USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1418 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 78 SER OG : rot 180:sc= -0.193 USER MOD Set 1.2: A 82 THR OG1 : rot -42:sc= 0.288 USER MOD Set 1.3: B 71 GLN : amide:sc= -1.13 K(o=-1,f=-4.1!) USER MOD Set 2.1: B 17 TYR OH : rot 38:sc= 0.359 USER MOD Set 2.2: B 38 ASN : amide:sc= -1.61! C(o=-1.3!,f=1.1!) USER MOD Set 3.1: A 71 GLN : amide:sc= -1.1 K(o=-0.96,f=-3.5!) USER MOD Set 3.2: B 78 SER OG : rot 180:sc= -0.185 USER MOD Set 3.3: B 82 THR OG1 : rot -38:sc= 0.332 USER MOD Set 4.1: A 17 TYR OH : rot 38:sc= 0.363 USER MOD Set 4.2: A 38 ASN : amide:sc= -1.58 K(o=-1.2,f=0.98) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ -130:sc= -0.0897 (180deg=-0.486) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 156:sc= -0.156 (180deg=-0.862) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -1.83 K(o=-1.8,f=-0.86) USER MOD Single : A 16 GLN : amide:sc= -0.365 K(o=-0.37,f=-2.7!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 151:sc= -0.188 (180deg=-0.973) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0654) USER MOD Single : A 28 LYS NZ :NH3+ 149:sc= -1.33 (180deg=-1.91) USER MOD Single : A 29 LYS NZ :NH3+ 166:sc= -0.191 (180deg=-0.698) USER MOD Single : A 30 SER OG : rot -109:sc= 1.08 USER MOD Single : A 33 LYS NZ :NH3+ 154:sc= -0.747 (180deg=-1.45) USER MOD Single : A 37 ASN : amide:sc= -0.0879 K(o=-0.088,f=1.1) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.0271 X(o=-0.027,f=-0.15) USER MOD Single : A 48 LYS NZ :NH3+ -153:sc= -0.0915 (180deg=-0.593) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 76:sc= 0.458 USER MOD Single : A 68 CYS SG : rot -44:sc= -0.0556 USER MOD Single : A 74 MET CE :methyl 172:sc= 0 (180deg=-0.0111) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 100:sc= 1.2 USER MOD Single : A 84 CYS SG : rot -15:sc= 0.198! USER MOD Single : A 85 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.13) USER MOD Single : A 90 HIS : no HD1:sc= -0.29 X(o=-0.29,f=-0.074) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ -130:sc= -0.0679 (180deg=-0.484) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 155:sc= -0.17 (180deg=-0.882) USER MOD Single : B 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= -1.86 K(o=-1.9,f=-0.89) USER MOD Single : B 16 GLN : amide:sc= -0.401 K(o=-0.4,f=-2.9!) USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 151:sc= -0.0914 (180deg=-0.809) USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 26 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0729) USER MOD Single : B 28 LYS NZ :NH3+ 153:sc= -1.34 (180deg=-1.95) USER MOD Single : B 29 LYS NZ :NH3+ 164:sc= -0.12 (180deg=-0.775) USER MOD Single : B 30 SER OG : rot -105:sc= 1.05 USER MOD Single : B 33 LYS NZ :NH3+ 157:sc= -0.732 (180deg=-1.42) USER MOD Single : B 37 ASN : amide:sc= -0.0934 K(o=-0.093,f=1.1) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.0437 X(o=-0.044,f=-0.16) USER MOD Single : B 48 LYS NZ :NH3+ -154:sc= -0.0934 (180deg=-0.603) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 80:sc= 0.501 USER MOD Single : B 68 CYS SG : rot -43:sc= -0.091 USER MOD Single : B 74 MET CE :methyl 169:sc= 0 (180deg=-0.00962) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 91:sc= 1.23 USER MOD Single : B 84 CYS SG : rot -13:sc= 0.219! USER MOD Single : B 85 HIS : no HD1:sc= -0.126 X(o=-0.13,f=-0.15) USER MOD Single : B 90 HIS : no HD1:sc= -0.293 X(o=-0.29,f=-0.069) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -11.197 6.759 13.320 1.00 0.00 N ATOM 2 CA MET A 0 -9.889 6.337 13.896 1.00 0.00 C ATOM 3 C MET A 0 -9.858 4.813 14.032 1.00 0.00 C ATOM 4 O MET A 0 -9.708 4.281 15.114 1.00 0.00 O ATOM 5 CB MET A 0 -9.709 6.974 15.275 1.00 0.00 C ATOM 6 CG MET A 0 -9.588 8.492 15.125 1.00 0.00 C ATOM 7 SD MET A 0 -9.466 9.251 16.763 1.00 0.00 S ATOM 8 CE MET A 0 -8.979 10.904 16.211 1.00 0.00 C ATOM 0 H1 MET A 0 -11.033 7.404 12.521 1.00 0.00 H new ATOM 0 H2 MET A 0 -11.716 5.921 12.988 1.00 0.00 H new ATOM 0 H3 MET A 0 -11.756 7.247 14.049 1.00 0.00 H new ATOM 0 HA MET A 0 -9.082 6.660 13.238 1.00 0.00 H new ATOM 0 HB2 MET A 0 -10.557 6.728 15.914 1.00 0.00 H new ATOM 0 HB3 MET A 0 -8.818 6.574 15.759 1.00 0.00 H new ATOM 0 HG2 MET A 0 -8.709 8.741 14.531 1.00 0.00 H new ATOM 0 HG3 MET A 0 -10.454 8.886 14.593 1.00 0.00 H new ATOM 0 HE1 MET A 0 -8.846 11.552 17.077 1.00 0.00 H new ATOM 0 HE2 MET A 0 -8.042 10.841 15.657 1.00 0.00 H new ATOM 0 HE3 MET A 0 -9.755 11.315 15.565 1.00 0.00 H new ATOM 20 N SER A 1 -9.996 4.106 12.944 1.00 0.00 N ATOM 21 CA SER A 1 -9.971 2.618 13.017 1.00 0.00 C ATOM 22 C SER A 1 -8.521 2.140 13.099 1.00 0.00 C ATOM 23 O SER A 1 -7.596 2.896 12.876 1.00 0.00 O ATOM 24 CB SER A 1 -10.628 2.035 11.766 1.00 0.00 C ATOM 25 OG SER A 1 -9.802 2.297 10.638 1.00 0.00 O ATOM 0 H SER A 1 -10.125 4.494 12.009 1.00 0.00 H new ATOM 0 HA SER A 1 -10.516 2.287 13.901 1.00 0.00 H new ATOM 0 HB2 SER A 1 -10.773 0.961 11.884 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.614 2.476 11.620 1.00 0.00 H new ATOM 0 HG SER A 1 -10.219 1.923 9.834 1.00 0.00 H new ATOM 31 N GLU A 2 -8.312 0.892 13.415 1.00 0.00 N ATOM 32 CA GLU A 2 -6.917 0.377 13.504 1.00 0.00 C ATOM 33 C GLU A 2 -6.191 0.669 12.191 1.00 0.00 C ATOM 34 O GLU A 2 -5.000 0.909 12.164 1.00 0.00 O ATOM 35 CB GLU A 2 -6.946 -1.134 13.746 1.00 0.00 C ATOM 36 CG GLU A 2 -7.420 -1.418 15.174 1.00 0.00 C ATOM 37 CD GLU A 2 -6.292 -1.109 16.160 1.00 0.00 C ATOM 38 OE1 GLU A 2 -5.265 -1.763 16.079 1.00 0.00 O ATOM 39 OE2 GLU A 2 -6.474 -0.225 16.981 1.00 0.00 O ATOM 0 H GLU A 2 -9.043 0.209 13.615 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.397 0.865 14.328 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -7.612 -1.614 13.029 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -5.953 -1.556 13.591 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -8.295 -0.811 15.405 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.722 -2.461 15.267 1.00 0.00 H new ATOM 46 N LEU A 3 -6.905 0.639 11.098 1.00 0.00 N ATOM 47 CA LEU A 3 -6.270 0.902 9.776 1.00 0.00 C ATOM 48 C LEU A 3 -5.703 2.328 9.747 1.00 0.00 C ATOM 49 O LEU A 3 -4.560 2.542 9.396 1.00 0.00 O ATOM 50 CB LEU A 3 -7.328 0.729 8.667 1.00 0.00 C ATOM 51 CG LEU A 3 -6.668 0.248 7.368 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.740 0.072 6.289 1.00 0.00 C ATOM 53 CD2 LEU A 3 -5.634 1.278 6.900 1.00 0.00 C ATOM 0 H LEU A 3 -7.905 0.443 11.065 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.454 0.198 9.612 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.084 0.011 8.986 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.840 1.675 8.493 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.169 -0.705 7.547 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.274 -0.270 5.365 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.472 -0.665 6.620 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.239 1.025 6.113 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.168 0.932 5.977 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.127 2.233 6.721 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.870 1.402 7.668 1.00 0.00 H new ATOM 65 N GLU A 4 -6.490 3.308 10.108 1.00 0.00 N ATOM 66 CA GLU A 4 -5.982 4.708 10.088 1.00 0.00 C ATOM 67 C GLU A 4 -4.696 4.798 10.913 1.00 0.00 C ATOM 68 O GLU A 4 -3.698 5.336 10.479 1.00 0.00 O ATOM 69 CB GLU A 4 -7.041 5.645 10.676 1.00 0.00 C ATOM 70 CG GLU A 4 -8.204 5.782 9.689 1.00 0.00 C ATOM 71 CD GLU A 4 -9.350 6.552 10.348 1.00 0.00 C ATOM 72 OE1 GLU A 4 -9.072 7.532 11.019 1.00 0.00 O ATOM 73 OE2 GLU A 4 -10.488 6.148 10.169 1.00 0.00 O ATOM 0 H GLU A 4 -7.457 3.199 10.414 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.771 5.004 9.060 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.401 5.253 11.627 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.605 6.623 10.879 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.872 6.303 8.791 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.547 4.796 9.377 1.00 0.00 H new ATOM 80 N LYS A 5 -4.722 4.263 12.103 1.00 0.00 N ATOM 81 CA LYS A 5 -3.516 4.294 12.979 1.00 0.00 C ATOM 82 C LYS A 5 -2.290 3.832 12.188 1.00 0.00 C ATOM 83 O LYS A 5 -1.208 4.371 12.313 1.00 0.00 O ATOM 84 CB LYS A 5 -3.732 3.329 14.150 1.00 0.00 C ATOM 85 CG LYS A 5 -4.724 3.937 15.145 1.00 0.00 C ATOM 86 CD LYS A 5 -4.879 3.000 16.345 1.00 0.00 C ATOM 87 CE LYS A 5 -5.983 3.522 17.266 1.00 0.00 C ATOM 88 NZ LYS A 5 -7.274 3.560 16.523 1.00 0.00 N ATOM 0 H LYS A 5 -5.535 3.801 12.510 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.357 5.309 13.342 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.110 2.375 13.782 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.783 3.126 14.646 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.372 4.914 15.476 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.690 4.092 14.664 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.122 1.994 16.004 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.938 2.933 16.891 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.074 2.880 18.142 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.729 4.519 17.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -8.064 3.512 17.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.336 4.445 15.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -7.324 2.750 15.873 1.00 0.00 H new ATOM 102 N ALA A 6 -2.464 2.818 11.387 1.00 0.00 N ATOM 103 CA ALA A 6 -1.335 2.268 10.583 1.00 0.00 C ATOM 104 C ALA A 6 -1.049 3.143 9.355 1.00 0.00 C ATOM 105 O ALA A 6 0.077 3.222 8.907 1.00 0.00 O ATOM 106 CB ALA A 6 -1.698 0.844 10.140 1.00 0.00 C ATOM 0 H ALA A 6 -3.355 2.339 11.253 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.434 2.256 11.196 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.882 0.427 9.550 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.866 0.221 11.019 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -2.605 0.871 9.536 1.00 0.00 H new ATOM 112 N MET A 7 -2.023 3.814 8.811 1.00 0.00 N ATOM 113 CA MET A 7 -1.725 4.675 7.631 1.00 0.00 C ATOM 114 C MET A 7 -0.741 5.767 8.077 1.00 0.00 C ATOM 115 O MET A 7 0.273 6.011 7.444 1.00 0.00 O ATOM 116 CB MET A 7 -3.034 5.307 7.099 1.00 0.00 C ATOM 117 CG MET A 7 -3.503 4.572 5.835 1.00 0.00 C ATOM 118 SD MET A 7 -2.528 5.142 4.417 1.00 0.00 S ATOM 119 CE MET A 7 -2.377 3.550 3.566 1.00 0.00 C ATOM 0 H MET A 7 -2.994 3.807 9.123 1.00 0.00 H new ATOM 0 HA MET A 7 -1.284 4.085 6.827 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.808 5.258 7.865 1.00 0.00 H new ATOM 0 HB3 MET A 7 -2.873 6.362 6.876 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.387 3.496 5.962 1.00 0.00 H new ATOM 0 HG3 MET A 7 -4.563 4.761 5.662 1.00 0.00 H new ATOM 0 HE1 MET A 7 -1.801 3.680 2.650 1.00 0.00 H new ATOM 0 HE2 MET A 7 -1.870 2.837 4.216 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.370 3.174 3.319 1.00 0.00 H new ATOM 129 N VAL A 8 -1.027 6.417 9.171 1.00 0.00 N ATOM 130 CA VAL A 8 -0.112 7.481 9.661 1.00 0.00 C ATOM 131 C VAL A 8 1.208 6.844 10.099 1.00 0.00 C ATOM 132 O VAL A 8 2.270 7.399 9.902 1.00 0.00 O ATOM 133 CB VAL A 8 -0.762 8.209 10.842 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.083 9.566 11.046 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.250 8.425 10.549 1.00 0.00 C ATOM 0 H VAL A 8 -1.855 6.256 9.745 1.00 0.00 H new ATOM 0 HA VAL A 8 0.082 8.200 8.865 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.649 7.608 11.744 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.547 10.082 11.887 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.977 9.415 11.253 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.195 10.168 10.144 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.715 8.943 11.388 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.360 9.026 9.646 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.736 7.460 10.404 1.00 0.00 H new ATOM 145 N ALA A 9 1.154 5.675 10.681 1.00 0.00 N ATOM 146 CA ALA A 9 2.412 5.007 11.110 1.00 0.00 C ATOM 147 C ALA A 9 3.317 4.843 9.889 1.00 0.00 C ATOM 148 O ALA A 9 4.487 5.157 9.927 1.00 0.00 O ATOM 149 CB ALA A 9 2.088 3.631 11.697 1.00 0.00 C ATOM 0 H ALA A 9 0.297 5.158 10.876 1.00 0.00 H new ATOM 0 HA ALA A 9 2.914 5.608 11.869 1.00 0.00 H new ATOM 0 HB1 ALA A 9 3.011 3.143 12.011 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.429 3.748 12.557 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.593 3.020 10.942 1.00 0.00 H new ATOM 155 N LEU A 10 2.789 4.346 8.809 1.00 0.00 N ATOM 156 CA LEU A 10 3.633 4.158 7.592 1.00 0.00 C ATOM 157 C LEU A 10 4.454 5.424 7.345 1.00 0.00 C ATOM 158 O LEU A 10 5.622 5.367 7.013 1.00 0.00 O ATOM 159 CB LEU A 10 2.724 3.916 6.378 1.00 0.00 C ATOM 160 CG LEU A 10 2.131 2.497 6.420 1.00 0.00 C ATOM 161 CD1 LEU A 10 1.109 2.354 5.287 1.00 0.00 C ATOM 162 CD2 LEU A 10 3.242 1.434 6.253 1.00 0.00 C ATOM 0 H LEU A 10 1.814 4.062 8.712 1.00 0.00 H new ATOM 0 HA LEU A 10 4.297 3.306 7.738 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.920 4.652 6.367 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.293 4.051 5.458 1.00 0.00 H new ATOM 0 HG LEU A 10 1.649 2.341 7.385 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.682 1.351 5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.315 3.089 5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.602 2.519 4.329 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.800 0.438 6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.742 1.578 5.295 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.967 1.536 7.060 1.00 0.00 H new ATOM 174 N ILE A 11 3.852 6.570 7.521 1.00 0.00 N ATOM 175 CA ILE A 11 4.603 7.840 7.313 1.00 0.00 C ATOM 176 C ILE A 11 5.713 7.931 8.364 1.00 0.00 C ATOM 177 O ILE A 11 6.829 8.318 8.079 1.00 0.00 O ATOM 178 CB ILE A 11 3.651 9.028 7.465 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.492 8.878 6.477 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.402 10.329 7.170 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.447 9.960 6.750 1.00 0.00 C ATOM 0 H ILE A 11 2.877 6.681 7.799 1.00 0.00 H new ATOM 0 HA ILE A 11 5.037 7.858 6.313 1.00 0.00 H new ATOM 0 HB ILE A 11 3.265 9.055 8.484 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.859 8.961 5.454 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.042 7.890 6.575 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.722 11.174 7.279 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.231 10.437 7.870 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.788 10.303 6.151 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.621 9.854 6.047 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.072 9.855 7.768 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.902 10.943 6.630 1.00 0.00 H new ATOM 193 N ASP A 12 5.404 7.568 9.581 1.00 0.00 N ATOM 194 CA ASP A 12 6.417 7.616 10.672 1.00 0.00 C ATOM 195 C ASP A 12 7.678 6.860 10.260 1.00 0.00 C ATOM 196 O ASP A 12 8.780 7.357 10.377 1.00 0.00 O ATOM 197 CB ASP A 12 5.843 6.943 11.922 1.00 0.00 C ATOM 198 CG ASP A 12 4.510 7.598 12.285 1.00 0.00 C ATOM 199 OD1 ASP A 12 3.959 8.282 11.438 1.00 0.00 O ATOM 200 OD2 ASP A 12 4.063 7.406 13.404 1.00 0.00 O ATOM 0 H ASP A 12 4.483 7.237 9.867 1.00 0.00 H new ATOM 0 HA ASP A 12 6.664 8.659 10.873 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.700 5.878 11.742 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.544 7.035 12.752 1.00 0.00 H new ATOM 205 N VAL A 13 7.523 5.642 9.805 1.00 0.00 N ATOM 206 CA VAL A 13 8.715 4.835 9.418 1.00 0.00 C ATOM 207 C VAL A 13 9.278 5.298 8.071 1.00 0.00 C ATOM 208 O VAL A 13 10.475 5.443 7.924 1.00 0.00 O ATOM 209 CB VAL A 13 8.336 3.353 9.360 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.510 2.539 8.810 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.994 2.868 10.770 1.00 0.00 C ATOM 0 H VAL A 13 6.624 5.175 9.686 1.00 0.00 H new ATOM 0 HA VAL A 13 9.492 4.977 10.170 1.00 0.00 H new ATOM 0 HB VAL A 13 7.474 3.223 8.706 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.235 1.485 8.771 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.756 2.887 7.807 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.376 2.664 9.460 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.723 1.813 10.736 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.859 3.000 11.420 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.156 3.445 11.160 1.00 0.00 H new ATOM 221 N PHE A 14 8.461 5.527 7.084 1.00 0.00 N ATOM 222 CA PHE A 14 9.034 5.967 5.781 1.00 0.00 C ATOM 223 C PHE A 14 9.893 7.211 6.017 1.00 0.00 C ATOM 224 O PHE A 14 10.902 7.424 5.371 1.00 0.00 O ATOM 225 CB PHE A 14 7.916 6.295 4.790 1.00 0.00 C ATOM 226 CG PHE A 14 8.528 6.638 3.452 1.00 0.00 C ATOM 227 CD1 PHE A 14 8.811 5.624 2.530 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.817 7.972 3.136 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.384 5.942 1.292 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.389 8.290 1.897 1.00 0.00 C ATOM 231 CZ PHE A 14 9.672 7.275 0.976 1.00 0.00 C ATOM 0 H PHE A 14 7.446 5.432 7.117 1.00 0.00 H new ATOM 0 HA PHE A 14 9.642 5.164 5.363 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.242 5.445 4.688 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.321 7.131 5.157 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.587 4.596 2.773 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.599 8.755 3.847 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.604 5.159 0.581 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.611 9.318 1.653 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.113 7.520 0.021 1.00 0.00 H new ATOM 241 N HIS A 15 9.490 8.035 6.947 1.00 0.00 N ATOM 242 CA HIS A 15 10.258 9.275 7.247 1.00 0.00 C ATOM 243 C HIS A 15 11.478 