26.060 -2.738 -8.013 1.00 1.00 H new ATOM 0 HG23 VAL A 65 -25.587 -4.286 -8.752 1.00 1.00 H new ATOM 1011 N GLU A 66 -28.617 -2.387 -9.412 1.00 1.00 N ATOM 1012 CA GLU A 66 -29.513 -1.599 -8.668 1.00 1.00 C ATOM 1013 C GLU A 66 -28.947 -1.508 -7.305 1.00 1.00 C ATOM 1014 O GLU A 66 -28.834 -2.503 -6.568 1.00 1.00 O ATOM 1015 CB GLU A 66 -30.976 -2.109 -8.688 1.00 1.00 C ATOM 1016 CG GLU A 66 -31.191 -3.530 -8.232 1.00 1.00 C ATOM 1017 CD GLU A 66 -32.655 -3.895 -8.184 1.00 1.00 C ATOM 1018 OE1 GLU A 66 -33.304 -3.948 -9.238 1.00 1.00 O ATOM 1019 OE2 GLU A 66 -33.185 -4.111 -7.072 1.00 1.00 O ATOM 0 H GLU A 66 -28.777 -3.394 -9.390 1.00 1.00 H new ATOM 0 HA GLU A 66 -29.603 -0.612 -9.121 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -31.577 -1.452 -8.058 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -31.358 -2.014 -9.704 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -30.670 -4.210 -8.907 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -30.752 -3.664 -7.243 1.00 1.00 H new ATOM 1026 N TRP A 67 -28.543 -0.354 -6.989 1.00 1.00 N ATOM 1027 CA TRP A 67 -27.881 -0.134 -5.788 1.00 1.00 C ATOM 1028 C TRP A 67 -28.852 0.200 -4.729 1.00 1.00 C ATOM 1029 O TRP A 67 -29.635 1.124 -4.862 1.00 1.00 O ATOM 1030 CB TRP A 67 -26.898 0.984 -5.947 1.00 1.00 C ATOM 1031 CG TRP A 67 -25.856 0.962 -4.910 1.00 1.00 C ATOM 1032 CD1 TRP A 67 -26.053 1.130 -3.587 1.00 1.00 C ATOM 1033 CD2 TRP A 67 -24.464 0.756 -5.097 1.00 1.00 C ATOM 1034 NE1 TRP A 67 -24.901 1.042 -2.917 1.00 1.00 N ATOM 1035 CE2 TRP A 67 -23.874 0.819 -3.833 1.00 1.00 C ATOM 1036 CE3 TRP A 67 -23.656 0.529 -6.218 1.00 1.00 C ATOM 1037 CZ2 TRP A 67 -22.503 0.662 -3.654 1.00 1.00 C ATOM 1038 CZ3 TRP A 67 -22.302 0.374 -6.037 1.00 1.00 C ATOM 1039 CH2 TRP A 67 -21.738 0.447 -4.767 1.00 1.00 C ATOM 0 H TRP A 67 -28.666 0.477 -7.568 1.00 1.00 H new ATOM 0 HA TRP A 67 -27.348 -1.042 -5.506 1.00 1.00 H new ATOM 0 HB2 TRP A 67 -26.431 0.917 -6.930 1.00 1.00 H new ATOM 0 HB3 TRP A 67 -27.426 1.937 -5.909 1.00 1.00 H new ATOM 0 HD1 TRP A 67 -27.014 1.312 -3.130 1.00 1.00 H new ATOM 0 HE1 TRP A 67 -24.791 1.124 -1.906 1.00 1.00 H new ATOM 0 HE3 TRP A 67 -24.088 0.477 -7.206 1.00 1.00 H new ATOM 0 HZ2 TRP A 67 -22.059 0.708 -2.671 1.00 1.00 H new ATOM 0 HZ3 TRP A 67 -21.668 0.193 -6.892 1.00 1.00 H new ATOM 0 HH2 TRP A 67 -20.670 0.331 -4.658 1.00 1.00 H new ATOM 1050 N ARG A 68 -28.784 -0.529 -3.671 1.00 1.00 N ATOM 1051 CA ARG A 68 -29.616 -0.310 -2.565 1.00 1.00 C ATOM 1052 C ARG A 68 -28.728 0.263 -1.486 1.00 1.00 C ATOM 1053 O ARG A 68 -28.118 -0.451 -0.694 1.00 1.00 O ATOM 1054 CB ARG A 68 -30.251 -1.639 -2.164 1.00 1.00 C ATOM 1055 CG ARG A 68 -31.030 -2.279 -3.316 1.00 1.00 C ATOM 1056 CD ARG A 68 -31.561 -3.650 -2.967 1.00 1.00 C ATOM 1057 NE ARG A 68 -32.210 -4.291 -4.125 1.00 1.00 N ATOM 1058 CZ ARG A 68 -32.935 -5.422 -4.073 1.00 1.00 C ATOM 1059 NH1 ARG A 68 -33.097 -6.065 -2.917 1.00 1.00 N ATOM 1060 NH2 ARG A 68 -33.494 -5.896 -5.184 1.00 1.00 N ATOM 0 H ARG A 68 -28.133 -1.306 -3.558 1.00 1.00 H new ATOM 0 HA ARG A 68 -30.434 0.382 -2.766 1.00 1.00 H new ATOM 0 HB2 ARG A 68 -29.473 -2.325 -1.829 1.00 1.00 H new ATOM 0 HB3 ARG A 68 -30.921 -1.479 -1.319 1.00 1.00 H new ATOM 0 HG2 ARG A 68 -31.862 -1.631 -3.592 1.00 1.00 H new ATOM 0 HG3 ARG A 68 -30.382 -2.356 -4.189 1.00 1.00 H new ATOM 0 HD2 ARG A 68 -30.744 -4.278 -2.613 1.00 1.00 H new ATOM 0 HD3 ARG A 68 -32.276 -3.566 -2.148 1.00 1.00 H new ATOM 0 HE ARG A 68 -32.101 -3.843 -5.035 1.00 1.00 H new ATOM 0 HH11 ARG A 68 -32.670 -5.699 -2.066 1.00 1.00 H new ATOM 0 HH12 ARG A 68 -33.648 -6.923 -2.883 1.00 1.00 H new ATOM 0 HH21 ARG A 68 -33.371 -5.402 -6.068 1.00 1.00 H new ATOM 0 HH22 ARG A 68 -34.045 -6.754 -5.152 1.00 1.00 H new ATOM 1074 N SER A 69 -28.635 1.555 -1.516 1.00 1.00 N ATOM 1075 CA SER A 69 -27.783 2.311 -0.631 1.00 1.00 C ATOM 1076 C SER A 69 -28.530 2.729 0.606 1.00 1.00 C ATOM 1077 O SER A 69 -27.944 3.184 1.579 1.00 1.00 O ATOM 1078 CB SER A 69 -27.270 3.543 -1.372 1.00 1.00 C ATOM 1079 OG SER A 69 -28.355 4.272 -1.943 1.00 1.00 O ATOM 0 H SER A 69 -29.160 2.135 -2.171 1.00 1.00 H new ATOM 0 HA SER A 69 -26.945 1.686 -0.322 1.00 1.00 H new ATOM 0 HB2 SER A 69 -26.716 4.183 -0.685 1.00 1.00 H new ATOM 0 HB3 SER A 69 -26.576 3.240 -2.156 1.00 1.00 H new ATOM 0 HG SER A 69 -28.330 4.185 -2.919 1.00 1.00 H new ATOM 1085 N GLY A 70 -29.826 2.609 0.545 1.00 1.00 N ATOM 1086 CA GLY A 70 -30.667 3.006 1.662 1.00 1.00 C ATOM 1087 C GLY A 70 -30.898 4.504 1.688 1.00 1.00 C ATOM 1088 O GLY A 70 -32.036 4.966 1.713 1.00 1.00 O ATOM 0 H GLY A 70 -30.332 2.241 -0.261 1.00 1.00 H new ATOM 0 HA2 GLY A 70 -31.626 2.491 1.596 1.00 1.00 H new ATOM 0 HA3 GLY A 70 -30.201 2.694 2.597 1.00 1.00 H new ATOM 1092 N VAL A 71 -29.813 5.256 1.643 1.00 1.00 N ATOM 1093 CA VAL A 71 -29.865 6.712 1.636 1.00 1.00 C ATOM 1094 C VAL A 71 -30.562 7.242 0.373 1.00 1.00 C ATOM 1095 O VAL A 71 -31.306 8.218 0.430 1.00 1.00 O ATOM 1096 CB VAL A 71 -28.448 7.356 1.796 1.00 1.00 C ATOM 1097 CG1 VAL A 71 -27.883 7.056 3.175 1.00 1.00 C ATOM 1098 CG2 VAL A 71 -27.480 6.865 0.718 1.00 1.00 C ATOM 0 H VAL A 71 -28.867 4.876 1.610 1.00 1.00 H new ATOM 0 HA VAL A 71 -30.457 7.007 2.503 1.00 1.00 H new ATOM 0 HB VAL A 71 -28.563 8.434 1.680 1.00 1.00 H new ATOM 0 HG11 VAL A 71 -26.897 7.511 3.271 1.00 1.00 H new ATOM 0 HG12 VAL A 71 -28.547 7.465 3.937 1.00 1.00 H new ATOM 0 HG13 VAL A 71 -27.800 5.977 3.307 1.00 1.00 H new ATOM 0 HG21 VAL A 71 -26.507 7.334 0.862 1.00 1.00 H new ATOM 0 HG22 VAL A 71 -27.375 5.782 0.789 1.00 1.00 H new ATOM 0 HG23 VAL A 71 -27.868 7.128 -0.266 1.00 1.00 H new ATOM 1108 N ALA A 72 -30.304 6.595 -0.750 1.00 1.00 N ATOM 1109 CA ALA A 72 -30.936 6.944 -2.010 1.00 1.00 C ATOM 1110 C ALA A 72 -31.934 5.868 -2.396 1.00 1.00 C ATOM 1111 O ALA A 72 -32.565 5.925 -3.444 1.00 1.00 O ATOM 1112 CB ALA A 72 -29.886 7.071 -3.082 1.00 1.00 C ATOM 0 H ALA A 72 -29.651 5.814 -0.814 1.00 1.00 H new ATOM 0 HA ALA A 72 -31.458 7.895 -1.902 1.00 1.00 H new ATOM 0 HB1 ALA A 72 -30.361 7.333 -4.027 1.00 1.00 H new ATOM 0 HB2 ALA A 72 -29.175 7.850 -2.805 1.00 1.00 H new ATOM 0 HB3 ALA A 72 -29.360 6.122 -3.191 1.00 1.00 H new ATOM 1118 N GLY A 73 -32.058 4.897 -1.537 1.00 1.00 N ATOM 1119 CA GLY A 73 -32.904 3.778 -1.776 1.00 1.00 C ATOM 1120 C GLY A 73 -32.268 2.861 -2.769 1.00 1.00 C ATOM 1121 O GLY A 73 -31.082 2.507 -2.624 1.00 1.00 O ATOM 0 H GLY A 73 -31.567 4.866 -0.644 1.00 1.00 H new ATOM 0 HA2 GLY A 73 -33.089 3.246 -0.843 1.00 1.00 H new ATOM 0 HA3 GLY A 73 -33.871 4.116 -2.148 1.00 1.00 H new ATOM 1125 N HIS A 