USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 831 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 137 TYR OH : rot -37:sc= -1.25! USER MOD Set 1.2: A 139 TYR OH : rot -120:sc= 0.338 USER MOD Set 2.1: A 93 LYS NZ :NH3+ -156:sc= -0.0575 (180deg=0) USER MOD Set 2.2: A 96 HIS :FLIP no HD1:sc= -2.42 F(o=-3.7!,f=-2.5) USER MOD Set 3.1: A 28 ASN : amide:sc= -17.3! C(o=-20!,f=-21!) USER MOD Set 3.2: A 54 SER OG : rot -100:sc= -1.42! USER MOD Set 3.3: A 63 ASN : amide:sc= -1.71 K(o=-20,f=-28!) USER MOD Single : A 1 GLU N :NH3+ -141:sc= -2.98! (180deg=-5.3!) USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -0.922 K(o=-0.92,f=-3.1!) USER MOD Single : A 7 ASN : amide:sc= -0.701 K(o=-0.7,f=-3.2!) USER MOD Single : A 11 LYS NZ :NH3+ -145:sc= -0.0602 (180deg=-0.836) USER MOD Single : A 13 GLN : amide:sc= -0.0455 X(o=-0.045,f=-0.032) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot -140:sc= -1.26 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.44! USER MOD Single : A 32 SER OG : rot -140:sc= -4.2! USER MOD Single : A 38 THR OG1 : rot 86:sc= -1.18! USER MOD Single : A 44 SER OG : rot -35:sc= -0.751! USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 THR OG1 : rot 48:sc= 0.671 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 110:sc= 1.21 USER MOD Single : A 58 GLN : amide:sc= -0.992 K(o=-0.99,f=-2.1!) USER MOD Single : A 59 SER OG : rot 64:sc= 0.826 USER MOD Single : A 61 THR OG1 : rot 27:sc= 0.959 USER MOD Single : A 62 LYS NZ :NH3+ 142:sc= -0.375 (180deg=-2.15!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 CYS SG : rot 22:sc= 0.961 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= -0.664 USER MOD Single : A 97 HIS :FLIP no HE2:sc= -2.39 F(o=-5.3!,f=-2.4) USER MOD Single : A 98 TYR OH : rot -51:sc= 0.362 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 136 TYR OH : rot 106:sc= -3.43! USER MOD Single : A 140 SER OG : rot -50:sc= 0.593 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot -160:sc= 0 USER MOD Single : B 165 SER OG : rot 37:sc= 0 USER MOD Single : B 166 THR OG1 : rot 180:sc= -0.184 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -5.500 -22.175 8.256 1.00 0.00 N ATOM 2 CA GLU A 1 -4.610 -21.010 7.977 1.00 0.00 C ATOM 3 C GLU A 1 -5.126 -20.231 6.764 1.00 0.00 C ATOM 4 O GLU A 1 -5.675 -19.154 6.893 1.00 0.00 O ATOM 5 CB GLU A 1 -3.240 -21.620 7.678 1.00 0.00 C ATOM 6 CG GLU A 1 -2.356 -21.523 8.923 1.00 0.00 C ATOM 7 CD GLU A 1 -3.092 -22.124 10.121 1.00 0.00 C ATOM 8 OE1 GLU A 1 -3.023 -23.331 10.288 1.00 0.00 O ATOM 9 OE2 GLU A 1 -3.713 -21.369 10.851 1.00 0.00 O ATOM 0 H1 GLU A 1 -5.611 -22.289 9.284 1.00 0.00 H new ATOM 0 H2 GLU A 1 -6.431 -22.012 7.823 1.00 0.00 H new ATOM 0 H3 GLU A 1 -5.079 -23.037 7.856 1.00 0.00 H new ATOM 0 HA GLU A 1 -4.571 -20.311 8.812 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -3.352 -22.662 7.378 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -2.771 -21.097 6.844 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -1.417 -22.052 8.757 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -2.104 -20.481 9.123 1.00 0.00 H new ATOM 15 N TYR A 2 -4.953 -20.765 5.587 1.00 0.00 N ATOM 16 CA TYR A 2 -5.431 -20.055 4.366 1.00 0.00 C ATOM 17 C TYR A 2 -6.925 -19.744 4.485 1.00 0.00 C ATOM 18 O TYR A 2 -7.385 -18.693 4.085 1.00 0.00 O ATOM 19 CB TYR A 2 -5.174 -21.028 3.215 1.00 0.00 C ATOM 20 CG TYR A 2 -6.180 -22.152 3.270 1.00 0.00 C ATOM 21 CD1 TYR A 2 -5.953 -23.255 4.102 1.00 0.00 C ATOM 22 CD2 TYR A 2 -7.340 -22.092 2.488 1.00 0.00 C ATOM 23 CE1 TYR A 2 -6.886 -24.298 4.153 1.00 0.00 C ATOM 24 CE2 TYR A 2 -8.273 -23.135 2.538 1.00 0.00 C ATOM 25 CZ TYR A 2 -8.046 -24.237 3.371 1.00 0.00 C ATOM 26 OH TYR A 2 -8.966 -25.265 3.421 1.00 0.00 O ATOM 0 H TYR A 2 -4.501 -21.663 5.417 1.00 0.00 H new ATOM 0 HA TYR A 2 -4.921 -19.103 4.216 1.00 0.00 H new ATOM 0 HB2 TYR A 2 -5.248 -20.506 2.261 1.00 0.00 H new ATOM 0 HB3 TYR A 2 -4.162 -21.428 3.282 1.00 0.00 H new ATOM 0 HD1 TYR A 2 -5.058 -23.301 4.705 1.00 0.00 H new ATOM 0 HD2 TYR A 2 -7.515 -21.241 1.846 1.00 0.00 H new ATOM 0 HE1 TYR A 2 -6.711 -25.149 4.795 1.00 0.00 H new ATOM 0 HE2 TYR A 2 -9.167 -23.089 1.934 1.00 0.00 H new ATOM 0 HH TYR A 2 -9.713 -25.065 2.819 1.00 0.00 H new ATOM 36 N GLN A 3 -7.689 -20.650 5.032 1.00 0.00 N ATOM 37 CA GLN A 3 -9.153 -20.406 5.175 1.00 0.00 C ATOM 38 C GLN A 3 -9.399 -19.180 6.060 1.00 0.00 C ATOM 39 O GLN A 3 -10.247 -18.357 5.776 1.00 0.00 O ATOM 40 CB GLN A 3 -9.703 -21.667 5.841 1.00 0.00 C ATOM 41 CG GLN A 3 -11.176 -21.456 6.196 1.00 0.00 C ATOM 42 CD GLN A 3 -11.964 -21.116 4.929 1.00 0.00 C ATOM 43 OE1 GLN A 3 -11.502 -21.355 3.830 1.00 0.00 O ATOM 44 NE2 GLN A 3 -13.143 -20.567 5.036 1.00 0.00 N ATOM 0 H GLN A 3 -7.363 -21.549 5.386 1.00 0.00 H new ATOM 0 HA GLN A 3 -9.635 -20.209 4.217 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -9.598 -22.520 5.171 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -9.130 -21.895 6.740 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -11.582 -22.356 6.659 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -11.274 -20.651 6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -13.530 -20.367 5.958 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -13.677 -20.338 4.198 1.00 0.00 H new ATOM 53 N LEU A 4 -8.666 -19.053 7.131 1.00 0.00 N ATOM 54 CA LEU A 4 -8.860 -17.881 8.032 1.00 0.00 C ATOM 55 C LEU A 4 -8.433 -16.590 7.324 1.00 0.00 C ATOM 56 O LEU A 4 -9.134 -15.598 7.344 1.00 0.00 O ATOM 57 CB LEU A 4 -7.957 -18.155 9.235 1.00 0.00 C ATOM 58 CG LEU A 4 -8.364 -19.475 9.891 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.148 -20.398 9.980 1.00 0.00 C ATOM 60 CD2 LEU A 4 -8.896 -19.200 11.300 1.00 0.00 C ATOM 0 H LEU A 4 -7.941 -19.709 7.422 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.902 -17.753 8.323 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.915 -18.201 8.918 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.035 -17.340 9.955 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.140 -19.953 9.293 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.439 -21.339 10.448 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -6.766 -20.594 8.978 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.372 -19.920 10.578 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -9.187 -20.140 11.769 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -8.118 -18.722 11.896 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -9.763 -18.542 11.240 1.00 0.00 H new ATOM 72 N VAL A 5 -7.285 -16.596 6.703 1.00 0.00 N ATOM 73 CA VAL A 5 -6.808 -15.369 6.000 1.00 0.00 C ATOM 74 C VAL A 5 -7.614 -15.132 4.719 1.00 0.00 C ATOM 75 O VAL A 5 -8.014 -14.023 4.422 1.00 0.00 O ATOM 76 CB VAL A 5 -5.340 -15.646 5.669 1.00 0.00 C ATOM 77 CG1 VAL A 5 -4.665 -16.319 6.866 1.00 0.00 C ATOM 78 CG2 VAL A 5 -5.251 -16.571 4.453 1.00 0.00 C ATOM 0 H VAL A 5 -6.656 -17.397 6.652 1.00 0.00 H new ATOM 0 HA VAL A 5 -6.928 -14.475 6.612 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.838 -14.704 5.446 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.619 -16.516 6.630 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.724 -15.662 7.734 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.171 -17.259 7.088 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.204 -16.766 4.220 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -5.755 -17.512 4.674 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.730 -16.095 3.598 1.00 0.00 H new ATOM 88 N VAL A 6 -7.851 -16.163 3.956 1.00 0.00 N ATOM 89 CA VAL A 6 -8.625 -15.995 2.691 1.00 0.00 C ATOM 90 C VAL A 6 -10.007 -15.409 2.991 1.00 0.00 C ATOM 91 O VAL A 6 -10.560 -14.665 2.206 1.00 0.00 O ATOM 92 CB VAL A 6 -8.748 -17.403 2.106 1.00 0.00 C ATOM 93 CG1 VAL A 6 -9.803 -18.194 2.881 1.00 0.00 C ATOM 94 CG2 VAL A 6 -9.161 -17.308 0.635 1.00 0.00 C ATOM 0 H VAL A 6 -7.543 -17.115 4.153 1.00 0.00 H new ATOM 0 HA VAL A 6 -8.137 -15.312 1.996 1.00 0.00 H new ATOM 0 HB VAL A 6 -7.787 -17.912 2.184 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -9.887 -19.196 2.461 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -9.509 -18.263 3.928 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -10.765 -17.687 2.807 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.249 -18.311 0.216 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -10.121 -16.797 0.559 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.407 -16.748 0.081 1.00 0.00 H new ATOM 104 N ASN A 7 -10.568 -15.731 4.123 1.00 0.00 N ATOM 105 CA ASN A 7 -11.909 -15.180 4.466 1.00 0.00 C ATOM 106 C ASN A 7 -11.804 -13.671 4.703 1.00 0.00 C ATOM 107 O ASN A 7 -12.653 -12.906 4.289 1.00 0.00 O ATOM 108 CB ASN A 7 -12.316 -15.900 5.753 1.00 0.00 C ATOM 109 CG ASN A 7 -13.760 -15.539 6.104 1.00 0.00 C ATOM 110 OD1 ASN A 7 -14.245 -14.490 5.730 1.00 0.00 O ATOM 111 ND2 ASN A 7 -14.474 -16.373 6.811 1.00 0.00 N ATOM 0 H ASN A 7 -10.158 -16.349 4.823 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.639 -15.331 3.671 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.220 -16.978 5.625 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -11.650 -15.615 6.568 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -15.439 -16.144 7.049 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.067 -17.254 7.125 1.00 0.00 H new ATOM 118 N ALA A 8 -10.766 -13.237 5.367 1.00 0.00 N ATOM 119 CA ALA A 8 -10.601 -11.778 5.633 1.00 0.00 C ATOM 120 C ALA A 8 -10.125 -11.054 4.371 1.00 0.00 C ATOM 121 O ALA A 8 -10.629 -10.006 4.018 1.00 0.00 O ATOM 122 CB ALA A 8 -9.531 -11.700 6.715 1.00 0.00 C ATOM 0 H ALA A 8 -10.024 -13.831 5.737 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.536 -11.308 5.936 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.348 -10.656 6.971 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.870 -12.237 7.601 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.609 -12.151 6.348 1.00 0.00 H new ATOM 128 N VAL A 9 -9.162 -11.607 3.687 1.00 0.00 N ATOM 129 CA VAL A 9 -8.661 -10.951 2.447 1.00 0.00 C ATOM 130 C VAL A 9 -9.816 -10.777 1.463 1.00 0.00 C ATOM 131 O VAL A 9 -9.932 -9.771 0.794 1.00 0.00 O ATOM 132 CB VAL A 9 -7.601 -11.897 1.881 1.00 0.00 C ATOM 133 CG1 VAL A 9 -6.641 -12.318 2.995 1.00 0.00 C ATOM 134 CG2 VAL A 9 -8.280 -13.137 1.300 1.00 0.00 C ATOM 0 H VAL A 9 -8.701 -12.483 3.933 1.00 0.00 H new ATOM 0 HA VAL A 9 -8.243 -9.962 2.637 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.044 -11.386 1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.886 -12.992 2.590 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.154 -11.435 3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -7.198 -12.827 3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -7.524 -13.811 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.839 -13.647 2.085 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.962 -12.839 0.504 1.00 0.00 H new ATOM 144 N ARG A 10 -10.672 -11.756 1.375 1.00 0.00 N ATOM 145 CA ARG A 10 -11.826 -11.652 0.437 1.00 0.00 C ATOM 146 C ARG A 10 -12.623 -10.381 0.739 1.00 0.00 C ATOM 147 O ARG A 10 -12.978 -9.632 -0.149 1.00 0.00 O ATOM 148 CB ARG A 10 -12.673 -12.897 0.706 1.00 0.00 C ATOM 149 CG ARG A 10 -14.072 -12.700 0.121 1.00 0.00 C ATOM 150 CD ARG A 10 -14.521 -13.986 -0.576 1.00 0.00 C ATOM 151 NE ARG A 10 -15.967 -13.782 -0.866 1.00 0.00 N ATOM 152 CZ ARG A 10 -16.699 -14.780 -1.280 1.00 0.00 C ATOM 153 NH1 ARG A 10 -16.164 -15.961 -1.440 1.00 0.00 N ATOM 154 NH2 ARG A 10 -17.966 -14.599 -1.534 1.00 0.00 N ATOM 0 H ARG A 10 -10.623 -12.623 1.911 1.00 0.00 H new ATOM 0 HA ARG A 10 -11.513 -11.597 -0.606 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.202 -13.773 0.261 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -12.738 -13.080 1.778 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -14.775 -12.438 0.912 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -14.068 -11.872 -0.588 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -13.955 -14.157 -1.492 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -14.365 -14.856 0.062 1.00 0.00 H new ATOM 0 HE ARG A 10 -16.386 -12.861 -0.741 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -15.174 -16.103 -1.241 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -16.737 -16.741 -1.764 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -18.385 -13.677 -1.409 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -18.538 -15.379 -1.858 1.00 0.00 H new ATOM 168 N LYS A 11 -12.897 -10.127 1.989 1.00 0.00 N ATOM 169 CA LYS A 11 -13.658 -8.898 2.349 1.00 0.00 C ATOM 170 C LYS A 11 -12.726 -7.684 2.309 1.00 0.00 C ATOM 171 O LYS A 11 -13.130 -6.587 1.980 1.00 0.00 O ATOM 172 CB LYS A 11 -14.162 -9.146 3.772 1.00 0.00 C ATOM 173 CG LYS A 11 -15.311 -8.183 4.082 1.00 0.00 C ATOM 174 CD LYS A 11 -16.626 -8.962 4.150 1.00 0.00 C ATOM 175 CE LYS A 11 -17.689 -8.242 3.317 1.00 0.00 C ATOM 176 NZ LYS A 11 -17.796 -6.886 3.922 1.00 0.00 N ATOM 0 H LYS A 11 -12.627 -10.717 2.776 1.00 0.00 H new ATOM 0 HA LYS A 11 -14.479 -8.696 1.661 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -14.500 -10.177 3.875 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.351 -9.003 4.486 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -15.128 -7.675 5.029 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -15.372 -7.413 3.313 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -16.480 -9.975 3.776 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -16.957 -9.049 5.185 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -17.397 -8.185 2.268 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -18.643 -8.768 3.