8.939 8.112 1.00 0.00 C ATOM 244 O HIS A 15 12.498 9.596 8.047 1.00 0.00 O ATOM 245 CB HIS A 15 9.346 10.255 7.995 1.00 0.00 C ATOM 246 CG HIS A 15 10.141 11.441 8.472 1.00 0.00 C ATOM 247 ND1 HIS A 15 9.759 12.188 9.575 1.00 0.00 N ATOM 248 CD2 HIS A 15 11.294 12.021 8.007 1.00 0.00 C ATOM 249 CE1 HIS A 15 10.668 13.167 9.735 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.626 13.111 8.807 1.00 0.00 N ATOM 0 H HIS A 15 8.654 7.900 7.516 1.00 0.00 H new ATOM 0 HA HIS A 15 10.602 9.727 6.317 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.541 10.587 7.340 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.880 9.755 8.844 1.00 0.00 H new ATOM 0 HD2 HIS A 15 11.858 11.683 7.150 1.00 0.00 H new ATOM 0 HE1 HIS A 15 10.628 13.908 10.519 1.00 0.00 H new ATOM 0 HE2 HIS A 15 12.428 13.733 8.706 1.00 0.00 H new ATOM 258 N GLN A 16 11.371 7.932 8.938 1.00 0.00 N ATOM 259 CA GLN A 16 12.514 7.570 9.826 1.00 0.00 C ATOM 260 C GLN A 16 13.772 7.322 8.993 1.00 0.00 C ATOM 261 O GLN A 16 14.844 7.788 9.325 1.00 0.00 O ATOM 262 CB GLN A 16 12.169 6.311 10.624 1.00 0.00 C ATOM 263 CG GLN A 16 13.170 6.141 11.768 1.00 0.00 C ATOM 264 CD GLN A 16 12.903 7.199 12.839 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.955 7.953 12.742 1.00 0.00 O ATOM 266 NE2 GLN A 16 13.703 7.287 13.866 1.00 0.00 N ATOM 0 H GLN A 16 10.542 7.345 9.036 1.00 0.00 H new ATOM 0 HA GLN A 16 12.702 8.395 10.513 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.156 6.385 11.021 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.193 5.437 9.973 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.082 5.143 12.197 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.188 6.238 11.392 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.499 6.654 13.948 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.532 7.988 14.587 1.00 0.00 H new ATOM 275 N TYR A 17 13.662 6.591 7.917 1.00 0.00 N ATOM 276 CA TYR A 17 14.862 6.321 7.079 1.00 0.00 C ATOM 277 C TYR A 17 15.259 7.597 6.339 1.00 0.00 C ATOM 278 O TYR A 17 16.420 7.949 6.269 1.00 0.00 O ATOM 279 CB TYR A 17 14.541 5.220 6.063 1.00 0.00 C ATOM 280 CG TYR A 17 14.527 3.877 6.757 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.430 3.509 7.545 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.611 3.002 6.614 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.417 2.266 8.190 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.598 1.759 7.258 1.00 0.00 C ATOM 285 CZ TYR A 17 14.501 1.392 8.046 1.00 0.00 C ATOM 286 OH TYR A 17 14.487 0.167 8.682 1.00 0.00 O ATOM 0 H TYR A 17 12.795 6.171 7.584 1.00 0.00 H new ATOM 0 HA TYR A 17 15.685 5.996 7.716 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.573 5.411 5.599 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.283 5.220 5.265 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.594 4.184 7.655 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.458 3.286 6.007 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.571 1.982 8.798 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.434 1.084 7.147 1.00 0.00 H new ATOM 0 HH TYR A 17 13.580 -0.204 8.658 1.00 0.00 H new ATOM 296 N SER A 18 14.302 8.291 5.780 1.00 0.00 N ATOM 297 CA SER A 18 14.616 9.547 5.033 1.00 0.00 C ATOM 298 C SER A 18 14.337 10.767 5.915 1.00 0.00 C ATOM 299 O SER A 18 13.565 11.632 5.551 1.00 0.00 O ATOM 300 CB SER A 18 13.737 9.620 3.785 1.00 0.00 C ATOM 301 OG SER A 18 13.993 8.489 2.963 1.00 0.00 O ATOM 0 H SER A 18 13.313 8.042 5.808 1.00 0.00 H new ATOM 0 HA SER A 18 15.669 9.542 4.751 1.00 0.00 H new ATOM 0 HB2 SER A 18 12.685 9.647 4.068 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.943 10.538 3.235 1.00 0.00 H new ATOM 0 HG SER A 18 13.429 8.532 2.162 1.00 0.00 H new ATOM 307 N GLY A 19 14.981 10.867 7.057 1.00 0.00 N ATOM 308 CA GLY A 19 14.782 12.052 7.957 1.00 0.00 C ATOM 309 C GLY A 19 16.112 12.802 8.032 1.00 0.00 C ATOM 310 O GLY A 19 16.191 13.911 8.522 1.00 0.00 O ATOM 0 H GLY A 19 15.641 10.173 7.407 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.997 12.701 7.568 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.467 11.731 8.950 1.00 0.00 H new ATOM 314 N ARG A 20 17.150 12.207 7.513 1.00 0.00 N ATOM 315 CA ARG A 20 18.485 12.869 7.500 1.00 0.00 C ATOM 316 C ARG A 20 18.426 14.101 6.599 1.00 0.00 C ATOM 317 O ARG A 20 19.009 15.118 6.918 1.00 0.00 O ATOM 318 CB ARG A 20 19.536 11.893 6.969 1.00 0.00 C ATOM 319 CG ARG A 20 19.615 10.676 7.893 1.00 0.00 C ATOM 320 CD ARG A 20 20.775 9.779 7.455 1.00 0.00 C ATOM 321 NE ARG A 20 20.538 9.306 6.060 1.00 0.00 N ATOM 322 CZ ARG A 20 21.543 8.926 5.318 1.00 0.00 C ATOM 323 NH1 ARG A 20 22.687 8.627 5.871 1.00 0.00 N ATOM 324 NH2 ARG A 20 21.406 8.846 4.022 1.00 0.00 N ATOM 0 H ARG A 20 17.130 11.278 7.092 1.00 0.00 H new ATOM 0 HA ARG A 20 18.755 13.170 8.512 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.278 11.579 5.958 1.00 0.00 H new ATOM 0 HB3 ARG A 20 20.508 12.384 6.912 1.00 0.00 H new ATOM 0 HG2 ARG A 20 19.759 10.998 8.924 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.678 10.120 7.860 1.00 0.00 H new ATOM 0 HD2 ARG A 20 21.715 10.329 7.509 1.00 0.00 H new ATOM 0 HD3 ARG A 20 20.865 8.927 8.129 1.00 0.00 H new ATOM 0 HE ARG A 20 19.590 9.279 5.685 1.00 0.00 H new ATOM 0 HH11 ARG A 20 22.796 8.690 6.883 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.472 8.330 5.291 1.00 0.00 H new ATOM 0 HH21 ARG A 20 20.513 9.080 3.588 1.00 0.00 H new ATOM 0 HH22 ARG A 20 22.192 8.549 3.443 1.00 0.00 H new ATOM 338 N GLU A 21 17.718 14.050 5.498 1.00 0.00 N ATOM 339 CA GLU A 21 17.634 15.264 4.622 1.00 0.00 C ATOM 340 C GLU A 21 16.230 15.370 4.024 1.00 0.00 C ATOM 341 O GLU A 21 15.641 16.433 3.998 1.00 0.00 O ATOM 342 CB GLU A 21 18.665 15.158 3.489 1.00 0.00 C ATOM 343 CG GLU A 21 20.062 15.499 4.017 1.00 0.00 C ATOM 344 CD GLU A 21 20.161 17.005 4.267 1.00 0.00 C ATOM 345 OE1 GLU A 21 19.172 17.687 4.055 1.00 0.00 O ATOM 346 OE2 GLU A 21 21.225 17.450 4.664 1.00 0.00 O ATOM 0 H GLU A 21 17.201 13.234 5.170 1.00 0.00 H new ATOM 0 HA GLU A 21 17.843 16.152 5.219 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.660 14.150 3.075 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.398 15.837 2.679 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.256 14.953 4.940 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.820 15.189 3.298 1.00 0.00 H new ATOM 353 N GLY A 22 15.681 14.287 3.547 1.00 0.00 N ATOM 354 CA GLY A 22 14.312 14.345 2.958 1.00 0.00 C ATOM 355 C GLY A 22 14.223 15.523 1.986 1.00 0.00 C ATOM 356 O GLY A 22 13.149 15.907 1.565 1.00 0.00 O ATOM 0 H GLY A 22 16.119 13.366 3.539 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.089 13.413 2.438 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.569 14.455 3.748 1.00 0.00 H new ATOM 360 N ASP A 23 15.336 16.101 1.621 1.00 0.00 N ATOM 361 CA ASP A 23 15.295 17.250 0.673 1.00 0.00 C ATOM 362 C ASP A 23 14.415 16.866 -0.518 1.00 0.00 C ATOM 363 O ASP A 23 13.437 17.521 -0.817 1.00 0.00 O ATOM 364 CB ASP A 23 16.709 17.568 0.185 1.00 0.00 C ATOM 365 CG ASP A 23 16.689 18.869 -0.619 1.00 0.00 C ATOM 366 OD1 ASP A 23 16.098 19.826 -0.146 1.00 0.00 O ATOM 367 OD2 ASP A 23 17.264 18.887 -1.695 1.00 0.00 O ATOM 0 H ASP A 23 16.267 15.829 1.937 1.00 0.00 H new ATOM 0 HA ASP A 23 14.888 18.130 1.172 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.386 17.663 1.034 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.085 16.752 -0.432 1.00 0.00 H new ATOM 372 N LYS A 24 14.737 15.787 -1.181 1.00 0.00 N ATOM 373 CA LYS A 24 13.900 15.339 -2.331 1.00 0.00 C ATOM 374 C LYS A 24 12.823 14.388 -1.802 1.00 0.00 C ATOM 375 O LYS A 24 12.983 13.770 -0.769 1.00 0.00 O ATOM 376 CB LYS A 24 14.772 14.600 -3.350 1.00 0.00 C ATOM 377 CG LYS A 24 15.856 15.539 -3.883 1.00 0.00 C ATOM 378 CD LYS A 24 16.726 14.785 -4.891 1.00 0.00 C ATOM 379 CE LYS A 24 17.782 15.731 -5.466 1.00 0.00 C ATOM 380 NZ LYS A 24 18.475 16.437 -4.351 1.00 0.00 N ATOM 0 H LYS A 24 15.543 15.197 -0.976 1.00 0.00 H new ATOM 0 HA LYS A 24 13.441 16.201 -2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.231 13.727 -2.885 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.157 14.236 -4.173 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.400 16.408 -4.357 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.469 15.909 -3.061 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.209 13.936 -4.407 1.00 0.00 H new ATOM 0 HD3 LYS A 24 16.107 14.384 -5.693 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.504 15.170 -6.060 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.313 16.454 -6.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.446 16.672 -4.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 17.961 17.311 -4.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.502 15.821 -3.514 1.00 0.00 H new ATOM 394 N HIS A 25 11.745 14.238 -2.525 1.00 0.00 N ATOM 395 CA HIS A 25 10.661 13.297 -2.105 1.00 0.00 C ATOM 396 C HIS A 25 10.727 12.098 -3.044 1.00 0.00 C ATOM 397 O HIS A 25 9.727 11.635 -3.556 1.00 0.00 O ATOM 398 CB HIS A 25 9.298 13.980 -2.240 1.00 0.00 C ATOM 399 CG HIS A 25 9.281 15.243 -1.423 1.00 0.00 C ATOM 400 ND1 HIS A 25 8.994 16.479 -1.980 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.508 15.477 -0.089 1.00 0.00 C ATOM 402 CE1 HIS A 25 9.055 17.393 -0.994 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.364 16.835 0.179 1.00 0.00 N ATOM 0 H HIS A 25 11.566 14.732 -3.399 1.00 0.00 H new ATOM 0 HA HIS A 25 10.790 12.992 -1.066 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.098 14.210 -3.287 1.00 0.00 H new ATOM 0 HB3 HIS A 25 8.509 13.308 -1.904 1.00 0.00 H new ATOM 0 HD2 HIS A 25 9.760 14.722 0.641 1.00 0.00 H new ATOM 0 HE1 HIS A 25 8.876 18.449 -1.134 1.00 0.00 H new ATOM 0 HE2 HIS A 25 9.471 17.304 1.079 1.00 0.00 H new ATOM 411 N LYS A 26 11.914 11.599 -3.271 1.00 0.00 N ATOM 412 CA LYS A 26 12.095 10.426 -4.178 1.00 0.00 C ATOM 413 C LYS A 26 13.006 9.392 -3.508 1.00 0.00 C ATOM 414 O LYS A 26 13.848 9.732 -2.700 1.00 0.00 O ATOM 415 CB LYS A 26 12.736 10.901 -5.483 1.00 0.00 C ATOM 416 CG LYS A 26 11.739 11.782 -6.240 1.00 0.00 C ATOM 417 CD LYS A 26 12.408 12.363 -7.487 1.00 0.00 C ATOM 418 CE LYS A 26 11.387 13.190 -8.273 1.00 0.00 C ATOM 419 NZ LYS A 26 11.139 14.479 -7.566 1.00 0.00 N ATOM 0 H LYS A 26 12.776 11.959 -2.862 1.00 0.00 H new ATOM 0 HA LYS A 26 11.127 9.969 -4.385 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.647 11.460 -5.272 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.022 10.045 -6.095 1.00 0.00 H new ATOM 0 HG2 LYS A 26 10.864 11.197 -6.524 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.388 12.588 -5.595 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.255 12.987 -7.202 1.00 0.00 H new ATOM 0 HD3 LYS A 26 12.799 11.560 -8.111 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.757 13.381 -9.280 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.455 12.634 -8.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.582 15.109 -8.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.615 14.297 -6.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.048 14.931 -7.340 1.00 0.00 H new ATOM 433 N LEU A 27 12.846 8.134 -3.839 1.00 0.00 N ATOM 434 CA LEU A 27 13.700 7.060 -3.231 1.00 0.00 C ATOM 435 C LEU A 27 14.350 6.256 -4.358 1.00 0.00 C ATOM 436 O LEU A 27 13.744 6.014 -5.382 1.00 0.00 O ATOM 437 CB LEU A 27 12.818 6.135 -2.384 1.00 0.00 C ATOM 438 CG LEU A 27 13.691 5.222 -1.507 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.440 6.045 -0.435 1.00 0.00 C ATOM 440 CD2 LEU A 27 12.792 4.183 -0.826 1.00 0.00 C ATOM 0 H LEU A 27 12.155 7.800 -4.510 1.00 0.00 H new ATOM 0 HA LEU A 27 14.470 7.503 -2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.155 6.729 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.185 5.530 -3.033 1.00 0.00 H new ATOM 0 HG LEU A 27 14.431 4.726 -2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.051 5.379 0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.080 6.781 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.718 6.557 0.201 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.400 3.529 -0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.052 4.691 -0.207 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.283 3.589 -1.585 1.00 0.00 H new ATOM 452 N LYS A 28 15.583 5.843 -4.189 1.00 0.00 N ATOM 453 CA LYS A 28 16.264 5.060 -5.266 1.00 0.00 C ATOM 454 C LYS A 28 16.065 3.562 -5.018 1.00 0.00 C ATOM 455 O LYS A 28 15.818 3.136 -3.907 1.00 0.00 O ATOM 456 CB LYS A 28 17.758 5.391 -5.273 1.00 0.00 C ATOM 457 CG LYS A 28 17.964 6.806 -5.820 1.00 0.00 C ATOM 458 CD LYS A 28 19.378 7.285 -5.486 1.00 0.00 C ATOM 459 CE LYS A 28 20.399 6.277 -6.017 1.00 0.00 C ATOM 460 NZ LYS A 28 19.993 5.829 -7.379 1.00 0.00 N ATOM 0 H LYS A 28 16.145 6.014 -3.355 1.00 0.00 H new ATOM 0 HA LYS A 28 15.833 5.322 -6.232 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.163 5.317 -4.264 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.298 4.670 -5.886 1.00 0.00 H new ATOM 0 HG2 LYS A 28 17.812 6.815 -6.899 1.00 0.00 H new ATOM 0 HG3 LYS A 28 17.228 7.484 -5.388 1.00 0.00 H new ATOM 0 HD2 LYS A 28 19.555 8.265 -5.929 1.00 0.00 H new ATOM 0 HD3 LYS A 28 19.490 7.398 -4.408 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.389 6.731 -6.052 1.00 0.00 H new ATOM 0 HE3 LYS A 28 20.464 5.421 -5.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 20.841 5.604 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.394 4.982 -7.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 19.460 6.588 -7.850 1.00 0.00 H new ATOM 474 N LYS A 29 16.165 2.759 -6.042 1.00 0.00 N ATOM 475 CA LYS A 29 15.976 1.290 -5.867 1.00 0.00 C ATOM 476 C LYS A 29 17.035 0.719 -4.911 1.00 0.00 C ATOM 477 O LYS A 29 16.755 -0.143 -4.102 1.00 0.00 O ATOM 478 CB LYS A 29 16.101 0.602 -7.237 1.00 0.00 C ATOM 479 CG LYS A 29 17.272 1.207 -8.042 1.00 0.00 C ATOM 480 CD LYS A 29 17.845 0.157 -9.003 1.00 0.00 C ATOM 481 CE LYS A 29 18.842 0.824 -9.955 1.00 0.00 C ATOM 482 NZ LYS A 29 19.597 1.879 -9.222 1.00 0.00 N ATOM 0 H LYS A 29 16.370 3.058 -6.995 1.00 0.00 H new ATOM 0 HA LYS A 29 14.989 1.107 -5.442 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.260 -0.468 -7.100 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.171 0.717 -7.794 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.928 2.076 -8.603 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.051 1.554 -7.363 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.338 -0.636 -8.440 1.00 0.00 H new ATOM 0 HD3 LYS A 29 17.040 -0.309 -9.571 1.00 0.00 H new ATOM 0 HE2 LYS A 29 19.531 0.081 -10.357 1.00 0.00 H new ATOM 0 HE3 LYS A 29 18.315 1.261 -10.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.424 2.167 -9.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.981 2.702 -9.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.914 1.505 -8.305 1.00 0.00 H new ATOM 496 N SER A 30 18.251 1.175 -5.017 1.00 0.00 N ATOM 497 CA SER A 30 19.339 0.648 -4.142 1.00 0.00 C ATOM 498 C SER A 30 19.013 0.869 -2.660 1.00 0.00 C ATOM 499 O SER A 30 19.250 0.012 -1.821 1.00 0.00 O ATOM 500 CB SER A 30 20.640 1.379 -4.476 1.00 0.00 C ATOM 501 OG SER A 30 21.530 1.282 -3.372 1.00 0.00 O ATOM 0 H SER A 30 18.542 1.896 -5.677 1.00 0.00 H new ATOM 0 HA SER A 30 19.439 -0.423 -4.320 1.00 0.00 H new ATOM 0 HB2 SER A 30 21.097 0.945 -5.365 1.00 0.00 H new ATOM 0 HB3 SER A 30 20.435 2.425 -4.702 1.00 0.00 H new ATOM 0 HG SER A 30 21.612 2.158 -2.940 1.00 0.00 H new ATOM 507 N GLU A 31 18.476 2.012 -2.323 1.00 0.00 N ATOM 508 CA GLU A 31 18.163 2.275 -0.889 1.00 0.00 C ATOM 509 C GLU A 31 16.886 1.528 -0.513 1.00 0.00 C ATOM 510 O GLU A 31 16.726 1.057 0.596 1.00 0.00 O ATOM 511 CB GLU A 31 17.978 3.779 -0.663 1.00 0.00 C ATOM 512 CG GLU A 31 19.344 4.473 -0.653 1.00 0.00 C ATOM 513 CD GLU A 31 20.121 4.103 -1.919 1.00 0.00 C ATOM 514 OE1 GLU A 31 20.693 3.026 -1.945 1.00 0.00 O ATOM 515 OE2 GLU A 31 20.130 4.903 -2.840 1.00 0.00 O ATOM 0 H GLU A 31 18.243 2.766 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 31 18.986 1.927 -0.264 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.351 4.200 -1.449 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.464 3.954 0.282 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.213 5.554 -0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.908 4.175 0.231 1.00 0.00 H new ATOM 522 N LEU A 32 15.981 1.408 -1.445 1.00 0.00 N ATOM 523 CA LEU A 32 14.712 0.682 -1.173 1.00 0.00 C ATOM 524 C LEU A 32 15.041 -0.779 -0.860 1.00 0.00 C ATOM 525 O LEU A 32 14.480 -1.360 0.047 1.00 0.00 O ATOM 526 CB LEU A 32 13.800 0.783 -2.406 1.00 0.00 C ATOM 527 CG LEU A 32 12.617 -0.192 -2.305 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.843 0.052 -1.009 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.683 0.035 -3.497 1.00 0.00 C ATOM 0 H LEU A 32 16.068 1.785 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 32 14.193 1.120 -0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.427 1.803 -2.503 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.376 0.568 -3.306 1.00 0.00 H new ATOM 0 HG LEU A 32 12.993 -1.215 -2.309 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.007 -0.645 -0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.505 -0.100 -0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.465 1.074 -0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.840 -0.653 -3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.316 1.061 -3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.227 -0.142 -4.425 1.00 0.00 H new ATOM 541 N LYS A 33 15.922 -1.398 -1.599 1.00 0.00 N ATOM 542 CA LYS A 33 16.218 -2.825 -1.310 1.00 0.00 C ATOM 543 C LYS A 33 16.609 -2.965 0.157 1.00 0.00 C ATOM 544 O LYS A 33 16.011 -3.719 0.899 1.00 0.00 O ATOM 545 CB LYS A 33 17.362 -3.316 -2.200 1.00 0.00 C ATOM 546 CG LYS A 33 17.661 -4.785 -1.880 1.00 0.00 C ATOM 547 CD LYS A 33 18.481 -5.404 -3.015 1.00 0.00 C ATOM 548 CE LYS A 33 19.764 -4.598 -3.220 1.00 0.00 C ATOM 549 NZ LYS A 33 20.366 -4.274 -1.896 1.00 0.00 N ATOM 0 H LYS A 33 16.439 -0.985 -2.375 1.00 0.00 H new ATOM 0 HA LYS A 33 15.333 -3.427 -1.515 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.092 -3.209 -3.251 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.252 -2.708 -2.036 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.209 -4.858 -0.941 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.729 -5.336 -1.749 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.724 -6.440 -2.778 1.00 0.00 H new ATOM 0 HD3 LYS A 33 17.896 -5.416 -3.935 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.471 -5.168 -3.823 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.546 -3.680 -3.