74 -33.010 2.504 -3.770 1.00 1.00 N ATOM 1126 CA HIS A 74 -32.510 1.670 -4.823 1.00 1.00 C ATOM 1127 C HIS A 74 -32.389 2.476 -6.119 1.00 1.00 C ATOM 1128 O HIS A 74 -33.379 2.910 -6.693 1.00 1.00 O ATOM 1129 CB HIS A 74 -33.319 0.337 -4.994 1.00 1.00 C ATOM 1130 CG HIS A 74 -34.750 0.436 -5.497 1.00 1.00 C ATOM 1131 ND1 HIS A 74 -35.858 0.355 -4.682 1.00 1.00 N ATOM 1132 CD2 HIS A 74 -35.229 0.560 -6.749 1.00 1.00 C ATOM 1133 CE1 HIS A 74 -36.947 0.421 -5.417 1.00 1.00 C ATOM 1134 NE2 HIS A 74 -36.591 0.546 -6.673 1.00 1.00 N ATOM 0 H HIS A 74 -33.985 2.783 -3.882 1.00 1.00 H new ATOM 0 HA HIS A 74 -31.510 1.341 -4.542 1.00 1.00 H new ATOM 0 HB2 HIS A 74 -32.766 -0.304 -5.680 1.00 1.00 H new ATOM 0 HB3 HIS A 74 -33.337 -0.170 -4.029 1.00 1.00 H new ATOM 0 HD2 HIS A 74 -34.641 0.654 -7.650 1.00 1.00 H new ATOM 0 HE1 HIS A 74 -37.961 0.379 -5.049 1.00 1.00 H new ATOM 0 HE2 HIS A 74 -37.229 0.621 -7.465 1.00 1.00 H new ATOM 1143 N LEU A 75 -31.183 2.681 -6.550 1.00 1.00 N ATOM 1144 CA LEU A 75 -30.907 3.494 -7.710 1.00 1.00 C ATOM 1145 C LEU A 75 -30.080 2.668 -8.683 1.00 1.00 C ATOM 1146 O LEU A 75 -29.209 1.925 -8.260 1.00 1.00 O ATOM 1147 CB LEU A 75 -30.112 4.737 -7.263 1.00 1.00 C ATOM 1148 CG LEU A 75 -30.300 6.048 -8.077 1.00 1.00 C ATOM 1149 CD1 LEU A 75 -29.654 5.977 -9.448 1.00 1.00 C ATOM 1150 CD2 LEU A 75 -31.779 6.399 -8.202 1.00 1.00 C ATOM 0 H LEU A 75 -30.351 2.289 -6.108 1.00 1.00 H new ATOM 0 HA LEU A 75 -31.831 3.813 -8.193 1.00 1.00 H new ATOM 0 HB2 LEU A 75 -30.373 4.946 -6.226 1.00 1.00 H new ATOM 0 HB3 LEU A 75 -29.053 4.481 -7.280 1.00 1.00 H new ATOM 0 HG LEU A 75 -29.793 6.839 -7.524 1.00 1.00 H new ATOM 0 HD11 LEU A 75 -29.815 6.918 -9.975 1.00 1.00 H new ATOM 0 HD12 LEU A 75 -28.584 5.801 -9.337 1.00 1.00 H new ATOM 0 HD13 LEU A 75 -30.099 5.161 -10.018 1.00 1.00 H new ATOM 0 HD21 LEU A 75 -31.887 7.320 -8.775 1.00 1.00 H new ATOM 0 HD22 LEU A 75 -32.303 5.590 -8.712 1.00 1.00 H new ATOM 0 HD23 LEU A 75 -32.205 6.538 -7.208 1.00 1.00 H new ATOM 1162 N ILE A 76 -30.348 2.776 -9.954 1.00 1.00 N ATOM 1163 CA ILE A 76 -29.585 2.021 -10.934 1.00 1.00 C ATOM 1164 C ILE A 76 -28.248 2.715 -11.181 1.00 1.00 C ATOM 1165 O ILE A 76 -28.206 3.842 -11.683 1.00 1.00 O ATOM 1166 CB ILE A 76 -30.360 1.908 -12.278 1.00 1.00 C ATOM 1167 CG1 ILE A 76 -31.822 1.478 -12.043 1.00 1.00 C ATOM 1168 CG2 ILE A 76 -29.670 0.942 -13.226 1.00 1.00 C ATOM 1169 CD1 ILE A 76 -31.975 0.186 -11.264 1.00 1.00 C ATOM 0 H ILE A 76 -31.080 3.371 -10.343 1.00 1.00 H new ATOM 0 HA ILE A 76 -29.421 1.017 -10.542 1.00 1.00 H new ATOM 0 HB ILE A 76 -30.365 2.896 -12.738 1.00 1.00 H new ATOM 0 HG12 ILE A 76 -32.341 2.274 -11.509 1.00 1.00 H new ATOM 0 HG13 ILE A 76 -32.315 1.367 -13.009 1.00 1.00 H new ATOM 0 HG21 ILE A 76 -30.233 0.882 -14.158 1.00 1.00 H new ATOM 0 HG22 ILE A 76 -28.660 1.295 -13.434 1.00 1.00 H new ATOM 0 HG23 ILE A 76 -29.621 -0.046 -12.767 1.00 1.00 H new ATOM 0 HD11 ILE A 76 -33.034 -0.043 -11.144 1.00 1.00 H new ATOM 0 HD12 ILE A 76 -31.488 -0.625 -11.805 1.00 1.00 H new ATOM 0 HD13 ILE A 76 -31.514 0.296 -10.283 1.00 1.00 H new ATOM 1181 N LEU A 77 -27.175 2.060 -10.822 1.00 1.00 N ATOM 1182 CA LEU A 77 -25.859 2.610 -10.980 1.00 1.00 C ATOM 1183 C LEU A 77 -25.064 1.903 -12.063 1.00 1.00 C ATOM 1184 O LEU A 77 -25.221 0.699 -12.306 1.00 1.00 O ATOM 1185 CB LEU A 77 -25.060 2.577 -9.668 1.00 1.00 C ATOM 1186 CG LEU A 77 -25.187 3.772 -8.702 1.00 1.00 C ATOM 1187 CD1 LEU A 77 -26.614 3.999 -8.276 1.00 1.00 C ATOM 1188 CD2 LEU A 77 -24.349 3.498 -7.494 1.00 1.00 C ATOM 0 H LEU A 77 -27.192 1.127 -10.411 1.00 1.00 H new ATOM 0 HA LEU A 77 -26.010 3.647 -11.279 1.00 1.00 H new ATOM 0 HB2 LEU A 77 -25.351 1.678 -9.124 1.00 1.00 H new ATOM 0 HB3 LEU A 77 -24.006 2.467 -9.924 1.00 1.00 H new ATOM 0 HG LEU A 77 -24.848 4.670 -9.218 1.00 1.00 H new ATOM 0 HD11 LEU A 77 -26.660 4.850 -7.596 1.00 1.00 H new ATOM 0 HD12 LEU A 77 -27.228 4.202 -9.154 1.00 1.00 H new ATOM 0 HD13 LEU A 77 -26.988 3.109 -7.770 1.00 1.00 H new ATOM 0 HD21 LEU A 77 -24.427 4.334 -6.799 1.00 1.00 H new ATOM 0 HD22 LEU A 77 -24.699 2.588 -7.007 1.00 1.00 H new ATOM 0 HD23 LEU A 77 -23.309 3.372 -7.794 1.00 1.00 H new ATOM 1200 N SER A 78 -24.216 2.677 -12.690 1.00 1.00 N ATOM 1201 CA SER A 78 -23.268 2.255 -13.676 1.00 1.00 C ATOM 1202 C SER A 78 -22.289 3.338 -13.824 1.00 1.00 C ATOM 1203 O SER A 78 -22.575 4.482 -13.464 1.00 1.00 O ATOM 1204 CB SER A 78 -23.869 1.841 -15.021 1.00 1.00 C ATOM 1205 OG SER A 78 -24.076 0.433 -15.031 1.00 1.00 O ATOM 0 H SER A 78 -24.170 3.680 -12.511 1.00 1.00 H new ATOM 0 HA SER A 78 -22.800 1.335 -13.325 1.00 1.00 H new ATOM 0 HB2 SER A 78 -24.813 2.360 -15.185 1.00 1.00 H new ATOM 0 HB3 SER A 78 -23.202 2.128 -15.834 1.00 1.00 H new ATOM 0 HG SER A 78 -24.830 0.217 -15.619 1.00 1.00 H new ATOM 1211 N ASP A 79 -21.145 3.015 -14.287 1.00 1.00 N ATOM 1212 CA ASP A 79 -20.101 3.961 -14.391 1.00 1.00 C ATOM 1213 C ASP A 79 -20.342 4.919 -15.516 1.00 1.00 C ATOM 1214 O ASP A 79 -20.102 6.100 -15.364 1.00 1.00 O ATOM 1215 CB ASP A 79 -18.743 3.291 -14.509 1.00 1.00 C ATOM 1216 CG ASP A 79 -18.630 2.377 -15.697 1.00 1.00 C ATOM 1217 OD1 ASP A 79 -19.621 1.714 -16.054 1.00 1.00 O ATOM 1218 OD2 ASP A 79 -17.544 2.294 -16.267 1.00 1.00 O ATOM 0 H ASP A 79 -20.902 2.078 -14.608 1.00 1.00 H new ATOM 0 HA ASP A 79 -20.094 4.538 -13.466 1.00 1.00 H new ATOM 0 HB2 ASP A 79 -17.972 4.059 -14.576 1.00 1.00 H new ATOM 0 HB3 ASP A 79 -18.547 2.721 -13.601 1.00 1.00 H new ATOM 1223 N GLU A 80 -20.870 4.429 -16.617 1.00 1.00 N ATOM 1224 CA GLU A 80 -21.112 5.279 -17.756 1.00 1.00 C ATOM 1225 C GLU A 80 -22.237 4.757 -18.625 1.00 1.00 C ATOM 1226 O GLU A 80 -22.001 3.977 -19.551 1.00 1.00 O ATOM 1227 CB GLU A 80 -19.844 5.428 -18.595 1.00 1.00 C ATOM 1228 CG GLU A 80 -19.986 6.376 -19.777 1.00 1.00 C ATOM 1229 CD GLU A 80 -18.753 6.413 -20.627 1.00 1.00 C ATOM 1230 OE1 GLU A 80 -18.602 5.547 -21.526 1.00 1.00 O ATOM 1231 OE2 GLU A 80 -17.913 7.303 -20.417 1.00 1.00 O ATOM 0 H GLU A 80 -21.137 3.453 -16.745 1.00 1.00 H new ATOM 0 HA GLU A 80 -21.409 6.253 -17.368 1.00 1.00 H new ATOM 0 HB2 GLU A 80 -19.037 5.783 -17.954 1.00 1.00 H new ATOM 0 HB3 GLU A 80 -19.549 4.446 -18.965 1.00 1.00 H new ATOM 0 HG2 GLU A 80 -20.836 6.069 -20.387 1.00 1.00 H new ATOM 0 HG3 GLU A 80 -20.203 7.380 -19.411 1.00 1.00 H new ATOM 1238 N ASP A 81 -23.456 5.151 -18.302 1.00 1.00 N ATOM 1239 CA ASP A 81 -24.620 4.860 -19.186 1.00 1.00 C ATOM 1240 C ASP A 81 -25.847 5.539 -18.692 1.00 1.00 C ATOM 1241 O ASP A 81 -26.086 6.704 -18.965 1.00 1.00 O ATOM 1242 CB ASP A 81 -24.937 3.357 -19.342 1.00 1.00 C ATOM 1243 CG ASP A 81 -25.852 3.098 -20.536 1.00 1.00 C ATOM 1244 OD1 ASP A 81 -25.343 2.948 -21.674 1.00 1.00 O ATOM 1245 OD2 ASP A 81 -27.077 3.049 -20.351 1.00 1.00 O ATOM 0 H ASP A 81 -23.686 5.667 -17.452 1.00 1.00 H new ATOM 0 HA ASP A 81 -24.324 5.241 -20.163 1.00 1.00 H new ATOM 0 HB2 ASP A 81 -24.009 2.800 -19.466 1.00 1.00 H new ATOM 0 HB3 ASP A 81 -25.411 2.988 -18.432 1.00 1.00 H new ATOM 1250 N VAL A 82 -26.584 4.811 -17.901 1.00 1.00 N ATOM 1251 CA VAL A 82 -27.838 5.201 -17.382 1.00 1.00 C ATOM 1252 C VAL A 82 -27.679 6.387 -16.427 1.00 1.00 C ATOM 1253 O VAL A 82 -28.563 7.218 -16.280 1.00 1.00 O ATOM 1254 CB VAL A 82 -28.477 3.977 -16.694 1.00 1.00 C ATOM 1255 CG1 VAL A 82 -27.823 3.601 -15.368 1.00 1.00 C ATOM 1256 CG2 VAL A 82 -29.941 4.114 -16.596 1.00 1.00 C ATOM 0 H VAL A 82 -26.299 3.882 -17.592 1.00 1.00 H new ATOM 0 HA VAL A 82 -28.497 5.537 -18.183 1.00 1.00 H new ATOM 0 HB VAL A 82 -28.277 3.126 -17.345 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -28.328 2.732 -14.947 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -26.772 3.365 -15.535 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -27.901 4.438 -14.674 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -30.357 3.234 -16.106 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -30.185 5.003 -16.014 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -30.365 4.207 -17.596 1.00 1.00 H new ATOM 1266 N THR A 83 -26.530 6.452 -15.825 1.00 1.00 N ATOM 1267 CA THR A 83 -26.187 7.482 -14.899 1.00 1.00 C ATOM 1268 C THR A 83 -25.551 8.668 -15.620 1.00 1.00 C ATOM 1269 O THR A 83 -25.554 9.792 -15.129 1.00 1.00 O ATOM 1270 CB THR A 83 -25.177 6.905 -13.935 1.00 1.00 C ATOM 1271 OG1 THR A 83 -24.281 6.052 -14.704 1.00 1.00 O ATOM 1272 CG2 THR A 83 -25.866 6.065 -12.878 1.00 1.00 C ATOM 0 H THR A 83 -25.786 5.769 -15.970 1.00 1.00 H new ATOM 0 HA THR A 83 -27.084 7.829 -14.386 1.00 1.00 H new ATOM 0 HB THR A 83 -24.637 7.710 -13.437 1.00 1.00 H new ATOM 0 HG1 THR A 83 -23.915 5.353 -14.122 1.00 1.00 H new ATOM 0 HG21 THR A 83 -25.121 5.659 -12.194 1.00 1.00 H new ATOM 0 HG22 THR A 83 -26.570 6.685 -12.322 1.00 1.00 H new ATOM 0 HG23 THR A 83 -26.403 5.247 -13.357 1.00 1.00 H new ATOM 1280 N SER A 84 -25.054 8.416 -16.808 1.00 1.00 N ATOM 1281 CA SER A 84 -24.301 9.396 -17.522 1.00 1.00 C ATOM 1282 C SER A 84 -25.200 10.265 -18.380 1.00 1.00 C ATOM 1283 O SER A 84 -25.479 9.960 -19.541 1.00 1.00 O ATOM 1284 CB SER A 84 -23.196 8.733 -18.365 1.00 1.00 C ATOM 1285 OG SER A 84 -22.199 9.667 -18.757 1.00 1.00 O ATOM 0 H SER A 84 -25.164 7.528 -17.297 1.00 1.00 H new ATOM 0 HA SER A 84 -23.820 10.045 -16.790 1.00 1.00 H new ATOM 0 HB2 SER A 84 -22.735 7.928 -17.792 1.00 1.00 H new ATOM 0 HB3 SER A 84 -23.638 8.280 -19.252 1.00 1.00 H new ATOM 0 HG SER A 84 -21.913 10.186 -17.977 1.00 1.00 H new ATOM 1291 N GLU A 85 -25.681 11.318 -17.784 1.00 1.00 N ATOM 1292 CA GLU A 85 -26.439 12.310 -18.483 1.00 1.00 C ATOM 1293 C GLU A 85 -25.538 13.496 -18.677 1.00 1.00 C ATOM 1294 O GLU A 85 -25.093 14.117 -17.704 1.00 1.00 O ATOM 1295 CB GLU A 85 -27.674 12.700 -17.701 1.00 1.00 C ATOM 1296 CG GLU A 85 -28.688 11.582 -17.569 1.00 1.00 C ATOM 1297 CD GLU A 85 -29.901 11.999 -16.796 1.00 1.00 C ATOM 1298 OE1 GLU A 85 -30.865 12.503 -17.413 1.00 1.00 O ATOM 1299 OE2 GLU A 85 -29.920 11.823 -15.569 1.00 1.00 O ATOM 0 H GLU A 85 -25.556 11.512 -16.790 1.00 1.00 H new ATOM 0 HA GLU A 85 -26.782 11.922 -19.442 1.00 1.00 H new ATOM 0 HB2 GLU A 85 -27.375 13.027 -16.705 1.00 1.00 H new ATOM 0 HB3 GLU A 85 -28.147 13.553 -18.188 1.00 1.00 H new ATOM 0 HG2 GLU A 85 -28.990 11.250 -18.562 1.00 1.00 H new ATOM 0 HG3 GLU A 85 -28.222 10.729 -17.076 1.00 1.00 H new ATOM 1306 N VAL A 86 -25.269 13.825 -19.899 1.00 1.00 N ATOM 1307 CA VAL A 86 -24.285 14.820 -20.211 1.00 1.00 C ATOM 1308 C VAL A 86 -24.777 16.258 -20.040 1.00 1.00 C ATOM 1309 O VAL A 86 -24.968 17.004 -21.001 1.00 1.00 O ATOM 1310 CB VAL A 86 -23.622 14.576 -21.578 1.00 1.00 C ATOM 1311 CG1 VAL A 86 -22.785 13.305 -21.515 1.00 1.00 C ATOM 1312 CG2 VAL A 86 -24.670 14.450 -22.683 1.00 1.00 C ATOM 0 H VAL A 86 -25.724 13.413 -20.713 1.00 1.00 H new ATOM 0 HA VAL A 86 -23.507 14.702 -19.457 1.00 1.00 H new ATOM 0 HB VAL A 86 -22.984 15.429 -21.810 1.00 1.00 H new ATOM 0 HG11 VAL A 86 -22.315 13.131 -22.483 1.00 1.00 H new ATOM 0 HG12 VAL A 86 -22.015 13.414 -20.752 1.00 1.00 H new ATOM 0 HG13 VAL A 86 -23.426 12.459 -21.266 1.00 1.00 H new ATOM 0 HG21 VAL A 86 -24.173 14.278 -23.638 1.00 1.00 H new ATOM 0 HG22 VAL A 86 -25.332 13.613 -22.463 1.00 1.00 H new ATOM 0 HG23 VAL A 86 -25.253 15.369 -22.738 1.00 1.00 H new ATOM 1322 N GLN A 87 -24.997 16.605 -18.801 1.00 1.00 N ATOM 1323 CA GLN A 87 -25.365 17.943 -18.409 1.00 1.00 C ATOM 1324 C GLN A 87 -24.169 18.631 -17.749 1.00 1.00 C ATOM 1325 O GLN A 87 -24.177 19.847 -17.528 1.00 1.00 O ATOM 1326 CB GLN A 87 -26.552 17.904 -17.451 1.00 1.00 C ATOM 1327 CG GLN A 87 -26.331 17.014 -16.245 1.00 1.00 C ATOM 1328 CD GLN A 87 -27.559 16.884 -15.385 1.00 1.00 C ATOM 1329 OE1 GLN A 87 -27.749 17.634 -14.429 1.00 1.00 O ATOM 1330 NE2 GLN A 87 -28.403 15.952 -15.715 1.00 1.00 N ATOM 0 H GLN A 87 -24.925 15.955 -18.019 1.00 1.00 H new ATOM 0 HA GLN A 87 -25.656 18.509 -19.294 1.00 1.00 H new ATOM 0 HB2 GLN A 87 -26.766 18.917 -17.110 1.00 1.00 H new ATOM 0 HB3 GLN A 87 -27.433 17.557 -17.991 1.00 1.00 H new ATOM 0 HG2 GLN A 87 -26.022 16.024 -16.581 1.00 1.00 H new ATOM 0 HG3 GLN A 87 -25.514 17.417 -15.646 1.00 1.00 H new ATOM 0 HE21 GLN A 87 -28.210 15.349 -16.515 1.00 1.00 H new ATOM 0 HE22 GLN A 87 -29.258 15.823 -15.174 1.00 1.00 H new ATOM 1339 N GLY A 88 -23.154 17.842 -17.412 1.00 1.00 N ATOM 1340 CA GLY A 88 -21.978 18.385 -16.823 1.00 1.00 C ATOM 1341 C GLY A 88 -21.193 17.355 -16.067 1.00 1.00 C ATOM 1342 O GLY A 88 -20.376 16.629 -16.639 1.00 1.00 O ATOM 0 H GLY A 88 -23.140 16.831 -17.544 1.00 1.00 H new ATOM 0 HA2 GLY A 88 -21.350 18.817 -17.602 1.00 1.00 H new ATOM 0 HA3 GLY A 88 -22.253 19.196 -16.149 1.00 1.00 H new ATOM 1346 N LEU A 89 -21.506 17.228 -14.803 1.00 1.00 N ATOM 1347 CA LEU A 89 -20.751 16.387 -13.868 1.00 1.00 C ATOM 1348 C LEU A 89 -20.928 14.888 -14.089 1.00 1.00 C ATOM 1349 O LEU A 89 -20.257 14.082 -13.456 1.00 1.00 O ATOM 1350 CB LEU A 89 -21.095 16.769 -12.436 1.00 1.00 C ATOM 1351 CG LEU A 89 -22.592 16.786 -12.076 1.00 1.00 C ATOM 1352 CD1 LEU A 89 -23.087 15.421 -11.636 1.00 1.00 C ATOM 1353 CD2 LEU A 89 -22.862 17.816 -11.014 1.00 1.00 C ATOM 0 H LEU A 89 -22.299 17.705 -14.375 1.00 1.00 H new