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -18.783 -6.561 3.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -17.494 -6.925 4.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -17.187 -6.224 3.400 1.00 0.00 H new ATOM 190 N LEU A 12 -11.478 -7.879 2.643 1.00 0.00 N ATOM 191 CA LEU A 12 -10.512 -6.747 2.627 1.00 0.00 C ATOM 192 C LEU A 12 -10.257 -6.287 1.189 1.00 0.00 C ATOM 193 O LEU A 12 -10.230 -5.107 0.900 1.00 0.00 O ATOM 194 CB LEU A 12 -9.236 -7.323 3.241 1.00 0.00 C ATOM 195 CG LEU A 12 -8.595 -6.284 4.159 1.00 0.00 C ATOM 196 CD1 LEU A 12 -9.630 -5.776 5.163 1.00 0.00 C ATOM 197 CD2 LEU A 12 -7.426 -6.921 4.914 1.00 0.00 C ATOM 0 H LEU A 12 -11.087 -8.777 2.927 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.878 -5.878 3.174 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.467 -8.227 3.804 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.538 -7.608 2.454 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.232 -5.449 3.559 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.170 -5.035 5.817 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.463 -5.320 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.996 -6.610 5.762 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.969 -6.179 5.569 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.791 -7.757 5.511 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.685 -7.281 4.200 1.00 0.00 H new ATOM 209 N GLN A 13 -10.072 -7.209 0.283 1.00 0.00 N ATOM 210 CA GLN A 13 -9.822 -6.821 -1.134 1.00 0.00 C ATOM 211 C GLN A 13 -11.052 -6.117 -1.714 1.00 0.00 C ATOM 212 O GLN A 13 -10.942 -5.225 -2.530 1.00 0.00 O ATOM 213 CB GLN A 13 -9.556 -8.137 -1.868 1.00 0.00 C ATOM 214 CG GLN A 13 -10.839 -8.968 -1.916 1.00 0.00 C ATOM 215 CD GLN A 13 -10.643 -10.159 -2.857 1.00 0.00 C ATOM 216 OE1 GLN A 13 -11.449 -10.392 -3.735 1.00 0.00 O ATOM 217 NE2 GLN A 13 -9.599 -10.927 -2.708 1.00 0.00 N ATOM 0 H GLN A 13 -10.083 -8.213 0.463 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.986 -6.128 -1.231 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -9.203 -7.936 -2.880 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -8.769 -8.695 -1.361 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -11.095 -9.319 -0.916 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -11.670 -8.353 -2.260 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -8.923 -10.731 -1.970 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.459 -11.724 -3.329 1.00 0.00 H new ATOM 226 N GLU A 14 -12.224 -6.514 -1.297 1.00 0.00 N ATOM 227 CA GLU A 14 -13.460 -5.866 -1.824 1.00 0.00 C ATOM 228 C GLU A 14 -13.426 -4.361 -1.547 1.00 0.00 C ATOM 229 O GLU A 14 -13.960 -3.570 -2.298 1.00 0.00 O ATOM 230 CB GLU A 14 -14.609 -6.526 -1.061 1.00 0.00 C ATOM 231 CG GLU A 14 -15.299 -7.551 -1.963 1.00 0.00 C ATOM 232 CD GLU A 14 -15.874 -8.681 -1.106 1.00 0.00 C ATOM 233 OE1 GLU A 14 -16.547 -8.376 -0.135 1.00 0.00 O ATOM 234 OE2 GLU A 14 -15.633 -9.830 -1.435 1.00 0.00 O ATOM 0 H GLU A 14 -12.379 -7.257 -0.616 1.00 0.00 H new ATOM 0 HA GLU A 14 -13.564 -5.988 -2.902 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -14.230 -7.013 -0.162 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -15.325 -5.771 -0.737 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -16.095 -7.072 -2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -14.588 -7.953 -2.684 1.00 0.00 H new ATOM 241 N SER A 15 -12.800 -3.960 -0.475 1.00 0.00 N ATOM 242 CA SER A 15 -12.731 -2.506 -0.152 1.00 0.00 C ATOM 243 C SER A 15 -11.874 -1.778 -1.191 1.00 0.00 C ATOM 244 O SER A 15 -12.201 -0.693 -1.629 1.00 0.00 O ATOM 245 CB SER A 15 -12.079 -2.437 1.228 1.00 0.00 C ATOM 246 OG SER A 15 -13.077 -2.592 2.228 1.00 0.00 O ATOM 0 H SER A 15 -12.333 -4.575 0.191 1.00 0.00 H new ATOM 0 HA SER A 15 -13.712 -2.032 -0.160 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.325 -3.218 1.326 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.567 -1.483 1.354 1.00 0.00 H new ATOM 0 HG SER A 15 -12.661 -2.550 3.114 1.00 0.00 H new ATOM 252 N GLY A 16 -10.781 -2.369 -1.588 1.00 0.00 N ATOM 253 CA GLY A 16 -9.904 -1.711 -2.599 1.00 0.00 C ATOM 254 C GLY A 16 -8.674 -1.122 -1.907 1.00 0.00 C ATOM 255 O GLY A 16 -8.190 -0.069 -2.273 1.00 0.00 O ATOM 0 H GLY A 16 -10.457 -3.278 -1.257 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.597 -2.434 -3.354 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.454 -0.925 -3.116 1.00 0.00 H new ATOM 259 N PHE A 17 -8.163 -1.791 -0.909 1.00 0.00 N ATOM 260 CA PHE A 17 -6.963 -1.263 -0.198 1.00 0.00 C ATOM 261 C PHE A 17 -6.063 -2.417 0.256 1.00 0.00 C ATOM 262 O PHE A 17 -5.347 -2.313 1.232 1.00 0.00 O ATOM 263 CB PHE A 17 -7.519 -0.495 1.005 1.00 0.00 C ATOM 264 CG PHE A 17 -7.735 -1.440 2.167 1.00 0.00 C ATOM 265 CD1 PHE A 17 -8.896 -2.218 2.229 1.00 0.00 C ATOM 266 CD2 PHE A 17 -6.773 -1.534 3.183 1.00 0.00 C ATOM 267 CE1 PHE A 17 -9.097 -3.091 3.304 1.00 0.00 C ATOM 268 CE2 PHE A 17 -6.976 -2.407 4.258 1.00 0.00 C ATOM 269 CZ PHE A 17 -8.137 -3.185 4.319 1.00 0.00 C ATOM 0 H PHE A 17 -8.523 -2.678 -0.556 1.00 0.00 H new ATOM 0 HA PHE A 17 -6.351 -0.625 -0.836 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -6.827 0.297 1.293 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.460 -0.014 0.737 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.637 -2.145 1.447 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.877 -0.933 3.136 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -9.993 -3.692 3.351 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.236 -2.480 5.041 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.293 -3.858 5.149 1.00 0.00 H new ATOM 279 N TYR A 18 -6.092 -3.516 -0.446 1.00 0.00 N ATOM 280 CA TYR A 18 -5.236 -4.672 -0.052 1.00 0.00 C ATOM 281 C TYR A 18 -3.880 -4.589 -0.757 1.00 0.00 C ATOM 282 O TYR A 18 -3.796 -4.295 -1.932 1.00 0.00 O ATOM 283 CB TYR A 18 -6.002 -5.912 -0.507 1.00 0.00 C ATOM 284 CG TYR A 18 -5.371 -7.140 0.105 1.00 0.00 C ATOM 285 CD1 TYR A 18 -4.051 -7.480 -0.211 1.00 0.00 C ATOM 286 CD2 TYR A 18 -6.108 -7.939 0.988 1.00 0.00 C ATOM 287 CE1 TYR A 18 -3.466 -8.618 0.356 1.00 0.00 C ATOM 288 CE2 TYR A 18 -5.523 -9.077 1.555 1.00 0.00 C ATOM 289 CZ TYR A 18 -4.201 -9.417 1.237 1.00 0.00 C ATOM 290 OH TYR A 18 -3.624 -10.539 1.796 1.00 0.00 O ATOM 0 H TYR A 18 -6.670 -3.664 -1.274 1.00 0.00 H new ATOM 0 HA TYR A 18 -5.037 -4.690 1.020 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -7.047 -5.838 -0.207 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -5.987 -5.985 -1.594 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -3.483 -6.864 -0.893 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -7.127 -7.677 1.231 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -2.447 -8.879 0.113 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -6.090 -9.693 2.237 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.281 -11.266 1.822 1.00 0.00 H new ATOM 300 N TRP A 19 -2.818 -4.840 -0.042 1.00 0.00 N ATOM 301 CA TRP A 19 -1.465 -4.771 -0.662 1.00 0.00 C ATOM 302 C TRP A 19 -0.786 -6.141 -0.617 1.00 0.00 C ATOM 303 O TRP A 19 -1.018 -6.932 0.275 1.00 0.00 O ATOM 304 CB TRP A 19 -0.696 -3.759 0.181 1.00 0.00 C ATOM 305 CG TRP A 19 -1.045 -2.376 -0.267 1.00 0.00 C ATOM 306 CD1 TRP A 19 -1.949 -1.571 0.334 1.00 0.00 C ATOM 307 CD2 TRP A 19 -0.511 -1.625 -1.395 1.00 0.00 C ATOM 308 NE1 TRP A 19 -2.005 -0.372 -0.352 1.00 0.00 N ATOM 309 CE2 TRP A 19 -1.137 -0.356 -1.426 1.00 0.00 C ATOM 310 CE3 TRP A 19 0.446 -1.916 -2.385 1.00 0.00 C ATOM 311 CZ2 TRP A 19 -0.826 0.589 -2.404 1.00 0.00 C ATOM 312 CZ3 TRP A 19 0.761 -0.967 -3.371 1.00 0.00 C ATOM 313 CH2 TRP A 19 0.127 0.283 -3.381 1.00 0.00 C ATOM 0 H TRP A 19 -2.829 -5.090 0.947 1.00 0.00 H new ATOM 0 HA TRP A 19 -1.507 -4.478 -1.711 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -0.942 -3.885 1.235 1.00 0.00 H new ATOM 0 HB3 TRP A 19 0.377 -3.926 0.082 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -2.532 -1.823 1.207 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -2.613 0.406 -0.096 1.00 0.00 H new ATOM 0 HE3 TRP A 19 0.941 -2.876 -2.386 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -1.318 1.551 -2.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 1.496 -1.202 -4.126 1.00 0.00 H new ATOM 0 HH2 TRP A 19 0.374 1.009 -4.142 1.00 0.00 H new ATOM 324 N SER A 20 0.045 -6.428 -1.581 1.00 0.00 N ATOM 325 CA SER A 20 0.741 -7.750 -1.611 1.00 0.00 C ATOM 326 C SER A 20 1.633 -7.842 -2.849 1.00 0.00 C ATOM 327 O SER A 20 2.493 -8.693 -2.953 1.00 0.00 O ATOM 328 CB SER A 20 -0.378 -8.779 -1.698 1.00 0.00 C ATOM 329 OG SER A 20 -1.099 -8.588 -2.909 1.00 0.00 O ATOM 0 H SER A 20 0.274 -5.802 -2.353 1.00 0.00 H new ATOM 0 HA SER A 20 1.377 -7.903 -0.739 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.036 -9.787 -1.663 1.00 0.00 H new ATOM 0 HB3 SER A 20 -1.047 -8.679 -0.843 1.00 0.00 H new ATOM 0 HG SER A 20 -1.819 -9.250 -2.969 1.00 0.00 H new ATOM 335 N ALA A 21 1.418 -6.971 -3.787 1.00 0.00 N ATOM 336 CA ALA A 21 2.230 -6.987 -5.038 1.00 0.00 C ATOM 337 C ALA A 21 3.718 -6.837 -4.714 1.00 0.00 C ATOM 338 O ALA A 21 4.570 -7.065 -5.548 1.00 0.00 O ATOM 339 CB ALA A 21 1.735 -5.786 -5.845 1.00 0.00 C ATOM 0 H ALA A 21 0.708 -6.239 -3.745 1.00 0.00 H new ATOM 0 HA ALA A 21 2.121 -7.923 -5.585 1.00 0.00 H new ATOM 0 HB1 ALA A 21 2.285 -5.727 -6.784 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.671 -5.901 -6.054 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.895 -4.872 -5.273 1.00 0.00 H new ATOM 345 N VAL A 22 4.038 -6.460 -3.507 1.00 0.00 N ATOM 346 CA VAL A 22 5.472 -6.303 -3.137 1.00 0.00 C ATOM 347 C VAL A 22 5.945 -7.544 -2.379 1.00 0.00 C ATOM 348 O VAL A 22 5.399 -8.619 -2.533 1.00 0.00 O ATOM 349 CB VAL A 22 5.545 -5.057 -2.244 1.00 0.00 C ATOM 350 CG1 VAL A 22 6.416 -4.008 -2.928 1.00 0.00 C ATOM 351 CG2 VAL A 22 4.146 -4.469 -2.024 1.00 0.00 C ATOM 0 H VAL A 22 3.371 -6.255 -2.763 1.00 0.00 H new ATOM 0 HA VAL A 22 6.112 -6.192 -4.012 1.00 0.00 H new ATOM 0 HB VAL A 22 5.968 -5.339 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 22 6.474 -3.118 -2.301 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.417 -4.410 -3.081 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.980 -3.745 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.218 -3.586 -1.389 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.713 -4.190 -2.985 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.511 -5.212 -1.542 1.00 0.00 H new ATOM 361 N THR A 23 6.948 -7.411 -1.558 1.00 0.00 N ATOM 362 CA THR A 23 7.437 -8.595 -0.799 1.00 0.00 C ATOM 363 C THR A 23 6.678 -8.712 0.523 1.00 0.00 C ATOM 364 O THR A 23 5.869 -7.872 0.863 1.00 0.00 O ATOM 365 CB THR A 23 8.920 -8.333 -0.546 1.00 0.00 C ATOM 366 OG1 THR A 23 9.389 -7.351 -1.460 1.00 0.00 O ATOM 367 CG2 THR A 23 9.708 -9.630 -0.738 1.00 0.00 C ATOM 0 H THR A 23 7.448 -6.540 -1.380 1.00 0.00 H new ATOM 0 HA THR A 23 7.284 -9.527 -1.344 1.00 0.00 H new ATOM 0 HB THR A 23 9.058 -7.974 0.474 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.340 -7.181 -1.298 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.767 -9.443 -0.557 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.348 -10.382 -0.036 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.572 -9.991 -1.758 1.00 0.00 H new ATOM 375 N GLY A 24 6.930 -9.748 1.270 1.00 0.00 N ATOM 376 CA GLY A 24 6.221 -9.917 2.566 1.00 0.00 C