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.391 -4.138 -2.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.939 -3.402 -1.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.189 -5.056 -1.233 1.00 0.00 H new ATOM 563 N GLU A 34 17.615 -2.251 0.582 1.00 0.00 N ATOM 564 CA GLU A 34 18.038 -2.362 2.012 1.00 0.00 C ATOM 565 C GLU A 34 16.805 -2.225 2.914 1.00 0.00 C ATOM 566 O GLU A 34 16.693 -2.885 3.927 1.00 0.00 O ATOM 567 CB GLU A 34 19.044 -1.256 2.339 1.00 0.00 C ATOM 568 CG GLU A 34 19.704 -1.546 3.689 1.00 0.00 C ATOM 569 CD GLU A 34 20.652 -2.739 3.551 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.184 -2.926 2.469 1.00 0.00 O ATOM 571 OE2 GLU A 34 20.832 -3.444 4.530 1.00 0.00 O ATOM 0 H GLU A 34 18.158 -1.603 0.012 1.00 0.00 H new ATOM 0 HA GLU A 34 18.508 -3.331 2.181 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.802 -1.197 1.558 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.541 -0.290 2.369 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.254 -0.670 4.032 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.942 -1.759 4.439 1.00 0.00 H new ATOM 578 N LEU A 35 15.874 -1.384 2.551 1.00 0.00 N ATOM 579 CA LEU A 35 14.646 -1.223 3.386 1.00 0.00 C ATOM 580 C LEU A 35 13.815 -2.510 3.319 1.00 0.00 C ATOM 581 O LEU A 35 13.355 -3.010 4.326 1.00 0.00 O ATOM 582 CB LEU A 35 13.819 -0.046 2.860 1.00 0.00 C ATOM 583 CG LEU A 35 12.673 0.285 3.841 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.175 1.226 4.943 1.00 0.00 C ATOM 585 CD2 LEU A 35 11.529 0.971 3.085 1.00 0.00 C ATOM 0 H LEU A 35 15.909 -0.802 1.714 1.00 0.00 H new ATOM 0 HA LEU A 35 14.930 -1.028 4.420 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.459 0.827 2.729 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.409 -0.290 1.880 1.00 0.00 H new ATOM 0 HG LEU A 35 12.319 -0.643 4.290 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.358 1.452 5.628 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.986 0.745 5.491 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.539 2.150 4.494 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.722 1.203 3.780 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.894 1.892 2.631 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.157 0.305 2.306 1.00 0.00 H new ATOM 597 N ILE A 36 13.631 -3.064 2.152 1.00 0.00 N ATOM 598 CA ILE A 36 12.849 -4.328 2.034 1.00 0.00 C ATOM 599 C ILE A 36 13.440 -5.388 2.970 1.00 0.00 C ATOM 600 O ILE A 36 12.736 -6.232 3.488 1.00 0.00 O ATOM 601 CB ILE A 36 12.934 -4.814 0.577 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.119 -3.852 -0.301 1.00 0.00 C ATOM 603 CG2 ILE A 36 12.358 -6.234 0.459 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.267 -4.226 -1.778 1.00 0.00 C ATOM 0 H ILE A 36 13.990 -2.694 1.272 1.00 0.00 H new ATOM 0 HA ILE A 36 11.809 -4.156 2.311 1.00 0.00 H new ATOM 0 HB ILE A 36 13.975 -4.834 0.253 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.068 -3.888 -0.013 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.458 -2.828 -0.142 1.00 0.00 H new ATOM 0 HG21 ILE A 36 12.423 -6.568 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.927 -6.912 1.095 1.00 0.00 H new ATOM 0 HG23 ILE A 36 11.315 -6.231 0.774 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.684 -3.536 -2.388 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.317 -4.166 -2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.905 -5.242 -1.934 1.00 0.00 H new ATOM 616 N ASN A 37 14.731 -5.379 3.155 1.00 0.00 N ATOM 617 CA ASN A 37 15.372 -6.416 4.016 1.00 0.00 C ATOM 618 C ASN A 37 15.016 -6.229 5.498 1.00 0.00 C ATOM 619 O ASN A 37 14.986 -7.183 6.250 1.00 0.00 O ATOM 620 CB ASN A 37 16.890 -6.326 3.852 1.00 0.00 C ATOM 621 CG ASN A 37 17.280 -6.817 2.456 1.00 0.00 C ATOM 622 OD1 ASN A 37 17.181 -6.085 1.492 1.00 0.00 O ATOM 623 ND2 ASN A 37 17.720 -8.037 2.305 1.00 0.00 N ATOM 0 H ASN A 37 15.372 -4.698 2.747 1.00 0.00 H new ATOM 0 HA ASN A 37 15.003 -7.392 3.703 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.222 -5.297 3.994 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.386 -6.929 4.613 1.00 0.00 H new ATOM 0 HD21 ASN A 37 17.980 -8.374 1.378 1.00 0.00 H new ATOM 0 HD22 ASN A 37 17.804 -8.653 3.114 1.00 0.00 H new ATOM 630 N ASN A 38 14.780 -5.014 5.937 1.00 0.00 N ATOM 631 CA ASN A 38 14.466 -4.776 7.389 1.00 0.00 C ATOM 632 C ASN A 38 12.986 -4.429 7.592 1.00 0.00 C ATOM 633 O ASN A 38 12.558 -4.200 8.706 1.00 0.00 O ATOM 634 CB ASN A 38 15.319 -3.610 7.894 1.00 0.00 C ATOM 635 CG ASN A 38 14.963 -3.309 9.352 1.00 0.00 C ATOM 636 OD1 ASN A 38 14.749 -2.169 9.714 1.00 0.00 O ATOM 637 ND2 ASN A 38 14.890 -4.291 10.209 1.00 0.00 N ATOM 0 H ASN A 38 14.791 -4.176 5.355 1.00 0.00 H new ATOM 0 HA ASN A 38 14.685 -5.689 7.942 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.377 -3.857 7.811 1.00 0.00 H new ATOM 0 HB3 ASN A 38 15.149 -2.727 7.278 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.653 -4.101 11.183 1.00 0.00 H new ATOM 0 HD22 ASN A 38 15.070 -5.248 9.905 1.00 0.00 H new ATOM 644 N GLU A 39 12.203 -4.375 6.541 1.00 0.00 N ATOM 645 CA GLU A 39 10.747 -4.025 6.695 1.00 0.00 C ATOM 646 C GLU A 39 9.870 -5.192 6.224 1.00 0.00 C ATOM 647 O GLU A 39 8.725 -5.303 6.615 1.00 0.00 O ATOM 648 CB GLU A 39 10.440 -2.776 5.851 1.00 0.00 C ATOM 649 CG GLU A 39 10.821 -1.512 6.633 1.00 0.00 C ATOM 650 CD GLU A 39 12.271 -1.616 7.107 1.00 0.00 C ATOM 651 OE1 GLU A 39 13.149 -1.668 6.262 1.00 0.00 O ATOM 652 OE2 GLU A 39 12.480 -1.640 8.309 1.00 0.00 O ATOM 0 H GLU A 39 12.504 -4.557 5.584 1.00 0.00 H new ATOM 0 HA GLU A 39 10.532 -3.826 7.745 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.994 -2.815 4.913 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.381 -2.751 5.595 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.697 -0.632 6.003 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.157 -1.388 7.488 1.00 0.00 H new ATOM 659 N LEU A 40 10.395 -6.062 5.396 1.00 0.00 N ATOM 660 CA LEU A 40 9.593 -7.230 4.901 1.00 0.00 C ATOM 661 C LEU A 40 10.287 -8.533 5.308 1.00 0.00 C ATOM 662 O LEU A 40 10.110 -9.564 4.689 1.00 0.00 O ATOM 663 CB LEU A 40 9.490 -7.158 3.373 1.00 0.00 C ATOM 664 CG LEU A 40 8.453 -6.089 2.963 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.779 -5.565 1.560 1.00 0.00 C ATOM 666 CD2 LEU A 40 7.039 -6.696 2.957 1.00 0.00 C ATOM 0 H LEU A 40 11.349 -6.015 5.039 1.00 0.00 H new ATOM 0 HA LEU A 40 8.594 -7.202 5.336 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.463 -6.915 2.946 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.200 -8.130 2.974 1.00 0.00 H new ATOM 0 HG LEU A 40 8.491 -5.270 3.682 1.00 0.00 H new ATOM 0 HD11 LEU A 40 8.046 -4.811 1.274 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.775 -5.121 1.560 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.749 -6.389 0.848 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.317 -5.933 2.667 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.000 -7.522 2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.797 -7.064 3.954 1.00 0.00 H new ATOM 678 N SER A 41 11.076 -8.492 6.346 1.00 0.00 N ATOM 679 CA SER A 41 11.785 -9.723 6.798 1.00 0.00 C ATOM 680 C SER A 41 10.786 -10.692 7.434 1.00 0.00 C ATOM 681 O SER A 41 11.021 -11.883 7.502 1.00 0.00 O ATOM 682 CB SER A 41 12.852 -9.347 7.827 1.00 0.00 C ATOM 683 OG SER A 41 13.574 -10.513 8.201 1.00 0.00 O ATOM 0 H SER A 41 11.261 -7.657 6.902 1.00 0.00 H new ATOM 0 HA SER A 41 12.256 -10.202 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 41 13.531 -8.603 7.409 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.386 -8.897 8.704 1.00 0.00 H new ATOM 0 HG SER A 41 14.260 -10.276 8.859 1.00 0.00 H new ATOM 689 N HIS A 42 9.673 -10.197 7.903 1.00 0.00 N ATOM 690 CA HIS A 42 8.667 -11.095 8.536 1.00 0.00 C ATOM 691 C HIS A 42 8.013 -11.974 7.466 1.00 0.00 C ATOM 692 O HIS A 42 7.924 -13.178 7.609 1.00 0.00 O ATOM 693 CB HIS A 42 7.596 -10.248 9.226 1.00 0.00 C ATOM 694 CG HIS A 42 6.728 -11.131 10.080 1.00 0.00 C ATOM 695 ND1 HIS A 42 7.256 -11.972 11.047 1.00 0.00 N ATOM 696 CD2 HIS A 42 5.368 -11.315 10.125 1.00 0.00 C ATOM 697 CE1 HIS A 42 6.227 -12.618 11.628 1.00 0.00 C ATOM 698 NE2 HIS A 42 5.054 -12.254 11.103 1.00 0.00 N ATOM 0 H HIS A 42 9.417 -9.210 7.875 1.00 0.00 H new ATOM 0 HA HIS A 42 9.160 -11.731 9.271 1.00 0.00 H new ATOM 0 HB2 HIS A 42 8.065 -9.479 9.840 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.988 -9.734 8.481 1.00 0.00 H new ATOM 0 HD2 HIS A 42 4.651 -10.808 9.497 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.337 -13.342 12.422 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.127 -12.592 11.363 1.00 0.00 H new ATOM 706 N PHE A 43 7.553 -11.385 6.396 1.00 0.00 N ATOM 707 CA PHE A 43 6.905 -12.190 5.320 1.00 0.00 C ATOM 708 C PHE A 43 7.978 -12.949 4.534 1.00 0.00 C ATOM 709 O PHE A 43 7.694 -13.903 3.836 1.00 0.00 O ATOM 710 CB PHE A 43 6.146 -11.256 4.372 1.00 0.00 C ATOM 711 CG PHE A 43 4.870 -10.784 5.033 1.00 0.00 C ATOM 712 CD1 PHE A 43 4.920 -9.820 6.049 1.00 0.00 C ATOM 713 CD2 PHE A 43 3.635 -11.308 4.629 1.00 0.00 C ATOM 714 CE1 PHE A 43 3.738 -9.382 6.658 1.00 0.00 C ATOM 715 CE2 PHE A 43 2.454 -10.870 5.239 1.00 0.00 C ATOM 716 CZ PHE A 43 2.505 -9.907 6.253 1.00 0.00 C ATOM 0 H PHE A 43 7.598 -10.381 6.220 1.00 0.00 H new ATOM 0 HA PHE A 43 6.210 -12.901 5.767 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.770 -10.401 4.112 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.914 -11.776 3.442 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.871 -9.415 6.362 1.00 0.00 H new ATOM 0 HD2 PHE A 43 3.594 -12.051 3.846 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.777 -8.639 7.441 1.00 0.00 H new ATOM 0 HE2 PHE A 43 1.503 -11.275 4.927 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.593 -9.569 6.723 1.00 0.00 H new ATOM 726 N LEU A 44 9.205 -12.520 4.627 1.00 0.00 N ATOM 727 CA LEU A 44 10.298 -13.197 3.872 1.00 0.00 C ATOM 728 C LEU A 44 10.239 -14.711 4.099 1.00 0.00 C ATOM 729 O LEU A 44 10.594 -15.491 3.238 1.00 0.00 O ATOM 730 CB LEU A 44 11.650 -12.654 4.351 1.00 0.00 C ATOM 731 CG LEU A 44 12.806 -13.408 3.676 1.00 0.00 C ATOM 732 CD1 LEU A 44 12.638 -13.383 2.150 1.00 0.00 C ATOM 733 CD2 LEU A 44 14.128 -12.734 4.057 1.00 0.00 C ATOM 0 H LEU A 44 9.500 -11.726 5.196 1.00 0.00 H new ATOM 0 HA LEU A 44 10.177 -12.999 2.807 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.721 -11.590 4.125 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.726 -12.755 5.434 1.00 0.00 H new ATOM 0 HG LEU A 44 12.805 -14.445 4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.464 -13.921 1.684 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.696 -13.860 1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.635 -12.350 1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 44 14.955 -13.262 3.583 1.00 0.00 H new ATOM 0 HD22 LEU A 44 14.118 -11.697 3.720 1.00 0.00 H new ATOM 0 HD23 LEU A 44 14.252 -12.763 5.140 1.00 0.00 H new ATOM 745 N GLU A 45 9.809 -15.134 5.255 1.00 0.00 N ATOM 746 CA GLU A 45 9.747 -16.598 5.537 1.00 0.00 C ATOM 747 C GLU A 45 8.458 -17.197 4.966 1.00 0.00 C ATOM 748 O GLU A 45 8.413 -18.354 4.600 1.00 0.00 O ATOM 749 CB GLU A 45 9.784 -16.827 7.050 1.00 0.00 C ATOM 750 CG GLU A 45 9.668 -18.326 7.343 1.00 0.00 C ATOM 751 CD GLU A 45 10.091 -18.601 8.787 1.00 0.00 C ATOM 752 OE1 GLU A 45 9.745 -17.807 9.647 1.00 0.00 O ATOM 753 OE2 GLU A 45 10.754 -19.601 9.009 1.00 0.00 O ATOM 0 H GLU A 45 9.498 -14.531 6.017 1.00 0.00 H new ATOM 0 HA GLU A 45 10.602 -17.083 5.067 1.00 0.00 H new ATOM 0 HB2 GLU A 45 10.713 -16.435 7.465 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.968 -16.288 7.530 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.643 -18.660 7.184 1.00 0.00 H new ATOM 0 HG3 GLU A 45 10.297 -18.891 6.655 1.00 0.00 H new ATOM 760 N GLU A 46 7.403 -16.430 4.910 1.00 0.00 N ATOM 761 CA GLU A 46 6.107 -16.971 4.389 1.00 0.00 C ATOM 762 C GLU A 46 5.994 -16.762 2.874 1.00 0.00 C ATOM 763 O GLU A 46 5.199 -15.966 2.413 1.00 0.00 O ATOM 764 CB GLU A 46 4.949 -16.250 5.080 1.00 0.00 C ATOM 765 CG GLU A 46 5.159 -16.278 6.596 1.00 0.00 C ATOM 766 CD GLU A 46 3.855 -15.901 7.300 1.00 0.00 C ATOM 767 OE1 GLU A 46 3.560 -14.719 7.367 1.00 0.00 O ATOM 768 OE2 GLU A 46 3.172 -16.802 7.760 1.00 0.00 O ATOM 0 H GLU A 46 7.379 -15.453 5.201 1.00 0.00 H new ATOM 0 HA GLU A 46 6.069 -18.040 4.597 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.888 -15.220 4.730 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.004 -16.730 4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.480 -17.271 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.950 -15.583 6.877 1.00 0.00 H new ATOM 775 N ILE A 47 6.766 -17.485 2.096 1.00 0.00 N ATOM 776 CA ILE A 47 6.691 -17.352 0.602 1.00 0.00 C ATOM 777 C ILE A 47 6.476 -18.734 -0.020 1.00 0.00 C ATOM 778 O ILE A 47 7.362 -19.566 -0.017 1.00 0.00 O ATOM 779 CB ILE A 47 7.998 -16.767 0.061 1.00 0.00 C ATOM 780 CG1 ILE A 47 8.308 -15.449 0.773 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.854 -16.510 -1.442 1.00 0.00 C ATOM 782 CD1 ILE A 47 9.720 -14.991 0.397 1.00 0.00 C ATOM 0 H ILE A 47 7.448 -18.165 2.432 1.00 0.00 H new ATOM 0 HA ILE A 47 5.863 -16.691 0.347 1.00 0.00 H new ATOM 0 HB ILE A 47 8.810 -17.472 0.238 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.579 -14.689 0.490 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.231 -15.578 1.853 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.783 -16.093 -1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.636 -17.448 -1.952 1.00 0.00 H new ATOM 0 HG23 ILE A 47 7.040 -15.805 -1.614 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.945 -14.052 0.903 1.00 0.00 H new ATOM 0 HD12 ILE A 47 10.442 -15.749 0.702 1.00 0.00 H new ATOM 0 HD13 ILE A 47 9.780 -14.846 -0.682 1.00 0.00 H new ATOM 794 N LYS A 48 5.316 -18.986 -0.567 1.00 0.00 N ATOM 795 CA LYS A 48 5.069 -20.315 -1.200 1.00 0.00 C ATOM 796 C LYS A 48 5.612 -20.272 -2.631 1.00 0.00 C ATOM 797 O LYS A 48 6.464 -21.051 -3.011 1.00 0.00 O ATOM 798 CB LYS A 48 3.560 -20.605 -1.216 1.00 0.00 C ATOM 799 CG LYS A 48 3.255 -21.816 -2.110 1.00 0.00 C ATOM 800 CD LYS A 48 4.173 -22.987 -1.742 1.00 0.00 C ATOM 801 CE LYS A 48 3.610 -24.283 -2.330 1.00 0.00 C ATOM 802 NZ LYS A 48 2.359 -24.653 -1.609 1.00 0.00 N ATOM 0 H LYS A 48 4.533 -18.333 -0.603 1.00 0.00 H new ATOM 0 HA LYS A 48 5.568 -21.104 -0.637 1.00 0.00 H new ATOM 0 HB2 LYS A 48 3.210 -20.797 -0.202 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.020 -19.731 -1.580 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.212 -22.111 -1.993 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.395 -21.549 -3.157 1.00 0.00 H new ATOM 0 HD2 LYS A 48 5.178 -22.809 -2.124 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.254 -23.072 -0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.405 -24.154 -3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.344 -25.084 -2.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 2.224 -25.683 -1.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.431 -24.356 -0.