ATOM 0 HA LEU A 89 -19.697 16.582 -14.064 1.00 1.00 H new ATOM 0 HB2 LEU A 89 -20.590 16.074 -11.766 1.00 1.00 H new ATOM 0 HB3 LEU A 89 -20.684 17.759 -12.238 1.00 1.00 H new ATOM 0 HG LEU A 89 -23.144 17.053 -12.977 1.00 1.00 H new ATOM 0 HD11 LEU A 89 -24.148 15.480 -11.392 1.00 1.00 H new ATOM 0 HD12 LEU A 89 -22.940 14.703 -12.443 1.00 1.00 H new ATOM 0 HD13 LEU A 89 -22.530 15.098 -10.757 1.00 1.00 H new ATOM 0 HD21 LEU A 89 -23.924 17.817 -10.770 1.00 1.00 H new ATOM 0 HD22 LEU A 89 -22.284 17.578 -10.121 1.00 1.00 H new ATOM 0 HD23 LEU A 89 -22.573 18.801 -11.381 1.00 1.00 H new ATOM 1365 N PHE A 90 -21.817 14.517 -14.972 1.00 1.00 N ATOM 1366 CA PHE A 90 -22.068 13.111 -15.206 1.00 1.00 C ATOM 1367 C PHE A 90 -21.129 12.523 -16.243 1.00 1.00 C ATOM 1368 O PHE A 90 -21.200 11.326 -16.557 1.00 1.00 O ATOM 1369 CB PHE A 90 -23.496 12.855 -15.562 1.00 1.00 C ATOM 1370 CG PHE A 90 -24.445 12.952 -14.399 1.00 1.00 C ATOM 1371 CD1 PHE A 90 -24.374 12.043 -13.355 1.00 1.00 C ATOM 1372 CD2 PHE A 90 -25.412 13.940 -14.352 1.00 1.00 C ATOM 1373 CE1 PHE A 90 -25.243 12.124 -12.285 1.00 1.00 C ATOM 1374 CE2 PHE A 90 -26.285 14.024 -13.288 1.00 1.00 C ATOM 1375 CZ PHE A 90 -26.202 13.113 -12.253 1.00 1.00 C ATOM 0 H PHE A 90 -22.376 15.156 -15.537 1.00 1.00 H new ATOM 0 HA PHE A 90 -21.865 12.600 -14.265 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -23.802 13.568 -16.327 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -23.577 11.861 -16.002 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -23.629 11.261 -13.379 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -25.484 14.654 -15.159 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -25.171 11.414 -11.475 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -27.034 14.802 -13.264 1.00 1.00 H new ATOM 0 HZ PHE A 90 -26.887 13.176 -11.421 1.00 1.00 H new ATOM 1385 N ARG A 91 -20.279 13.356 -16.807 1.00 1.00 N ATOM 1386 CA ARG A 91 -19.215 12.845 -17.643 1.00 1.00 C ATOM 1387 C ARG A 91 -18.073 12.471 -16.730 1.00 1.00 C ATOM 1388 O ARG A 91 -17.205 13.304 -16.424 1.00 1.00 O ATOM 1389 CB ARG A 91 -18.741 13.879 -18.669 1.00 1.00 C ATOM 1390 CG ARG A 91 -19.658 14.060 -19.853 1.00 1.00 C ATOM 1391 CD ARG A 91 -19.134 15.141 -20.775 1.00 1.00 C ATOM 1392 NE ARG A 91 -19.901 15.233 -22.021 1.00 1.00 N ATOM 1393 CZ ARG A 91 -20.022 16.337 -22.763 1.00 1.00 C ATOM 1394 NH1 ARG A 91 -19.475 17.477 -22.368 1.00 1.00 N ATOM 1395 NH2 ARG A 91 -20.695 16.296 -23.899 1.00 1.00 N ATOM 0 H ARG A 91 -20.302 14.371 -16.705 1.00 1.00 H new ATOM 0 HA ARG A 91 -19.579 11.986 -18.208 1.00 1.00 H new ATOM 0 HB2 ARG A 91 -18.623 14.840 -18.168 1.00 1.00 H new ATOM 0 HB3 ARG A 91 -17.756 13.586 -19.032 1.00 1.00 H new ATOM 0 HG2 ARG A 91 -19.745 13.120 -20.399 1.00 1.00 H new ATOM 0 HG3 ARG A 91 -20.658 14.322 -19.508 1.00 1.00 H new ATOM 0 HD2 ARG A 91 -19.166 16.101 -20.260 1.00 1.00 H new ATOM 0 HD3 ARG A 91 -18.089 14.940 -21.009 1.00 1.00 H new ATOM 0 HE ARG A 91 -20.378 14.392 -22.345 1.00 1.00 H new ATOM 0 HH11 ARG A 91 -18.956 17.517 -21.491 1.00 1.00 H new ATOM 0 HH12 ARG A 91 -19.573 18.315 -22.941 1.00 1.00 H new ATOM 0 HH21 ARG A 91 -21.121 15.422 -24.208 1.00 1.00 H new ATOM 0 HH22 ARG A 91 -20.789 17.138 -24.467 1.00 1.00 H new ATOM 1409 N ARG A 92 -18.077 11.226 -16.314 1.00 1.00 N ATOM 1410 CA ARG A 92 -17.140 10.689 -15.357 1.00 1.00 C ATOM 1411 C ARG A 92 -17.603 9.282 -15.049 1.00 1.00 C ATOM 1412 O ARG A 92 -18.773 8.959 -15.270 1.00 1.00 O ATOM 1413 CB ARG A 92 -17.208 11.523 -14.055 1.00 1.00 C ATOM 1414 CG ARG A 92 -16.121 11.238 -13.041 1.00 1.00 C ATOM 1415 CD ARG A 92 -16.348 12.016 -11.756 1.00 1.00 C ATOM 1416 NE ARG A 92 -16.348 13.464 -11.974 1.00 1.00 N ATOM 1417 CZ ARG A 92 -16.360 14.387 -11.013 1.00 1.00 C ATOM 1418 NH1 ARG A 92 -16.233 14.033 -9.738 1.00 1.00 N ATOM 1419 NH2 ARG A 92 -16.457 15.668 -11.337 1.00 1.00 N ATOM 0 H ARG A 92 -18.754 10.538 -16.643 1.00 1.00 H new ATOM 0 HA ARG A 92 -16.122 10.708 -15.746 1.00 1.00 H new ATOM 0 HB2 ARG A 92 -17.167 12.580 -14.319 1.00 1.00 H new ATOM 0 HB3 ARG A 92 -18.175 11.350 -13.583 1.00 1.00 H new ATOM 0 HG2 ARG A 92 -16.095 10.170 -12.823 1.00 1.00 H new ATOM 0 HG3 ARG A 92 -15.150 11.501 -13.461 1.00 1.00 H new ATOM 0 HD2 ARG A 92 -17.300 11.717 -11.317 1.00 1.00 H new ATOM 0 HD3 ARG A 92 -15.570 11.759 -11.037 1.00 1.00 H new ATOM 0 HE ARG A 92 -16.338 13.793 -12.940 1.00 1.00 H new ATOM 0 HH11 ARG A 92 -16.125 13.049 -9.490 1.00 1.00 H new ATOM 0 HH12 ARG A 92 -16.243 14.745 -9.008 1.00 1.00 H new ATOM 0 HH21 ARG A 92 -16.522 15.943 -12.317 1.00 1.00 H new ATOM 0 HH22 ARG A 92 -16.467 16.380 -10.606 1.00 1.00 H new ATOM 1433 N LEU A 93 -16.713 8.439 -14.581 1.00 1.00 N ATOM 1434 CA LEU A 93 -17.113 7.134 -14.145 1.00 1.00 C ATOM 1435 C LEU A 93 -17.755 7.291 -12.792 1.00 1.00 C ATOM 1436 O LEU A 93 -17.263 8.053 -11.961 1.00 1.00 O ATOM 1437 CB LEU A 93 -15.911 6.193 -14.038 1.00 1.00 C ATOM 1438 CG LEU A 93 -15.178 5.867 -15.333 1.00 1.00 C ATOM 1439 CD1 LEU A 93 -13.982 4.988 -15.049 1.00 1.00 C ATOM 1440 CD2 LEU A 93 -16.105 5.176 -16.300 1.00 1.00 C ATOM 0 H LEU A 93 -15.716 8.637 -14.495 1.00 1.00 H new ATOM 0 HA LEU A 93 -17.806 6.700 -14.866 1.00 1.00 H new ATOM 0 HB2 LEU A 93 -15.195 6.633 -13.344 1.00 1.00 H new ATOM 0 HB3 LEU A 93 -16.250 5.257 -13.595 1.00 1.00 H new ATOM 0 HG LEU A 93 -14.834 6.799 -15.781 1.00 1.00 H new ATOM 0 HD11 LEU A 93 -13.467 4.762 -15.983 1.00 1.00 H new ATOM 0 HD12 LEU A 93 -13.301 5.507 -14.375 1.00 1.00 H new ATOM 0 HD13 LEU A 93 -14.315 4.060 -14.584 1.00 1.00 H new ATOM 0 HD21 LEU A 93 -15.567 4.949 -17.221 1.00 1.00 H new ATOM 0 HD22 LEU A 93 -16.470 4.250 -15.856 1.00 1.00 H new ATOM 0 HD23 LEU A 93 -16.949 5.828 -16.524 1.00 1.00 H new ATOM 1452 N ASN A 94 -18.834 6.604 -12.558 1.00 1.00 N ATOM 1453 CA ASN A 94 -19.505 6.735 -11.295 1.00 1.00 C ATOM 1454 C ASN A 94 -18.832 5.858 -10.275 1.00 1.00 C ATOM 1455 O ASN A 94 -18.397 4.765 -10.593 1.00 1.00 O ATOM 1456 CB ASN A 94 -20.997 6.391 -11.414 1.00 1.00 C ATOM 1457 CG ASN A 94 -21.806 7.466 -12.132 1.00 1.00 C ATOM 1458 OD1 ASN A 94 -22.315 8.389 -11.508 1.00 1.00 O ATOM 1459 ND2 ASN A 94 -21.925 7.351 -13.452 1.00 1.00 N ATOM 0 H ASN A 94 -19.266 5.954 -13.215 1.00 1.00 H new ATOM 0 HA ASN A 94 -19.439 7.774 -10.972 1.00 1.00 H new ATOM 0 HB2 ASN A 94 -21.104 5.447 -11.949 1.00 1.00 H new ATOM 0 HB3 ASN A 94 -21.409 6.241 -10.416 1.00 1.00 H new ATOM 0 HD21 ASN A 94 -22.454 8.046 -13.979 1.00 1.00 H new ATOM 0 HD22 ASN A 94 -21.487 6.568 -13.937 1.00 1.00 H new ATOM 1466 N THR A 95 -18.708 6.361 -9.086 