ATOM 377 C GLY A 24 6.229 -8.594 3.335 1.00 0.00 C ATOM 378 O GLY A 24 5.281 -7.834 3.296 1.00 0.00 O ATOM 0 H GLY A 24 7.596 -10.485 1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 24 5.195 -10.241 2.391 1.00 0.00 H new ATOM 0 HA3 GLY A 24 6.704 -10.695 3.157 1.00 0.00 H new ATOM 382 N GLY A 25 7.287 -8.323 4.044 1.00 0.00 N ATOM 383 CA GLY A 25 7.363 -7.060 4.832 1.00 0.00 C ATOM 384 C GLY A 25 7.722 -5.879 3.927 1.00 0.00 C ATOM 385 O GLY A 25 7.343 -4.754 4.185 1.00 0.00 O ATOM 0 H GLY A 25 8.108 -8.925 4.113 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.407 -6.872 5.321 1.00 0.00 H new ATOM 0 HA3 GLY A 25 8.110 -7.161 5.620 1.00 0.00 H new ATOM 389 N GLU A 26 8.467 -6.112 2.883 1.00 0.00 N ATOM 390 CA GLU A 26 8.859 -4.979 1.995 1.00 0.00 C ATOM 391 C GLU A 26 7.620 -4.280 1.446 1.00 0.00 C ATOM 392 O GLU A 26 7.648 -3.105 1.138 1.00 0.00 O ATOM 393 CB GLU A 26 9.668 -5.609 0.863 1.00 0.00 C ATOM 394 CG GLU A 26 10.764 -6.502 1.449 1.00 0.00 C ATOM 395 CD GLU A 26 12.133 -5.868 1.190 1.00 0.00 C ATOM 396 OE1 GLU A 26 12.189 -4.910 0.437 1.00 0.00 O ATOM 397 OE2 GLU A 26 13.102 -6.352 1.751 1.00 0.00 O ATOM 0 H GLU A 26 8.819 -7.028 2.607 1.00 0.00 H new ATOM 0 HA GLU A 26 9.436 -4.225 2.530 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.014 -6.195 0.218 1.00 0.00 H new ATOM 0 HB3 GLU A 26 10.112 -4.830 0.243 1.00 0.00 H new ATOM 0 HG2 GLU A 26 10.608 -6.631 2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 26 10.720 -7.493 0.998 1.00 0.00 H new ATOM 404 N ALA A 27 6.527 -4.976 1.335 1.00 0.00 N ATOM 405 CA ALA A 27 5.297 -4.317 0.826 1.00 0.00 C ATOM 406 C ALA A 27 4.787 -3.329 1.876 1.00 0.00 C ATOM 407 O ALA A 27 4.518 -2.181 1.588 1.00 0.00 O ATOM 408 CB ALA A 27 4.288 -5.448 0.602 1.00 0.00 C ATOM 0 H ALA A 27 6.432 -5.963 1.572 1.00 0.00 H new ATOM 0 HA ALA A 27 5.468 -3.759 -0.094 1.00 0.00 H new ATOM 0 HB1 ALA A 27 3.353 -5.032 0.225 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.689 -6.155 -0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.102 -5.962 1.545 1.00 0.00 H new ATOM 414 N ASN A 28 4.661 -3.769 3.099 1.00 0.00 N ATOM 415 CA ASN A 28 4.180 -2.854 4.176 1.00 0.00 C ATOM 416 C ASN A 28 5.241 -1.794 4.503 1.00 0.00 C ATOM 417 O ASN A 28 4.949 -0.626 4.634 1.00 0.00 O ATOM 418 CB ASN A 28 3.915 -3.760 5.382 1.00 0.00 C ATOM 419 CG ASN A 28 5.099 -3.701 6.348 1.00 0.00 C ATOM 420 OD1 ASN A 28 5.126 -2.883 7.245 1.00 0.00 O ATOM 421 ND2 ASN A 28 6.091 -4.532 6.193 1.00 0.00 N ATOM 0 H ASN A 28 4.870 -4.721 3.399 1.00 0.00 H new ATOM 0 HA ASN A 28 3.285 -2.307 3.879 1.00 0.00 H new ATOM 0 HB2 ASN A 28 3.004 -3.446 5.891 1.00 0.00 H new ATOM 0 HB3 ASN A 28 3.757 -4.786 5.049 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.890 -4.495 6.825 1.00 0.00 H new ATOM 0 HD22 ASN A 28 6.068 -5.219 5.439 1.00 0.00 H new ATOM 428 N LEU A 29 6.467 -2.210 4.657 1.00 0.00 N ATOM 429 CA LEU A 29 7.560 -1.253 5.008 1.00 0.00 C ATOM 430 C LEU A 29 7.704 -0.151 3.955 1.00 0.00 C ATOM 431 O LEU A 29 8.084 0.960 4.267 1.00 0.00 O ATOM 432 CB LEU A 29 8.824 -2.107 5.085 1.00 0.00 C ATOM 433 CG LEU A 29 9.233 -2.279 6.553 1.00 0.00 C ATOM 434 CD1 LEU A 29 7.987 -2.505 7.416 1.00 0.00 C ATOM 435 CD2 LEU A 29 10.166 -3.486 6.683 1.00 0.00 C ATOM 0 H LEU A 29 6.764 -3.180 4.554 1.00 0.00 H new ATOM 0 HA LEU A 29 7.355 -0.737 5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 29 8.647 -3.081 4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.630 -1.634 4.524 1.00 0.00 H new ATOM 0 HG LEU A 29 9.747 -1.379 6.891 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.283 -2.627 8.458 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.321 -1.647 7.326 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.469 -3.403 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.458 -3.610 7.726 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.650 -4.383 6.342 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.056 -3.325 6.074 1.00 0.00 H new ATOM 447 N LEU A 30 7.420 -0.435 2.716 1.00 0.00 N ATOM 448 CA LEU A 30 7.566 0.624 1.677 1.00 0.00 C ATOM 449 C LEU A 30 6.757 1.852 2.086 1.00 0.00 C ATOM 450 O LEU A 30 7.051 2.961 1.687 1.00 0.00 O ATOM 451 CB LEU A 30 7.021 0.008 0.385 1.00 0.00 C ATOM 452 CG LEU A 30 5.495 0.129 0.353 1.00 0.00 C ATOM 453 CD1 LEU A 30 5.104 1.523 -0.141 1.00 0.00 C ATOM 454 CD2 LEU A 30 4.922 -0.925 -0.596 1.00 0.00 C ATOM 0 H LEU A 30 7.097 -1.342 2.379 1.00 0.00 H new ATOM 0 HA LEU A 30 8.599 0.947 1.550 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.453 0.513 -0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.313 -1.040 0.320 1.00 0.00 H new ATOM 0 HG LEU A 30 5.097 -0.027 1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.018 1.609 -0.164 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.514 2.276 0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.502 1.678 -1.144 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.836 -0.841 -0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.321 -0.767 -1.598 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.201 -1.919 -0.247 1.00 0.00 H new ATOM 466 N LEU A 31 5.761 1.673 2.906 1.00 0.00 N ATOM 467 CA LEU A 31 4.970 2.846 3.358 1.00 0.00 C ATOM 468 C LEU A 31 5.848 3.703 4.270 1.00 0.00 C ATOM 469 O LEU A 31 5.757 4.915 4.287 1.00 0.00 O ATOM 470 CB LEU A 31 3.788 2.266 4.136 1.00 0.00 C ATOM 471 CG LEU A 31 4.275 1.701 5.472 1.00 0.00 C ATOM 472 CD1 LEU A 31 4.383 2.827 6.502 1.00 0.00 C ATOM 473 CD2 LEU A 31 3.281 0.650 5.971 1.00 0.00 C ATOM 0 H LEU A 31 5.463 0.772 3.280 1.00 0.00 H new ATOM 0 HA LEU A 31 4.626 3.472 2.534 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.040 3.039 4.309 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.306 1.481 3.553 1.00 0.00 H new ATOM 0 HG LEU A 31 5.255 1.244 5.334 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.730 2.419 7.452 1.00 0.00 H new ATOM 0 HD12 LEU A 31 5.091 3.577 6.148 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.405 3.288 6.641 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.626 0.246 6.923 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.302 1.110 6.105 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.206 -0.156 5.241 1.00 0.00 H new ATOM 485 N SER A 32 6.707 3.069 5.023 1.00 0.00 N ATOM 486 CA SER A 32 7.612 3.819 5.938 1.00 0.00 C ATOM 487 C SER A 32 8.656 4.593 5.132 1.00 0.00 C ATOM 488 O SER A 32 9.094 5.657 5.524 1.00 0.00 O ATOM 489 CB SER A 32 8.287 2.744 6.789 1.00 0.00 C ATOM 490 OG SER A 32 9.579 3.195 7.176 1.00 0.00 O ATOM 0 H SER A 32 6.820 2.055 5.042 1.00 0.00 H new ATOM 0 HA SER A 32 7.075 4.547 6.545 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.684 2.531 7.672 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.367 1.815 6.225 1.00 0.00 H new ATOM 0 HG SER A 32 10.214 2.450 7.127 1.00 0.00 H new ATOM 496 N ALA A 33 9.066 4.061 4.013 1.00 0.00 N ATOM 497 CA ALA A 33 10.092 4.763 3.191 1.00 0.00 C ATOM 498 C ALA A 33 9.444 5.866 2.354 1.00 0.00 C ATOM 499 O ALA A 33 10.101 6.790 1.918 1.00 0.00 O ATOM 500 CB ALA A 33 10.680 3.680 2.287 1.00 0.00 C ATOM 0 H ALA A 33 8.736 3.174 3.633 1.00 0.00 H new ATOM 0 HA ALA A 33 10.854 5.243 3.806 1.00 0.00 H new ATOM 0 HB1 ALA A 33 11.447 4.117 1.647 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.123 2.895 2.900 1.00 0.00 H new ATOM 0 HB3 ALA A 33 9.890 3.254 1.668 1.00 0.00 H new ATOM 506 N GLU A 34 8.160 5.790 2.130 1.00 0.00 N ATOM 507 CA GLU A 34 7.497 6.856 1.322 1.00 0.00 C ATOM 508 C GLU A 34 6.353 7.516 2.115 1.00 0.00 C ATOM 509 O GLU A 34 6.539 8.581 2.669 1.00 0.00 O ATOM 510 CB GLU A 34 6.988 6.154 0.062 1.00 0.00 C ATOM 511 CG GLU A 34 8.091 6.149 -0.998 1.00 0.00 C ATOM 512 CD GLU A 34 8.694 4.746 -1.102 1.00 0.00 C ATOM 513 OE1 GLU A 34 8.102 3.917 -1.774 1.00 0.00 O ATOM 514 OE2 GLU A 34 9.736 4.526 -0.509 1.00 0.00 O ATOM 0 H GLU A 34 7.547 5.047 2.466 1.00 0.00 H new ATOM 0 HA GLU A 34 8.183 7.665 1.070 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.690 5.132 0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 34 6.104 6.664 -0.320 1.00 0.00 H new ATOM 0 HG2 GLU A 34 7.684 6.454 -1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.865 6.870 -0.736 1.00 0.00 H new ATOM 521 N PRO A 35 5.203 6.880 2.153 1.00 0.00 N ATOM 522 CA PRO A 35 4.053 7.460 2.894 1.00 0.00 C ATOM 523 C PRO A 35 4.244 7.295 4.407 1.00 0.00 C ATOM 524 O PRO A 35 3.534 6.551 5.052 1.00 0.00 O ATOM 525 CB PRO A 35 2.864 6.637 2.413 1.00 0.00 C ATOM 526 CG PRO A 35 3.445 5.331 1.980 1.00 0.00 C ATOM 527 CD PRO A 35 4.857 5.598 1.527 1.00 0.00 C ATOM 0 HA PRO A 35 3.931 8.529 2.717 1.00 0.00 H new ATOM 0 HB2 PRO A 35 2.132 6.499 3.209 1.00 0.00 H new ATOM 0 HB3 PRO A 35 2.349 7.132 1.590 1.00 0.00 H new ATOM 0 HG2 PRO A 35 3.434 4.614 2.801 1.00 0.00 H new ATOM 0 HG3 PRO A 35 2.857 4.898 1.171 1.00 0.00 H new ATOM 0 HD2 PRO A 35 5.533 4.805 1.845 1.00 0.00 H new ATOM 0 HD3 PRO A 35 4.922 5.656 0.440 1.00 0.00 H new ATOM 535 N ALA A 36 5.194 7.983 4.979 1.00 0.00 N ATOM 536 CA ALA A 36 5.419 7.861 6.451 1.00 0.00 C ATOM 537 C ALA A 36 4.100 8.037 7.209 1.00 0.00 C ATOM 538 O ALA A 36 3.271 8.850 6.851 1.00 0.00 O ATOM 539 CB ALA A 36 6.389 8.988 6.800 1.00 0.00 C ATOM 0 H ALA A 36 5.823 8.623 4.494 1.00 0.00 H new ATOM 0 HA ALA A 36 5.814 6.883 6.725 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.604 8.965 7.868 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.315 8.857 6.240 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.941 9.947 6.541 1.00 0.00 H new ATOM 545 N GLY A 37 3.897 7.278 8.252 1.00 0.00 N ATOM 546 CA GLY A 37 2.629 7.399 9.029 1.00 0.00 C ATOM 547 C GLY A 37 1.516 6.660 8.288 1.00 0.00 C ATOM 548 O GLY A 37 0.345 6.908 8.491 1.00 0.00 O ATOM 0 H GLY A 37 4.554 6.580 8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.758 6.981 10.027 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.364 8.449 9.155 1.00 0.00 H new ATOM 552 N THR A 38 1.881 5.757 7.423 1.00 0.00 N ATOM 553 CA THR A 38 0.858 4.995 6.648 1.00 0.00 C ATOM 554 C THR A 38 0.945 3.502 6.975 1.00 0.00 C ATOM 555 O THR A 38 2.000 2.983 7.268 1.00 0.00 O ATOM 556 CB THR A 38 1.202 5.246 5.181 1.00 0.00 C ATOM 557 OG1 THR A 38 1.034 6.626 4.890 1.00 0.00 O ATOM 558 CG2 THR A 38 0.276 4.417 4.289 1.00 0.00 C ATOM 0 H THR A 38 2.849 5.511 7.217 1.00 0.00 H new ATOM 0 HA THR A 38 -0.158 5.310 6.887 1.00 0.00 H new ATOM 0 HB THR A 38 2.236 4.957 4.993 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.855 7.111 5.117 1.00 0.00 H new ATOM 0 HG21 THR A 38 0.522 4.597 3.242 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.404 3.359 4.515 1.00 0.00 H new ATOM 0 HG23 THR A 38 -0.759 4.704 4.473 1.00 0.00 H new ATOM 566 N PHE A 39 -0.158 2.806 6.934 1.00 0.00 N ATOM 567 CA PHE A 39 -0.126 1.349 7.249 1.00 0.00 C ATOM 568 C PHE A 39 -0.663 0.549 6.058 1.00 0.00 C ATOM 569 O PHE A 39 -1.620 0.935 5.418 1.00 0.00 O ATOM 570 CB PHE A 39 -1.038 1.188 8.466 1.00 0.00 C ATOM 571 CG PHE A 39 -2.484 1.249 8.029 1.00 0.00 C ATOM 572 CD1 PHE A 39 -3.082 0.133 7.431 1.00 0.00 C ATOM 573 CD2 PHE A 39 -3.224 2.421 8.223 1.00 0.00 C ATOM 574 CE1 PHE A 39 -4.421 0.190 7.027 1.00 0.00 C ATOM 575 CE2 PHE A 39 -4.564 2.477 7.819 1.00 0.00 C ATOM 576 CZ PHE A 39 -5.162 1.362 7.221 1.00 0.00 C ATOM 0 H PHE A 39 -1.077 3.181 6.697 1.00 0.00 H new ATOM 0 HA PHE A 39 0.882 0.985 7.450 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.837 0.238 8.960 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.834 1.975 9.192 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.511 -0.771 7.282 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.762 3.282 8.684 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -4.883 -0.670 6.565 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.136 3.381 7.969 1.00 0.00 H new ATOM 0 HZ PHE A 39 -6.195 1.406 6.909 1.00 0.00 H new ATOM 586 N LEU A 40 -0.037 -0.553 5.749 1.00 0.00 N ATOM 587 CA LEU A 40 -0.488 -1.373 4.587 1.00 0.00 C ATOM 588 C LEU A 40 -0.433 -2.865 4.933 1.00 0.00 C ATOM 589 O LEU A 40 0.299 -3.279 5.810 1.00 0.00 O ATOM 590 CB LEU A 40 0.518 -1.029 3.483 1.00 0.00 C ATOM 591 CG LEU A 40 0.529 -2.120 2.413 1.00 0.00 C ATOM 592 CD1 LEU A 40 1.144 -1.559 1.130 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.369 -3.307 2.894 1.00 0.00 C ATOM 0 H LEU A 40 0.770 -0.923 6.252 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.517 -1.167 4.293 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.259 -0.071 3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.515 -0.921 3.911 