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.548 -24.178 -2.055 1.00 0.00 H new ATOM 816 N GLU A 49 5.133 -19.348 -3.422 1.00 0.00 N ATOM 817 CA GLU A 49 5.622 -19.224 -4.826 1.00 0.00 C ATOM 818 C GLU A 49 6.869 -18.329 -4.828 1.00 0.00 C ATOM 819 O GLU A 49 6.780 -17.131 -4.641 1.00 0.00 O ATOM 820 CB GLU A 49 4.514 -18.606 -5.686 1.00 0.00 C ATOM 821 CG GLU A 49 4.939 -18.586 -7.160 1.00 0.00 C ATOM 822 CD GLU A 49 4.809 -19.992 -7.751 1.00 0.00 C ATOM 823 OE1 GLU A 49 5.671 -20.811 -7.477 1.00 0.00 O ATOM 824 OE2 GLU A 49 3.849 -20.226 -8.467 1.00 0.00 O ATOM 0 H GLU A 49 4.420 -18.670 -3.154 1.00 0.00 H new ATOM 0 HA GLU A 49 5.880 -20.201 -5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.593 -19.178 -5.573 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.303 -17.592 -5.347 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.317 -17.887 -7.719 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.968 -18.237 -7.248 1.00 0.00 H new ATOM 831 N GLN A 50 8.029 -18.895 -5.018 1.00 0.00 N ATOM 832 CA GLN A 50 9.278 -18.072 -5.006 1.00 0.00 C ATOM 833 C GLN A 50 9.496 -17.374 -6.356 1.00 0.00 C ATOM 834 O GLN A 50 10.257 -16.433 -6.454 1.00 0.00 O ATOM 835 CB GLN A 50 10.474 -18.982 -4.716 1.00 0.00 C ATOM 836 CG GLN A 50 10.499 -20.138 -5.721 1.00 0.00 C ATOM 837 CD GLN A 50 11.769 -20.965 -5.517 1.00 0.00 C ATOM 838 OE1 GLN A 50 12.787 -20.696 -6.123 1.00 0.00 O ATOM 839 NE2 GLN A 50 11.752 -21.970 -4.684 1.00 0.00 N ATOM 0 H GLN A 50 8.169 -19.892 -5.181 1.00 0.00 H new ATOM 0 HA GLN A 50 9.180 -17.309 -4.234 1.00 0.00 H new ATOM 0 HB2 GLN A 50 11.401 -18.412 -4.780 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.409 -19.372 -3.700 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.618 -20.767 -5.590 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.465 -19.750 -6.739 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.897 -22.196 -4.175 1.00 0.00 H new ATOM 0 HE22 GLN A 50 12.593 -22.529 -4.542 1.00 0.00 H new ATOM 848 N GLU A 51 8.868 -17.838 -7.399 1.00 0.00 N ATOM 849 CA GLU A 51 9.085 -17.206 -8.736 1.00 0.00 C ATOM 850 C GLU A 51 8.446 -15.812 -8.804 1.00 0.00 C ATOM 851 O GLU A 51 8.871 -14.979 -9.580 1.00 0.00 O ATOM 852 CB GLU A 51 8.519 -18.101 -9.839 1.00 0.00 C ATOM 853 CG GLU A 51 8.974 -17.581 -11.203 1.00 0.00 C ATOM 854 CD GLU A 51 8.486 -18.530 -12.299 1.00 0.00 C ATOM 855 OE1 GLU A 51 9.117 -19.557 -12.490 1.00 0.00 O ATOM 856 OE2 GLU A 51 7.489 -18.215 -12.927 1.00 0.00 O ATOM 0 H GLU A 51 8.217 -18.623 -7.388 1.00 0.00 H new ATOM 0 HA GLU A 51 10.159 -17.091 -8.884 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.857 -19.128 -9.698 1.00 0.00 H new ATOM 0 HB3 GLU A 51 7.430 -18.114 -9.788 1.00 0.00 H new ATOM 0 HG2 GLU A 51 8.579 -16.579 -11.372 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.061 -17.504 -11.231 1.00 0.00 H new ATOM 863 N VAL A 52 7.465 -15.523 -8.000 1.00 0.00 N ATOM 864 CA VAL A 52 6.871 -14.156 -8.041 1.00 0.00 C ATOM 865 C VAL A 52 7.817 -13.191 -7.318 1.00 0.00 C ATOM 866 O VAL A 52 8.099 -12.117 -7.810 1.00 0.00 O ATOM 867 CB VAL A 52 5.499 -14.154 -7.352 1.00 0.00 C ATOM 868 CG1 VAL A 52 4.430 -14.661 -8.320 1.00 0.00 C ATOM 869 CG2 VAL A 52 5.536 -15.062 -6.123 1.00 0.00 C ATOM 0 H VAL A 52 7.051 -16.164 -7.323 1.00 0.00 H new ATOM 0 HA VAL A 52 6.738 -13.844 -9.077 1.00 0.00 H new ATOM 0 HB VAL A 52 5.259 -13.136 -7.047 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.459 -14.657 -7.825 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.394 -14.012 -9.195 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.674 -15.677 -8.632 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.560 -15.057 -5.638 1.00 0.00 H new ATOM 0 HG22 VAL A 52 5.784 -16.078 -6.429 1.00 0.00 H new ATOM 0 HG23 VAL A 52 6.290 -14.699 -5.425 1.00 0.00 H new ATOM 879 N VAL A 53 8.317 -13.548 -6.168 1.00 0.00 N ATOM 880 CA VAL A 53 9.243 -12.621 -5.462 1.00 0.00 C ATOM 881 C VAL A 53 10.527 -12.483 -6.280 1.00 0.00 C ATOM 882 O VAL A 53 11.140 -11.436 -6.326 1.00 0.00 O ATOM 883 CB VAL A 53 9.577 -13.179 -4.077 1.00 0.00 C ATOM 884 CG1 VAL A 53 10.585 -12.257 -3.388 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.301 -13.256 -3.235 1.00 0.00 C ATOM 0 H VAL A 53 8.128 -14.430 -5.692 1.00 0.00 H new ATOM 0 HA VAL A 53 8.769 -11.646 -5.349 1.00 0.00 H new ATOM 0 HB VAL A 53 10.004 -14.176 -4.181 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.824 -12.653 -2.401 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.494 -12.200 -3.986 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.155 -11.261 -3.285 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.539 -13.654 -2.249 1.00 0.00 H new ATOM 0 HG22 VAL A 53 7.873 -12.259 -3.131 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.580 -13.910 -3.725 1.00 0.00 H new ATOM 895 N ASP A 54 10.941 -13.539 -6.924 1.00 0.00 N ATOM 896 CA ASP A 54 12.186 -13.476 -7.737 1.00 0.00 C ATOM 897 C ASP A 54 12.061 -12.381 -8.800 1.00 0.00 C ATOM 898 O ASP A 54 13.005 -11.668 -9.077 1.00 0.00 O ATOM 899 CB ASP A 54 12.419 -14.824 -8.421 1.00 0.00 C ATOM 900 CG ASP A 54 12.878 -15.851 -7.384 1.00 0.00 C ATOM 901 OD1 ASP A 54 13.718 -15.506 -6.569 1.00 0.00 O ATOM 902 OD2 ASP A 54 12.380 -16.964 -7.422 1.00 0.00 O ATOM 0 H ASP A 54 10.470 -14.444 -6.922 1.00 0.00 H new ATOM 0 HA ASP A 54 13.027 -13.247 -7.083 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.502 -15.163 -8.902 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.170 -14.721 -9.204 1.00 0.00 H new ATOM 907 N LYS A 55 10.913 -12.246 -9.413 1.00 0.00 N ATOM 908 CA LYS A 55 10.765 -11.202 -10.466 1.00 0.00 C ATOM 909 C LYS A 55 10.764 -9.811 -9.827 1.00 0.00 C ATOM 910 O LYS A 55 11.182 -8.850 -10.440 1.00 0.00 O ATOM 911 CB LYS A 55 9.472 -11.422 -11.255 1.00 0.00 C ATOM 912 CG LYS A 55 9.545 -10.664 -12.585 1.00 0.00 C ATOM 913 CD LYS A 55 8.139 -10.517 -13.173 1.00 0.00 C ATOM 914 CE LYS A 55 7.552 -11.902 -13.451 1.00 0.00 C ATOM 915 NZ LYS A 55 6.361 -11.767 -14.337 1.00 0.00 N ATOM 0 H LYS A 55 10.081 -12.808 -9.232 1.00 0.00 H new ATOM 0 HA LYS A 55 11.608 -11.275 -11.153 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.323 -12.486 -11.439 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.617 -11.076 -10.674 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.990 -9.681 -12.430 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.188 -11.198 -13.284 1.00 0.00 H new ATOM 0 HD2 LYS A 55 7.499 -9.972 -12.479 1.00 0.00 H new ATOM 0 HD3 LYS A 55 8.178 -9.936 -14.094 1.00 0.00 H new ATOM 0 HE2 LYS A 55 8.300 -12.538 -13.924 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.270 -12.384 -12.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.961 -12.708 -14.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.646 -11.175 -13.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.644 -11.324 -15.234 1.00 0.00 H new ATOM 929 N VAL A 56 10.344 -9.684 -8.598 1.00 0.00 N ATOM 930 CA VAL A 56 10.381 -8.343 -7.949 1.00 0.00 C ATOM 931 C VAL A 56 11.841 -7.896 -7.871 1.00 0.00 C ATOM 932 O VAL A 56 12.205 -6.838 -8.345 1.00 0.00 O ATOM 933 CB VAL A 56 9.782 -8.443 -6.536 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.169 -7.212 -5.706 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.257 -8.514 -6.642 1.00 0.00 C ATOM 0 H VAL A 56 9.980 -10.442 -8.020 1.00 0.00 H new ATOM 0 HA VAL A 56 9.800 -7.621 -8.523 1.00 0.00 H new ATOM 0 HB VAL A 56 10.169 -9.338 -6.049 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.738 -7.296 -4.708 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.255 -7.152 -5.629 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.789 -6.312 -6.191 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.826 -8.585 -5.643 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.884 -7.616 -7.135 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.973 -9.391 -7.223 1.00 0.00 H new ATOM 945 N MET A 57 12.679 -8.696 -7.273 1.00 0.00 N ATOM 946 CA MET A 57 14.112 -8.317 -7.160 1.00 0.00 C ATOM 947 C MET A 57 14.658 -7.954 -8.541 1.00 0.00 C ATOM 948 O MET A 57 15.548 -7.138 -8.668 1.00 0.00 O ATOM 949 CB MET A 57 14.907 -9.491 -6.582 1.00 0.00 C ATOM 950 CG MET A 57 14.609 -9.630 -5.085 1.00 0.00 C ATOM 951 SD MET A 57 15.551 -8.389 -4.162 1.00 0.00 S ATOM 952 CE MET A 57 14.847 -8.732 -2.530 1.00 0.00 C ATOM 0 H MET A 57 12.432 -9.595 -6.858 1.00 0.00 H new ATOM 0 HA MET A 57 14.208 -7.456 -6.499 1.00 0.00 H new ATOM 0 HB2 MET A 57 14.644 -10.412 -7.102 1.00 0.00 H new ATOM 0 HB3 MET A 57 15.974 -9.331 -6.737 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.542 -9.502 -4.903 1.00 0.00 H new ATOM 0 HG3 MET A 57 14.873 -10.631 -4.743 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.296 -8.066 -1.793 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.769 -8.570 -2.557 1.00 0.00 H new ATOM 0 HE3 MET A 57 15.051 -9.767 -2.256 1.00 0.00 H new ATOM 962 N GLU A 58 14.115 -8.532 -9.589 1.00 0.00 N ATOM 963 CA GLU A 58 14.586 -8.193 -10.965 1.00 0.00 C ATOM 964 C GLU A 58 13.793 -6.994 -11.488 1.00 0.00 C ATOM 965 O GLU A 58 14.330 -6.130 -12.152 1.00 0.00 O ATOM 966 CB GLU A 58 14.410 -9.393 -11.896 1.00 0.00 C ATOM 967 CG GLU A 58 14.894 -9.025 -13.299 1.00 0.00 C ATOM 968 CD GLU A 58 14.979 -10.289 -14.156 1.00 0.00 C ATOM 969 OE1 GLU A 58 14.352 -11.270 -13.793 1.00 0.00 O ATOM 970 OE2 GLU A 58 15.669 -10.254 -15.161 1.00 0.00 O ATOM 0 H GLU A 58 13.366 -9.223 -9.547 1.00 0.00 H new ATOM 0 HA GLU A 58 15.645 -7.938 -10.932 1.00 0.00 H new ATOM 0 HB2 GLU A 58 14.973 -10.246 -11.518 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.362 -9.692 -11.928 1.00 0.00 H new ATOM 0 HG2 GLU A 58 14.211 -8.309 -13.755 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.870 -8.543 -13.244 1.00 0.00 H new ATOM 977 N THR A 59 12.524 -6.921 -11.185 1.00 0.00 N ATOM 978 CA THR A 59 11.724 -5.760 -11.663 1.00 0.00 C ATOM 979 C THR A 59 12.199 -4.520 -10.913 1.00 0.00 C ATOM 980 O THR A 59 12.346 -3.459 -11.487 1.00 0.00 O ATOM 981 CB THR A 59 10.232 -6.001 -11.410 1.00 0.00 C ATOM 982 OG1 THR A 59 9.908 -7.342 -11.747 1.00 0.00 O ATOM 983 CG2 THR A 59 9.399 -5.045 -12.268 1.00 0.00 C ATOM 0 H THR A 59 12.012 -7.609 -10.632 1.00 0.00 H new ATOM 0 HA THR A 59 11.861 -5.624 -12.736 1.00 0.00 H new ATOM 0 HB THR A 59 10.012 -5.823 -10.357 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.237 -7.944 -11.047 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.339 -5.221 -12.084 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.646 -4.015 -12.010 1.00 0.00 H new ATOM 0 HG23 THR A 59 9.618 -5.217 -13.322 1.00 0.00 H new ATOM 991 N LEU A 60 12.490 -4.642 -9.650 1.00 0.00 N ATOM 992 CA LEU A 60 13.008 -3.477 -8.890 1.00 0.00 C ATOM 993 C LEU A 60 14.422 -3.172 -9.389 1.00 0.00 C ATOM 994 O LEU A 60 14.707 -2.081 -9.841 1.00 0.00 O ATOM 995 CB LEU A 60 13.043 -3.839 -7.397 1.00 0.00 C ATOM 996 CG LEU A 60 13.841 -2.795 -6.605 1.00 0.00 C ATOM 997 CD1 LEU A 60 13.337 -1.387 -6.939 1.00 0.00 C ATOM 998 CD2 LEU A 60 13.662 -3.061 -5.107 1.00 0.00 C ATOM 0 H LEU A 60 12.391 -5.502 -9.111 1.00 0.00 H new ATOM 0 HA LEU A 60 12.372 -2.603 -9.032 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.026 -3.899 -7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 60 13.493 -4.823 -7.267 1.00 0.00 H new ATOM 0 HG LEU A 60 14.896 -2.866 -6.871 1.00 0.00 H new ATOM 0 HD11 LEU A 60 13.909 -0.652 -6.373 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.461 -1.200 -8.006 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.282 -1.306 -6.677 1.00 0.00 H new ATOM 0 HD21 LEU A 60 14.226 -2.323 -4.536 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.606 -2.989 -4.848 1.00 0.00 H new ATOM 0 HD23 LEU A 60 14.027 -4.060 -4.869 1.00 0.00 H new ATOM 1010 N ASP A 61 15.312 -4.125 -9.316 1.00 0.00 N ATOM 1011 CA ASP A 61 16.702 -3.877 -9.794 1.00 0.00 C ATOM 1012 C ASP A 61 16.654 -3.243 -11.187 1.00 0.00 C ATOM 1013 O ASP A 61 17.617 -2.662 -11.648 1.00 0.00 O ATOM 1014 CB ASP A 61 17.461 -5.205 -9.863 1.00 0.00 C ATOM 1015 CG ASP A 61 18.852 -4.969 -10.455 1.00 0.00 C ATOM 1016 OD1 ASP A 61 19.323 -3.846 -10.381 1.00 0.00 O ATOM 1017 OD2 ASP A 61 19.423 -5.915 -10.972 1.00 0.00 O ATOM 0 H ASP A 61 15.138 -5.060 -8.948 1.00 0.00 H new ATOM 0 HA ASP A 61 17.211 -3.203 -9.105 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.547 -5.639 -8.867 1.00 0.00 H new ATOM 0 HB3 ASP A 61 16.910 -5.919 -10.475 1.00 0.00 H new ATOM 1022 N GLU A 62 15.536 -3.355 -11.862 1.00 0.00 N ATOM 1023 CA GLU A 62 15.406 -2.768 -13.235 1.00 0.00 C ATOM 1024 C GLU A 62 14.615 -1.469 -13.156 1.00 0.00 C ATOM 1025 O GLU A 62 13.761 -1.180 -13.971 1.00 0.00 O ATOM 1026 CB GLU A 62 14.667 -3.727 -14.119 1.00 0.00 C ATOM 1027 CG GLU A 62 15.557 -4.924 -14.454 1.00 0.00 C ATOM 1028 CD GLU A 62 14.704 -6.039 -15.061 1.00 0.00 C ATOM 1029 OE1 GLU A 62 13.494 -5.883 -15.091 1.00 0.00 O ATOM 1030 OE2 GLU A 62 15.275 -7.030 -15.486 1.00 0.00 O ATOM 0 H GLU A 62 14.702 -3.831 -11.519 1.00 0.00 H new ATOM 0 HA GLU A 62 16.399 -2.577 -13.641 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.759 -4.067 -13.621 1.00 0.00 H new ATOM 0 HB3 GLU A 62 14.359 -3.225 -15.036 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.337 -4.626 -15.154 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.057 -5.283 -13.554 1.00 0.00 H new ATOM 1037 N ASP A 63 14.911 -0.703 -12.181 1.00 0.00 N ATOM 1038 CA ASP A 63 14.218 0.605 -11.983 1.00 0.00 C ATOM 1039 C ASP A 63 14.095 1.336 -13.317 1.00 0.00 C ATOM 1040 O ASP A 63 13.083 1.933 -13.622 1.00 0.00 O ATOM 1041 CB ASP A 63 15.082 1.468 -11.057 1.00 0.00 C ATOM 1042 CG ASP A 63 14.439 2.847 -10.892 1.00 0.00 C ATOM 1043 OD1 ASP A 63 13.242 2.950 -11.101 1.00 0.00 O ATOM 1044 OD2 ASP A 63 15.156 3.777 -10.559 1.00 0.00 O ATOM 0 H ASP A 63 15.622 -0.916 -11.481 1.00 0.00 H new ATOM 0 HA ASP A 63 13.228 0.431 -11.562 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.185 0.985 -10.085 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.085 1.571 -11.470 1.00 0.00 H new ATOM 1049 N GLY A 64 15.114 1.253 -14.123 1.00 0.00 N ATOM 1050 CA GLY A 64 15.086 1.903 -15.469 1.00 0.00 C ATOM 1051 C GLY A 64 14.677 3.384 -15.379 1.00 0.00 C ATOM 1052 O GLY A 64 14.700 4.081 -16.373 1.00 0.00 O ATOM 0 H GLY A 64 15.978 0.757 -13.907 1.00 0.00 H new ATOM 0 HA2 GLY A 64 16.070 1.825 -15.931 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.387 1.371 -16.115 1.00 0.00 H new ATOM 1056 N ASP A 65 14.296 3.877 -14.215 1.00 0.00 N ATOM 1057 CA ASP A 65 13.876 5.325 -14.091 1.00 0.00 C ATOM 1058 C ASP A 65 14.916 6.179 -13.318 1.00 0.00 C ATOM 1059 O ASP A 65 14.798 7.388 -13.290 1.00 0.00 O ATOM 1060 CB ASP A 65 12.539 5.387 -13.352 1.00 0.00 C ATOM 1061 CG ASP A 65 11.438 4.794 -14.232 1.00 0.00 C ATOM 1062 OD1 ASP A 65 11.612 3.678 -14.693 1.00 0.00 O ATOM 1063 OD2 ASP A 65 10.438 5.465 -14.429 1.00 0.00 O ATOM 0 H ASP A 65 14.257 3.343 -13.347 1.00 0.00 H new ATOM 0 HA ASP A 65 13.794 5.735 -15.098 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.605 4.836 -12.414 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.299 6.420 -13.099 1.00 0.00 H new ATOM 1068 N GLY A 66 15.933 5.610 -12.703 1.00 0.00 N ATOM 1069 CA GLY A 66 16.928 6.455 -11.981 1.00 0.00 C ATOM 1070 C GLY A 66 16.387 6.870 -10.610 1.00 0.00 C ATOM 1071 O GLY A 66 17.142 7.069 -9.679 1.00 0.00 O ATOM 0 H GLY A 66 16.110 4.606 -12.673 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.861 5.904 -11.859 1.00 0.00 H new ATOM 0 HA3 GLY A 66 17.157 7.342 -12.572 1.00 0.00 H new ATOM 1075 N GLU A 67 15.089 6.996 -10.467 1.00 0.00 N ATOM 1076 CA GLU A 67 14.517 7.396 -9.137 1.00 0.00 C ATOM 1077 C GLU A 67 13.159 6.718 -8.930 1.00 0.00 C ATOM 1078 O GLU A 67 12.300 6.770 -9.789 1.00 0.00 O ATOM 1079 CB GLU A 67 14.328 8.921 -9.094 1.00 0.00 C ATOM 1080 CG GLU A 67 15.675 9.621 -8.883 1.00 0.00 C ATOM 1081 CD GLU A 67 16.199 9.320 -7.478 1.00 0.00 C ATOM 1082 OE1 GLU A 67 15.405 9.343 -6.553 1.00 0.00 O ATOM 1083 OE2 GLU A 67 17.387 9.072 -7.351 1.00 0.00 O ATOM 0 H GLU A 67 14.404 6.841 -11.206 1.00 0.00 H new ATOM 0 HA GLU A 67 15.203 7.087 -8.348 1.00 0.00 H new ATOM 0 HB2 GLU A 67 13.875 9.264 -10.024 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.643 9.186 -8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 67 16.393 9.281 -9.630 1.00 0.00 H new ATOM 0 HG3 GLU A 67 15.561 10.697 -9.016 1.00 0.00 H new ATOM 1090 N CYS A 68 12.947 6.097 -7.794 1.00 0.00 N ATOM 1091 CA CYS A 68 11.632 5.429 -7.524 1.00 0.00 C ATOM 1092 C CYS A 68 10.809 6.318 -6.586 1.00 0.00 C ATOM 1093 O CYS A 68 11.261 6.702 -5.526 1.00 0.00 O ATOM 1094 CB CYS A 68 11.873 4.069 -6.865 1.00 0.00 C ATOM 1095 SG CYS A 68 12.982 3.084 -7.902 1.00 0.00 S ATOM 0 H CYS A 68 13.629 6.023 -7.040 1.00 0.00 H new ATOM 0 HA CYS A 68 11.093 5.280 -8.460 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.308 4.205 -5.875 1.00 0.00 H new ATOM 0 HB3 CYS A 68 10.926 3.546 -6.728 1.00 0.00 H new ATOM 0 HG CYS A 68 12.622 3.192 -9.147 1.00 0.00 H new ATOM 1101 N ASP A 69 9.609 6.659 -6.973 1.00 0.00 N ATOM 1102 CA ASP A 69 8.762 7.537 -6.111 1.00 0.00 C ATOM 1103 C ASP A 69 8.026 6.700 -5.060 1.00 0.00 C ATOM 1104 O ASP A 69 8.243 5.511 -4.932 1.00 0.00 O ATOM 1105 CB ASP A 69 7.738 8.264 -6.984 1.00 0.00 C ATOM 1106 CG ASP A 69 8.466 9.177 -7.973 1.00 0.00 C ATOM 1107 OD1 ASP A 69 9.667 9.338 -7.827 1.00 0.00 O ATOM 1108 OD2 ASP A 69 7.811 9.700 -8.859 1.00 0.00 O ATOM 0 H ASP A 69 9.177 6.368 -7.850 1.00 0.00 H new ATOM 0 HA ASP A 69 9.402 8.260 -5.604 1.00 0.00 H new ATOM 0 HB2 ASP A 69 7.126 7.541 -7.523 1.00 0.00 H new ATOM 0 HB3 ASP A 69 7.064 8.851 -6.360 1.00 0.00 H new ATOM 1113 N PHE A 70 7.145 7.317 -4.316 1.00 0.00 N ATOM 1114 CA PHE A 70 6.376 6.568 -3.279 1.00 0.00 C ATOM 1115 C PHE A 70 5.311 5.716 -3.978 1.00 0.00 C ATOM 1116 O PHE A 70 4.928 4.672 -3.490 1.00 0.00 O ATOM 1117 CB PHE A 70 5.720 7.569 -2.317 1.00 0.00 C ATOM 1118 CG PHE A 70 5.320 6.891 -1.024 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.221 6.022 -0.996 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.039 7.144 0.153 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.845 5.405 0.204 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.662 6.528 1.351 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.566 5.659 1.377 1.00 0.00 C ATOM 0 H PHE A 70 6.925 8.311 -4.383 1.00 0.00 H new ATOM 0 HA PHE A 70 7.037 5.917 -2.708 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.412 8.384 -2.106 1.00 0.00 H new ATOM 0 HB3 PHE A 70 4.842 8.010 -2.788 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.663 5.828 -1.900 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.885 7.815 0.135 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.999 4.734 0.224 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.217 6.723 2.256 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.276 5.184 2.302 1.00 0.00 H new ATOM 1133 N GLN A 71 4.843 6.132 -5.123 1.00 0.00 N ATOM 1134 CA GLN A 71 3.820 5.316 -5.837 1.00 0.00 C ATOM 1135 C GLN A 71 4.462 3.994 -6.270 1.00 0.00 C ATOM 1136 O GLN A 71 3.852 2.945 -6.201 1.00 0.00 O ATOM 1137 CB GLN A 71 3.323 6.079 -7.069 1.00 0.00 C ATOM 1138 CG GLN A 71 2.183 5.305 -7.738 1.00 0.00 C ATOM 1139 CD GLN A 71 0.966 5.279 -6.812 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.339 4.252 -6.643 1.00 0.00 O ATOM 1141 NE2 GLN A 71 0.602 6.374 -6.201 1.00 0.00 N ATOM 0 H GLN A 71 5.122 6.994 -5.592 1.00 0.00 H new ATOM 0 HA GLN A 71 2.974 5.118 -5.179 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.979 