1.00 1.00 N ATOM 1467 CA THR A 95 -18.124 5.656 -7.978 1.00 1.00 C ATOM 1468 C THR A 95 -19.180 5.426 -6.943 1.00 1.00 C ATOM 1469 O THR A 95 -20.309 5.932 -7.079 1.00 1.00 O ATOM 1470 CB THR A 95 -17.074 6.531 -7.328 1.00 1.00 C ATOM 1471 OG1 THR A 95 -17.516 7.899 -7.382 1.00 1.00 O ATOM 1472 CG2 THR A 95 -15.735 6.385 -7.984 1.00 1.00 C ATOM 0 H THR A 95 -19.019 7.303 -8.848 1.00 1.00 H new ATOM 0 HA THR A 95 -17.696 4.720 -8.336 1.00 1.00 H new ATOM 0 HB THR A 95 -16.951 6.216 -6.292 1.00 1.00 H new ATOM 0 HG1 THR A 95 -16.740 8.490 -7.476 1.00 1.00 H new ATOM 0 HG21 THR A 95 -15.013 7.031 -7.485 1.00 1.00 H new ATOM 0 HG22 THR A 95 -15.405 5.349 -7.912 1.00 1.00 H new ATOM 0 HG23 THR A 95 -15.811 6.669 -9.034 1.00 1.00 H new ATOM 1480 N LEU A 96 -18.846 4.699 -5.904 1.00 1.00 N ATOM 1481 CA LEU A 96 -19.777 4.557 -4.818 1.00 1.00 C ATOM 1482 C LEU A 96 -19.823 5.864 -4.055 1.00 1.00 C ATOM 1483 O LEU A 96 -20.846 6.222 -3.484 1.00 1.00 O ATOM 1484 CB LEU A 96 -19.496 3.326 -3.906 1.00 1.00 C ATOM 1485 CG LEU A 96 -18.343 3.393 -2.882 1.00 1.00 C ATOM 1486 CD1 LEU A 96 -18.759 4.120 -1.605 1.00 1.00 C ATOM 1487 CD2 LEU A 96 -17.901 1.995 -2.533 1.00 1.00 C ATOM 0 H LEU A 96 -17.959 4.209 -5.790 1.00 1.00 H new ATOM 0 HA LEU A 96 -20.763 4.345 -5.231 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -20.411 3.111 -3.355 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -19.307 2.472 -4.557 1.00 1.00 H new ATOM 0 HG LEU A 96 -17.525 3.951 -3.338 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -17.919 4.145 -0.911 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -19.060 5.139 -1.848 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -19.596 3.595 -1.144 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -17.087 2.041 -1.810 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -18.738 1.446 -2.103 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -17.558 1.486 -3.434 1.00 1.00 H new ATOM 1499 N GLN A 97 -18.687 6.597 -4.065 1.00 1.00 N ATOM 1500 CA GLN A 97 -18.622 7.911 -3.429 1.00 1.00 C ATOM 1501 C GLN A 97 -19.515 8.928 -4.121 1.00 1.00 C ATOM 1502 O GLN A 97 -19.918 9.906 -3.509 1.00 1.00 O ATOM 1503 CB GLN A 97 -17.202 8.431 -3.315 1.00 1.00 C ATOM 1504 CG GLN A 97 -16.588 8.926 -4.597 1.00 1.00 C ATOM 1505 CD GLN A 97 -15.111 8.923 -4.491 1.00 1.00 C ATOM 1506 OE1 GLN A 97 -14.475 9.938 -4.220 1.00 1.00 O ATOM 1507 NE2 GLN A 97 -14.560 7.779 -4.664 1.00 1.00 N ATOM 0 H GLN A 97 -17.817 6.296 -4.504 1.00 1.00 H new ATOM 0 HA GLN A 97 -19.000 7.771 -2.416 1.00 1.00 H new ATOM 0 HB2 GLN A 97 -17.189 9.244 -2.589 1.00 1.00 H new ATOM 0 HB3 GLN A 97 -16.573 7.635 -2.915 1.00 1.00 H new ATOM 0 HG2 GLN A 97 -16.902 8.293 -5.427 1.00 1.00 H new ATOM 0 HG3 GLN A 97 -16.942 9.934 -4.813 1.00 1.00 H new ATOM 0 HE21 GLN A 97 -15.133 6.965 -4.888 1.00 1.00 H new ATOM 0 HE22 GLN A 97 -13.548 7.682 -4.578 1.00 1.00 H new ATOM 1516 N HIS A 98 -19.803 8.697 -5.396 1.00 1.00 N ATOM 1517 CA HIS A 98 -20.637 9.608 -6.182 1.00 1.00 C ATOM 1518 C HIS A 98 -22.012 9.713 -5.526 1.00 1.00 C ATOM 1519 O HIS A 98 -22.555 10.795 -5.386 1.00 1.00 O ATOM 1520 CB HIS A 98 -20.779 9.108 -7.640 1.00 1.00 C ATOM 1521 CG HIS A 98 -21.275 10.144 -8.628 1.00 1.00 C ATOM 1522 ND1 HIS A 98 -22.564 10.619 -8.661 1.00 1.00 N ATOM 1523 CD2 HIS A 98 -20.627 10.778 -9.636 1.00 1.00 C ATOM 1524 CE1 HIS A 98 -22.686 11.495 -9.636 1.00 1.00 C ATOM 1525 NE2 HIS A 98 -21.525 11.616 -10.241 1.00 1.00 N ATOM 0 H HIS A 98 -19.471 7.883 -5.913 1.00 1.00 H new ATOM 0 HA HIS A 98 -20.164 10.590 -6.209 1.00 1.00 H new ATOM 0 HB2 HIS A 98 -19.810 8.741 -7.978 1.00 1.00 H new ATOM 0 HB3 HIS A 98 -21.463 8.260 -7.652 1.00 1.00 H new ATOM 0 HD2 HIS A 98 -19.591 10.646 -9.912 1.00 1.00 H new ATOM 0 HE1 HIS A 98 -23.590 12.026 -9.896 1.00 1.00 H new ATOM 0 HE2 HIS A 98 -21.326 12.232 -11.030 1.00 1.00 H new ATOM 1534 N TYR A 99 -22.560 8.572 -5.120 1.00 1.00 N ATOM 1535 CA TYR A 99 -23.845 8.556 -4.432 1.00 1.00 C ATOM 1536 C TYR A 99 -23.669 8.509 -2.912 1.00 1.00 C ATOM 1537 O TYR A 99 -24.629 8.710 -2.168 1.00 1.00 O ATOM 1538 CB TYR A 99 -24.675 7.357 -4.900 1.00 1.00 C ATOM 1539 CG TYR A 99 -25.194 7.497 -6.313 1.00 1.00 C ATOM 1540 CD1 TYR A 99 -24.390 7.198 -7.409 1.00 1.00 C ATOM 1541 CD2 TYR A 99 -26.491 7.931 -6.555 1.00 1.00 C ATOM 1542 CE1 TYR A 99 -24.861 7.330 -8.697 1.00 1.00 C ATOM 1543 CE2 TYR A 99 -26.969 8.066 -7.839 1.00 1.00 C ATOM 1544 CZ TYR A 99 -26.151 7.761 -8.906 1.00 1.00 C ATOM 1545 OH TYR A 99 -26.626 7.894 -10.187 1.00 1.00 O ATOM 0 H TYR A 99 -22.138 7.653 -5.254 1.00 1.00 H new ATOM 0 HA TYR A 99 -24.368 9.480 -4.680 1.00 1.00 H new ATOM 0 HB2 TYR A 99 -24.066 6.455 -4.833 1.00 1.00 H new ATOM 0 HB3 TYR A 99 -25.519 7.223 -4.223 1.00 1.00 H new ATOM 0 HD1 TYR A 99 -23.378 6.856 -7.247 1.00 1.00 H new ATOM 0 HD2 TYR A 99 -27.136 8.167 -5.721 1.00 1.00 H new ATOM 0 HE1 TYR A 99 -24.223 7.097 -9.536 1.00 1.00 H new ATOM 0 HE2 TYR A 99 -27.979 8.409 -8.009 1.00 1.00 H new ATOM 0 HH TYR A 99 -27.554 8.207 -10.161 1.00 1.00 H new ATOM 1555 N LYS A 100 -22.432 8.277 -2.477 1.00 1.00 N ATOM 1556 CA LYS A 100 -22.070 8.120 -1.067 1.00 1.00 C ATOM 1557 C LYS A 100 -22.899 7.081 -0.355 1.00 1.00 C ATOM 1558 O LYS A 100 -23.794 7.393 0.436 1.00 1.00 O ATOM 1559 CB LYS A 100 -21.988 9.448 -0.285 1.00 1.00 C ATOM 1560 CG LYS A 100 -20.690 10.217 -0.512 1.00 1.00 C ATOM 1561 CD LYS A 100 -19.486 9.419 -0.003 1.00 1.00 C ATOM 1562 CE LYS A 100 -18.174 10.155 -0.217 1.00 1.00 C ATOM 1563 NZ LYS A 100 -17.009 9.355 0.248 1.00 1.00 N ATOM 0 H LYS A 100 -21.635 8.191 -3.108 1.00 1.00 H new ATOM 0 HA LYS A 100 -21.049 7.738 -1.089 1.00 1.00 H new ATOM 0 HB2 LYS A 100 -22.829 10.080 -0.571 1.00 1.00 H new ATOM 0 HB3 LYS A 100 -22.094 9.239 0.780 1.00 1.00 H new ATOM 0 HG2 LYS A 100 -20.569 10.428 -1.574 1.00 1.00 H new ATOM 0 HG3 LYS A 100 -20.737 11.178 0.000 1.00 1.00 H new ATOM 0 HD2 LYS A 100 -19.614 9.210 1.059 1.00 1.00 H new ATOM 0 HD3 LYS A 100 -19.448 8.457 -0.514 1.00 1.00 H new ATOM 0 HE2 LYS A 100 -18.056 10.387 -1.275 1.00 1.00 H new ATOM 0 HE3 LYS A 100 -18.199 11.105 0.317 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 -16.128 9.845 -0.007 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 -17.056 9.241 1.281 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 -17.028 8.419 -0.205 1.00 1.00 H new ATOM 1577 N VAL A 101 -22.622 5.845 -0.665 1.00 1.00 N ATOM 1578 CA VAL A 101 -23.311 4.754 -0.013 1.00 1.00 C ATOM 1579 C VAL A 101 -22.661 4.427 1.335 1.00 1.00 C ATOM 1580 O VAL A 101 -21.445 4.606 1.514 1.00 1.00 O ATOM 1581 