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.492 -2.451 2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.155 -2.333 0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.552 -0.712 0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.164 -1.231 1.329 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.374 -4.083 2.128 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.390 -2.977 3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.941 -3.707 3.813 1.00 0.00 H new ATOM 605 N ILE A 41 -1.198 -3.675 4.252 1.00 0.00 N ATOM 606 CA ILE A 41 -1.182 -5.137 4.548 1.00 0.00 C ATOM 607 C ILE A 41 -0.646 -5.920 3.343 1.00 0.00 C ATOM 608 O ILE A 41 -1.039 -5.692 2.218 1.00 0.00 O ATOM 609 CB ILE A 41 -2.645 -5.502 4.829 1.00 0.00 C ATOM 610 CG1 ILE A 41 -2.700 -6.586 5.907 1.00 0.00 C ATOM 611 CG2 ILE A 41 -3.309 -6.023 3.552 1.00 0.00 C ATOM 612 CD1 ILE A 41 -4.140 -6.747 6.397 1.00 0.00 C ATOM 0 H ILE A 41 -1.832 -3.389 3.506 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.535 -5.381 5.391 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.175 -4.614 5.172 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.333 -7.531 5.506 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -2.049 -6.319 6.740 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.348 -6.280 3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.273 -5.252 2.783 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -2.779 -6.909 3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -4.179 -7.519 7.165 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.490 -5.803 6.814 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.779 -7.034 5.562 1.00 0.00 H new ATOM 624 N ARG A 42 0.247 -6.843 3.575 1.00 0.00 N ATOM 625 CA ARG A 42 0.809 -7.645 2.449 1.00 0.00 C ATOM 626 C ARG A 42 0.359 -9.104 2.574 1.00 0.00 C ATOM 627 O ARG A 42 0.287 -9.649 3.657 1.00 0.00 O ATOM 628 CB ARG A 42 2.324 -7.537 2.610 1.00 0.00 C ATOM 629 CG ARG A 42 2.744 -8.193 3.926 1.00 0.00 C ATOM 630 CD ARG A 42 3.372 -9.558 3.635 1.00 0.00 C ATOM 631 NE ARG A 42 2.451 -10.546 4.258 1.00 0.00 N ATOM 632 CZ ARG A 42 2.889 -11.732 4.582 1.00 0.00 C ATOM 633 NH1 ARG A 42 4.130 -12.060 4.346 1.00 0.00 N ATOM 634 NH2 ARG A 42 2.085 -12.593 5.142 1.00 0.00 N ATOM 0 H ARG A 42 0.613 -7.077 4.498 1.00 0.00 H new ATOM 0 HA ARG A 42 0.476 -7.289 1.474 1.00 0.00 H new ATOM 0 HB2 ARG A 42 2.825 -8.023 1.773 1.00 0.00 H new ATOM 0 HB3 ARG A 42 2.628 -6.490 2.600 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.457 -7.557 4.451 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.879 -8.310 4.579 1.00 0.00 H new ATOM 0 HD2 ARG A 42 3.467 -9.728 2.563 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.374 -9.630 4.059 1.00 0.00 H new ATOM 0 HE ARG A 42 1.477 -10.297 4.432 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.760 -11.389 3.907 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.470 -12.988 4.600 1.00 0.00 H new ATOM 0 HH21 ARG A 42 1.114 -12.339 5.326 1.00 0.00 H new ATOM 0 HH22 ARG A 42 2.427 -13.520 5.395 1.00 0.00 H new ATOM 648 N ASP A 43 0.054 -9.742 1.476 1.00 0.00 N ATOM 649 CA ASP A 43 -0.391 -11.165 1.542 1.00 0.00 C ATOM 650 C ASP A 43 0.822 -12.096 1.636 1.00 0.00 C ATOM 651 O ASP A 43 1.778 -11.961 0.899 1.00 0.00 O ATOM 652 CB ASP A 43 -1.149 -11.403 0.236 1.00 0.00 C ATOM 653 CG ASP A 43 -1.625 -12.856 0.178 1.00 0.00 C ATOM 654 OD1 ASP A 43 -1.121 -13.655 0.951 1.00 0.00 O ATOM 655 OD2 ASP A 43 -2.485 -13.145 -0.637 1.00 0.00 O ATOM 0 H ASP A 43 0.093 -9.341 0.539 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.011 -11.363 2.416 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -2.002 -10.727 0.170 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.504 -11.186 -0.616 1.00 0.00 H new ATOM 660 N SER A 44 0.792 -13.037 2.540 1.00 0.00 N ATOM 661 CA SER A 44 1.945 -13.975 2.682 1.00 0.00 C ATOM 662 C SER A 44 2.224 -14.681 1.353 1.00 0.00 C ATOM 663 O SER A 44 3.275 -14.521 0.763 1.00 0.00 O ATOM 664 CB SER A 44 1.508 -14.988 3.739 1.00 0.00 C ATOM 665 OG SER A 44 0.531 -15.857 3.181 1.00 0.00 O ATOM 0 H SER A 44 0.020 -13.198 3.187 1.00 0.00 H new ATOM 0 HA SER A 44 2.861 -13.456 2.966 1.00 0.00 H new ATOM 0 HB2 SER A 44 2.367 -15.563 4.086 1.00 0.00 H new ATOM 0 HB3 SER A 44 1.099 -14.471 4.607 1.00 0.00 H new ATOM 0 HG SER A 44 -0.031 -15.357 2.553 1.00 0.00 H new ATOM 735 N HIS A 49 0.343 -18.843 4.470 1.00 0.00 N ATOM 736 CA HIS A 49 -0.929 -18.355 3.864 1.00 0.00 C ATOM 737 C HIS A 49 -1.632 -17.384 4.817 1.00 0.00 C ATOM 738 O HIS A 49 -2.428 -17.778 5.645 1.00 0.00 O ATOM 739 CB HIS A 49 -1.777 -19.611 3.658 1.00 0.00 C ATOM 740 CG HIS A 49 -0.978 -20.637 2.903 1.00 0.00 C ATOM 741 ND1 HIS A 49 -0.543 -20.426 1.605 1.00 0.00 N ATOM 742 CD2 HIS A 49 -0.529 -21.886 3.251 1.00 0.00 C ATOM 743 CE1 HIS A 49 0.135 -21.523 1.221 1.00 0.00 C ATOM 744 NE2 HIS A 49 0.174 -22.444 2.188 1.00 0.00 N ATOM 0 HA HIS A 49 -0.761 -17.818 2.930 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -2.089 -20.014 4.621 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -2.684 -19.364 3.107 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -0.696 -22.363 4.205 1.00 0.00 H new ATOM 0 HE1 HIS A 49 0.592 -21.644 0.250 1.00 0.00 H new ATOM 0 HE2 HIS A 49 0.623 -23.359 2.154 1.00 0.00 H new ATOM 752 N PHE A 50 -1.342 -16.116 4.705 1.00 0.00 N ATOM 753 CA PHE A 50 -1.993 -15.120 5.605 1.00 0.00 C ATOM 754 C PHE A 50 -1.541 -13.705 5.239 1.00 0.00 C ATOM 755 O PHE A 50 -0.696 -13.516 4.387 1.00 0.00 O ATOM 756 CB PHE A 50 -1.524 -15.494 7.012 1.00 0.00 C ATOM 757 CG PHE A 50 -0.102 -15.027 7.219 1.00 0.00 C ATOM 758 CD1 PHE A 50 0.958 -15.738 6.643 1.00 0.00 C ATOM 759 CD2 PHE A 50 0.156 -13.888 7.990 1.00 0.00 C ATOM 760 CE1 PHE A 50 2.276 -15.308 6.839 1.00 0.00 C ATOM 761 CE2 PHE A 50 1.474 -13.459 8.185 1.00 0.00 C ATOM 762 CZ PHE A 50 2.533 -14.169 7.610 1.00 0.00 C ATOM 0 H PHE A 50 -0.683 -15.727 4.030 1.00 0.00 H new ATOM 0 HA PHE A 50 -3.080 -15.133 5.524 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.178 -15.039 7.756 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.586 -16.573 7.151 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.759 -16.617 6.048 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -0.662 -13.340 8.434 1.00 0.00 H new ATOM 0 HE1 PHE A 50 3.094 -15.855 6.395 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.673 -12.580 8.780 1.00 0.00 H new ATOM 0 HZ PHE A 50 3.550 -13.838 7.761 1.00 0.00 H new ATOM 772 N PHE A 51 -2.093 -12.706 5.873 1.00 0.00 N ATOM 773 CA PHE A 51 -1.679 -11.313 5.548 1.00 0.00 C ATOM 774 C PHE A 51 -1.238 -10.576 6.813 1.00 0.00 C ATOM 775 O PHE A 51 -1.809 -10.737 7.873 1.00 0.00 O ATOM 776 CB PHE A 51 -2.912 -10.650 4.932 1.00 0.00 C ATOM 777 CG PHE A 51 -4.103 -10.779 5.856 1.00 0.00 C ATOM 778 CD1 PHE A 51 -4.298 -9.850 6.890 1.00 0.00 C ATOM 779 CD2 PHE A 51 -5.030 -11.813 5.663 1.00 0.00 C ATOM 780 CE1 PHE A 51 -5.416 -9.957 7.721 1.00 0.00 C ATOM 781 CE2 PHE A 51 -6.145 -11.919 6.501 1.00 0.00 C ATOM 782 CZ PHE A 51 -6.338 -10.991 7.528 1.00 0.00 C ATOM 0 H PHE A 51 -2.807 -12.794 6.596 1.00 0.00 H new ATOM 0 HA PHE A 51 -0.831 -11.292 4.863 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -2.707 -9.597 4.739 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.138 -11.112 3.971 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.585 -9.054 7.043 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.883 -12.528 4.867 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.569 -9.240 8.514 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.857 -12.718 6.354 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.200 -11.072 8.173 1.00 0.00 H new ATOM 792 N THR A 52 -0.218 -9.770 6.705 1.00 0.00 N ATOM 793 CA THR A 52 0.275 -9.019 7.894 1.00 0.00 C ATOM 794 C THR A 52 0.316 -7.520 7.592 1.00 0.00 C ATOM 795 O THR A 52 0.612 -7.107 6.488 1.00 0.00 O ATOM 796 CB THR A 52 1.688 -9.553 8.151 1.00 0.00 C ATOM 797 OG1 THR A 52 2.462 -8.549 8.790 1.00 0.00 O ATOM 798 CG2 THR A 52 2.347 -9.935 6.825 1.00 0.00 C ATOM 0 H THR A 52 0.297 -9.599 5.841 1.00 0.00 H new ATOM 0 HA THR A 52 -0.372 -9.153 8.761 1.00 0.00 H new ATOM 0 HB THR A 52 1.629 -10.434 8.790 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.955 -8.172 9.539 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.351 -10.314 7.014 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.755 -10.706 6.333 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.405 -9.057 6.182 1.00 0.00 H new ATOM 806 N LEU A 53 0.021 -6.702 8.563 1.00 0.00 N ATOM 807 CA LEU A 53 0.042 -5.231 8.332 1.00 0.00 C ATOM 808 C LEU A 53 1.020 -4.565 9.305 1.00 0.00 C ATOM 809 O LEU A 53 1.027 -4.845 10.488 1.00 0.00 O ATOM 810 CB LEU A 53 -1.400 -4.780 8.585 1.00 0.00 C ATOM 811 CG LEU A 53 -1.428 -3.432 9.317 1.00 0.00 C ATOM 812 CD1 LEU A 53 -0.486 -2.447 8.630 1.00 0.00 C ATOM 813 CD2 LEU A 53 -2.850 -2.870 9.291 1.00 0.00 C ATOM 0 H LEU A 53 -0.234 -6.989 9.508 1.00 0.00 H new ATOM 0 HA LEU A 53 0.374 -4.960 7.330 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.931 -4.695 7.637 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.922 -5.531 9.177 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.106 -3.579 10.348 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.511 -1.492 9.155 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.529 -2.843 8.646 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.802 -2.301 7.597 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.872 -1.912 9.811 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.167 -2.730 8.258 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.526 -3.567 9.786 1.00 0.00 H new ATOM 825 N SER A 54 1.847 -3.689 8.809 1.00 0.00 N ATOM 826 CA SER A 54 2.832 -3.003 9.691 1.00 0.00 C ATOM 827 C SER A 54 2.934 -1.524 9.314 1.00 0.00 C ATOM 828 O SER A 54 2.654 -1.135 8.197 1.00 0.00 O ATOM 829 CB SER A 54 4.152 -3.724 9.448 1.00 0.00 C ATOM 830 OG SER A 54 5.224 -2.797 9.562 1.00 0.00 O ATOM 0 H SER A 54 1.884 -3.417 7.827 1.00 0.00 H new ATOM 0 HA SER A 54 2.546 -3.038 10.742 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.276 -4.531 10.170 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.154 -4.179 8.457 1.00 0.00 H new ATOM 0 HG SER A 54 5.517 -2.524 8.668 1.00 0.00 H new ATOM 836 N VAL A 55 3.316 -0.694 10.244 1.00 0.00 N ATOM 837 CA VAL A 55 3.417 0.766 9.949 1.00 0.00 C ATOM 838 C VAL A 55 4.744 1.330 10.465 1.00 0.00 C ATOM 839 O VAL A 55 5.514 0.645 11.108 1.00 0.00 O ATOM 840 CB VAL A 55 2.244 1.400 10.694 1.00 0.00 C ATOM 841 CG1 VAL A 55 2.470 1.274 12.203 1.00 0.00 C ATOM 842 CG2 VAL A 55 2.140 2.878 10.317 1.00 0.00 C ATOM 0 H VAL A 55 3.563 -0.962 11.197 1.00 0.00 H new ATOM 0 HA VAL A 55 3.385 0.970 8.879 1.00 0.00 H new ATOM 0 HB VAL A 55 1.321 0.889 10.420 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.633 1.726 12.735 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.545 0.221 12.473 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.393 1.785 12.477 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.303 3.331 10.848 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.063 3.389 10.591 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.980 2.969 9.243 1.00 0.00 H new ATOM 852 N LYS A 56 5.012 2.575 10.185 1.00 0.00 N ATOM 853 CA LYS A 56 6.286 3.191 10.655 1.00 0.00 C ATOM 854 C LYS A 56 6.023 4.098 11.860 1.00 0.00 C ATOM 855 O LYS A 56 5.087 4.874 11.872 1.00 0.00 O ATOM 856 CB LYS A 56 6.785 4.015 9.468 1.00 0.00 C ATOM 857 CG LYS A 56 8.313 4.089 9.506 1.00 0.00 C ATOM 858 CD LYS A 56 8.787 5.290 8.685 1.00 0.00 C ATOM 859 CE LYS A 56 9.025 6.483 9.614 1.00 0.00 C ATOM 860 NZ LYS A 56 10.459 6.385 10.004 1.00 0.00 N ATOM 0 H LYS A 56 4.403 3.194 9.650 1.00 0.00 H new ATOM 0 HA LYS A 56 7.014 2.444 10.972 1.00 0.00 H new ATOM 0 HB2 LYS A 56 6.455 3.562 8.533 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.360 5.018 9.504 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.658 4.180 10.536 1.00 0.00 H new ATOM 0 HG3 LYS A 56 8.742 3.170 9.107 1.00 0.00 H new ATOM 0 HD2 LYS A 56 9.705 5.041 8.154 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.042 5.545 7.931 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.817 7.426 9.108 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.374 6.440 10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 10.700 7.170 10.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 10.626 5.481 10.