7.071 -6.778 1.00 0.00 H new ATOM 0 HB3 GLN A 71 4.142 6.220 -7.775 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.920 5.773 -8.687 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.504 4.288 -7.962 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.128 7.236 -6.343 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.209 6.367 -5.582 1.00 0.00 H new ATOM 1150 N GLU A 72 5.692 4.034 -6.706 1.00 0.00 N ATOM 1151 CA GLU A 72 6.377 2.780 -7.132 1.00 0.00 C ATOM 1152 C GLU A 72 6.674 1.919 -5.900 1.00 0.00 C ATOM 1153 O GLU A 72 6.805 0.716 -5.983 1.00 0.00 O ATOM 1154 CB GLU A 72 7.680 3.117 -7.860 1.00 0.00 C ATOM 1155 CG GLU A 72 7.370 3.952 -9.105 1.00 0.00 C ATOM 1156 CD GLU A 72 8.678 4.372 -9.778 1.00 0.00 C ATOM 1157 OE1 GLU A 72 9.527 3.516 -9.963 1.00 0.00 O ATOM 1158 OE2 GLU A 72 8.809 5.543 -10.096 1.00 0.00 O ATOM 0 H GLU A 72 6.253 4.882 -6.786 1.00 0.00 H new ATOM 0 HA GLU A 72 5.728 2.227 -7.812 1.00 0.00 H new ATOM 0 HB2 GLU A 72 8.347 3.668 -7.197 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.198 2.201 -8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.760 3.375 -9.800 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.791 4.834 -8.829 1.00 0.00 H new ATOM 1165 N PHE A 73 6.746 2.534 -4.754 1.00 0.00 N ATOM 1166 CA PHE A 73 6.994 1.770 -3.497 1.00 0.00 C ATOM 1167 C PHE A 73 5.707 1.050 -3.078 1.00 0.00 C ATOM 1168 O PHE A 73 5.748 -0.096 -2.685 1.00 0.00 O ATOM 1169 CB PHE A 73 7.478 2.724 -2.398 1.00 0.00 C ATOM 1170 CG PHE A 73 7.530 2.018 -1.058 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.328 0.880 -0.895 1.00 0.00 C ATOM 1172 CD2 PHE A 73 6.792 2.513 0.029 1.00 0.00 C ATOM 1173 CE1 PHE A 73 8.389 0.236 0.347 1.00 0.00 C ATOM 1174 CE2 PHE A 73 6.855 1.870 1.271 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.653 0.732 1.430 1.00 0.00 C ATOM 0 H PHE A 73 6.643 3.541 -4.631 1.00 0.00 H new ATOM 0 HA PHE A 73 7.770 1.023 -3.663 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.467 3.106 -2.651 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.810 3.583 -2.336 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.898 0.498 -1.729 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.175 3.391 -0.093 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.004 -0.643 0.470 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.287 2.253 2.106 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.701 0.236 2.388 1.00 0.00 H new ATOM 1185 N MET A 74 4.568 1.666 -3.170 1.00 0.00 N ATOM 1186 CA MET A 74 3.332 0.925 -2.778 1.00 0.00 C ATOM 1187 C MET A 74 3.120 -0.230 -3.771 1.00 0.00 C ATOM 1188 O MET A 74 3.021 -1.372 -3.369 1.00 0.00 O ATOM 1189 CB MET A 74 2.120 1.878 -2.780 1.00 0.00 C ATOM 1190 CG MET A 74 1.892 2.438 -1.370 1.00 0.00 C ATOM 1191 SD MET A 74 1.078 1.176 -0.349 1.00 0.00 S ATOM 1192 CE MET A 74 2.331 1.047 0.956 1.00 0.00 C ATOM 0 H MET A 74 4.433 2.625 -3.490 1.00 0.00 H new ATOM 0 HA MET A 74 3.439 0.523 -1.771 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.290 2.695 -3.482 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.230 1.347 -3.118 1.00 0.00 H new ATOM 0 HG2 MET A 74 2.843 2.727 -0.922 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.277 3.336 -1.418 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.952 0.420 1.763 1.00 0.00 H new ATOM 0 HE2 MET A 74 3.238 0.603 0.547 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.556 2.041 1.344 1.00 0.00 H new ATOM 1202 N ALA A 75 3.047 0.027 -5.043 1.00 0.00 N ATOM 1203 CA ALA A 75 2.839 -1.094 -6.006 1.00 0.00 C ATOM 1204 C ALA A 75 3.853 -2.218 -5.758 1.00 0.00 C ATOM 1205 O ALA A 75 3.511 -3.383 -5.790 1.00 0.00 O ATOM 1206 CB ALA A 75 3.005 -0.571 -7.433 1.00 0.00 C ATOM 0 H ALA A 75 3.121 0.955 -5.459 1.00 0.00 H new ATOM 0 HA ALA A 75 1.834 -1.493 -5.866 1.00 0.00 H new ATOM 0 HB1 ALA A 75 2.854 -1.387 -8.140 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.271 0.212 -7.621 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.009 -0.165 -7.557 1.00 0.00 H new ATOM 1212 N PHE A 76 5.094 -1.894 -5.525 1.00 0.00 N ATOM 1213 CA PHE A 76 6.107 -2.970 -5.294 1.00 0.00 C ATOM 1214 C PHE A 76 5.880 -3.619 -3.920 1.00 0.00 C ATOM 1215 O PHE A 76 6.024 -4.815 -3.759 1.00 0.00 O ATOM 1216 CB PHE A 76 7.523 -2.365 -5.373 1.00 0.00 C ATOM 1217 CG PHE A 76 8.031 -2.433 -6.802 1.00 0.00 C ATOM 1218 CD1 PHE A 76 7.426 -1.656 -7.799 1.00 0.00 C ATOM 1219 CD2 PHE A 76 9.099 -3.279 -7.129 1.00 0.00 C ATOM 1220 CE1 PHE A 76 7.888 -1.725 -9.118 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.560 -3.347 -8.447 1.00 0.00 C ATOM 1222 CZ PHE A 76 8.955 -2.571 -9.443 1.00 0.00 C ATOM 0 H PHE A 76 5.452 -0.940 -5.484 1.00 0.00 H new ATOM 0 HA PHE A 76 6.003 -3.738 -6.061 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.506 -1.330 -5.032 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.198 -2.908 -4.711 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.603 -1.003 -7.549 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.566 -3.879 -6.362 1.00 0.00 H new ATOM 0 HE1 PHE A 76 7.421 -1.125 -9.886 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.384 -3.999 -8.697 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.311 -2.625 -10.461 1.00 0.00 H new ATOM 1232 N VAL A 77 5.522 -2.848 -2.936 1.00 0.00 N ATOM 1233 CA VAL A 77 5.282 -3.437 -1.586 1.00 0.00 C ATOM 1234 C VAL A 77 4.155 -4.471 -1.692 1.00 0.00 C ATOM 1235 O VAL A 77 4.146 -5.466 -0.995 1.00 0.00 O ATOM 1236 CB VAL A 77 4.881 -2.322 -0.605 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.256 -2.927 0.661 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.123 -1.502 -0.217 1.00 0.00 C ATOM 0 H VAL A 77 5.385 -1.840 -3.003 1.00 0.00 H new ATOM 0 HA VAL A 77 6.188 -3.920 -1.221 1.00 0.00 H new ATOM 0 HB VAL A 77 4.150 -1.675 -1.090 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.977 -2.127 1.347 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.369 -3.500 0.391 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.978 -3.584 1.145 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.836 -0.713 0.478 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.856 -2.154 0.258 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.559 -1.057 -1.111 1.00 0.00 H new ATOM 1248 N SER A 78 3.203 -4.240 -2.551 1.00 0.00 N ATOM 1249 CA SER A 78 2.079 -5.206 -2.692 1.00 0.00 C ATOM 1250 C SER A 78 2.572 -6.496 -3.359 1.00 0.00 C ATOM 1251 O SER A 78 2.332 -7.582 -2.880 1.00 0.00 O ATOM 1252 CB SER A 78 0.974 -4.578 -3.543 1.00 0.00 C ATOM 1253 OG SER A 78 -0.240 -5.288 -3.333 1.00 0.00 O ATOM 0 H SER A 78 3.154 -3.424 -3.162 1.00 0.00 H new ATOM 0 HA SER A 78 1.689 -5.447 -1.703 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.846 -3.529 -3.277 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.249 -4.608 -4.597 1.00 0.00 H new ATOM 0 HG SER A 78 -0.951 -4.888 -3.876 1.00 0.00 H new ATOM 1259 N MET A 79 3.240 -6.384 -4.473 1.00 0.00 N ATOM 1260 CA MET A 79 3.722 -7.606 -5.182 1.00 0.00 C ATOM 1261 C MET A 79 4.448 -8.539 -4.210 1.00 0.00 C ATOM 1262 O MET A 79 4.310 -9.744 -4.275 1.00 0.00 O ATOM 1263 CB MET A 79 4.684 -7.196 -6.299 1.00 0.00 C ATOM 1264 CG MET A 79 3.909 -6.465 -7.397 1.00 0.00 C ATOM 1265 SD MET A 79 5.074 -5.653 -8.519 1.00 0.00 S ATOM 1266 CE MET A 79 5.266 -7.027 -9.680 1.00 0.00 C ATOM 0 H MET A 79 3.474 -5.500 -4.925 1.00 0.00 H new ATOM 0 HA MET A 79 2.863 -8.131 -5.600 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.467 -6.551 -5.901 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.176 -8.077 -6.711 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.287 -7.170 -7.949 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.239 -5.727 -6.955 1.00 0.00 H new ATOM 0 HE1 MET A 79 5.957 -6.740 -10.472 1.00 0.00 H new ATOM 0 HE2 MET A 79 5.659 -7.897 -9.153 1.00 0.00 H new ATOM 0 HE3 MET A 79 4.298 -7.273 -10.115 1.00 0.00 H new ATOM 1276 N VAL A 80 5.219 -7.997 -3.311 1.00 0.00 N ATOM 1277 CA VAL A 80 5.948 -8.866 -2.342 1.00 0.00 C ATOM 1278 C VAL A 80 4.965 -9.413 -1.304 1.00 0.00 C ATOM 1279 O VAL A 80 4.974 -10.585 -0.984 1.00 0.00 O ATOM 1280 CB VAL A 80 7.031 -8.048 -1.636 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.692 -8.900 -0.550 1.00 0.00 C ATOM 1282 CG2 VAL A 80 8.089 -7.616 -2.654 1.00 0.00 C ATOM 0 H VAL A 80 5.377 -6.995 -3.204 1.00 0.00 H new ATOM 0 HA VAL A 80 6.410 -9.696 -2.877 1.00 0.00 H new ATOM 0 HB VAL A 80 6.579 -7.167 -1.182 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.463 -8.316 -0.048 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.941 -9.210 0.177 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.143 -9.782 -1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.861 -7.033 -2.151 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.539 -8.499 -3.108 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.622 -7.008 -3.429 1.00 0.00 H new ATOM 1292 N THR A 81 4.111 -8.577 -0.783 1.00 0.00 N ATOM 1293 CA THR A 81 3.119 -9.051 0.224 1.00 0.00 C ATOM 1294 C THR A 81 2.064 -9.921 -0.471 1.00 0.00 C ATOM 1295 O THR A 81 1.702 -10.979 0.004 1.00 0.00 O ATOM 1296 CB THR A 81 2.440 -7.839 0.871 1.00 0.00 C ATOM 1297 OG1 THR A 81 3.423 -6.861 1.181 1.00 0.00 O ATOM 1298 CG2 THR A 81 1.725 -8.268 2.152 1.00 0.00 C ATOM 0 H THR A 81 4.056 -7.584 -1.011 1.00 0.00 H new ATOM 0 HA THR A 81 3.624 -9.639 0.990 1.00 0.00 H new ATOM 0 HB THR A 81 1.711 -7.420 0.178 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.426 -6.169 0.487 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.244 -7.402 2.608 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.971 -9.018 1.914 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.449 -8.690 2.849 1.00 0.00 H new ATOM 1306 N THR A 82 1.567 -9.471 -1.591 1.00 0.00 N ATOM 1307 CA THR A 82 0.528 -10.247 -2.331 1.00 0.00 C ATOM 1308 C THR A 82 1.146 -11.497 -2.963 1.00 0.00 C ATOM 1309 O THR A 82 0.455 -12.448 -3.269 1.00 0.00 O ATOM 1310 CB THR A 82 -0.074 -9.370 -3.432 1.00 0.00 C ATOM 1311 OG1 THR A 82 0.962 -8.904 -4.286 1.00 0.00 O ATOM 1312 CG2 THR A 82 -0.792 -8.178 -2.799 1.00 0.00 C ATOM 0 H THR A 82 1.838 -8.591 -2.030 1.00 0.00 H new ATOM 0 HA THR A 82 -0.250 -10.551 -1.630 1.00 0.00 H new ATOM 0 HB THR A 82 -0.787 -9.954 -4.014 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.736 -8.638 -3.747 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.221 -7.553 -3.583 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.587 -8.537 -2.146 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.081 -7.592 -2.217 1.00 0.00 H new ATOM 1320 N ALA A 83 2.437 -11.512 -3.161 1.00 0.00 N ATOM 1321 CA ALA A 83 3.072 -12.715 -3.772 1.00 0.00 C ATOM 1322 C ALA A 83 2.690 -13.946 -2.946 1.00 0.00 C ATOM 1323 O ALA A 83 2.348 -14.982 -3.478 1.00 0.00 O ATOM 1324 CB ALA A 83 4.598 -12.544 -3.785 1.00 0.00 C ATOM 0 H ALA A 83 3.074 -10.750 -2.928 1.00 0.00 H new ATOM 0 HA ALA A 83 2.725 -12.839 -4.798 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.059 -13.425 -4.232 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.860 -11.661 -4.368 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.959 -12.424 -2.764 1.00 0.00 H new ATOM 1330 N CYS A 84 2.739 -13.834 -1.646 1.00 0.00 N ATOM 1331 CA CYS A 84 2.370 -14.990 -0.778 1.00 0.00 C ATOM 1332 C CYS A 84 0.867 -14.945 -0.494 1.00 0.00 C ATOM 1333 O CYS A 84 0.441 -14.613 0.594 1.00 0.00 O ATOM 1334 CB CYS A 84 3.139 -14.902 0.541 1.00 0.00 C ATOM 1335 SG CYS A 84 2.719 -13.355 1.381 1.00 0.00 S ATOM 0 H CYS A 84 3.019 -12.990 -1.146 1.00 0.00 H new ATOM 0 HA CYS A 84 2.621 -15.923 -1.283 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.891 -15.752 1.176 1.00 0.00 H new ATOM 0 HB3 CYS A 84 4.212 -14.947 0.353 1.00 0.00 H new ATOM 0 HG CYS A 84 2.122 -12.556 0.547 1.00 0.00 H new ATOM 1341 N HIS A 85 0.059 -15.276 -1.465 1.00 0.00 N ATOM 1342 CA HIS A 85 -1.417 -15.251 -1.250 1.00 0.00 C ATOM 1343 C HIS A 85 -1.758 -15.996 0.042 1.00 0.00 C ATOM 1344 O HIS A 85 -2.868 -15.932 0.533 1.00 0.00 O ATOM 1345 CB HIS A 85 -2.115 -15.929 -2.431 1.00 0.00 C ATOM 1346 CG HIS A 85 -1.775 -15.197 -3.701 1.00 0.00 C ATOM 1347 ND1 HIS A 85 -2.138 -13.876 -3.913 1.00 0.00 N ATOM 1348 CD2 HIS A 85 -1.102 -15.587 -4.833 1.00 0.00 C ATOM 1349 CE1 HIS A 85 -1.685 -13.521 -5.130 1.00 0.00 C ATOM 1350 NE2 HIS A 85 -1.047 -14.527 -5.733 1.00 0.00 N ATOM 0 H HIS A 85 0.357 -15.563 -2.398 1.00 0.00 H new ATOM 0 HA HIS A 85 -1.756 -14.218 -1.172 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -1.801 -16.970 -2.504 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -3.194 -15.931 -2.277 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -0.680 -16.567 -4.999 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -1.821 -12.542 -5.565 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -0.612 -14.520 -6.656 1.00 0.00 H new ATOM 1358 N GLU A 86 -0.813 -16.702 0.597 1.00 0.00 N ATOM 1359 CA GLU A 86 -1.080 -17.448 1.855 1.00 0.00 C ATOM 1360 C GLU A 86 -1.145 -16.465 3.029 1.00 0.00 C ATOM 1361 O GLU A 86 -1.244 -16.859 4.173 1.00 0.00 O ATOM 1362 CB GLU A 86 0.049 -18.462 2.087 1.00 0.00 C ATOM 1363 CG GLU A 86 -0.410 -19.543 3.070 1.00 0.00 C ATOM 1364 CD GLU A 86 0.667 -20.624 3.177 1.00 0.00 C ATOM 1365 OE1 GLU A 86 1.722 -20.330 3.716 1.00 0.00 O ATOM 1366 OE2 GLU A 86 0.421 -21.726 2.716 1.00 0.00 O ATOM 0 H GLU A 86 0.135 -16.794 0.232 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.031 -17.974 1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 86 0.338 -18.919 1.141 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.930 -17.954 2.478 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.598 -19.103 4.049 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.349 -19.982 2.732 1.00 0.00 H new ATOM 1373 N PHE A 87 -1.088 -15.185 2.760 1.00 0.00 N ATOM 1374 CA PHE A 87 -1.145 -14.199 3.877 1.00 0.00 C ATOM 1375 C PHE A 87 -2.517 -14.273 4.553 1.00 0.00 C ATOM 1376 O PHE A 87 -2.653 -14.004 5.730 1.00 0.00 O ATOM 1377 CB PHE A 87 -0.876 -12.782 3.349 1.00 0.00 C ATOM 1378 CG PHE A 87 -2.056 -12.269 2.554 1.00 0.00 C ATOM 1379 CD1 PHE A 87 -3.145 -11.684 3.212 1.00 0.00 C ATOM 1380 CD2 PHE A 87 -2.050 -12.361 1.156 1.00 0.00 C ATOM 1381 CE1 PHE A 87 -4.228 -11.194 2.473 1.00 0.00 C ATOM 1382 CE2 PHE A 87 -3.133 -11.868 0.418 1.00 0.00 C ATOM 1383 CZ PHE A 87 -4.221 -11.285 1.076 1.00 0.00 C ATOM 0 H PHE A 87 -1.005 -14.785 1.825 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.376 -14.439 4.611 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.675 -12.111 4.184 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.016 -12.786 2.722 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.149 -11.611 4.290 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -1.210 -12.812 0.648 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.069 -10.746 2.981 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.128 -11.938 -0.660 1.00 0.00 H new ATOM 0 HZ PHE A 87 -5.056 -10.905 0.506 1.00 0.00 H new ATOM 1393 N PHE A 88 -3.531 -14.663 3.828 1.00 0.00 N ATOM 1394 CA PHE A 88 -4.881 -14.783 4.444 1.00 0.00 C ATOM 1395 C PHE A 88 -4.888 -16.045 5.321 1.00 0.00 C ATOM 1396 O PHE A 88 -5.509 -16.087 6.365 1.00 0.00 O ATOM 1397 CB PHE A 88 -5.957 -14.875 3.329 1.00 0.00 C ATOM 1398 CG PHE A 88 -6.994 -13.778 3.495 1.00 0.00 C ATOM 1399 CD1 PHE A 88 -7.923 -13.845 4.540 1.00 0.00 C ATOM 1400 CD2 PHE A 88 -7.019 -12.694 2.608 1.00 0.00 C ATOM 1401 CE1 PHE A 88 -8.877 -12.831 4.697 1.00 0.00 C ATOM 1402 CE2 PHE A 88 -7.972 -11.680 2.765 1.00 0.00 C ATOM 1403 CZ PHE A 88 -8.901 -11.749 3.809 1.00 0.00 C ATOM 0 H PHE A 88 -3.482 -14.903 2.838 1.00 0.00 H new ATOM 0 HA PHE A 88 -5.109 -13.911 5.056 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -5.483 -14.790 2.351 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -6.443 -15.850 3.364 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.904 -14.679 5.226 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.302 -12.640 1.802 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -9.594 -12.884 5.503 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -7.990 -10.845 2.080 1.00 0.00 H new ATOM 0 HZ PHE A 88 -9.637 -10.968 3.930 1.00 0.00 H new ATOM 1413 N GLU A 89 -4.187 -17.066 4.901 1.00 0.00 N ATOM 1414 CA GLU A 89 -4.126 -18.328 5.697 1.00 0.00 C ATOM 1415 C GLU A 89 -2.820 -18.351 6.494 1.00 0.00 C ATOM 1416 O GLU A 89 -1.854 -18.976 6.104 1.00 0.00 O ATOM 1417 CB GLU A 89 -4.166 -19.530 4.749 1.00 0.00 C ATOM 1418 CG GLU A 89 -4.333 -20.818 5.560 1.00 0.00 C ATOM 1419 CD GLU A 89 -5.749 -20.881 6.134 1.00 0.00 C ATOM 1420 OE1 GLU A 89 -6.661 -21.177 5.378 1.00 0.00 O ATOM 1421 OE2 GLU A 89 -5.899 -20.632 7.319 1.00 0.00 O ATOM 0 H GLU A 89 -3.650 -17.080 4.034 1.00 0.00 H new ATOM 0 HA GLU A 89 -4.975 -18.377 6.379 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.990 -19.423 4.044 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.248 -19.574 4.162 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -4.147 -21.685 4.927 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.601 -20.850 6.367 1.00 0.00 H new ATOM 1428 N HIS A 90 -2.783 -17.673 7.610 1.00 0.00 N ATOM 1429 CA HIS A 90 -1.540 -17.654 8.434 1.00 0.00 C ATOM 1430 C HIS A 90 -1.490 -18.908 9.310 1.00 0.00 C ATOM 1431 O HIS A 90 -2.310 -19.099 10.186 1.00 0.00 O ATOM 1432 CB HIS A 90 -1.539 -16.409 9.323 1.00 0.00 C ATOM 1433 CG HIS A 90 -0.188 -16.253 9.966 1.00 0.00 C ATOM 1434 ND1 HIS A 90 0.868 -15.626 9.323 1.00 0.00 N ATOM 1435 CD2 HIS A 90 0.294 -16.638 11.192 1.00 0.00 C ATOM 1436 CE1 HIS A 90 1.923 -15.651 10.158 1.00 0.00 C ATOM 1437 NE2 HIS A 90 1.628 -16.256 11.311 1.00 0.00 N ATOM 0 H HIS A 90 -3.561 -17.131 7.987 1.00 0.00 H new ATOM 0 HA HIS A 90 -0.669 -17.634 7.779 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -1.776 -15.526 