CB VAL A 101 -23.395 3.475 -0.895 1.00 1.00 C ATOM 1582 CG1 VAL A 101 -23.573 3.833 -2.351 1.00 1.00 C ATOM 1583 CG2 VAL A 101 -22.208 2.522 -0.693 1.00 1.00 C ATOM 0 H VAL A 101 -21.930 5.564 -1.359 1.00 1.00 H new ATOM 0 HA VAL A 101 -24.333 5.093 0.153 1.00 1.00 H new ATOM 0 HB VAL A 101 -24.278 2.929 -0.564 1.00 1.00 H new ATOM 0 HG11 VAL A 101 -23.629 2.921 -2.946 1.00 1.00 H new ATOM 0 HG12 VAL A 101 -24.493 4.404 -2.475 1.00 1.00 H new ATOM 0 HG13 VAL A 101 -22.726 4.432 -2.685 1.00 1.00 H new ATOM 0 HG21 VAL A 101 -22.327 1.651 -1.337 1.00 1.00 H new ATOM 0 HG22 VAL A 101 -21.281 3.036 -0.947 1.00 1.00 H new ATOM 0 HG23 VAL A 101 -22.172 2.202 0.348 1.00 1.00 H new ATOM 1593 N PRO A 102 -23.468 3.978 2.297 1.00 1.00 N ATOM 1594 CA PRO A 102 -22.978 3.582 3.609 1.00 1.00 C ATOM 1595 C PRO A 102 -22.307 2.232 3.602 1.00 1.00 C ATOM 1596 O PRO A 102 -22.499 1.417 2.675 1.00 1.00 O ATOM 1597 CB PRO A 102 -24.250 3.561 4.456 1.00 1.00 C ATOM 1598 CG PRO A 102 -25.314 3.167 3.502 1.00 1.00 C ATOM 1599 CD PRO A 102 -24.931 3.803 2.188 1.00 1.00 C ATOM 0 HA PRO A 102 -22.209 4.259 3.983 1.00 1.00 H new ATOM 0 HB2 PRO A 102 -24.169 2.850 5.279 1.00 1.00 H new ATOM 0 HB3 PRO A 102 -24.451 4.537 4.897 1.00 1.00 H new ATOM 0 HG2 PRO A 102 -25.377 2.083 3.410 1.00 1.00 H new ATOM 0 HG3 PRO A 102 -26.291 3.516 3.837 1.00 1.00 H new ATOM 0 HD2 PRO A 102 -25.196 3.168 1.343 1.00 1.00 H new ATOM 0 HD3 PRO A 102 -25.439 4.756 2.042 1.00 1.00 H new ATOM 1607 N ASP A 103 -21.495 1.995 4.605 1.00 1.00 N ATOM 1608 CA ASP A 103 -20.852 0.722 4.764 1.00 1.00 C ATOM 1609 C ASP A 103 -21.885 -0.326 5.046 1.00 1.00 C ATOM 1610 O ASP A 103 -22.666 -0.229 5.996 1.00 1.00 O ATOM 1611 CB ASP A 103 -19.750 0.741 5.843 1.00 1.00 C ATOM 1612 CG ASP A 103 -20.252 1.006 7.246 1.00 1.00 C ATOM 1613 OD1 ASP A 103 -20.421 2.195 7.613 1.00 1.00 O ATOM 1614 OD2 ASP A 103 -20.450 0.045 8.005 1.00 1.00 O ATOM 0 H ASP A 103 -21.266 2.678 5.327 1.00 1.00 H new ATOM 0 HA ASP A 103 -20.344 0.482 3.830 1.00 1.00 H new ATOM 0 HB2 ASP A 103 -19.231 -0.217 5.831 1.00 1.00 H new ATOM 0 HB3 ASP A 103 -19.017 1.504 5.582 1.00 1.00 H new ATOM 1619 N GLY A 104 -21.920 -1.303 4.206 1.00 1.00 N ATOM 1620 CA GLY A 104 -22.886 -2.346 4.355 1.00 1.00 C ATOM 1621 C GLY A 104 -24.058 -2.136 3.437 1.00 1.00 C ATOM 1622 O GLY A 104 -25.177 -2.588 3.723 1.00 1.00 O ATOM 0 H GLY A 104 -21.293 -1.405 3.408 1.00 1.00 H new ATOM 0 HA2 GLY A 104 -22.422 -3.309 4.142 1.00 1.00 H new ATOM 0 HA3 GLY A 104 -23.231 -2.381 5.388 1.00 1.00 H new ATOM 1626 N ALA A 105 -23.828 -1.416 2.343 1.00 1.00 N ATOM 1627 CA ALA A 105 -24.863 -1.212 1.348 1.00 1.00 C ATOM 1628 C ALA A 105 -25.053 -2.481 0.510 1.00 1.00 C ATOM 1629 O ALA A 105 -24.190 -3.373 0.498 1.00 1.00 O ATOM 1630 CB ALA A 105 -24.553 -0.016 0.468 1.00 1.00 C ATOM 0 H ALA A 105 -22.937 -0.968 2.128 1.00 1.00 H new ATOM 0 HA ALA A 105 -25.798 -1.000 1.867 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -25.348 0.110 -0.267 1.00 1.00 H new ATOM 0 HB2 ALA A 105 -24.483 0.881 1.084 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -23.605 -0.178 -0.046 1.00 1.00 H new ATOM 1636 N THR A 106 -26.151 -2.569 -0.177 1.00 1.00 N ATOM 1637 CA THR A 106 -26.468 -3.767 -0.917 1.00 1.00 C ATOM 1638 C THR A 106 -26.505 -3.476 -2.404 1.00 1.00 C ATOM 1639 O THR A 106 -27.111 -2.507 -2.838 1.00 1.00 O ATOM 1640 CB THR A 106 -27.830 -4.354 -0.457 1.00 1.00 C ATOM 1641 OG1 THR A 106 -27.795 -4.570 0.959 1.00 1.00 O ATOM 1642 CG2 THR A 106 -28.127 -5.682 -1.152 1.00 1.00 C ATOM 0 H THR A 106 -26.848 -1.828 -0.245 1.00 1.00 H new ATOM 0 HA THR A 106 -25.689 -4.503 -0.720 1.00 1.00 H new ATOM 0 HB THR A 106 -28.613 -3.643 -0.720 1.00 1.00 H new ATOM 0 HG1 THR A 106 -28.653 -4.939 1.255 1.00 1.00 H new ATOM 0 HG21 THR A 106 -29.087 -6.066 -0.808 1.00 1.00 H new ATOM 0 HG22 THR A 106 -28.163 -5.528 -2.230 1.00 1.00 H new ATOM 0 HG23 THR A 106 -27.343 -6.401 -0.914 1.00 1.00 H new ATOM 1650 N VAL A 107 -25.840 -4.290 -3.177 1.00 1.00 N ATOM 1651 CA VAL A 107 -25.845 -4.121 -4.600 1.00 1.00 C ATOM 1652 C VAL A 107 -26.521 -5.302 -5.248 1.00 1.00 C ATOM 1653 O VAL A 107 -26.352 -6.435 -4.803 1.00 1.00 O ATOM 1654 CB VAL A 107 -24.421 -3.939 -5.200 1.00 1.00 C ATOM 1655 CG1 VAL A 107 -23.733 -2.738 -4.601 1.00 1.00 C ATOM 1656 CG2 VAL A 107 -23.555 -5.187 -5.043 1.00 1.00 C ATOM 0 H VAL A 107 -25.287 -5.079 -2.842 1.00 1.00 H new ATOM 0 HA VAL A 107 -26.395 -3.203 -4.808 1.00 1.00 H new ATOM 0 HB VAL A 107 -24.551 -3.773 -6.269 1.00 1.00 H new ATOM 0 HG11 VAL A 107 -22.740 -2.633 -5.037 1.00 1.00 H new ATOM 0 HG12 VAL A 107 -24.318 -1.842 -4.810 1.00 1.00 H new ATOM 0 HG13 VAL A 107 -23.644 -2.870 -3.523 1.00 1.00 H new ATOM 0 HG21 VAL A 107 -22.572 -5.005 -5.479 1.00 1.00 H new ATOM 0 HG22 VAL A 107 -23.445 -5.423 -3.984 1.00 1.00 H new ATOM 0 HG23 VAL A 107 -24.029 -6.025 -5.554 1.00 1.00 H new ATOM 1666 N ALA A 108 -27.328 -5.038 -6.229 1.00 1.00 N ATOM 1667 CA ALA A 108 -27.961 -6.098 -6.960 1.00 1.00 C ATOM 1668 C ALA A 108 -27.709 -5.949 -8.427 1.00 1.00 C ATOM 1669 O ALA A 108 -27.963 -4.916 -9.005 1.00 1.00 O ATOM 1670 CB ALA A 108 -29.429 -6.180 -6.685 1.00 1.00 C ATOM 0 H ALA A 108 -27.566 -4.097 -6.544 1.00 1.00 H new ATOM 0 HA ALA A 108 -27.517 -7.033 -6.617 1.00 1.00 H new ATOM 0 HB1 ALA A 108 -29.862 -6.997 -7.262 1.00 1.00 H new ATOM 0 HB2 ALA A 108 -29.591 -6.360 -5.622 1.00 1.00 H new ATOM 0 HB3 ALA A 108 -29.906 -5.242 -6.971 1.00 1.00 H new ATOM 1676 N LEU A 109 -27.247 -6.975 -9.013 1.00 1.00 N ATOM 1677 CA LEU A 109 -26.864 -6.949 -10.414 1.00 1.00 C ATOM 1678 C LEU A 109 -28.022 -7.386 -11.274 1.00 1.00 C ATOM 1679 O LEU A 109 -28.602 -8.444 -11.048 1.00 1.00 O ATOM 1680 CB LEU A 109 -25.631 -7.847 -10.667 1.00 1.00 C ATOM 1681 CG LEU A 109 -24.244 -7.245 -10.341 1.00 1.00 C ATOM 1682 CD1 LEU A 109 -24.044 -7.053 -8.841 1.00 1.00 C ATOM 1683 CD2 LEU A 109 -23.133 -8.116 -10.914 1.00 1.00 C ATOM 0 H LEU A 109 -27.112 -7.877 -8.557 1.00 1.00 H new ATOM 0 HA LEU A 109 -26.594 -5.927 -10.679 1.00 1.00 H new ATOM 0 HB2 LEU A 109 -25.750 -8.759 -10.082 1.00 1.00 H new ATOM 0 HB3 LEU A 109 -25.635 -8.139 -11.717 1.00 1.00 H new ATOM 0 HG LEU A 109 -24.201 -6.261 -10.808 1.00 1.00 H new ATOM 0 HD11 LEU A 109 -23.057 -6.628 -8.657 1.00 1.00 H new ATOM 0 HD12 LEU A 109 -24.808 -6.377 -8.456 1.00 1.00 H new ATOM 0 HD13 LEU A 109 -24.124 -8.016 -8.337 1.00 1.00 H new ATOM 0 HD21 LEU A 109 -22.165 -7.676 -10.674 1.00 1.00 H new ATOM 0 HD22 LEU A 109 -23.194 -9.115 -10.482 1.00 1.00 H new ATOM 0 HD23 LEU A 109 -23.244 -8.181 -11.996 1.00 1.00 H new