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 11.054 6.436 9.153 1.00 0.00 H new ATOM 874 N THR A 57 6.840 4.005 12.873 1.00 0.00 N ATOM 875 CA THR A 57 6.636 4.862 14.077 1.00 0.00 C ATOM 876 C THR A 57 7.545 6.092 14.013 1.00 0.00 C ATOM 877 O THR A 57 7.934 6.535 12.950 1.00 0.00 O ATOM 878 CB THR A 57 7.017 3.974 15.263 1.00 0.00 C ATOM 879 OG1 THR A 57 6.963 2.610 14.867 1.00 0.00 O ATOM 880 CG2 THR A 57 6.042 4.213 16.416 1.00 0.00 C ATOM 0 H THR A 57 7.640 3.373 12.920 1.00 0.00 H new ATOM 0 HA THR A 57 5.613 5.229 14.154 1.00 0.00 H new ATOM 0 HB THR A 57 8.028 4.218 15.591 1.00 0.00 H new ATOM 0 HG1 THR A 57 7.872 2.246 14.824 1.00 0.00 H new ATOM 0 HG21 THR A 57 6.315 3.580 17.260 1.00 0.00 H new ATOM 0 HG22 THR A 57 6.086 5.259 16.718 1.00 0.00 H new ATOM 0 HG23 THR A 57 5.030 3.971 16.093 1.00 0.00 H new ATOM 888 N GLN A 58 7.886 6.648 15.144 1.00 0.00 N ATOM 889 CA GLN A 58 8.769 7.849 15.149 1.00 0.00 C ATOM 890 C GLN A 58 10.167 7.482 14.645 1.00 0.00 C ATOM 891 O GLN A 58 10.899 8.318 14.153 1.00 0.00 O ATOM 892 CB GLN A 58 8.825 8.294 16.611 1.00 0.00 C ATOM 893 CG GLN A 58 9.141 7.090 17.501 1.00 0.00 C ATOM 894 CD GLN A 58 10.439 7.348 18.268 1.00 0.00 C ATOM 895 OE1 GLN A 58 11.395 6.611 18.131 1.00 0.00 O ATOM 896 NE2 GLN A 58 10.513 8.368 19.077 1.00 0.00 N ATOM 0 H GLN A 58 7.591 6.322 16.065 1.00 0.00 H new ATOM 0 HA GLN A 58 8.395 8.638 14.497 1.00 0.00 H new ATOM 0 HB2 GLN A 58 9.586 9.063 16.739 1.00 0.00 H new ATOM 0 HB3 GLN A 58 7.873 8.736 16.904 1.00 0.00 H new ATOM 0 HG2 GLN A 58 8.322 6.916 18.199 1.00 0.00 H new ATOM 0 HG3 GLN A 58 9.238 6.191 16.893 1.00 0.00 H new ATOM 0 HE21 GLN A 58 9.710 8.987 19.192 1.00 0.00 H new ATOM 0 HE22 GLN A 58 11.373 8.547 19.595 1.00 0.00 H new ATOM 905 N SER A 59 10.545 6.239 14.762 1.00 0.00 N ATOM 906 CA SER A 59 11.896 5.823 14.288 1.00 0.00 C ATOM 907 C SER A 59 12.080 4.312 14.463 1.00 0.00 C ATOM 908 O SER A 59 13.179 3.829 14.656 1.00 0.00 O ATOM 909 CB SER A 59 12.879 6.588 15.174 1.00 0.00 C ATOM 910 OG SER A 59 13.155 7.852 14.586 1.00 0.00 O ATOM 0 H SER A 59 9.978 5.493 15.165 1.00 0.00 H new ATOM 0 HA SER A 59 12.045 6.039 13.230 1.00 0.00 H new ATOM 0 HB2 SER A 59 12.460 6.722 16.171 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.801 6.019 15.290 1.00 0.00 H new ATOM 0 HG SER A 59 12.336 8.390 14.567 1.00 0.00 H new ATOM 916 N GLY A 60 11.014 3.564 14.396 1.00 0.00 N ATOM 917 CA GLY A 60 11.130 2.087 14.558 1.00 0.00 C ATOM 918 C GLY A 60 10.134 1.392 13.629 1.00 0.00 C ATOM 919 O GLY A 60 8.938 1.442 13.836 1.00 0.00 O ATOM 0 H GLY A 60 10.068 3.911 14.236 1.00 0.00 H new ATOM 0 HA2 GLY A 60 12.145 1.764 14.327 1.00 0.00 H new ATOM 0 HA3 GLY A 60 10.934 1.808 15.593 1.00 0.00 H new ATOM 923 N THR A 61 10.617 0.742 12.606 1.00 0.00 N ATOM 924 CA THR A 61 9.695 0.045 11.664 1.00 0.00 C ATOM 925 C THR A 61 9.613 -1.444 12.008 1.00 0.00 C ATOM 926 O THR A 61 10.548 -2.192 11.800 1.00 0.00 O ATOM 927 CB THR A 61 10.318 0.243 10.281 1.00 0.00 C ATOM 928 OG1 THR A 61 11.521 -0.509 10.194 1.00 0.00 O ATOM 929 CG2 THR A 61 10.624 1.725 10.063 1.00 0.00 C ATOM 0 H THR A 61 11.609 0.663 12.381 1.00 0.00 H new ATOM 0 HA THR A 61 8.679 0.438 11.714 1.00 0.00 H new ATOM 0 HB THR A 61 9.620 -0.097 9.516 1.00 0.00 H new ATOM 0 HG1 THR A 61 11.471 -1.278 10.799 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.068 1.864 9.077 1.00 0.00 H new ATOM 0 HG22 THR A 61 9.701 2.301 10.130 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.322 2.069 10.827 1.00 0.00 H new ATOM 937 N LYS A 62 8.501 -1.881 12.532 1.00 0.00 N ATOM 938 CA LYS A 62 8.357 -3.322 12.888 1.00 0.00 C ATOM 939 C LYS A 62 7.244 -3.959 12.052 1.00 0.00 C ATOM 940 O LYS A 62 6.386 -3.279 11.527 1.00 0.00 O ATOM 941 CB LYS A 62 7.987 -3.331 14.372 1.00 0.00 C ATOM 942 CG LYS A 62 9.230 -3.651 15.206 1.00 0.00 C ATOM 943 CD LYS A 62 10.176 -2.449 15.196 1.00 0.00 C ATOM 944 CE LYS A 62 11.595 -2.913 15.528 1.00 0.00 C ATOM 945 NZ LYS A 62 11.956 -3.857 14.435 1.00 0.00 N ATOM 0 H LYS A 62 7.685 -1.302 12.729 1.00 0.00 H new ATOM 0 HA LYS A 62 9.267 -3.890 12.695 1.00 0.00 H new ATOM 0 HB2 LYS A 62 7.581 -2.362 14.662 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.210 -4.072 14.559 1.00 0.00 H new ATOM 0 HG2 LYS A 62 8.942 -3.892 16.229 1.00 0.00 H new ATOM 0 HG3 LYS A 62 9.736 -4.528 14.802 1.00 0.00 H new ATOM 0 HD2 LYS A 62 10.159 -1.968 14.218 1.00 0.00 H new ATOM 0 HD3 LYS A 62 9.845 -1.707 15.923 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.287 -2.071 15.567 1.00 0.00 H new ATOM 0 HE3 LYS A 62 11.633 -3.403 16.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.957 -3.730 14.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 11.800 -4.834 14.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 11.363 -3.667 13.602 1.00 0.00 H new ATOM 959 N ASN A 63 7.252 -5.257 11.923 1.00 0.00 N ATOM 960 CA ASN A 63 6.192 -5.927 11.116 1.00 0.00 C ATOM 961 C ASN A 63 5.278 -6.758 12.023 1.00 0.00 C ATOM 962 O ASN A 63 5.736 -7.485 12.882 1.00 0.00 O ATOM 963 CB ASN A 63 6.947 -6.832 10.142 1.00 0.00 C ATOM 964 CG ASN A 63 7.303 -6.041 8.882 1.00 0.00 C ATOM 965 OD1 ASN A 63 6.856 -4.925 8.705 1.00 0.00 O ATOM 966 ND2 ASN A 63 8.095 -6.575 7.993 1.00 0.00 N ATOM 0 H ASN A 63 7.943 -5.881 12.339 1.00 0.00 H new ATOM 0 HA ASN A 63 5.556 -5.210 10.597 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.853 -7.214 10.612 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.334 -7.695 9.881 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.339 -6.056 7.150 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.470 -7.512 8.141 1.00 0.00 H new ATOM 973 N LEU A 64 3.988 -6.653 11.842 1.00 0.00 N ATOM 974 CA LEU A 64 3.050 -7.435 12.697 1.00 0.00 C ATOM 975 C LEU A 64 2.389 -8.545 11.877 1.00 0.00 C ATOM 976 O LEU A 64 1.680 -8.286 10.925 1.00 0.00 O ATOM 977 CB LEU A 64 2.004 -6.421 13.163 1.00 0.00 C ATOM 978 CG LEU A 64 2.696 -5.211 13.794 1.00 0.00 C ATOM 979 CD1 LEU A 64 3.801 -5.684 14.739 1.00 0.00 C ATOM 980 CD2 LEU A 64 3.303 -4.336 12.696 1.00 0.00 C ATOM 0 H LEU A 64 3.545 -6.060 11.140 1.00 0.00 H new ATOM 0 HA LEU A 64 3.556 -7.916 13.534 1.00 0.00 H new ATOM 0 HB2 LEU A 64 1.393 -6.102 12.319 1.00 0.00 H new ATOM 0 HB3 LEU A 64 1.332 -6.884 13.886 1.00 0.00 H new ATOM 0 HG LEU A 64 1.964 -4.631 14.356 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.292 -4.820 15.187 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.368 -6.303 15.525 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.533 -6.267 14.180 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.795 -3.475 13.148 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.032 -4.916 12.130 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.514 -3.993 12.026 1.00 0.00 H new ATOM 992 N ARG A 65 2.609 -9.777 12.242 1.00 0.00 N ATOM 993 CA ARG A 65 1.990 -10.899 11.480 1.00 0.00 C ATOM 994 C ARG A 65 1.029 -11.682 12.377 1.00 0.00 C ATOM 995 O ARG A 65 1.229 -11.789 13.571 1.00 0.00 O ATOM 996 CB ARG A 65 3.162 -11.783 11.051 1.00 0.00 C ATOM 997 CG ARG A 65 3.817 -12.400 12.288 1.00 0.00 C ATOM 998 CD ARG A 65 3.212 -13.780 12.553 1.00 0.00 C ATOM 999 NE ARG A 65 4.192 -14.465 13.441 1.00 0.00 N ATOM 1000 CZ ARG A 65 5.305 -14.935 12.946 1.00 0.00 C ATOM 1001 NH1 ARG A 65 5.561 -14.806 11.673 1.00 0.00 N ATOM 1002 NH2 ARG A 65 6.163 -15.534 13.727 1.00 0.00 N ATOM 0 H ARG A 65 3.189 -10.056 13.033 1.00 0.00 H new ATOM 0 HA ARG A 65 1.411 -10.547 10.626 1.00 0.00 H new ATOM 0 HB2 ARG A 65 2.812 -12.569 10.382 1.00 0.00 H new ATOM 0 HB3 ARG A 65 3.892 -11.193 10.496 1.00 0.00 H new ATOM 0 HG2 ARG A 65 4.893 -12.486 12.138 1.00 0.00 H new ATOM 0 HG3 ARG A 65 3.667 -11.753 13.153 1.00 0.00 H new ATOM 0 HD2 ARG A 65 2.236 -13.698 13.031 1.00 0.00 H new ATOM 0 HD3 ARG A 65 3.067 -14.332 11.625 1.00 0.00 H new ATOM 0 HE ARG A 65 3.994 -14.567 14.436 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.891 -14.337 11.063 1.00 0.00 H new ATOM 0 HH12 ARG A 65 6.431 -15.174 11.288 1.00 0.00 H new ATOM 0 HH21 ARG A 65 5.963 -15.634 14.722 1.00 0.00 H new ATOM 0 HH22 ARG A 65 7.033 -15.902 13.342 1.00 0.00 H new ATOM 1016 N ILE A 66 -0.012 -12.230 11.812 1.00 0.00 N ATOM 1017 CA ILE A 66 -0.981 -13.005 12.636 1.00 0.00 C ATOM 1018 C ILE A 66 -0.406 -14.384 12.968 1.00 0.00 C ATOM 1019 O ILE A 66 0.071 -15.093 12.105 1.00 0.00 O ATOM 1020 CB ILE A 66 -2.228 -13.138 11.763 1.00 0.00 C ATOM 1021 CG1 ILE A 66 -3.395 -13.633 12.620 1.00 0.00 C ATOM 1022 CG2 ILE A 66 -1.958 -14.140 10.639 1.00 0.00 C ATOM 1023 CD1 ILE A 66 -4.337 -12.467 12.924 1.00 0.00 C ATOM 0 H ILE A 66 -0.233 -12.175 10.818 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.201 -12.516 13.585 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.478 -12.169 11.332 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.934 -14.423 12.097 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.021 -14.063 13.549 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.847 -14.236 10.016 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.124 -13.789 10.031 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.710 -15.111 11.069 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.168 -12.820 13.534 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.794 -11.692 13.464 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.721 -12.057 11.990 1.00 0.00 H new ATOM 1035 N GLN A 67 -0.445 -14.766 14.214 1.00 0.00 N ATOM 1036 CA GLN A 67 0.104 -16.096 14.606 1.00 0.00 C ATOM 1037 C GLN A 67 -1.010 -17.146 14.637 1.00 0.00 C ATOM 1038 O GLN A 67 -2.160 -16.839 14.881 1.00 0.00 O ATOM 1039 CB GLN A 67 0.681 -15.890 16.007 1.00 0.00 C ATOM 1040 CG GLN A 67 2.173 -15.565 15.901 1.00 0.00 C ATOM 1041 CD GLN A 67 2.982 -16.632 16.639 1.00 0.00 C ATOM 1042 OE1 GLN A 67 2.897 -16.749 17.846 1.00 0.00 O ATOM 1043 NE2 GLN A 67 3.770 -17.422 15.962 1.00 0.00 N ATOM 0 H GLN A 67 -0.834 -14.215 14.979 1.00 0.00 H new ATOM 0 HA GLN A 67 0.855 -16.452 13.901 1.00 0.00 H new ATOM 0 HB2 GLN A 67 0.156 -15.079 16.513 1.00 0.00 H new ATOM 0 HB3 GLN A 67 0.535 -16.788 16.608 1.00 0.00 H new ATOM 0 HG2 GLN A 67 2.474 -15.525 14.854 1.00 0.00 H new ATOM 0 HG3 GLN A 67 2.373 -14.582 16.328 1.00 0.00 H new ATOM 0 HE21 GLN A 67 3.842 -17.325 14.949 1.00 0.00 H new ATOM 0 HE22 GLN A 67 4.314 -18.137 16.446 1.00 0.00 H new ATOM 1052 N CYS A 68 -0.677 -18.384 14.389 1.00 0.00 N ATOM 1053 CA CYS A 68 -1.714 -19.455 14.403 1.00 0.00 C ATOM 1054 C CYS A 68 -1.704 -20.182 15.751 1.00 0.00 C ATOM 1055 O CYS A 68 -0.661 -20.460 16.309 1.00 0.00 O ATOM 1056 CB CYS A 68 -1.312 -20.408 13.277 1.00 0.00 C ATOM 1057 SG CYS A 68 0.247 -21.221 13.703 1.00 0.00 S ATOM 0 H CYS A 68 0.269 -18.700 14.177 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.720 -19.059 14.263 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -2.092 -21.153 13.121 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -1.204 -19.858 12.342 1.00 0.00 H new ATOM 0 HG CYS A 68 0.418 -21.183 14.991 1.00 0.00 H new ATOM 1063 N GLU A 69 -2.857 -20.491 16.279 1.00 0.00 N ATOM 1064 CA GLU A 69 -2.909 -21.199 17.591 1.00 0.00 C ATOM 1065 C GLU A 69 -3.859 -22.397 17.512 1.00 0.00 C ATOM 1066 O GLU A 69 -5.056 -22.245 17.364 1.00 0.00 O ATOM 1067 CB GLU A 69 -3.440 -20.160 18.579 1.00 0.00 C ATOM 1068 CG GLU A 69 -2.631 -18.868 18.446 1.00 0.00 C ATOM 1069 CD GLU A 69 -3.160 -17.830 19.437 1.00 0.00 C ATOM 1070 OE1 GLU A 69 -4.096 -18.147 20.153 1.00 0.00 O ATOM 1071 OE2 GLU A 69 -2.620 -16.737 19.464 1.00 0.00 O ATOM 0 H GLU A 69 -3.764 -20.285 15.860 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.935 -21.587 17.888 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.494 -19.963 18.384 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.370 -20.542 19.597 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.576 -19.065 18.638 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.703 -18.484 17.428 1.00 0.00 H new ATOM 1078 N GLY A 70 -3.335 -23.588 17.611 1.00 0.00 N ATOM 1079 CA GLY A 70 -4.208 -24.795 17.544 1.00 0.00 C ATOM 1080 C GLY A 70 -5.180 -24.666 16.369 1.00 0.00 C ATOM 1081 O GLY A 70 -6.236 -25.267 16.357 1.00 0.00 O ATOM 0 H GLY A 70 -2.341 -23.778 17.735 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -3.598 -25.691 17.427 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -4.762 -24.907 18.476 1.00 0.00 H new ATOM 1085 N GLY A 71 -4.832 -23.888 15.379 1.00 0.00 N ATOM 1086 CA GLY A 71 -5.739 -23.726 14.208 1.00 0.00 C ATOM 1087 C GLY A 71 -6.422 -22.359 14.268 1.00 0.00 C ATOM 1088 O GLY A 71 -7.175 -21.992 13.388 1.00 0.00 O ATOM 0 H GLY A 71 -3.961 -23.359 15.331 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -5.172 -23.819 13.282 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.488 -24.518 14.204 1.00 0.00 H new ATOM 1092 N SER A 72 -6.163 -21.599 15.296 1.00 0.00 N ATOM 1093 CA SER A 72 -6.799 -20.255 15.407 1.00 0.00 C ATOM 1094 C SER A 72 -5.860 -19.184 14.848 1.00 0.00 C ATOM 1095 O SER A 72 -4.656 -19.344 14.838 1.00 0.00 O ATOM 1096 CB SER A 72 -7.025 -20.043 16.903 1.00 0.00 C ATOM 1097 OG SER A 72 -8.288 -20.582 17.268 1.00 0.00 O ATOM 0 H SER A 72 -5.539 -21.850 16.063 1.00 0.00 H new ATOM 0 HA SER A 72 -7.730 -20.190 14.844 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.232 -20.526 17.474 1.00 0.00 H new ATOM 0 HB3 SER A 72 -6.988 -18.980 17.141 1.00 0.00 H new ATOM 0 HG SER A 72 -8.435 -20.449 18.228 1.00 0.00 H new ATOM 1103 N PHE A 73 -6.402 -18.092 14.382 1.00 0.00 N ATOM 1104 CA PHE A 73 -5.539 -17.013 13.820 1.00 0.00 C ATOM 1105 C PHE A 73 -5.609 -15.764 14.703 1.00 0.00 C ATOM 1106 O PHE A 73 -6.675 -15.267 14.995 1.00 0.00 O ATOM 1107 CB PHE A 73 -6.128 -16.725 12.440 1.00 0.00 C ATOM 1108 CG PHE A 73 -5.041 -16.818 11.398 1.00 0.00 C ATOM 1109 CD1 PHE A 73 -4.213 -17.946 11.349 1.00 0.00 C ATOM 1110 CD2 PHE A 73 -4.860 -15.776 10.483 1.00 0.00 C ATOM 1111 CE1 PHE A 73 -3.203 -18.031 10.383 1.00 0.00 C ATOM 1112 CE2 PHE A 73 -3.851 -15.860 9.518 1.00 0.00 C ATOM 1113 CZ PHE A 73 -3.023 -16.987 9.468 1.00 0.00 C ATOM 0 H PHE A 73 -7.404 -17.900 14.366 1.00 0.00 H new ATOM 0 HA PHE A 73 -4.490 -17.305 13.768 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -6.922 -17.437 12.216 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.577 -15.732 12.425 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.353 -18.750 12.056 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.499 -14.906 10.521 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -2.564 -18.901 10.344 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.711 -15.055 8.812 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.244 -17.051 8.723 1.00 0.00 H new ATOM 1123 N SER A 74 -4.485 -15.253 15.128 1.00 0.00 N ATOM 1124 CA SER A 74 -4.502 -14.035 15.991 1.00 0.00 C ATOM 1125 C SER A 74 -3.176 -13.275 15.874 1.00 0.00 C ATOM 1126 O SER A 74 -2.129 -13.860 15.687 1.00 0.00 O ATOM 1127 CB SER A 74 -4.694 -14.560 17.413 1.00 0.00 C ATOM 1128 OG SER A 74 -5.224 -15.877 17.359 1.00 0.00 O ATOM 0 H SER A 74 -3.559 -15.624 14.916 1.00 0.00 H new ATOM 0 HA SER A 74 -5.289 -13.339 15.701 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.742 -14.560 17.945 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.368 -13.907 17.966 1.00 0.00 H new ATOM 0 HG SER A 74 -5.347 -16.218 18.270 1.00 0.00 H new ATOM 1134 N LEU A 75 -3.214 -11.973 15.988 1.00 0.00 N ATOM 1135 CA LEU A 75 -1.955 -11.177 15.890 1.00 0.00 C ATOM 1136 C LEU A 75 -1.170 -11.277 17.200 1.00 0.00 C ATOM 1137 O LEU A 75 -0.014 -10.910 17.272 1.00 0.00 O ATOM 1138 CB LEU A 75 -2.411 -9.737 15.646 1.00 0.00 C ATOM 1139 CG LEU A 75 -1.262 -8.931 15.033 1.00 0.00 C ATOM 1140 CD1 LEU A 75 -0.877 -9.532 13.679 1.00 0.00 C ATOM 1141 CD2 LEU A 75 -1.704 -7.480 14.834 1.00 0.00 C ATOM 0 H LEU A 75 -4.061 -11.427 16.145 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.300 -11.534 15.095 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.273 -9.726 14.979 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.728 -9.281 16.584 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.403 -8.963 15.703 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.059 -8.957 13.245 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.560 -10.566 13.817 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.737 -9.502 13.010 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.886 -6.907 14.398 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.565 -7.450 14.166 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.977 -7.048 15.797 1.00 0.00 H new ATOM 1384 N VAL A 91 -7.755 -12.527 13.072 1.00 0.00 N ATOM 1385 CA VAL A 91 -7.161 -11.404 12.296 1.00 0.00 C ATOM 1386 C VAL A 91 -8.199 -10.291 12.152 1.00 0.00 C ATOM 1387 O VAL A 91 -7.871 -9.123 12.115 1.00 0.00 O ATOM 1388 CB VAL A 91 -6.784 -11.980 10.928 1.00 0.00 C ATOM 1389 CG1 VAL A 91 -8.039 -12.132 10.068 1.00 0.00 C ATOM 1390 CG2 VAL A 91 -5.806 -11.025 10.247 1.00 0.00 C ATOM 0 HA VAL A 91 -6.285 -10.980 12.787 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.321 -12.959 11.053 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.766 -12.542 9.096 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.739 -12.805 10.562 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.507 -11.157 9.932 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.529 -11.423 9.271 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -6.277 -10.050 10.121 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.913 -10.919 10.863 1.00 0.00 H new ATOM 1400 N LEU A 92 -9.456 -10.642 12.093 1.00 0.00 N ATOM 1401 CA LEU A 92 -10.508 -9.594 11.981 1.00 0.00 C ATOM 1402 C LEU A 92 -10.406 -8.667 13.191 1.00 0.00 C ATOM 1403 O LEU A 92 -10.416 -7.459 13.068 1.00 0.00 O ATOM 1404 CB LEU A 92 -11.835 -10.355 11.987 1.00 0.00 C ATOM 1405 CG LEU A 92 -12.172 -10.805 10.566 1.00 0.00 C ATOM 1406 CD1 LEU A 92 -11.140 -11.834 10.098 1.00 0.00 C ATOM 1407 CD2 LEU A 92 -13.565 -11.439 10.549 1.00 0.00 C ATOM 0 H LEU A 92 -9.797 -11.603 12.117 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.411 -8.982 11.084 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.767 -11.220 12.647 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.630 -9.718 12.376 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.155 -9.943 9.899 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.380 -12.155 9.084 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.147 -11.385 10.111 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.157 -12.696 10.765 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -13.806 -11.760 9.536 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -13.581 -12.301 11.216 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.302 -10.708 10.883 1.00 0.00 H new ATOM 1419 N LYS A 93 -10.280 -9.233 14.360 1.00 0.00 N ATOM 1420 CA LYS A 93 -10.144 -8.403 15.589 1.00 0.00 C ATOM 1421 C LYS A 93 -8.806 -7.662 15.549 1.00 0.00 C ATOM 1422 O LYS A 93 -8.665 -6.573 16.070 1.00 0.00 O ATOM 1423 CB LYS A 93 -10.178 -9.398 16.751 1.00 0.00 C ATOM 1424 CG LYS A 93 -10.724 -8.706 18.000 1.00 0.00 C ATOM 1425 CD LYS A 93 -12.253 -8.701 17.955 1.00 0.00 C ATOM 1426 CE LYS A 93 -12.785 -7.556 18.820 1.00 0.00 C ATOM 1427 NZ LYS A 93 -14.109 -7.212 18.230 1.00 0.00 N ATOM 0 H LYS A 93 -10.265 -10.241 14.517 1.00 0.00 H new ATOM 0 HA LYS A 93 -10.931 -7.655 15.684 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -10.803 -10.253 16.493 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -9.176 -9.782 16.944 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.378 -9.223 18.895 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.348 -7.684 18.056 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -12.597 -8.585 16.927 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -12.641 -9.654 18.315 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -12.884 -7.861 19.862 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -12.110 -6.700 18.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -14.351 -6.229 18.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -14.066 -7.316 17.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -14.836 -7.851 18.612 1.00 0.00 H new ATOM 1441 N LEU A 94 -7.823 -8.256 14.928 1.00 0.00 N ATOM 1442 CA LEU A 94 -6.484 -7.608 14.838 1.00 0.00 C ATOM 1443 C LEU A 94 -6.609 -6.249 14.145 1.00 0.00 C ATOM 1444 O LEU A 94 -5.908 -5.312 14.470 1.00 0.00 O ATOM 1445 CB LEU A 94 -5.633 -8.580 14.007 1.00 0.00 C ATOM 1446 CG LEU A 94 -4.673 -7.802 13.101 1.00 0.00 C ATOM 1447 CD1 LEU A 94 -3.544 -8.727 12.641 1.00 0.00 C ATOM 1448 CD2 LEU A 94 -5.430 -7.283 11.877 1.00 0.00 C ATOM 0 H LEU A 94 -7.891 -9.168 14.477 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.038 -7.420 15.815 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.068 -9.237 14.668 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.280 -9.216 13.403 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.256 -6.961 13.655 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.861 -8.174 11.996 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.002 -9.099 13.510 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.964 -9.567 12.088 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.746 -6.730 11.234 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.848 -8.124 11.324 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.236 -6.625 12.200 1.00 0.00 H new ATOM 1460 N VAL A 95 -7.496 -6.132 13.195 1.00 0.00 N ATOM 1461 CA VAL A 95 -7.653 -4.826 12.493 1.00 0.00 C ATOM 1462 C VAL A 95 -7.914 -3.724 13.522 1.00 0.00 C ATOM 1463 O VAL A 95 -7.427 -2.618 13.395 1.00 0.00 O ATOM 1464 CB VAL A 95 -8.859 -5.000 11.564 1.00 0.00 C ATOM 1465 CG1 VAL A 95 -8.767 -6.349 10.848 1.00 0.00 C ATOM 1466 CG2 VAL A 95 -10.151 -4.947 12.383 1.00 0.00 C ATOM 0 H VAL A 95 -8.115 -6.878 12.876 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.762 -4.545 11.932 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.862 -4.197 10.827 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.626 -6.470 10.188 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -7.850 -6.387 10.260 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.760 -7.152 11.585 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -11.007 -5.071 11.720 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -10.146 -5.747 13.123 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.221 -3.985 12.890 1.00 0.00 H new ATOM 1476 N HIS A 96 -8.661 -4.019 14.551 1.00 0.00 N ATOM 1477 CA HIS A 96 -8.927 -2.987 15.592 1.00 0.00 C ATOM 1478 C HIS A 96 -7.594 -2.457 16.122 1.00 0.00 C ATOM 1479 O HIS A 96 -7.384 -1.266 16.226 1.00 0.00 O ATOM 1480 CB HIS A 96 -9.695 -3.718 16.693 1.00 0.00 C ATOM 1481 CG HIS A 96 -10.931 -4.347 16.110 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -11.585 -5.520 16.395 1.00 0.00 N flip ATOM 1483 CD2 HIS A 96 -11.652 -3.751 15.087 1.00 0.00 C flip ATOM 1484 CE1 HIS A 96 -12.695 -5.651 15.565 1.00 0.00 C flip ATOM 1485 NE2 HIS A 96 -12.688 -4.558 14.796 1.00 0.00 N flip ATOM 0 H HIS A 96 -9.097 -4.926 14.715 1.00 0.00 H new ATOM 0 HA HIS A 96 -9.492 -2.136 15.212 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -9.064 -4.483 17.145 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -9.968 -3.021 17.485 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -11.423 -2.809 14.610 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -13.408 -6.462 15.547 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -13.383 -4.360 14.076 1.00 0.00 H new ATOM 1493 N HIS A 97 -6.686 -3.340 16.441 1.00 0.00 N ATOM 1494 CA HIS A 97 -5.357 -2.894 16.944 1.00 0.00 C ATOM 1495 C HIS A 97 -4.666 -2.055 15.868 1.00 0.00 C ATOM 1496 O HIS A 97 -3.992 -1.086 16.154 1.00 0.00 O ATOM 1497 CB HIS A 97 -4.578 -4.185 17.205 1.00 0.00 C ATOM 1498 CG HIS A 97 -4.143 -4.232 18.646 1.00 0.00 C ATOM 1499 ND1 HIS A 97 -2.938 -4.536 19.234 1.00 0.00 N flip ATOM 1500 CD2 HIS A 97 -5.011 -3.947 19.688 1.00 0.00 C flip ATOM 1501 CE1 HIS A 97 -3.056 -4.440 20.617 1.00 0.00 C flip ATOM 1502 NE2 HIS A 97 -4.324 -4.083 20.837 1.00 0.00 N flip ATOM 0 H HIS A 97 -6.808 -4.350 16.375 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.428 -2.281 17.842 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.200 -5.050 16.974 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.708 -4.235 16.550 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -2.087 -4.793 18.733 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.050 -3.667 19.595 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -2.287 -4.616 21.355 1.00 0.00 H new ATOM 1510 N TYR A 98 -4.840 -2.422 14.625 1.00 0.00 N ATOM 1511 CA TYR A 98 -4.206 -1.651 13.518 1.00 0.00 C ATOM 1512 C TYR A 98 -4.798 -0.241 13.457 1.00 0.00 C ATOM 1513 O TYR A 98 -4.318 0.616 12.742 1.00 0.00 O ATOM 1514 CB TYR A 98 -4.550 -2.430 12.246 1.00 0.00 C ATOM 1515 CG TYR A 98 -3.554 -3.548 12.037 1.00 0.00 C ATOM 1516 CD1 TYR A 98 -2.256 -3.439 12.552 1.00 0.00 C ATOM 1517 CD2 TYR A 98 -3.930 -4.693 11.323 1.00 0.00 C ATOM 1518 CE1 TYR A 98 -1.336 -4.472 