8.730 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -2.310 -16.495 10.088 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -0.274 -17.158 11.949 1.00 0.00 H new ATOM 0 HE1 HIS A 90 2.891 -15.233 9.924 1.00 0.00 H new ATOM 0 HE2 HIS A 90 2.247 -16.406 12.108 1.00 0.00 H new ATOM 1445 N GLU A 91 -0.531 -19.764 9.082 1.00 0.00 N ATOM 1446 CA GLU A 91 -0.427 -21.003 9.903 1.00 0.00 C ATOM 1447 C GLU A 91 -0.173 -20.627 11.364 1.00 0.00 C ATOM 1448 O GLU A 91 -1.061 -20.837 12.173 1.00 0.00 O ATOM 1449 CB GLU A 91 0.730 -21.862 9.388 1.00 0.00 C ATOM 1450 CG GLU A 91 0.559 -22.108 7.887 1.00 0.00 C ATOM 1451 CD GLU A 91 1.794 -22.828 7.342 1.00 0.00 C ATOM 1452 OE1 GLU A 91 2.042 -23.944 7.768 1.00 0.00 O ATOM 1453 OE2 GLU A 91 2.471 -22.251 6.507 1.00 0.00 O ATOM 1454 OXT GLU A 91 0.907 -20.134 11.649 1.00 0.00 O ATOM 0 H GLU A 91 0.185 -19.658 8.363 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.357 -21.566 9.829 1.00 0.00 H new ATOM 0 HB2 GLU A 91 1.680 -21.363 9.579 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.756 -22.812 9.922 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.333 -22.707 7.706 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.418 -21.161 7.366 1.00 0.00 H new TER 1461 GLU A 91 ATOM 1462 N MET B 0 10.477 -6.910 13.978 1.00 0.00 N ATOM 1463 CA MET B 0 9.139 -6.485 14.477 1.00 0.00 C ATOM 1464 C MET B 0 9.105 -4.961 14.612 1.00 0.00 C ATOM 1465 O MET B 0 8.894 -4.428 15.684 1.00 0.00 O ATOM 1466 CB MET B 0 8.878 -7.122 15.844 1.00 0.00 C ATOM 1467 CG MET B 0 8.762 -8.639 15.687 1.00 0.00 C ATOM 1468 SD MET B 0 8.543 -9.398 17.315 1.00 0.00 S ATOM 1469 CE MET B 0 8.085 -11.050 16.735 1.00 0.00 C ATOM 0 H1 MET B 0 10.358 -7.554 13.170 1.00 0.00 H new ATOM 0 H2 MET B 0 11.017 -6.074 13.677 1.00 0.00 H new ATOM 0 H3 MET B 0 10.991 -7.400 14.738 1.00 0.00 H new ATOM 0 HA MET B 0 8.371 -6.806 13.773 1.00 0.00 H new ATOM 0 HB2 MET B 0 9.688 -6.878 16.531 1.00 0.00 H new ATOM 0 HB3 MET B 0 7.962 -6.719 16.276 1.00 0.00 H new ATOM 0 HG2 MET B 0 7.918 -8.885 15.042 1.00 0.00 H new ATOM 0 HG3 MET B 0 9.657 -9.035 15.206 1.00 0.00 H new ATOM 0 HE1 MET B 0 7.900 -11.698 17.592 1.00 0.00 H new ATOM 0 HE2 MET B 0 7.182 -10.985 16.128 1.00 0.00 H new ATOM 0 HE3 MET B 0 8.896 -11.463 16.136 1.00 0.00 H new ATOM 1481 N SER B 1 9.307 -4.254 13.534 1.00 0.00 N ATOM 1482 CA SER B 1 9.283 -2.765 13.606 1.00 0.00 C ATOM 1483 C SER B 1 7.831 -2.284 13.604 1.00 0.00 C ATOM 1484 O SER B 1 6.919 -3.037 13.327 1.00 0.00 O ATOM 1485 CB SER B 1 10.013 -2.185 12.395 1.00 0.00 C ATOM 1486 OG SER B 1 9.252 -2.445 11.222 1.00 0.00 O ATOM 0 H SER B 1 9.487 -4.642 12.608 1.00 0.00 H new ATOM 0 HA SER B 1 9.777 -2.434 14.520 1.00 0.00 H new ATOM 0 HB2 SER B 1 10.155 -1.112 12.521 1.00 0.00 H new ATOM 0 HB3 SER B 1 11.004 -2.629 12.306 1.00 0.00 H new ATOM 0 HG SER B 1 9.715 -2.073 10.442 1.00 0.00 H new ATOM 1492 N GLU B 2 7.607 -1.035 13.908 1.00 0.00 N ATOM 1493 CA GLU B 2 6.212 -0.517 13.917 1.00 0.00 C ATOM 1494 C GLU B 2 5.562 -0.807 12.563 1.00 0.00 C ATOM 1495 O GLU B 2 4.374 -1.043 12.467 1.00 0.00 O ATOM 1496 CB GLU B 2 6.230 0.994 14.160 1.00 0.00 C ATOM 1497 CG GLU B 2 6.622 1.276 15.613 1.00 0.00 C ATOM 1498 CD GLU B 2 5.438 0.971 16.532 1.00 0.00 C ATOM 1499 OE1 GLU B 2 4.419 1.627 16.391 1.00 0.00 O ATOM 1500 OE2 GLU B 2 5.570 0.086 17.362 1.00 0.00 O ATOM 0 H GLU B 2 8.327 -0.354 14.149 1.00 0.00 H new ATOM 0 HA GLU B 2 5.644 -1.004 14.710 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.937 1.473 13.483 1.00 0.00 H new ATOM 0 HB3 GLU B 2 5.248 1.418 13.949 1.00 0.00 H new ATOM 0 HG2 GLU B 2 7.480 0.665 15.894 1.00 0.00 H new ATOM 0 HG3 GLU B 2 6.922 2.318 15.724 1.00 0.00 H new ATOM 1507 N LEU B 3 6.338 -0.779 11.513 1.00 0.00 N ATOM 1508 CA LEU B 3 5.780 -1.040 10.157 1.00 0.00 C ATOM 1509 C LEU B 3 5.211 -2.464 10.095 1.00 0.00 C ATOM 1510 O LEU B 3 4.090 -2.675 9.679 1.00 0.00 O ATOM 1511 CB LEU B 3 6.900 -0.870 9.111 1.00 0.00 C ATOM 1512 CG LEU B 3 6.318 -0.386 7.776 1.00 0.00 C ATOM 1513 CD1 LEU B 3 7.451 -0.213 6.761 1.00 0.00 C ATOM 1514 CD2 LEU B 3 5.310 -1.414 7.249 1.00 0.00 C ATOM 0 H LEU B 3 7.339 -0.586 11.538 1.00 0.00 H new ATOM 0 HA LEU B 3 4.977 -0.334 9.946 1.00 0.00 H new ATOM 0 HB2 LEU B 3 7.639 -0.155 9.473 1.00 0.00 H new ATOM 0 HB3 LEU B 3 7.418 -1.818 8.967 1.00 0.00 H new ATOM 0 HG LEU B 3 5.813 0.568 7.926 1.00 0.00 H new ATOM 0 HD11 LEU B 3 7.040 0.131 5.812 1.00 0.00 H new ATOM 0 HD12 LEU B 3 8.165 0.521 7.134 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.956 -1.168 6.613 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.899 -1.067 6.301 1.00 0.00 H new ATOM 0 HD22 LEU B 3 5.811 -2.371 7.099 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.503 -1.536 7.972 1.00 0.00 H new ATOM 1526 N GLU B 4 5.973 -3.446 10.501 1.00 0.00 N ATOM 1527 CA GLU B 4 5.464 -4.845 10.450 1.00 0.00 C ATOM 1528 C GLU B 4 4.132 -4.932 11.200 1.00 0.00 C ATOM 1529 O GLU B 4 3.159 -5.467 10.708 1.00 0.00 O ATOM 1530 CB GLU B 4 6.484 -5.785 11.099 1.00 0.00 C ATOM 1531 CG GLU B 4 7.701 -5.925 10.180 1.00 0.00 C ATOM 1532 CD GLU B 4 8.806 -6.698 10.904 1.00 0.00 C ATOM 1533 OE1 GLU B 4 8.486 -7.677 11.558 1.00 0.00 O ATOM 1534 OE2 GLU B 4 9.953 -6.297 10.792 1.00 0.00 O ATOM 0 H GLU B 4 6.920 -3.339 10.864 1.00 0.00 H new ATOM 0 HA GLU B 4 5.313 -5.139 9.411 1.00 0.00 H new ATOM 0 HB2 GLU B 4 6.790 -5.394 12.069 1.00 0.00 H new ATOM 0 HB3 GLU B 4 6.034 -6.762 11.277 1.00 0.00 H new ATOM 0 HG2 GLU B 4 7.420 -6.445 9.264 1.00 0.00 H new ATOM 0 HG3 GLU B 4 8.064 -4.940 9.888 1.00 0.00 H new ATOM 1541 N LYS B 5 4.090 -4.396 12.390 1.00 0.00 N ATOM 1542 CA LYS B 5 2.835 -4.424 13.194 1.00 0.00 C ATOM 1543 C LYS B 5 1.659 -3.959 12.334 1.00 0.00 C ATOM 1544 O LYS B 5 0.570 -4.495 12.396 1.00 0.00 O ATOM 1545 CB LYS B 5 2.986 -3.460 14.377 1.00 0.00 C ATOM 1546 CG LYS B 5 3.917 -4.071 15.427 1.00 0.00 C ATOM 1547 CD LYS B 5 4.006 -3.134 16.634 1.00 0.00 C ATOM 1548 CE LYS B 5 5.053 -3.660 17.617 1.00 0.00 C ATOM 1549 NZ LYS B 5 6.385 -3.701 16.950 1.00 0.00 N ATOM 0 H LYS B 5 4.879 -3.936 12.843 1.00 0.00 H new ATOM 0 HA LYS B 5 2.652 -5.439 13.546 1.00 0.00 H new ATOM 0 HB2 LYS B 5 3.387 -2.507 14.032 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.010 -3.255 14.818 1.00 0.00 H new ATOM 0 HG2 LYS B 5 3.543 -5.047 15.737 1.00 0.00 H new ATOM 0 HG3 LYS B 5 4.908 -4.230 15.002 1.00 0.00 H new ATOM 0 HD2 LYS B 5 4.272 -2.129 16.308 1.00 0.00 H new ATOM 0 HD3 LYS B 5 3.035 -3.064 17.125 1.00 0.00 H new ATOM 0 HE2 LYS B 5 5.095 -3.019 18.498 1.00 0.00 H new ATOM 0 HE3 LYS B 5 4.776 -4.656 17.961 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 7.135 -3.639 17.668 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 6.482 -4.593 16.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 6.469 -2.900 16.292 1.00 0.00 H new ATOM 1563 N ALA B 6 1.881 -2.945 11.545 1.00 0.00 N ATOM 1564 CA ALA B 6 0.803 -2.392 10.677 1.00 0.00 C ATOM 1565 C ALA B 6 0.585 -3.266 9.434 1.00 0.00 C ATOM 1566 O ALA B 6 -0.513 -3.342 8.921 1.00 0.00 O ATOM 1567 CB ALA B 6 1.195 -0.969 10.256 1.00 0.00 C ATOM 0 H ALA B 6 2.779 -2.468 11.464 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.132 -2.377 11.237 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.415 -0.550 9.620 1.00 0.00 H new ATOM 0 HB2 ALA B 6 1.313 -0.347 11.143 1.00 0.00 H new ATOM 0 HB3 ALA B 6 2.136 -0.998 9.706 1.00 0.00 H new ATOM 1573 N MET B 7 1.587 -3.939 8.947 1.00 0.00 N ATOM 1574 CA MET B 7 1.355 -4.800 7.752 1.00 0.00 C ATOM 1575 C MET B 7 0.345 -5.889 8.140 1.00 0.00 C ATOM 1576 O MET B 7 -0.631 -6.130 7.449 1.00 0.00 O ATOM 1577 CB MET B 7 2.692 -5.435 7.296 1.00 0.00 C ATOM 1578 CG MET B 7 3.235 -4.701 6.062 1.00 0.00 C ATOM 1579 SD MET B 7 2.342 -5.268 4.589 1.00 0.00 S ATOM 1580 CE MET B 7 2.245 -3.676 3.731 1.00 0.00 C ATOM 0 H MET B 7 2.539 -3.934 9.314 1.00 0.00 H new ATOM 0 HA MET B 7 0.962 -4.210 6.924 1.00 0.00 H new ATOM 0 HB2 MET B 7 3.420 -5.388 8.106 1.00 0.00 H new ATOM 0 HB3 MET B 7 2.542 -6.489 7.064 1.00 0.00 H new ATOM 0 HG2 MET B 7 3.115 -3.624 6.183 1.00 0.00 H new ATOM 0 HG3 MET B 7 4.302 -4.892 5.951 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.722 -3.805 2.783 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.703 -2.961 4.350 1.00 0.00 H new ATOM 0 HE3 MET B 7 3.251 -3.302 3.542 1.00 0.00 H new ATOM 1590 N VAL B 8 0.565 -6.540 9.248 1.00 0.00 N ATOM 1591 CA VAL B 8 -0.380 -7.601 9.684 1.00 0.00 C ATOM 1592 C VAL B 8 -1.721 -6.961 10.046 1.00 0.00 C ATOM 1593 O VAL B 8 -2.771 -7.513 9.787 1.00 0.00 O ATOM 1594 CB VAL B 8 0.199 -8.332 10.901 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -0.494 -9.687 11.065 1.00 0.00 C ATOM 1596 CG2 VAL B 8 1.701 -8.551 10.694 1.00 0.00 C ATOM 0 H VAL B 8 1.358 -6.382 9.869 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.530 -8.319 8.877 1.00 0.00 H new ATOM 0 HB VAL B 8 0.036 -7.732 11.796 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -0.081 -10.205 11.931 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -1.563 -9.534 11.210 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -0.332 -10.289 10.171 1.00 0.00 H new ATOM 0 HG21 VAL B 8 2.115 -9.071 11.558 1.00 0.00 H new ATOM 0 HG22 VAL B 8 1.861 -9.151 9.798 1.00 0.00 H new ATOM 0 HG23 VAL B 8 2.197 -7.587 10.578 1.00 0.00 H new ATOM 1606 N ALA B 9 -1.697 -5.792 10.630 1.00 0.00 N ATOM 1607 CA ALA B 9 -2.977 -5.121 10.986 1.00 0.00 C ATOM 1608 C ALA B 9 -3.809 -4.954 9.715 1.00 0.00 C ATOM 1609 O ALA B 9 -4.980 -5.265 9.684 1.00 0.00 O ATOM 1610 CB ALA B 9 -2.683 -3.746 11.591 1.00 0.00 C ATOM 0 H ALA B 9 -0.851 -5.277 10.874 1.00 0.00 H new ATOM 0 HA ALA B 9 -3.524 -5.721 11.714 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -3.621 -3.255 11.851 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.075 -3.865 12.488 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.144 -3.137 10.865 1.00 0.00 H new ATOM 1616 N LEU B 10 -3.218 -4.459 8.667 1.00 0.00 N ATOM 1617 CA LEU B 10 -3.990 -4.268 7.404 1.00 0.00 C ATOM 1618 C LEU B 10 -4.799 -5.532 7.109 1.00 0.00 C ATOM 1619 O LEU B 10 -5.945 -5.471 6.710 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.011 -4.029 6.244 1.00 0.00 C ATOM 1621 CG LEU B 10 -2.418 -2.611 6.321 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -1.332 -2.471 5.248 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -3.514 -1.545 6.090 1.00 0.00 C ATOM 0 H LEU B 10 -2.238 -4.178 8.627 1.00 0.00 H new ATOM 0 HA LEU B 10 -4.659 -3.414 7.513 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.210 -4.767 6.279 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.526 -4.163 5.293 1.00 0.00 H new ATOM 0 HG LEU B 10 -1.993 -2.456 7.313 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -0.904 -1.470 5.292 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -0.549 -3.209 5.424 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.770 -2.635 4.263 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.072 -0.550 6.149 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.958 -1.687 5.105 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -4.286 -1.645 6.853 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.210 -6.680 7.320 1.00 0.00 N ATOM 1636 CA ILE B 11 -4.952 -7.947 7.067 1.00 0.00 C ATOM 1637 C ILE B 11 -6.121 -8.035 8.053 1.00 0.00 C ATOM 1638 O ILE B 11 -7.220 -8.419 7.704 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.014 -9.138 7.274 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -2.799 -8.991 6.355 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -4.749 -10.437 6.936 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -1.774 -10.076 6.687 1.00 0.00 C ATOM 0 H ILE B 11 -3.253 -6.793 7.655 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.327 -7.963 6.044 1.00 0.00 H new ATOM 0 HB ILE B 11 -3.688 -9.166 8.314 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.106 -9.073 5.312 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.353 -8.004 6.479 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.079 -11.284 7.084 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -5.617 -10.544 7.586 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.075 -10.410 5.896 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.909 -9.971 6.033 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.458 -9.973 7.725 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.223 -11.058 6.540 1.00 0.00 H new ATOM 1654 N ASP B 12 -5.882 -7.674 9.285 1.00 0.00 N ATOM 1655 CA ASP B 12 -6.956 -7.719 10.316 1.00 0.00 C ATOM 1656 C ASP B 12 -8.189 -6.960 9.832 1.00 0.00 C ATOM 1657 O ASP B 12 -9.298 -7.453 9.885 1.00 0.00 O ATOM 1658 CB ASP B 12 -6.454 -7.047 11.597 1.00 0.00 C ATOM 1659 CG ASP B 12 -5.146 -7.706 12.037 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -4.549 -8.392 11.223 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -4.764 -7.516 13.179 1.00 0.00 O ATOM 0 H ASP B 12 -4.977 -7.346 9.624 1.00 0.00 H new ATOM 0 HA ASP B 12 -7.216 -8.761 10.502 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.298 -5.982 11.425 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.202 -7.136 12.385 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.005 -5.741 9.387 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.171 -4.931 8.932 1.00 0.00 C ATOM 1668 C VAL B 13 -9.656 -5.393 7.555 1.00 0.00 C ATOM 1669 O VAL B 13 -10.843 -5.534 7.338 1.00 0.00 O ATOM 1670 CB VAL B 13 -8.785 -3.451 8.896 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -9.923 -2.633 8.280 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -8.523 -2.966 10.325 1.00 0.00 C ATOM 0 H VAL B 13 -7.100 -5.276 9.320 1.00 0.00 H new ATOM 0 HA VAL B 13 -9.990 -5.071 9.637 1.00 0.00 H new ATOM 0 HB VAL B 13 -7.886 -3.324 8.292 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -9.643 -1.580 8.257 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.113 -2.981 7.264 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -10.825 -2.755 8.880 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.247 -1.912 10.307 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.424 -3.095 10.924 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -7.710 -3.546 10.763 1.00 0.00 H new ATOM 1682 N PHE B 14 -8.784 -5.624 6.617 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.282 -6.062 5.283 1.00 0.00 C ATOM 1684 C PHE B 14 -10.157 -7.304 5.469 1.00 0.00 C ATOM 1685 O PHE B 14 -11.127 -7.514 4.765 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.109 -6.393 4.358 1.00 0.00 C ATOM 1687 CG PHE B 14 -8.644 -6.735 2.987 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -8.871 -5.719 2.050 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -8.918 -8.067 2.654 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -9.371 -6.036 0.781 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.417 -8.384 1.384 1.00 0.00 C ATOM 1692 CZ PHE B 14 -9.645 -7.368 0.448 1.00 0.00 C ATOM 0 H PHE B 14 -7.772 -5.532 6.709 1.00 0.00 H new ATOM 0 HA PHE B 14 -9.862 -5.258 4.831 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.428 -5.544 4.295 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -7.538 -7.231 4.759 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -8.660 -4.691 2.306 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.745 -8.851 3.377 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.545 -5.252 0.059 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.626 -9.412 1.127 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.032 -7.612 -0.530 1.00 0.00 H new ATOM 1702 N HIS B 15 -9.810 -8.129 6.419 1.00 0.00 N ATOM 1703 CA HIS B 15 -10.597 -9.367 6.674 1.00 0.00 C ATOM 1704 C HIS B 15 -11.864 -9.027 7.467 1.00 0.00 C ATOM 1705 O HIS B 15 -12.880 -9.682 7.343 1.00 0.00 O ATOM 1706 CB HIS B 15 -9.733 -10.349 7.474 1.00 0.00 C ATOM 1707 CG HIS B 15 -10.557 -11.533 7.904 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -10.242 -12.282 9.026 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -11.683 -12.110 7.373 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -11.161 -13.258 9.134 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.064 -13.199 8.151 1.00 0.00 N ATOM 0 H HIS B 15 -9.007 -7.996 7.034 1.00 0.00 H new ATOM 0 HA HIS B 15 -10.887 -9.818 5.725 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -8.892 -10.683 6.867 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -9.316 -9.849 8.349 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.196 -11.770 6.485 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -11.168 -13.999 9.920 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.861 -13.818 8.003 1.00 0.00 H new ATOM 1719 N GLN B 16 -11.803 -8.021 8.299 1.00 0.00 N ATOM 1720 CA GLN B 16 -12.994 -7.656 9.119 1.00 0.00 C ATOM 1721 C GLN B 16 -14.201 -7.404 8.215 1.00 0.00 C ATOM 1722 O GLN B 16 -15.292 -7.868 8.484 1.00 0.00 O ATOM 1723 CB GLN B 16 -12.692 -6.398 9.936 1.00 0.00 C ATOM 1724 CG GLN B 16 -13.757 -6.225 11.020 1.00 0.00 C ATOM 1725 CD GLN B 16 -13.555 -7.284 12.105 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -12.606 -8.041 12.062 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -14.414 -7.370 13.084 1.00 0.00 N ATOM 0 H GLN B 16 -10.980 -7.437 8.446 1.00 0.00 H new ATOM 0 HA GLN B 16 -13.223 -8.481 9.794 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -11.704 -6.475 10.391 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -12.675 -5.524 9.285 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.691 -5.227 11.454 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -14.752 -6.319 10.586 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -15.211 -6.735 13.120 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -14.288 -8.073 13.813 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.027 -6.674 7.147 