ATOM 1695 N VAL A 110 -28.359 -6.579 -12.247 1.00 1.00 N ATOM 1696 CA VAL A 110 -29.469 -6.848 -13.130 1.00 1.00 C ATOM 1697 C VAL A 110 -28.993 -6.720 -14.570 1.00 1.00 C ATOM 1698 O VAL A 110 -28.022 -6.016 -14.826 1.00 1.00 O ATOM 1699 CB VAL A 110 -30.656 -5.852 -12.881 1.00 1.00 C ATOM 1700 CG1 VAL A 110 -31.295 -6.107 -11.539 1.00 1.00 C ATOM 1701 CG2 VAL A 110 -30.196 -4.401 -12.970 1.00 1.00 C ATOM 0 H VAL A 110 -27.868 -5.709 -12.452 1.00 1.00 H new ATOM 0 HA VAL A 110 -29.832 -7.857 -12.934 1.00 1.00 H new ATOM 0 HB VAL A 110 -31.394 -6.024 -13.664 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -32.115 -5.405 -11.387 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -31.679 -7.127 -11.507 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -30.553 -5.974 -10.752 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -31.044 -3.739 -12.792 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -29.428 -4.216 -12.219 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -29.787 -4.209 -13.962 1.00 1.00 H new ATOM 1711 N PRO A 111 -29.636 -7.403 -15.530 1.00 1.00 N ATOM 1712 CA PRO A 111 -29.267 -7.296 -16.950 1.00 1.00 C ATOM 1713 C PRO A 111 -29.669 -5.920 -17.513 1.00 1.00 C ATOM 1714 O PRO A 111 -30.662 -5.784 -18.208 1.00 1.00 O ATOM 1715 CB PRO A 111 -30.078 -8.419 -17.613 1.00 1.00 C ATOM 1716 CG PRO A 111 -31.242 -8.627 -16.707 1.00 1.00 C ATOM 1717 CD PRO A 111 -30.749 -8.352 -15.319 1.00 1.00 C ATOM 0 HA PRO A 111 -28.195 -7.388 -17.123 1.00 1.00 H new ATOM 0 HB2 PRO A 111 -30.401 -8.136 -18.615 1.00 1.00 H new ATOM 0 HB3 PRO A 111 -29.486 -9.329 -17.714 1.00 1.00 H new ATOM 0 HG2 PRO A 111 -32.062 -7.958 -16.968 1.00 1.00 H new ATOM 0 HG3 PRO A 111 -31.622 -9.645 -16.790 1.00 1.00 H new ATOM 0 HD2 PRO A 111 -31.531 -7.921 -14.693 1.00 1.00 H new ATOM 0 HD3 PRO A 111 -30.411 -9.263 -14.825 1.00 1.00 H new ATOM 1725 N CYS A 112 -28.899 -4.903 -17.121 1.00 1.00 N ATOM 1726 CA CYS A 112 -29.086 -3.482 -17.507 1.00 1.00 C ATOM 1727 C CYS A 112 -30.451 -2.958 -17.091 1.00 1.00 C ATOM 1728 O CYS A 112 -30.929 -1.960 -17.626 1.00 1.00 O ATOM 1729 CB CYS A 112 -28.884 -3.283 -19.009 1.00 1.00 C ATOM 1730 SG CYS A 112 -27.921 -1.815 -19.437 1.00 1.00 S ATOM 0 H CYS A 112 -28.098 -5.039 -16.505 1.00 1.00 H new ATOM 0 HA CYS A 112 -28.327 -2.909 -16.974 1.00 1.00 H new ATOM 0 HB2 CYS A 112 -28.386 -4.163 -19.417 1.00 1.00 H new ATOM 0 HB3 CYS A 112 -29.860 -3.217 -19.490 1.00 1.00 H new ATOM 0 HG CYS A 112 -27.971 -0.963 -18.457 1.00 1.00 H new ATOM 1736 N LEU A 113 -31.096 -3.681 -16.152 1.00 1.00 N ATOM 1737 CA LEU A 113 -32.440 -3.401 -15.632 1.00 1.00 C ATOM 1738 C LEU A 113 -33.468 -3.810 -16.689 1.00 1.00 C ATOM 1739 O LEU A 113 -34.499 -4.429 -16.398 1.00 1.00 O ATOM 1740 CB LEU A 113 -32.568 -1.901 -15.191 1.00 1.00 C ATOM 1741 CG LEU A 113 -33.895 -1.426 -14.560 1.00 1.00 C ATOM 1742 CD1 LEU A 113 -34.895 -1.036 -15.630 1.00 1.00 C ATOM 1743 CD2 LEU A 113 -34.474 -2.483 -13.618 1.00 1.00 C ATOM 0 H LEU A 113 -30.675 -4.505 -15.723 1.00 1.00 H new ATOM 0 HA LEU A 113 -32.631 -3.987 -14.733 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -31.770 -1.697 -14.477 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -32.378 -1.281 -16.067 1.00 1.00 H new ATOM 0 HG LEU A 113 -33.681 -0.539 -13.963 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -35.821 -0.705 -15.159 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -34.485 -0.226 -16.233 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -35.099 -1.896 -16.268 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -35.408 -2.117 -13.191 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -34.664 -3.401 -14.174 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -33.763 -2.685 -12.817 1.00 1.00 H new ATOM 1755 N THR A 114 -33.127 -3.528 -17.887 1.00 1.00 N ATOM 1756 CA THR A 114 -33.895 -3.793 -18.997 1.00 1.00 C ATOM 1757 C THR A 114 -33.119 -4.774 -19.861 1.00 1.00 C ATOM 1758 O THR A 114 -32.012 -4.513 -20.329 1.00 1.00 O ATOM 1759 CB THR A 114 -34.293 -2.483 -19.701 1.00 1.00 C ATOM 1760 OG1 THR A 114 -35.199 -2.725 -20.778 1.00 1.00 O ATOM 1761 CG2 THR A 114 -33.102 -1.672 -20.182 1.00 1.00 C ATOM 0 H THR A 114 -32.241 -3.076 -18.113 1.00 1.00 H new ATOM 0 HA THR A 114 -34.846 -4.260 -18.740 1.00 1.00 H new ATOM 0 HB THR A 114 -34.797 -1.882 -18.944 1.00 1.00 H new ATOM 0 HG1 THR A 114 -35.435 -1.875 -21.204 1.00 1.00 H new ATOM 0 HG21 THR A 114 -33.454 -0.762 -20.669 1.00 1.00 H new ATOM 0 HG22 THR A 114 -32.474 -1.409 -19.331 1.00 1.00 H new ATOM 0 HG23 THR A 114 -32.523 -2.262 -20.892 1.00 1.00 H new ATOM 1769 N LYS A 115 -33.716 -5.897 -20.012 1.00 1.00 N ATOM 1770 CA LYS A 115 -33.104 -7.093 -20.548 1.00 1.00 C ATOM 1771 C LYS A 115 -32.643 -6.977 -21.997 1.00 1.00 C ATOM 1772 O LYS A 115 -31.572 -7.475 -22.338 1.00 1.00 O ATOM 1773 CB LYS A 115 -34.027 -8.314 -20.319 1.00 1.00 C ATOM 1774 CG LYS A 115 -34.209 -8.715 -18.829 1.00 1.00 C ATOM 1775 CD LYS A 115 -35.057 -7.691 -18.048 1.00 1.00 C ATOM 1776 CE LYS A 115 -35.144 -8.004 -16.561 1.00 1.00 C ATOM 1777 NZ LYS A 115 -35.861 -6.935 -15.805 1.00 1.00 N ATOM 0 H LYS A 115 -34.694 -6.032 -19.758 1.00 1.00 H new ATOM 0 HA LYS A 115 -32.179 -7.240 -19.991 1.00 1.00 H new ATOM 0 HB2 LYS A 115 -35.006 -8.098 -20.746 1.00 1.00 H new ATOM 0 HB3 LYS A 115 -33.622 -9.167 -20.865 1.00 1.00 H new ATOM 0 HG2 LYS A 115 -34.684 -9.695 -18.774 1.00 1.00 H new ATOM 0 HG3 LYS A 115 -33.231 -8.808 -18.358 1.00 1.00 H new ATOM 0 HD2 LYS A 115 -34.630 -6.697 -18.180 1.00 1.00 H new ATOM 0 HD3 LYS A 115 -36.063 -7.664 -18.468 1.00 1.00 H new ATOM 0 HE2 LYS A 115 -35.658 -8.955 -16.420 1.00 1.00 H new ATOM 0 HE3 LYS A 115 -34.139 -8.122 -16.156 1.00 1.00 H new ATOM 0 HZ1 LYS A 115 -35.810 -7.136 -14.786 1.00 1.00 H new ATOM 0 HZ2 LYS A 115 -35.417 -6.015 -15.999 1.00 1.00 H new ATOM 0 HZ3 LYS A 115 -36.857 -6.908 -16.103 1.00 1.00 H new ATOM 1791 N HIS A 116 -33.411 -6.335 -22.845 1.00 1.00 N ATOM 1792 CA HIS A 116 -33.002 -6.223 -24.233 1.00 1.00 C ATOM 1793 C HIS A 116 -32.369 -4.863 -24.500 1.00 1.00 C ATOM 1794 O HIS A 116 -33.066 -3.865 -24.682 1.00 1.00 O ATOM 1795 CB HIS A 116 -34.178 -6.475 -25.185 1.00 1.00 C ATOM 1796 CG HIS A 116 -33.786 -6.490 -26.637 1.00 1.00 C ATOM 1797 ND1 HIS A 116 -33.266 -7.592 -27.267 1.00 1.00 N ATOM 1798 CD2 HIS A 116 -33.834 -5.517 -27.574 1.00 1.00 C ATOM 1799 CE1 HIS A 116 -33.009 -7.294 -28.516 1.00 1.00 C ATOM 1800 NE2 HIS A 116 -33.345 -6.046 -28.727 1.00 1.00 N ATOM 0 H HIS A 116 -34.300 -5.892 -22.612 1.00 1.00 H new ATOM 0 HA HIS A 116 -32.254 -6.993 -24.423 1.00 