12.353 1.00 0.00 C ATOM 1519 CE2 TYR A 98 -3.007 -5.730 11.123 1.00 0.00 C ATOM 1520 CZ TYR A 98 -1.710 -5.618 11.639 1.00 0.00 C ATOM 1521 OH TYR A 98 -0.800 -6.637 11.444 1.00 0.00 O ATOM 0 H TYR A 98 -5.396 -3.225 14.330 1.00 0.00 H new ATOM 0 HA TYR A 98 -3.130 -1.542 13.651 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -5.557 -2.839 12.322 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -4.542 -1.760 11.386 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -1.966 -2.557 13.103 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.931 -4.777 10.926 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.335 -4.387 12.750 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -3.296 -6.613 10.572 1.00 0.00 H new ATOM 0 HH TYR A 98 0.030 -6.268 11.075 1.00 0.00 H new ATOM 1531 N MET A 99 -5.841 0.003 14.201 1.00 0.00 N ATOM 1532 CA MET A 99 -6.468 1.355 14.189 1.00 0.00 C ATOM 1533 C MET A 99 -7.452 1.491 15.354 1.00 0.00 C ATOM 1534 O MET A 99 -8.454 0.805 15.404 1.00 0.00 O ATOM 1535 CB MET A 99 -7.205 1.438 12.851 1.00 0.00 C ATOM 1536 CG MET A 99 -8.336 0.408 12.826 1.00 0.00 C ATOM 1537 SD MET A 99 -8.714 -0.030 11.112 1.00 0.00 S ATOM 1538 CE MET A 99 -10.467 0.420 11.144 1.00 0.00 C ATOM 0 H MET A 99 -6.287 -0.676 14.818 1.00 0.00 H new ATOM 0 HA MET A 99 -5.733 2.153 14.299 1.00 0.00 H new ATOM 0 HB2 MET A 99 -7.609 2.440 12.708 1.00 0.00 H new ATOM 0 HB3 MET A 99 -6.512 1.253 12.030 1.00 0.00 H new ATOM 0 HG2 MET A 99 -8.045 -0.482 13.384 1.00 0.00 H new ATOM 0 HG3 MET A 99 -9.223 0.814 13.313 1.00 0.00 H new ATOM 0 HE1 MET A 99 -10.910 0.227 10.167 1.00 0.00 H new ATOM 0 HE2 MET A 99 -10.981 -0.174 11.899 1.00 0.00 H new ATOM 0 HE3 MET A 99 -10.567 1.478 11.385 1.00 0.00 H new ATOM 2022 N ARG A 134 -7.368 -1.093 24.121 1.00 0.00 N ATOM 2023 CA ARG A 134 -6.867 -0.854 22.738 1.00 0.00 C ATOM 2024 C ARG A 134 -5.590 -0.010 22.777 1.00 0.00 C ATOM 2025 O ARG A 134 -5.477 0.929 23.540 1.00 0.00 O ATOM 2026 CB ARG A 134 -7.992 -0.095 22.035 1.00 0.00 C ATOM 2027 CG ARG A 134 -8.552 -0.949 20.896 1.00 0.00 C ATOM 2028 CD ARG A 134 -9.822 -0.298 20.345 1.00 0.00 C ATOM 2029 NE ARG A 134 -10.943 -1.068 20.952 1.00 0.00 N ATOM 2030 CZ ARG A 134 -12.179 -0.754 20.673 1.00 0.00 C ATOM 2031 NH1 ARG A 134 -12.435 0.237 19.862 1.00 0.00 N ATOM 2032 NH2 ARG A 134 -13.160 -1.431 21.204 1.00 0.00 N ATOM 0 HA ARG A 134 -6.618 -1.781 22.222 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.783 0.145 22.746 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -7.617 0.851 21.644 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -7.810 -1.050 20.104 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.773 -1.954 21.256 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -9.875 0.756 20.616 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -9.852 -0.349 19.257 1.00 0.00 H new ATOM 0 HE ARG A 134 -10.745 -1.842 21.586 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -11.669 0.766 19.446 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -13.401 0.482 19.645 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -12.961 -2.206 21.837 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -14.126 -1.186 20.986 1.00 0.00 H new ATOM 2046 N ALA A 135 -4.628 -0.335 21.958 1.00 0.00 N ATOM 2047 CA ALA A 135 -3.358 0.449 21.947 1.00 0.00 C ATOM 2048 C ALA A 135 -2.330 -0.223 21.040 1.00 0.00 C ATOM 2049 O ALA A 135 -1.835 -1.288 21.345 1.00 0.00 O ATOM 2050 CB ALA A 135 -2.863 0.433 23.397 1.00 0.00 C ATOM 0 H ALA A 135 -4.665 -1.109 21.295 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.509 1.462 21.574 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -1.930 0.991 23.469 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -3.612 0.893 24.042 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -2.695 -0.597 23.713 1.00 0.00 H new ATOM 2056 N TYR A 136 -1.983 0.389 19.938 1.00 0.00 N ATOM 2057 CA TYR A 136 -0.962 -0.240 19.056 1.00 0.00 C ATOM 2058 C TYR A 136 0.366 0.501 19.218 1.00 0.00 C ATOM 2059 O TYR A 136 0.452 1.693 19.004 1.00 0.00 O ATOM 2060 CB TYR A 136 -1.498 -0.078 17.628 1.00 0.00 C ATOM 2061 CG TYR A 136 -1.243 -1.347 16.846 1.00 0.00 C ATOM 2062 CD1 TYR A 136 -1.694 -2.573 17.344 1.00 0.00 C ATOM 2063 CD2 TYR A 136 -0.553 -1.301 15.625 1.00 0.00 C ATOM 2064 CE1 TYR A 136 -1.457 -3.751 16.628 1.00 0.00 C ATOM 2065 CE2 TYR A 136 -0.316 -2.481 14.909 1.00 0.00 C ATOM 2066 CZ TYR A 136 -0.769 -3.705 15.413 1.00 0.00 C ATOM 2067 OH TYR A 136 -0.535 -4.869 14.713 1.00 0.00 O ATOM 0 H TYR A 136 -2.356 1.282 19.616 1.00 0.00 H new ATOM 0 HA TYR A 136 -0.789 -1.289 19.297 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.566 0.139 17.652 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -1.012 0.767 17.139 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.226 -2.611 18.283 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -0.205 -0.355 15.237 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -1.806 -4.697 17.015 1.00 0.00 H new ATOM 0 HE2 TYR A 136 0.215 -2.446 13.969 1.00 0.00 H new ATOM 0 HH TYR A 136 -1.133 -4.911 13.938 1.00 0.00 H new ATOM 2077 N TYR A 137 1.403 -0.198 19.586 1.00 0.00 N ATOM 2078 CA TYR A 137 2.724 0.464 19.751 1.00 0.00 C ATOM 2079 C TYR A 137 3.848 -0.565 19.616 1.00 0.00 C ATOM 2080 O TYR A 137 3.647 -1.748 19.803 1.00 0.00 O ATOM 2081 CB TYR A 137 2.682 1.117 21.132 1.00 0.00 C ATOM 2082 CG TYR A 137 3.065 0.141 22.203 1.00 0.00 C ATOM 2083 CD1 TYR A 137 4.379 -0.319 22.288 1.00 0.00 C ATOM 2084 CD2 TYR A 137 2.106 -0.285 23.124 1.00 0.00 C ATOM 2085 CE1 TYR A 137 4.739 -1.211 23.295 1.00 0.00 C ATOM 2086 CE2 TYR A 137 2.459 -1.180 24.132 1.00 0.00 C ATOM 2087 CZ TYR A 137 3.778 -1.647 24.222 1.00 0.00 C ATOM 2088 OH TYR A 137 4.131 -2.530 25.222 1.00 0.00 O ATOM 0 H TYR A 137 1.392 -1.199 19.779 1.00 0.00 H new ATOM 0 HA TYR A 137 2.921 1.214 18.985 1.00 0.00 H new ATOM 0 HB2 TYR A 137 3.359 1.971 21.155 1.00 0.00 H new ATOM 0 HB3 TYR A 137 1.680 1.500 21.326 1.00 0.00 H new ATOM 0 HD1 TYR A 137 5.116 0.016 21.574 1.00 0.00 H new ATOM 0 HD2 TYR A 137 1.091 0.079 23.055 1.00 0.00 H new ATOM 0 HE1 TYR A 137 5.756 -1.567 23.363 1.00 0.00 H new ATOM 0 HE2 TYR A 137 1.718 -1.514 24.843 1.00 0.00 H new ATOM 0 HH TYR A 137 4.783 -3.174 24.875 1.00 0.00 H new ATOM 2098 N ILE A 138 5.024 -0.124 19.266 1.00 0.00 N ATOM 2099 CA ILE A 138 6.153 -1.074 19.085 1.00 0.00 C ATOM 2100 C ILE A 138 7.085 -1.000 20.283 1.00 0.00 C ATOM 2101 O ILE A 138 7.223 0.030 20.912 1.00 0.00 O ATOM 2102 CB ILE A 138 6.862 -0.607 17.811 1.00 0.00 C ATOM 2103 CG1 ILE A 138 6.235 -1.300 16.599 1.00 0.00 C ATOM 2104 CG2 ILE A 138 8.349 -0.964 17.882 1.00 0.00 C ATOM 2105 CD1 ILE A 138 6.231 -0.340 15.407 1.00 0.00 C ATOM 0 H ILE A 138 5.251 0.856 19.097 1.00 0.00 H new ATOM 0 HA ILE A 138 5.822 -2.109 19.004 1.00 0.00 H new ATOM 0 HB ILE A 138 6.755 0.474 17.717 1.00 0.00 H new ATOM 0 HG12 ILE A 138 6.796 -2.201 16.352 1.00 0.00 H new ATOM 0 HG13 ILE A 138 5.217 -1.612 16.832 1.00 0.00 H new ATOM 0 HG21 ILE A 138 8.847 -0.629 16.972 1.00 0.00 H new ATOM 0 HG22 ILE A 138 8.800 -0.474 18.745 1.00 0.00 H new ATOM 0 HG23 ILE A 138 8.460 -2.044 17.980 1.00 0.00 H new ATOM 0 HD11 ILE A 138 5.784 -0.834 14.544 1.00 0.00 H new ATOM 0 HD12 ILE A 138 5.651 0.548 15.657 1.00 0.00 H new ATOM 0 HD13 ILE A 138 7.255 -0.050 15.170 1.00 0.00 H new ATOM 2117 N TYR A 139 7.724 -2.080 20.614 1.00 0.00 N ATOM 2118 CA TYR A 139 8.637 -2.044 21.779 1.00 0.00 C ATOM 2119 C TYR A 139 10.019 -1.543 21.354 1.00 0.00 C ATOM 2120 O TYR A 139 10.580 -1.995 20.374 1.00 0.00 O ATOM 2121 CB TYR A 139 8.720 -3.488 22.276 1.00 0.00 C ATOM 2122 CG TYR A 139 7.405 -3.890 22.897 1.00 0.00 C ATOM 2123 CD1 TYR A 139 6.362 -4.359 22.088 1.00 0.00 C ATOM 2124 CD2 TYR A 139 7.230 -3.799 24.283 1.00 0.00 C ATOM 2125 CE1 TYR A 139 5.145 -4.736 22.665 1.00 0.00 C ATOM 2126 CE2 TYR A 139 6.011 -4.176 24.860 1.00 0.00 C ATOM 2127 CZ TYR A 139 4.969 -4.646 24.051 1.00 0.00 C ATOM 2128 OH TYR A 139 3.768 -5.017 24.620 1.00 0.00 O ATOM 0 H TYR A 139 7.655 -2.977 20.134 1.00 0.00 H new ATOM 0 HA TYR A 139 8.279 -1.370 22.557 1.00 0.00 H new ATOM 0 HB2 TYR A 139 8.960 -4.154 21.448 1.00 0.00 H new ATOM 0 HB3 TYR A 139 9.523 -3.585 23.007 1.00 0.00 H new ATOM 0 HD1 TYR A 139 6.498 -4.429 21.019 1.00 0.00 H new ATOM 0 HD2 TYR A 139 8.035 -3.438 24.907 1.00 0.00 H new ATOM 0 HE1 TYR A 139 4.341 -5.097 22.041 1.00 0.00 H new ATOM 0 HE2 TYR A 139 5.874 -4.104 25.929 1.00 0.00 H new ATOM 0 HH TYR A 139 3.380 -4.252 25.093 1.00 0.00 H new ATOM 2138 N SER A 140 10.574 -0.612 22.079 1.00 0.00 N ATOM 2139 CA SER A 140 11.920 -0.086 21.715 1.00 0.00 C ATOM 2140 C SER A 140 13.007 -0.819 22.506 1.00 0.00 C ATOM 2141 O SER A 140 13.765 -0.218 23.241 1.00 0.00 O ATOM 2142 CB SER A 140 11.884 1.393 22.097 1.00 0.00 C ATOM 2143 OG SER A 140 13.211 1.856 22.307 1.00 0.00 O ATOM 0 H SER A 140 10.154 -0.192 22.908 1.00 0.00 H new ATOM 0 HA SER A 140 12.147 -0.228 20.658 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.405 1.973 21.308 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.290 1.533 23.000 1.00 0.00 H new ATOM 0 HG SER A 140 13.677 1.247 22.917 1.00 0.00 H new ATOM 2149 N GLY A 141 13.086 -2.114 22.362 1.00 0.00 N ATOM 2150 CA GLY A 141 14.123 -2.883 23.107 1.00 0.00 C ATOM 2151 C GLY A 141 13.915 -2.696 24.612 1.00 0.00 C ATOM 2152 O GLY A 141 14.816 -2.307 25.329 1.00 0.00 O ATOM 0 H GLY A 141 12.478 -2.672 21.762 1.00 0.00 H new ATOM 0 HA2 GLY A 141 14.062 -3.940 22.849 1.00 0.00 H new ATOM 0 HA3 GLY A 141 15.118 -2.542 22.822 1.00 0.00 H new ATOM 2156 N GLY A 142 12.734 -2.969 25.095 1.00 0.00 N ATOM 2157 CA GLY A 142 12.470 -2.806 26.552 1.00 0.00 C ATOM 2158 C GLY A 142 11.783 -1.462 26.800 1.00 0.00 C ATOM 2159 O GLY A 142 11.486 -1.104 27.923 1.00 0.00 O ATOM 0 H GLY A 142 11.941 -3.298 24.544 1.00 0.00 H new ATOM 0 HA2 GLY A 142 11.840 -3.620 26.911 1.00 0.00 H new ATOM 0 HA3 GLY A 142 13.405 -2.857 27.110 1.00 0.00 H new ATOM 2163 N GLU A 143 11.527 -0.714 25.762 1.00 0.00 N ATOM 2164 CA GLU A 143 10.859 0.607 25.940 1.00 0.00 C ATOM 2165 C GLU A 143 9.533 0.639 25.174 1.00 0.00 C ATOM 2166 O GLU A 143 9.489 0.417 23.981 1.00 0.00 O ATOM 2167 CB GLU A 143 11.840 1.626 25.359 1.00 0.00 C ATOM 2168 CG GLU A 143 12.861 2.020 26.428 1.00 0.00 C ATOM 2169 CD GLU A 143 12.268 3.111 27.323 1.00 0.00 C ATOM 2170 OE1 GLU A 143 11.055 3.161 27.436 1.00 0.00 O ATOM 2171 OE2 GLU A 143 13.038 3.877 27.878 1.00 0.00 O ATOM 0 H GLU A 143 11.751 -0.960 24.798 1.00 0.00 H new ATOM 0 HA GLU A 143 10.625 0.815 26.984 1.00 0.00 H new ATOM 0 HB2 GLU A 143 12.349 1.203 24.493 1.00 0.00 H new ATOM 0 HB3 GLU A 143 11.302 2.508 25.013 1.00 0.00 H new ATOM 0 HG2 GLU A 143 13.130 1.150 27.027 1.00 0.00 H new ATOM 0 HG3 GLU A 143 13.776 2.379 25.957 1.00 0.00 H new ATOM 2178 N LYS A 144 8.454 0.913 25.853 1.00 0.00 N ATOM 2179 CA LYS A 144 7.130 0.958 25.166 1.00 0.00 C ATOM 2180 C LYS A 144 7.042 2.189 24.259 1.00 0.00 C ATOM 2181 O LYS A 144 7.125 3.315 24.711 1.00 0.00 O ATOM 2182 CB LYS A 144 6.102 1.048 26.294 1.00 0.00 C ATOM 2183 CG LYS A 144 6.204 -0.196 27.180 1.00 0.00 C ATOM 2184 CD LYS A 144 5.322 -0.016 28.417 1.00 0.00 C ATOM 2185 CE LYS A 144 5.932 1.052 29.327 1.00 0.00 C ATOM 2186 NZ LYS A 144 5.923 0.447 30.689 1.00 0.00 N ATOM 0 H LYS A 144 8.430 1.108 26.854 1.00 0.00 H new ATOM 0 HA LYS A 144 6.965 0.087 24.532 1.00 0.00 H new ATOM 0 HB2 LYS A 144 6.276 1.945 26.888 1.00 0.00 H new ATOM 0 HB3 LYS A 144 5.097 1.130 25.879 1.00 0.00 H new ATOM 0 HG2 LYS A 144 5.891 -1.079 26.623 1.00 0.00 H new ATOM 0 HG3 LYS A 144 7.239 -0.358 27.479 1.00 0.00 H new ATOM 0 HD2 LYS A 144 4.315 0.276 28.119 1.00 0.00 H new ATOM 0 HD3 LYS A 144 5.234 -0.960 28.955 1.00 0.00 H new ATOM 0 HE2 LYS A 144 6.945 1.306 29.014 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.350 1.973 29.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 6.327 1.121 31.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 4.945 0.222 30.