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.176 -6.400 6.241 1.00 0.00 C ATOM 1738 C TYR B 17 -15.533 -7.676 5.480 1.00 0.00 C ATOM 1739 O TYR B 17 -16.689 -8.025 5.343 1.00 0.00 O ATOM 1740 CB TYR B 17 -14.794 -5.300 5.246 1.00 0.00 C ATOM 1741 CG TYR B 17 -14.817 -3.957 5.940 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -13.766 -3.592 6.790 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -15.888 -3.079 5.734 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -13.787 -2.350 7.435 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -15.909 -1.837 6.379 1.00 0.00 C ATOM 1746 CZ TYR B 17 -14.858 -1.472 7.229 1.00 0.00 C ATOM 1747 OH TYR B 17 -14.877 -0.248 7.865 1.00 0.00 O ATOM 0 H TYR B 17 -13.140 -6.257 6.864 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.034 -6.072 6.828 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -13.802 -5.493 4.839 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -15.489 -5.298 4.406 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -12.939 -4.269 6.948 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -16.698 -3.360 5.077 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -12.977 -2.069 8.092 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.736 -1.160 6.221 1.00 0.00 H new ATOM 0 HH TYR B 17 -13.969 0.120 7.894 1.00 0.00 H new ATOM 1757 N SER B 18 -14.548 -8.372 4.976 1.00 0.00 N ATOM 1758 CA SER B 18 -14.821 -9.627 4.212 1.00 0.00 C ATOM 1759 C SER B 18 -14.597 -10.848 5.108 1.00 0.00 C ATOM 1760 O SER B 18 -13.808 -11.714 4.790 1.00 0.00 O ATOM 1761 CB SER B 18 -13.872 -9.702 3.017 1.00 0.00 C ATOM 1762 OG SER B 18 -14.076 -8.570 2.182 1.00 0.00 O ATOM 0 H SER B 18 -13.562 -8.125 5.061 1.00 0.00 H new ATOM 0 HA SER B 18 -15.856 -9.620 3.870 1.00 0.00 H new ATOM 0 HB2 SER B 18 -12.838 -9.733 3.361 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.049 -10.619 2.455 1.00 0.00 H new ATOM 0 HG SER B 18 -13.467 -8.615 1.415 1.00 0.00 H new ATOM 1768 N GLY B 19 -15.306 -10.946 6.211 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.163 -12.131 7.120 1.00 0.00 C ATOM 1770 C GLY B 19 -16.497 -12.878 7.118 1.00 0.00 C ATOM 1771 O GLY B 19 -16.607 -13.987 7.603 1.00 0.00 O ATOM 0 H GLY B 19 -15.983 -10.249 6.522 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -14.359 -12.782 6.777 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -14.905 -11.811 8.129 1.00 0.00 H new ATOM 1775 N ARG B 20 -17.501 -12.280 6.541 1.00 0.00 N ATOM 1776 CA ARG B 20 -18.835 -12.939 6.451 1.00 0.00 C ATOM 1777 C ARG B 20 -18.727 -14.170 5.555 1.00 0.00 C ATOM 1778 O ARG B 20 -19.331 -15.186 5.838 1.00 0.00 O ATOM 1779 CB ARG B 20 -19.851 -11.959 5.860 1.00 0.00 C ATOM 1780 CG ARG B 20 -19.980 -10.742 6.778 1.00 0.00 C ATOM 1781 CD ARG B 20 -21.110 -9.842 6.274 1.00 0.00 C ATOM 1782 NE ARG B 20 -20.792 -9.369 4.895 1.00 0.00 N ATOM 1783 CZ ARG B 20 -21.752 -8.987 4.096 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -22.924 -8.685 4.582 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -21.539 -8.907 2.811 1.00 0.00 N ATOM 0 H ARG B 20 -17.454 -11.351 6.122 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.164 -13.240 7.446 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -19.534 -11.646 4.865 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.819 -12.447 5.747 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -20.184 -11.063 7.799 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.041 -10.188 6.800 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -22.053 -10.389 6.274 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -21.236 -8.990 6.942 1.00 0.00 H new ATOM 0 HE ARG B 20 -19.824 -9.344 4.576 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -23.091 -8.747 5.586 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -23.674 -8.387 3.958 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -20.623 -9.143 2.430 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -22.289 -8.609 2.187 1.00 0.00 H new ATOM 1799 N GLU B 21 -17.957 -14.121 4.496 1.00 0.00 N ATOM 1800 CA GLU B 21 -17.826 -15.335 3.626 1.00 0.00 C ATOM 1801 C GLU B 21 -16.389 -15.446 3.110 1.00 0.00 C ATOM 1802 O GLU B 21 -15.803 -16.510 3.118 1.00 0.00 O ATOM 1803 CB GLU B 21 -18.789 -15.226 2.436 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.215 -15.563 2.881 1.00 0.00 C ATOM 1805 CD GLU B 21 -20.333 -17.069 3.125 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -19.336 -17.755 2.970 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -21.419 -17.512 3.460 1.00 0.00 O ATOM 0 H GLU B 21 -17.420 -13.307 4.198 1.00 0.00 H new ATOM 0 HA GLU B 21 -18.072 -16.222 4.210 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -18.757 -14.218 2.023 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -18.477 -15.905 1.642 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -20.462 -15.016 3.791 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -20.928 -15.251 2.118 1.00 0.00 H new ATOM 1814 N GLY B 22 -15.812 -14.363 2.666 1.00 0.00 N ATOM 1815 CA GLY B 22 -14.410 -14.425 2.156 1.00 0.00 C ATOM 1816 C GLY B 22 -14.268 -15.603 1.191 1.00 0.00 C ATOM 1817 O GLY B 22 -13.174 -15.990 0.833 1.00 0.00 O ATOM 0 H GLY B 22 -16.247 -13.441 2.634 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.155 -13.494 1.650 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -13.714 -14.537 2.988 1.00 0.00 H new ATOM 1821 N ASP B 23 -15.361 -16.178 0.763 1.00 0.00 N ATOM 1822 CA ASP B 23 -15.267 -17.328 -0.182 1.00 0.00 C ATOM 1823 C ASP B 23 -14.319 -16.945 -1.320 1.00 0.00 C ATOM 1824 O ASP B 23 -13.327 -17.604 -1.562 1.00 0.00 O ATOM 1825 CB ASP B 23 -16.652 -17.642 -0.751 1.00 0.00 C ATOM 1826 CG ASP B 23 -16.589 -18.943 -1.553 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -16.029 -19.901 -1.046 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -17.102 -18.959 -2.660 1.00 0.00 O ATOM 0 H ASP B 23 -16.308 -15.903 1.025 1.00 0.00 H new ATOM 0 HA ASP B 23 -14.891 -18.209 0.338 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.377 -17.735 0.058 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -16.989 -16.825 -1.389 1.00 0.00 H new ATOM 1833 N LYS B 24 -14.600 -15.866 -2.000 1.00 0.00 N ATOM 1834 CA LYS B 24 -13.697 -15.420 -3.100 1.00 0.00 C ATOM 1835 C LYS B 24 -12.649 -14.472 -2.510 1.00 0.00 C ATOM 1836 O LYS B 24 -12.867 -13.853 -1.487 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.506 -14.679 -4.167 1.00 0.00 C ATOM 1838 CG LYS B 24 -15.560 -15.614 -4.762 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.368 -14.858 -5.819 1.00 0.00 C ATOM 1840 CE LYS B 24 -17.392 -15.801 -6.454 1.00 0.00 C ATOM 1841 NZ LYS B 24 -18.150 -16.505 -5.382 1.00 0.00 N ATOM 0 H LYS B 24 -15.416 -15.274 -1.841 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.214 -16.284 -3.557 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -14.988 -13.805 -3.729 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -13.843 -14.317 -4.953 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -15.080 -16.485 -5.209 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.221 -15.982 -3.977 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.875 -14.007 -5.364 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.702 -14.460 -6.584 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -18.076 -15.238 -7.088 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -16.888 -16.525 -7.093 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -19.104 -16.737 -5.726 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -17.653 -17.381 -5.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -18.224 -15.889 -4.547 1.00 0.00 H new ATOM 1855 N HIS B 25 -11.531 -14.325 -3.168 1.00 0.00 N ATOM 1856 CA HIS B 25 -10.470 -13.387 -2.686 1.00 0.00 C ATOM 1857 C HIS B 25 -10.478 -12.187 -3.627 1.00 0.00 C ATOM 1858 O HIS B 25 -9.449 -11.727 -4.080 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.104 -14.074 -2.742 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.138 -15.337 -1.926 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -8.822 -16.574 -2.466 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -9.442 -15.570 -0.608 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -8.942 -17.487 -1.486 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -9.317 -16.928 -0.332 1.00 0.00 N ATOM 0 H HIS B 25 -11.303 -14.820 -4.030 1.00 0.00 H new ATOM 0 HA HIS B 25 -10.658 -13.082 -1.657 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -8.844 -14.304 -3.775 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -8.333 -13.404 -2.361 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -9.734 -14.814 0.106 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -8.758 -18.543 -1.616 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -9.477 -17.396 0.560 1.00 0.00 H new ATOM 1872 N LYS B 26 -11.649 -11.685 -3.922 1.00 0.00 N ATOM 1873 CA LYS B 26 -11.774 -10.512 -4.838 1.00 0.00 C ATOM 1874 C LYS B 26 -12.720 -9.475 -4.221 1.00 0.00 C ATOM 1875 O LYS B 26 -13.608 -9.813 -3.463 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.340 -10.985 -6.178 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.304 -11.868 -6.876 1.00 0.00 C ATOM 1878 CD LYS B 26 -11.900 -12.448 -8.160 1.00 0.00 C ATOM 1879 CE LYS B 26 -10.838 -13.277 -8.886 1.00 0.00 C ATOM 1880 NZ LYS B 26 -10.635 -14.567 -8.166 1.00 0.00 N ATOM 0 H LYS B 26 -12.534 -12.042 -3.563 1.00 0.00 H new ATOM 0 HA LYS B 26 -10.794 -10.058 -4.989 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.264 -11.542 -6.020 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.587 -10.128 -6.805 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.413 -11.285 -7.109 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -10.993 -12.674 -6.212 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -12.764 -13.070 -7.924 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.253 -11.644 -8.806 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.149 -13.467 -9.913 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -9.900 -12.724 -8.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -10.031 -15.192 -8.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -10.177 -14.385 -7.250 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -11.555 -15.025 -8.008 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.537 -8.218 -4.543 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.421 -7.141 -3.985 1.00 0.00 C ATOM 1896 C LEU B 27 -14.004 -6.336 -5.147 1.00 0.00 C ATOM 1897 O LEU B 27 -13.339 -6.095 -6.134 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.588 -6.219 -3.088 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.508 -5.303 -2.262 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.320 -6.125 -1.235 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.647 -4.267 -1.530 1.00 0.00 C ATOM 0 H LEU B 27 -11.807 -7.887 -5.174 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.227 -7.582 -3.399 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -11.964 -6.815 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -11.916 -5.616 -3.699 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.209 -4.804 -2.931 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -14.964 -5.458 -0.662 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -14.933 -6.859 -1.759 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.637 -6.639 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.289 -3.612 -0.941 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -11.946 -4.778 -0.870 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.094 -3.674 -2.258 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.243 -5.920 -5.049 1.00 0.00 N ATOM 1914 CA LYS B 28 -15.859 -5.134 -6.164 1.00 0.00 C ATOM 1915 C LYS B 28 -15.670 -3.636 -5.904 1.00 0.00 C ATOM 1916 O LYS B 28 -15.487 -3.211 -4.781 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.351 -5.461 -6.257 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.528 -6.875 -6.815 1.00 0.00 C ATOM 1919 CD LYS B 28 -18.961 -7.350 -6.564 1.00 0.00 C ATOM 1920 CE LYS B 28 -19.946 -6.340 -7.153 1.00 0.00 C ATOM 1921 NZ LYS B 28 -19.461 -5.893 -8.489 1.00 0.00 N ATOM 0 H LYS B 28 -15.852 -6.090 -4.249 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.374 -5.397 -7.104 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.813 -5.386 -5.273 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.853 -4.739 -6.900 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -17.313 -6.885 -7.883 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -16.820 -7.555 -6.341 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.115 -8.330 -7.016 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.136 -7.462 -5.494 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -20.934 -6.791 -7.245 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -20.048 -5.484 -6.486 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -20.271 -5.601 -9.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -18.812 -5.089 -8.371 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -18.961 -6.676 -8.957 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.709 -2.833 -6.932 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.526 -1.365 -6.746 1.00 0.00 C ATOM 1937 C LYS B 29 -16.637 -0.791 -5.852 1.00 0.00 C ATOM 1938 O LYS B 29 -16.401 0.070 -5.029 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.570 -0.677 -8.120 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.694 -1.278 -8.992 1.00 0.00 C ATOM 1941 CD LYS B 29 -17.207 -0.226 -9.985 1.00 0.00 C ATOM 1942 CE LYS B 29 -18.150 -0.890 -10.993 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.949 -1.944 -10.305 1.00 0.00 N ATOM 0 H LYS B 29 -15.860 -3.131 -7.896 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.564 -1.185 -6.265 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -15.734 0.393 -7.992 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.610 -0.794 -8.623 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -16.321 -2.148 -9.532 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -17.512 -1.622 -8.359 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -17.729 0.569 -9.452 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -16.369 0.237 -10.506 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.813 -0.145 -11.433 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.577 -1.328 -11.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.763 -2.205 -10.898 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.354 -2.782 -10.145 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.288 -1.581 -9.391 1.00 0.00 H new ATOM 1957 N SER B 30 -17.846 -1.244 -6.029 1.00 0.00 N ATOM 1958 CA SER B 30 -18.981 -0.713 -5.218 1.00 0.00 C ATOM 1959 C SER B 30 -18.742 -0.936 -3.720 1.00 0.00 C ATOM 1960 O SER B 30 -19.025 -0.079 -2.896 1.00 0.00 O ATOM 1961 CB SER B 30 -20.263 -1.442 -5.627 1.00 0.00 C ATOM 1962 OG SER B 30 -21.215 -1.342 -4.576 1.00 0.00 O ATOM 0 H SER B 30 -18.100 -1.964 -6.705 1.00 0.00 H new ATOM 0 HA SER B 30 -19.067 0.358 -5.400 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.667 -1.007 -6.541 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.048 -2.489 -5.840 1.00 0.00 H new ATOM 0 HG SER B 30 -21.278 -2.201 -4.109 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.229 -2.080 -3.353 1.00 0.00 N ATOM 1969 CA GLU B 31 -17.999 -2.345 -1.903 1.00 0.00 C ATOM 1970 C GLU B 31 -16.745 -1.601 -1.453 1.00 0.00 C ATOM 1971 O GLU B 31 -16.648 -1.130 -0.337 1.00 0.00 O ATOM 1972 CB GLU B 31 -17.833 -3.849 -1.668 1.00 0.00 C ATOM 1973 CG GLU B 31 -19.198 -4.539 -1.736 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.900 -4.167 -3.045 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -20.467 -3.088 -3.104 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -19.858 -4.967 -3.965 1.00 0.00 O ATOM 0 H GLU B 31 -17.962 -2.834 -3.986 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.855 -1.995 -1.326 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.164 -4.272 -2.418 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.374 -4.026 -0.695 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -19.073 -5.620 -1.674 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.811 -4.239 -0.886 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.787 -1.483 -2.332 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.534 -0.761 -1.987 1.00 0.00 C ATOM 1985 C LEU B 32 -14.876 0.701 -1.693 1.00 0.00 C ATOM 1986 O LEU B 32 -14.367 1.281 -0.755 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.552 -0.864 -3.165 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.375 0.107 -2.996 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.678 -0.139 -1.657 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.374 -0.122 -4.131 1.00 0.00 C ATOM 0 H LEU B 32 -15.821 -1.859 -3.280 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.067 -1.201 -1.106 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.176 -1.885 -3.240 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -14.074 -0.647 -4.097 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.748 1.131 -3.022 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.845 0.555 -1.548 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.387 0.015 -0.844 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.304 -1.162 -1.624 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.534 0.564 -4.019 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -11.011 -1.149 -4.094 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.863 0.056 -5.089 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.711 1.322 -2.481 1.00 0.00 N ATOM 2003 CA LYS B 33 -16.020 2.750 -2.210 1.00 0.00 C ATOM 2004 C LYS B 33 -16.494 2.891 -0.768 1.00 0.00 C ATOM 2005 O LYS B 33 -15.939 3.643 0.008 1.00 