1.00 H new ATOM 0 HB2 HIS A 116 -34.641 -7.429 -24.933 1.00 1.00 H new ATOM 0 HB3 HIS A 116 -34.932 -5.704 -25.029 1.00 1.00 H new ATOM 0 HD2 HIS A 116 -34.193 -4.508 -27.433 1.00 1.00 H new ATOM 0 HE1 HIS A 116 -32.590 -7.966 -29.250 1.00 1.00 H new ATOM 0 HE2 HIS A 116 -33.254 -5.550 -29.614 1.00 1.00 H new ATOM 1809 N VAL A 117 -31.057 -4.833 -24.525 1.00 1.00 N ATOM 1810 CA VAL A 117 -30.303 -3.610 -24.780 1.00 1.00 C ATOM 1811 C VAL A 117 -29.171 -3.872 -25.740 1.00 1.00 C ATOM 1812 O VAL A 117 -28.838 -5.025 -26.024 1.00 1.00 O ATOM 1813 CB VAL A 117 -29.713 -2.987 -23.486 1.00 1.00 C ATOM 1814 CG1 VAL A 117 -30.801 -2.420 -22.617 1.00 1.00 C ATOM 1815 CG2 VAL A 117 -28.890 -4.008 -22.717 1.00 1.00 C ATOM 0 H VAL A 117 -30.473 -5.655 -24.369 1.00 1.00 H new ATOM 0 HA VAL A 117 -31.014 -2.904 -25.209 1.00 1.00 H new ATOM 0 HB VAL A 117 -29.053 -2.171 -23.780 1.00 1.00 H new ATOM 0 HG11 VAL A 117 -30.361 -1.990 -21.717 1.00 1.00 H new ATOM 0 HG12 VAL A 117 -31.337 -1.645 -23.165 1.00 1.00 H new ATOM 0 HG13 VAL A 117 -31.494 -3.213 -22.338 1.00 1.00 H new ATOM 0 HG21 VAL A 117 -28.488 -3.546 -21.815 1.00 1.00 H new ATOM 0 HG22 VAL A 117 -29.522 -4.852 -22.442 1.00 1.00 H new ATOM 0 HG23 VAL A 117 -28.069 -4.359 -23.342 1.00 1.00 H new ATOM 1825 N LEU A 118 -28.605 -2.822 -26.260 1.00 1.00 N ATOM 1826 CA LEU A 118 -27.446 -2.938 -27.092 1.00 1.00 C ATOM 1827 C LEU A 118 -26.249 -2.376 -26.353 1.00 1.00 C ATOM 1828 O LEU A 118 -26.380 -1.429 -25.565 1.00 1.00 O ATOM 1829 CB LEU A 118 -27.643 -2.244 -28.471 1.00 1.00 C ATOM 1830 CG LEU A 118 -28.144 -0.784 -28.477 1.00 1.00 C ATOM 1831 CD1 LEU A 118 -26.998 0.204 -28.276 1.00 1.00 C ATOM 1832 CD2 LEU A 118 -28.860 -0.489 -29.780 1.00 1.00 C ATOM 0 H LEU A 118 -28.933 -1.866 -26.120 1.00 1.00 H new ATOM 0 HA LEU A 118 -27.274 -3.993 -27.307 1.00 1.00 H new ATOM 0 HB2 LEU A 118 -26.690 -2.273 -29.000 1.00 1.00 H new ATOM 0 HB3 LEU A 118 -28.347 -2.842 -29.049 1.00 1.00 H new ATOM 0 HG LEU A 118 -28.837 -0.664 -27.644 1.00 1.00 H new ATOM 0 HD11 LEU A 118 -27.389 1.221 -28.286 1.00 1.00 H new ATOM 0 HD12 LEU A 118 -26.514 0.010 -27.319 1.00 1.00 H new ATOM 0 HD13 LEU A 118 -26.271 0.087 -29.080 1.00 1.00 H new ATOM 0 HD21 LEU A 118 -29.211 0.543 -29.777 1.00 1.00 H new ATOM 0 HD22 LEU A 118 -28.174 -0.637 -30.614 1.00 1.00 H new ATOM 0 HD23 LEU A 118 -29.711 -1.161 -29.888 1.00 1.00 H new ATOM 1844 N ARG A 119 -25.121 -2.968 -26.556 1.00 1.00 N ATOM 1845 CA ARG A 119 -23.912 -2.508 -25.940 1.00 1.00 C ATOM 1846 C ARG A 119 -22.813 -2.429 -26.967 1.00 1.00 C ATOM 1847 O ARG A 119 -22.324 -3.449 -27.457 1.00 1.00 O ATOM 1848 CB ARG A 119 -23.522 -3.426 -24.766 1.00 1.00 C ATOM 1849 CG ARG A 119 -22.122 -3.194 -24.178 1.00 1.00 C ATOM 1850 CD ARG A 119 -21.957 -1.847 -23.473 1.00 1.00 C ATOM 1851 NE ARG A 119 -20.672 -1.813 -22.755 1.00 1.00 N ATOM 1852 CZ ARG A 119 -19.733 -0.856 -22.812 1.00 1.00 C ATOM 1853 NH1 ARG A 119 -19.979 0.318 -23.393 1.00 1.00 N ATOM 1854 NH2 ARG A 119 -18.549 -1.069 -22.238 1.00 1.00 N ATOM 0 H ARG A 119 -25.006 -3.786 -27.154 1.00 1.00 H new ATOM 0 HA ARG A 119 -24.073 -1.509 -25.536 1.00 1.00 H new ATOM 0 HB2 ARG A 119 -24.256 -3.300 -23.970 1.00 1.00 H new ATOM 0 HB3 ARG A 119 -23.589 -4.461 -25.100 1.00 1.00 H new ATOM 0 HG2 ARG A 119 -21.900 -3.992 -23.470 1.00 1.00 H new ATOM 0 HG3 ARG A 119 -21.387 -3.265 -24.979 1.00 1.00 H new ATOM 0 HD2 ARG A 119 -21.998 -1.037 -24.202 1.00 1.00 H new ATOM 0 HD3 ARG A 119 -22.779 -1.689 -22.774 1.00 1.00 H new ATOM 0 HE ARG A 119 -20.473 -2.606 -22.146 1.00 1.00 H new ATOM 0 HH11 ARG A 119 -20.894 0.502 -23.804 1.00 1.00 H new ATOM 0 HH12 ARG A 119 -19.252 1.033 -23.426 1.00 1.00 H new ATOM 0 HH21 ARG A 119 -18.364 -1.952 -21.762 1.00 1.00 H new ATOM 0 HH22 ARG A 119 -17.827 -0.349 -22.275 1.00 1.00 H new ATOM 1868 N GLU A 120 -22.474 -1.237 -27.325 1.00 1.00 N ATOM 1869 CA GLU A 120 -21.378 -0.994 -28.202 1.00 1.00 C ATOM 1870 C GLU A 120 -20.159 -0.826 -27.341 1.00 1.00 C ATOM 1871 O GLU A 120 -20.295 -0.580 -26.136 1.00 1.00 O ATOM 1872 CB GLU A 120 -21.630 0.258 -29.031 1.00 1.00 C ATOM 1873 CG GLU A 120 -22.810 0.114 -29.974 1.00 1.00 C ATOM 1874 CD GLU A 120 -23.052 1.348 -30.779 1.00 1.00 C ATOM 1875 OE1 GLU A 120 -23.764 2.251 -30.303 1.00 1.00 O ATOM 1876 OE2 GLU A 120 -22.549 1.427 -31.915 1.00 1.00 O ATOM 0 H GLU A 120 -22.956 -0.393 -27.013 1.00 1.00 H new ATOM 0 HA GLU A 120 -21.245 -1.821 -28.900 1.00 1.00 H new ATOM 0 HB2 GLU A 120 -21.806 1.101 -28.363 1.00 1.00 H new ATOM 0 HB3 GLU A 120 -20.736 0.491 -29.609 1.00 1.00 H new ATOM 0 HG2 GLU A 120 -22.633 -0.726 -30.646 1.00 1.00 H new ATOM 0 HG3 GLU A 120 -23.705 -0.122 -29.398 1.00 1.00 H new ATOM 1883 N ASN A 121 -18.996 -0.940 -27.908 1.00 1.00 N ATOM 1884 CA ASN A 121 -17.771 -0.868 -27.125 1.00 1.00 C ATOM 1885 C ASN A 121 -17.383 0.566 -26.804 1.00 1.00 C ATOM 1886 O ASN A 121 -16.359 1.072 -27.255 1.00 1.00 O ATOM 1887 CB ASN A 121 -16.623 -1.617 -27.805 1.00 1.00 C ATOM 1888 CG ASN A 121 -16.784 -3.125 -27.717 1.00 1.00 C ATOM 1889 OD1 ASN A 121 -17.369 -3.754 -28.612 1.00 1.00 O ATOM 1890 ND2 ASN A 121 -16.274 -3.716 -26.660 1.00 1.00 N ATOM 0 H ASN A 121 -18.856 -1.083 -28.908 1.00 1.00 H new ATOM 0 HA ASN A 121 -17.973 -1.366 -26.176 1.00 1.00 H new ATOM 0 HB2 ASN A 121 -16.569 -1.320 -28.853 1.00 1.00 H new ATOM 0 HB3 ASN A 121 -15.679 -1.327 -27.343 1.00 1.00 H new ATOM 0 HD21 ASN A 121 -16.352 -4.727 -26.554 1.00 1.00 H new ATOM 0 HD22 ASN A 121 -15.800 -3.163 -25.946 1.00 1.00 H new ATOM 1897 N GLN A 122 -18.227 1.213 -26.030 1.00 1.00 N ATOM 1898 CA GLN A 122 -18.004 2.564 -25.586 1.00 1.00 C ATOM 1899 C GLN A 122 -17.213 2.498 -24.308 1.00 1.00 C ATOM 1900 O GLN A 122 -16.123 3.096 -24.230 1.00 1.00 O ATOM 1901 CB GLN A 122 -19.334 3.271 -25.301 1.00 1.00 C ATOM 1902 CG GLN A 122 -20.294 3.327 -26.479 1.00 1.00 C ATOM 1903 CD GLN A 122 -21.567 4.117 -26.169 1.00 1.00 C ATOM 1904 OE1 GLN A 122 -21.918 4.226 -24.902 1.00 1.00 O flip ATOM 1905 NE2 GLN A 122 -22.225 4.640 -27.077 1.00 1.00 N flip ATOM 1906 OXT GLN A 122 -17.675 1.800 -23.371 1.00 1.00 O ATOM 0 H GLN A 122 -19.098 0.806 -25.689 1.00 1.00 H new ATOM 0 HA GLN A 122 -17.475 3.119 -26.360 1.00 1.00 H new ATOM 0 HB2 GLN A 122 -19.828 2.764 -24.472 1.00 1.00 H new ATOM 0 HB3 GLN A 122 -19.125 4.289 -24.973 1.00 1.00 H new ATOM 0 HG2 GLN A 122 -19.789 3.780 -27.332 1.00 1.00 H new ATOM 0 HG3 GLN A 122 -20.564 2.312 -26.771 1.00 1.00 H new ATOM 0 HE21 GLN A 122 -21.927 4.537 -28.047 1.00 1.00 H new ATOM 0 HE22 GLN A 122 -23.065 5.174 -26.855 1.00 1.00 H new TER 1915 GLN A 122