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 6.491 -0.424 30.686 1.00 0.00 H new ATOM 2200 N ILE A 145 6.866 1.980 22.984 1.00 0.00 N ATOM 2201 CA ILE A 145 6.762 3.128 22.040 1.00 0.00 C ATOM 2202 C ILE A 145 5.388 3.101 21.372 1.00 0.00 C ATOM 2203 O ILE A 145 5.076 2.173 20.653 1.00 0.00 O ATOM 2204 CB ILE A 145 7.875 2.883 21.019 1.00 0.00 C ATOM 2205 CG1 ILE A 145 9.096 3.720 21.397 1.00 0.00 C ATOM 2206 CG2 ILE A 145 7.396 3.268 19.620 1.00 0.00 C ATOM 2207 CD1 ILE A 145 9.582 3.293 22.783 1.00 0.00 C ATOM 0 H ILE A 145 6.789 1.059 22.553 1.00 0.00 H new ATOM 0 HA ILE A 145 6.867 4.100 22.523 1.00 0.00 H new ATOM 0 HB ILE A 145 8.141 1.826 21.020 1.00 0.00 H new ATOM 0 HG12 ILE A 145 9.889 3.583 20.661 1.00 0.00 H new ATOM 0 HG13 ILE A 145 8.841 4.780 21.397 1.00 0.00 H new ATOM 0 HG21 ILE A 145 8.195 3.090 18.900 1.00 0.00 H new ATOM 0 HG22 ILE A 145 6.527 2.666 19.354 1.00 0.00 H new ATOM 0 HG23 ILE A 145 7.124 4.323 19.606 1.00 0.00 H new ATOM 0 HD11 ILE A 145 10.454 3.885 23.061 1.00 0.00 H new ATOM 0 HD12 ILE A 145 8.787 3.452 23.512 1.00 0.00 H new ATOM 0 HD13 ILE A 145 9.852 2.237 22.765 1.00 0.00 H new ATOM 2219 N PRO A 146 4.599 4.111 21.642 1.00 0.00 N ATOM 2220 CA PRO A 146 3.232 4.164 21.065 1.00 0.00 C ATOM 2221 C PRO A 146 3.274 4.399 19.555 1.00 0.00 C ATOM 2222 O PRO A 146 3.833 5.367 19.078 1.00 0.00 O ATOM 2223 CB PRO A 146 2.598 5.355 21.783 1.00 0.00 C ATOM 2224 CG PRO A 146 3.750 6.208 22.207 1.00 0.00 C ATOM 2225 CD PRO A 146 4.897 5.273 22.483 1.00 0.00 C ATOM 0 HA PRO A 146 2.679 3.234 21.199 1.00 0.00 H new ATOM 0 HB2 PRO A 146 1.924 5.901 21.123 1.00 0.00 H new ATOM 0 HB3 PRO A 146 2.010 5.031 22.641 1.00 0.00 H new ATOM 0 HG2 PRO A 146 4.011 6.922 21.426 1.00 0.00 H new ATOM 0 HG3 PRO A 146 3.498 6.786 23.096 1.00 0.00 H new ATOM 0 HD2 PRO A 146 5.854 5.723 22.221 1.00 0.00 H new ATOM 0 HD3 PRO A 146 4.950 5.003 23.538 1.00 0.00 H new ATOM 2233 N LEU A 147 2.643 3.534 18.804 1.00 0.00 N ATOM 2234 CA LEU A 147 2.594 3.719 17.325 1.00 0.00 C ATOM 2235 C LEU A 147 1.135 3.665 16.866 1.00 0.00 C ATOM 2236 O LEU A 147 0.544 2.608 16.772 1.00 0.00 O ATOM 2237 CB LEU A 147 3.437 2.583 16.725 1.00 0.00 C ATOM 2238 CG LEU A 147 2.673 1.259 16.759 1.00 0.00 C ATOM 2239 CD1 LEU A 147 2.019 1.012 15.399 1.00 0.00 C ATOM 2240 CD2 LEU A 147 3.656 0.122 17.059 1.00 0.00 C ATOM 0 H LEU A 147 2.159 2.707 19.153 1.00 0.00 H new ATOM 0 HA LEU A 147 2.992 4.681 17.002 1.00 0.00 H new ATOM 0 HB2 LEU A 147 3.704 2.827 15.697 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.369 2.484 17.281 1.00 0.00 H new ATOM 0 HG LEU A 147 1.904 1.299 17.531 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.474 0.068 15.423 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.328 1.824 15.175 1.00 0.00 H new ATOM 0 HD13 LEU A 147 2.788 0.967 14.628 1.00 0.00 H new ATOM 0 HD21 LEU A 147 3.119 -0.826 17.085 1.00 0.00 H new ATOM 0 HD22 LEU A 147 4.419 0.086 16.281 1.00 0.00 H new ATOM 0 HD23 LEU A 147 4.131 0.297 18.025 1.00 0.00 H new ATOM 2252 N VAL A 148 0.536 4.790 16.600 1.00 0.00 N ATOM 2253 CA VAL A 148 -0.892 4.774 16.176 1.00 0.00 C ATOM 2254 C VAL A 148 -1.018 4.971 14.666 1.00 0.00 C ATOM 2255 O VAL A 148 -0.638 5.992 14.127 1.00 0.00 O ATOM 2256 CB VAL A 148 -1.537 5.943 16.919 1.00 0.00 C ATOM 2257 CG1 VAL A 148 -0.795 7.236 16.580 1.00 0.00 C ATOM 2258 CG2 VAL A 148 -3.002 6.071 16.495 1.00 0.00 C ATOM 0 H VAL A 148 0.967 5.713 16.657 1.00 0.00 H new ATOM 0 HA VAL A 148 -1.370 3.821 16.405 1.00 0.00 H new ATOM 0 HB VAL A 148 -1.483 5.764 17.993 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -1.256 8.070 17.110 1.00 0.00 H new ATOM 0 HG12 VAL A 148 0.249 7.146 16.881 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -0.848 7.415 15.506 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -3.463 6.905 17.025 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -3.056 6.249 15.421 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -3.533 5.150 16.737 1.00 0.00 H new ATOM 2268 N LEU A 149 -1.568 4.006 13.980 1.00 0.00 N ATOM 2269 CA LEU A 149 -1.738 4.148 12.505 1.00 0.00 C ATOM 2270 C LEU A 149 -2.922 5.077 12.219 1.00 0.00 C ATOM 2271 O LEU A 149 -4.053 4.768 12.539 1.00 0.00 O ATOM 2272 CB LEU A 149 -2.031 2.735 11.994 1.00 0.00 C ATOM 2273 CG LEU A 149 -1.150 1.724 12.733 1.00 0.00 C ATOM 2274 CD1 LEU A 149 -1.986 0.991 13.783 1.00 0.00 C ATOM 2275 CD2 LEU A 149 -0.593 0.710 11.732 1.00 0.00 C ATOM 0 H LEU A 149 -1.906 3.128 14.375 1.00 0.00 H new ATOM 0 HA LEU A 149 -0.859 4.574 12.021 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.083 2.494 12.146 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.843 2.680 10.922 1.00 0.00 H new ATOM 0 HG LEU A 149 -0.328 2.247 13.222 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.359 0.271 14.309 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.388 1.711 14.495 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -2.807 0.467 13.294 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.035 -0.011 12.256 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.417 0.188 11.246 1.00 0.00 H new ATOM 0 HD23 LEU A 149 0.001 1.230 10.980 1.00 0.00 H new ATOM 2287 N SER A 150 -2.674 6.217 11.633 1.00 0.00 N ATOM 2288 CA SER A 150 -3.793 7.162 11.349 1.00 0.00 C ATOM 2289 C SER A 150 -3.986 7.344 9.841 1.00 0.00 C ATOM 2290 O SER A 150 -5.080 7.592 9.374 1.00 0.00 O ATOM 2291 CB SER A 150 -3.369 8.480 11.996 1.00 0.00 C ATOM 2292 OG SER A 150 -4.507 9.109 12.569 1.00 0.00 O ATOM 0 H SER A 150 -1.750 6.534 11.340 1.00 0.00 H new ATOM 0 HA SER A 150 -4.742 6.796 11.740 1.00 0.00 H new ATOM 0 HB2 SER A 150 -2.616 8.297 12.762 1.00 0.00 H new ATOM 0 HB3 SER A 150 -2.914 9.134 11.252 1.00 0.00 H new ATOM 0 HG SER A 150 -4.238 9.954 12.986 1.00 0.00 H new ATOM 2298 N ARG A 151 -2.938 7.231 9.073 1.00 0.00 N ATOM 2299 CA ARG A 151 -3.082 7.407 7.599 1.00 0.00 C ATOM 2300 C ARG A 151 -3.490 6.084 6.946 1.00 0.00 C ATOM 2301 O ARG A 151 -2.824 5.081 7.102 1.00 0.00 O ATOM 2302 CB ARG A 151 -1.700 7.844 7.114 1.00 0.00 C ATOM 2303 CG ARG A 151 -1.853 8.901 6.020 1.00 0.00 C ATOM 2304 CD ARG A 151 -2.004 8.215 4.661 1.00 0.00 C ATOM 2305 NE ARG A 151 -3.078 8.974 3.963 1.00 0.00 N ATOM 2306 CZ ARG A 151 -3.195 8.899 2.665 1.00 0.00 C ATOM 2307 NH1 ARG A 151 -2.372 8.156 1.976 1.00 0.00 N ATOM 2308 NH2 ARG A 151 -4.136 9.567 2.055 1.00 0.00 N ATOM 0 H ARG A 151 -1.993 7.026 9.399 1.00 0.00 H new ATOM 0 HA ARG A 151 -3.851 8.136 7.343 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -1.122 8.247 7.946 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -1.149 6.985 6.730 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -2.724 9.525 6.222 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -0.984 9.559 6.012 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -1.071 8.244 4.098 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -2.274 7.165 4.777 1.00 0.00 H new ATOM 0 HE ARG A 151 -3.723 9.553 4.500 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -1.637 7.633 2.452 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -2.464 8.098 0.962 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -4.780 10.148 2.593 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -4.228 9.508 1.041 1.00 0.00 H new ATOM 2322 N PRO A 152 -4.581 6.133 6.229 1.00 0.00 N ATOM 2323 CA PRO A 152 -5.094 4.927 5.539 1.00 0.00 C ATOM 2324 C PRO A 152 -4.291 4.658 4.263 1.00 0.00 C ATOM 2325 O PRO A 152 -3.921 5.568 3.548 1.00 0.00 O ATOM 2326 CB PRO A 152 -6.534 5.297 5.199 1.00 0.00 C ATOM 2327 CG PRO A 152 -6.553 6.793 5.132 1.00 0.00 C ATOM 2328 CD PRO A 152 -5.433 7.305 6.004 1.00 0.00 C ATOM 0 HA PRO A 152 -5.019 4.024 6.144 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -6.839 4.857 4.250 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -7.224 4.929 5.958 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -6.423 7.132 4.104 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -7.513 7.179 5.476 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -4.883 8.108 5.513 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -5.813 7.707 6.944 1.00 0.00 H new ATOM 2336 N LEU A 153 -4.021 3.416 3.971 1.00 0.00 N ATOM 2337 CA LEU A 153 -3.245 3.093 2.740 1.00 0.00 C ATOM 2338 C LEU A 153 -4.004 3.566 1.497 1.00 0.00 C ATOM 2339 O LEU A 153 -5.203 3.755 1.522 1.00 0.00 O ATOM 2340 CB LEU A 153 -3.084 1.564 2.747 1.00 0.00 C ATOM 2341 CG LEU A 153 -4.397 0.863 2.364 1.00 0.00 C ATOM 2342 CD1 LEU A 153 -5.559 1.423 3.189 1.00 0.00 C ATOM 2343 CD2 LEU A 153 -4.682 1.070 0.874 1.00 0.00 C ATOM 0 H LEU A 153 -4.304 2.611 4.530 1.00 0.00 H new ATOM 0 HA LEU A 153 -2.276 3.592 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -2.298 1.276 2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -2.768 1.234 3.737 1.00 0.00 H new ATOM 0 HG LEU A 153 -4.296 -0.203 2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -6.482 0.917 2.907 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -5.365 1.259 4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -5.658 2.492 2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -5.614 0.571 0.609 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -4.769 2.136 0.665 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -3.866 0.651 0.286 1.00 0.00 H new ATOM 2355 N SER A 154 -3.312 3.764 0.408 1.00 0.00 N ATOM 2356 CA SER A 154 -3.994 4.227 -0.834 1.00 0.00 C ATOM 2357 C SER A 154 -3.658 3.298 -2.004 1.00 0.00 C ATOM 2358 O SER A 154 -2.669 3.476 -2.685 1.00 0.00 O ATOM 2359 CB SER A 154 -3.443 5.629 -1.088 1.00 0.00 C ATOM 2360 OG SER A 154 -3.959 6.521 -0.109 1.00 0.00 O ATOM 0 H SER A 154 -2.305 3.625 0.325 1.00 0.00 H new ATOM 0 HA SER A 154 -5.079 4.227 -0.732 1.00 0.00 H new ATOM 0 HB2 SER A 154 -2.354 5.617 -1.048 1.00 0.00 H new ATOM 0 HB3 SER A 154 -3.721 5.966 -2.086 1.00 0.00 H new ATOM 0 HG SER A 154 -3.881 7.443 -0.433 1.00 0.00 H new ATOM 2510 N SER B 165 7.594 -7.882 15.995 1.00 0.00 N ATOM 2511 CA SER B 165 7.753 -7.397 17.395 1.00 0.00 C ATOM 2512 C SER B 165 6.383 -7.240 18.062 1.00 0.00 C ATOM 2513 O SER B 165 6.266 -6.684 19.136 1.00 0.00 O ATOM 2514 CB SER B 165 8.444 -6.040 17.266 1.00 0.00 C ATOM 2515 OG SER B 165 9.838 -6.241 17.074 1.00 0.00 O ATOM 0 HA SER B 165 8.326 -8.091 18.009 1.00 0.00 H new ATOM 0 HB2 SER B 165 8.026 -5.484 16.427 1.00 0.00 H new ATOM 0 HB3 SER B 165 8.271 -5.444 18.162 1.00 0.00 H new ATOM 0 HG SER B 165 9.980 -7.032 16.513 1.00 0.00 H new ATOM 2521 N THR B 166 5.347 -7.725 17.435 1.00 0.00 N ATOM 2522 CA THR B 166 3.989 -7.602 18.036 1.00 0.00 C ATOM 2523 C THR B 166 3.697 -6.139 18.382 1.00 0.00 C ATOM 2524 O THR B 166 4.573 -5.298 18.347 1.00 0.00 O ATOM 2525 CB THR B 166 4.038 -8.454 19.305 1.00 0.00 C ATOM 2526 OG1 THR B 166 5.000 -9.486 19.142 1.00 0.00 O ATOM 2527 CG2 THR B 166 2.663 -9.072 19.563 1.00 0.00 C ATOM 0 H THR B 166 5.382 -8.201 16.533 1.00 0.00 H new ATOM 0 HA THR B 166 3.204 -7.931 17.355 1.00 0.00 H new ATOM 0 HB THR B 166 4.315 -7.827 20.153 1.00 0.00 H new ATOM 0 HG1 THR B 166 5.034 -10.032 19.955 1.00 0.00 H new ATOM 0 HG21 THR B 166 2.701 -9.679 20.468 1.00 0.00 H new ATOM 0 HG22 THR B 166 1.925 -8.279 19.688 1.00 0.00 H new ATOM 0 HG23 THR B 166 2.381 -9.699 18.717 1.00 0.00 H new ATOM 2535 N VAL B 167 2.475 -5.829 18.715 1.00 0.00 N ATOM 2536 CA VAL B 167 2.133 -4.418 19.063 1.00 0.00 C ATOM 2537 C VAL B 167 1.442 -4.364 20.426 1.00 0.00 C ATOM 2538 O VAL B 167 0.273 -4.672 20.551 1.00 0.00 O ATOM 2539 CB VAL B 167 1.176 -3.948 17.965 1.00 0.00 C ATOM 2540 CG1 VAL B 167 1.258 -2.428 17.829 1.00 0.00 C ATOM 2541 CG2 VAL B 167 1.559 -4.592 16.633 1.00 0.00 C ATOM 0 H VAL B 167 1.699 -6.489 18.762 1.00 0.00 H new ATOM 0 HA VAL B 167 3.020 -3.788 19.125 1.00 0.00 H new ATOM 0 HB VAL B 167 0.160 -4.239 18.231 1.00 0.00 H new ATOM 0 HG11 VAL B 167 0.576 -2.095 17.047 1.00 0.00 H new ATOM 0 HG12 VAL B 167 0.980 -1.963 18.775 1.00 0.00 H new ATOM 0 HG13 VAL B 167 2.277 -2.140 17.569 1.00 0.00 H new ATOM 0 HG21 VAL B 167 0.874 -4.254 15.855 1.00 0.00 H new ATOM 0 HG22 VAL B 167 2.577 -4.306 16.370 1.00 0.00 H new ATOM 0 HG23 VAL B 167 1.499 -5.677 16.723 1.00 0.00 H new ATOM 2551 N VAL B 168 2.150 -3.973 21.448 1.00 0.00 N ATOM 2552 CA VAL B 168 1.525 -3.898 22.800 1.00 0.00 C ATOM 2553 C VAL B 168 1.176 -5.304 23.297 1.00 0.00 C ATOM 2554 O VAL B 168 0.763 -6.156 22.537 1.00 0.00 O ATOM 2555 CB VAL B 168 0.256 -3.067 22.603 1.00 0.00 C ATOM 2556 CG1 VAL B 168 -0.174 -2.463 23.941 1.00 0.00 C ATOM 2557 CG2 VAL B 168 0.532 -1.941 21.603 1.00 0.00 C ATOM 0 H VAL B 168 3.133 -3.702 21.407 1.00 0.00 H new ATOM 0 HA VAL B 168 2.190 -3.455 23.541 1.00 0.00 H new ATOM 0 HB VAL B 168 -0.539 -3.707 22.221 1.00 0.00 H new ATOM 0 HG11 VAL B 168 -1.078 -1.871 23.799 1.00 0.00 H new ATOM 0 HG12 VAL B 168 -0.372 -3.263 24.654 1.00 0.00 H new ATOM 0 HG13 VAL B 168 0.622 -1.824 24.324 1.00 0.00 H new ATOM 0 HG21 VAL B 168 -0.372 -1.349 21.463 1.00 0.00 H new ATOM 0 HG22 VAL B 168 1.328 -1.302 21.985 1.00 0.00 H new ATOM 0 HG23 VAL B 168 0.837 -2.369 20.648 1.00 0.00 H new