0.00 O ATOM 2006 CB LYS B 33 -17.109 3.244 -3.164 1.00 0.00 C ATOM 2007 CG LYS B 33 -17.422 4.714 -2.862 1.00 0.00 C ATOM 2008 CD LYS B 33 -18.173 5.336 -4.042 1.00 0.00 C ATOM 2009 CE LYS B 33 -19.445 4.533 -4.321 1.00 0.00 C ATOM 2010 NZ LYS B 33 -20.123 4.211 -3.034 1.00 0.00 N ATOM 0 H LYS B 33 -16.184 0.910 -3.286 1.00 0.00 H new ATOM 0 HA LYS B 33 -15.123 3.350 -2.364 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.779 3.136 -4.197 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -18.008 2.639 -3.051 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -18.023 4.789 -1.956 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -16.498 5.262 -2.677 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -18.427 6.372 -3.819 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -17.536 5.347 -4.927 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -20.115 5.104 -4.964 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -19.198 3.615 -4.854 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -21.132 4.028 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.686 3.366 -2.613 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.025 5.014 -2.380 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.525 2.179 -0.402 1.00 0.00 N ATOM 2025 CA GLU B 34 -18.030 2.292 1.001 1.00 0.00 C ATOM 2026 C GLU B 34 -16.851 2.151 1.973 1.00 0.00 C ATOM 2027 O GLU B 34 -16.796 2.811 2.991 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.057 1.188 1.270 1.00 0.00 C ATOM 2029 CG GLU B 34 -19.792 1.481 2.579 1.00 0.00 C ATOM 2030 CD GLU B 34 -20.728 2.676 2.387 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -21.195 2.864 1.276 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -20.962 3.381 3.354 1.00 0.00 O ATOM 0 H GLU B 34 -18.035 1.532 -1.003 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.506 3.262 1.142 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.769 1.130 0.446 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -18.559 0.220 1.329 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.362 0.606 2.891 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -19.074 1.692 3.371 1.00 0.00 H new ATOM 2039 N LEU B 35 -15.904 1.308 1.665 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.727 1.143 2.569 1.00 0.00 C ATOM 2041 C LEU B 35 -13.889 2.428 2.550 1.00 0.00 C ATOM 2042 O LEU B 35 -13.487 2.927 3.582 1.00 0.00 O ATOM 2043 CB LEU B 35 -13.873 -0.036 2.091 1.00 0.00 C ATOM 2044 CG LEU B 35 -12.787 -0.370 3.137 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.354 -1.310 4.207 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -11.603 -1.059 2.448 1.00 0.00 C ATOM 0 H LEU B 35 -15.893 0.726 0.827 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.071 0.948 3.585 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.506 -0.907 1.923 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.406 0.208 1.137 1.00 0.00 H new ATOM 0 HG LEU B 35 -12.457 0.557 3.606 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -12.579 -1.538 4.939 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.194 -0.828 4.707 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -13.693 -2.234 3.737 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -10.838 -1.294 3.188 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -11.943 -1.979 1.974 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -11.185 -0.394 1.692 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.637 2.982 1.396 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.846 4.244 1.324 1.00 0.00 C ATOM 2060 C ILE B 36 -13.487 5.305 2.225 1.00 0.00 C ATOM 2061 O ILE B 36 -12.812 6.147 2.783 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.845 4.730 -0.135 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -11.983 3.766 -0.965 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -12.260 6.148 -0.220 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -12.045 4.140 -2.448 1.00 0.00 C ATOM 0 H ILE B 36 -13.946 2.614 0.496 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.824 4.069 1.661 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.865 4.752 -0.518 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -10.950 3.800 -0.617 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.333 2.743 -0.826 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -12.264 6.482 -1.258 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.863 6.827 0.382 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -11.237 6.142 0.155 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.430 3.449 -3.024 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -13.077 4.083 -2.795 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.673 5.156 -2.583 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.786 5.300 2.335 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.473 6.338 3.157 1.00 0.00 C ATOM 2079 C ASN B 37 -15.204 6.150 4.658 1.00 0.00 C ATOM 2080 O ASN B 37 -15.215 7.104 5.410 1.00 0.00 O ATOM 2081 CB ASN B 37 -16.980 6.252 2.905 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.287 6.745 1.490 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -17.134 6.013 0.533 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -17.714 7.966 1.314 1.00 0.00 N ATOM 0 H ASN B 37 -15.404 4.621 1.891 1.00 0.00 H new ATOM 0 HA ASN B 37 -15.084 7.313 2.866 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.322 5.224 3.026 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.517 6.855 3.637 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -17.919 8.304 0.374 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -17.843 8.582 2.117 1.00 0.00 H new ATOM 2091 N ASN B 38 -14.997 4.935 5.109 1.00 0.00 N ATOM 2092 CA ASN B 38 -14.768 4.695 6.577 1.00 0.00 C ATOM 2093 C ASN B 38 -13.304 4.345 6.865 1.00 0.00 C ATOM 2094 O ASN B 38 -12.941 4.114 8.001 1.00 0.00 O ATOM 2095 CB ASN B 38 -15.652 3.532 7.031 1.00 0.00 C ATOM 2096 CG ASN B 38 -15.382 3.230 8.507 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -15.193 2.089 8.881 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -15.356 4.211 9.367 1.00 0.00 N ATOM 0 H ASN B 38 -14.976 4.097 4.527 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.016 5.608 7.118 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.703 3.782 6.887 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.449 2.649 6.425 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -15.177 4.020 10.353 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -15.515 5.169 9.053 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.461 4.289 5.861 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.017 3.935 6.099 1.00 0.00 C ATOM 2107 C GLU B 39 -10.112 5.099 5.680 1.00 0.00 C ATOM 2108 O GLU B 39 -8.990 5.207 6.136 1.00 0.00 O ATOM 2109 CB GLU B 39 -10.665 2.685 5.273 1.00 0.00 C ATOM 2110 CG GLU B 39 -11.094 1.422 6.031 1.00 0.00 C ATOM 2111 CD GLU B 39 -12.570 1.530 6.422 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -13.397 1.584 5.527 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -12.848 1.554 7.609 1.00 0.00 O ATOM 0 H GLU B 39 -12.706 4.472 4.888 1.00 0.00 H new ATOM 0 HA GLU B 39 -10.864 3.735 7.160 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.164 2.726 4.305 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.593 2.657 5.078 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -10.937 0.542 5.408 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -10.480 1.295 6.923 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.586 5.970 4.823 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.753 7.137 4.376 1.00 0.00 C ATOM 2122 C LEU B 40 -10.465 8.442 4.742 1.00 0.00 C ATOM 2123 O LEU B 40 -10.250 9.471 4.134 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.562 7.064 2.856 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.506 5.992 2.506 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.752 5.470 1.086 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.093 6.595 2.581 1.00 0.00 C ATOM 0 H LEU B 40 -11.518 5.925 4.410 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.781 7.107 4.869 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.509 6.824 2.373 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.247 8.035 2.474 1.00 0.00 H new ATOM 0 HG LEU B 40 -8.588 5.173 3.221 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -8.006 4.714 0.842 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.747 5.029 1.028 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.678 6.295 0.377 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.357 5.830 2.332 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.012 7.420 1.874 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -6.907 6.963 3.590 1.00 0.00 H new ATOM 2139 N SER B 41 -11.314 8.403 5.732 1.00 0.00 N ATOM 2140 CA SER B 41 -12.045 9.635 6.143 1.00 0.00 C ATOM 2141 C SER B 41 -11.081 10.602 6.835 1.00 0.00 C ATOM 2142 O SER B 41 -11.316 11.793 6.890 1.00 0.00 O ATOM 2143 CB SER B 41 -13.170 9.262 7.108 1.00 0.00 C ATOM 2144 OG SER B 41 -13.910 10.430 7.441 1.00 0.00 O ATOM 0 H SER B 41 -11.534 7.568 6.276 1.00 0.00 H new ATOM 0 HA SER B 41 -12.465 10.115 5.259 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.825 8.520 6.651 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.756 8.810 8.010 1.00 0.00 H new ATOM 0 HG SER B 41 -14.633 10.194 8.059 1.00 0.00 H new ATOM 2150 N HIS B 42 -9.999 10.103 7.369 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.028 10.999 8.059 1.00 0.00 C ATOM 2152 C HIS B 42 -8.310 11.876 7.029 1.00 0.00 C ATOM 2153 O HIS B 42 -8.227 13.079 7.176 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.001 10.148 8.810 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.181 11.029 9.712 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -7.762 11.872 10.647 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -5.826 11.209 9.836 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -6.767 12.514 11.286 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -5.566 12.147 10.830 1.00 0.00 N ATOM 0 H HIS B 42 -9.746 9.115 7.357 1.00 0.00 H new ATOM 0 HA HIS B 42 -9.561 11.637 8.763 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -8.508 9.381 9.396 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.353 9.632 8.102 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -5.075 10.699 9.250 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -6.921 13.238 12.072 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -4.655 12.482 11.143 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.792 11.286 5.986 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.080 12.089 4.950 1.00 0.00 C ATOM 2169 C PHE B 43 -8.104 12.851 4.104 1.00 0.00 C ATOM 2170 O PHE B 43 -7.777 13.804 3.424 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.270 11.153 4.048 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.035 10.678 4.781 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -5.147 9.714 5.792 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -3.778 11.199 4.449 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -4.003 9.272 6.468 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -2.635 10.757 5.126 1.00 0.00 C ATOM 2177 CZ PHE B 43 -2.748 9.794 6.135 1.00 0.00 C ATOM 0 H PHE B 43 -7.831 10.283 5.806 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.409 12.798 5.436 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -6.880 10.299 3.753 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.984 11.672 3.133 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -6.116 9.312 6.050 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -3.690 11.942 3.670 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -4.089 8.528 7.246 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -1.666 11.159 4.870 1.00 0.00 H new ATOM 0 HZ PHE B 43 -1.866 9.453 6.657 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.335 12.425 4.126 1.00 0.00 N ATOM 2188 CA LEU B 44 -10.381 13.106 3.309 1.00 0.00 C ATOM 2189 C LEU B 44 -10.331 14.620 3.539 1.00 0.00 C ATOM 2190 O LEU B 44 -10.633 15.401 2.659 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.760 12.566 3.709 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.873 13.324 2.968 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.617 13.298 1.454 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -14.216 12.653 3.272 1.00 0.00 C ATOM 0 H LEU B 44 -9.665 11.632 4.676 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.199 12.908 2.253 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.821 11.502 3.478 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.898 12.667 4.785 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.888 14.361 3.302 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.413 13.838 0.941 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.659 13.772 1.239 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.597 12.265 1.106 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -15.014 13.183 2.751 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -14.189 11.616 2.936 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -14.402 12.682 4.346 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.968 15.041 4.718 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.918 16.505 5.004 1.00 0.00 C ATOM 2208 C GLU B 45 -8.597 17.100 4.508 1.00 0.00 C ATOM 2209 O GLU B 45 -8.527 18.258 4.146 1.00 0.00 O ATOM 2210 CB GLU B 45 -10.041 16.733 6.512 1.00 0.00 C ATOM 2211 CG GLU B 45 -9.939 18.232 6.812 1.00 0.00 C ATOM 2212 CD GLU B 45 -10.444 18.508 8.229 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -10.150 17.714 9.107 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -11.116 19.510 8.413 1.00 0.00 O ATOM 0 H GLU B 45 -9.704 14.437 5.496 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.743 16.994 4.486 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.993 16.343 6.873 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.254 16.192 7.038 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.905 18.563 6.713 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.526 18.798 6.089 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.542 16.331 4.513 1.00 0.00 N ATOM 2222 CA GLU B 46 -6.217 16.868 4.068 1.00 0.00 C ATOM 2223 C GLU B 46 -6.016 16.659 2.562 1.00 0.00 C ATOM 2224 O GLU B 46 -5.198 15.861 2.148 1.00 0.00 O ATOM 2225 CB GLU B 46 -5.103 16.144 4.825 1.00 0.00 C ATOM 2226 CG GLU B 46 -5.400 16.172 6.326 1.00 0.00 C ATOM 2227 CD GLU B 46 -4.139 15.792 7.104 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -3.852 14.609 7.188 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.482 16.690 7.603 1.00 0.00 O ATOM 0 H GLU B 46 -7.537 15.354 4.805 1.00 0.00 H new ATOM 0 HA GLU B 46 -6.189 17.937 4.277 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -5.025 15.113 4.479 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -4.144 16.621 4.625 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -5.737 17.165 6.622 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -6.207 15.478 6.561 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.740 17.384 1.741 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.580 17.251 0.254 1.00 0.00 C ATOM 2238 C ILE B 47 -6.325 18.632 -0.354 1.00 0.00 C ATOM 2239 O ILE B 47 -7.207 19.466 -0.402 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.854 16.670 -0.362 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -8.209 15.352 0.330 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.625 16.412 -1.854 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -9.598 14.898 -0.126 1.00 0.00 C ATOM 0 H ILE B 47 -7.438 18.066 2.037 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.741 16.587 0.047 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.672 17.378 -0.232 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -7.468 14.590 0.089 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.193 15.481 1.412 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.532 15.998 -2.295 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.375 17.349 -2.351 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.805 15.705 -1.979 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -9.853 13.959 0.365 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -10.334 15.658 0.138 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -9.597 14.753 -1.206 1.00 0.00 H new ATOM 2255 N LYS B 48 -5.135 18.882 -0.833 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.848 20.210 -1.451 1.00 0.00 C ATOM 2257 C LYS B 48 -5.307 20.168 -2.911 1.00 0.00 C ATOM 2258 O LYS B 48 -6.134 20.949 -3.339 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.340 20.495 -1.379 1.00 0.00 C ATOM 2260 CG LYS B 48 -2.980 21.705 -2.254 1.00 0.00 C ATOM 2261 CD LYS B 48 -3.915 22.879 -1.939 1.00 0.00 C ATOM 2262 CE LYS B 48 -3.315 24.174 -2.493 1.00 0.00 C ATOM 2263 NZ LYS B 48 -2.107 24.540 -1.702 1.00 0.00 N ATOM 0 H LYS B 48 -4.353 18.228 -0.823 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.377 21.001 -0.919 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -3.049 20.686 -0.346 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.782 19.620 -1.711 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -1.945 21.997 -2.077 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -3.060 21.438 -3.308 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -4.897 22.704 -2.379 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -4.059 22.964 -0.862 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -3.050 24.045 -3.542 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -4.050 24.977 -2.446 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -1.957 25.568 -1.752 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -2.243 24.258 -0.710 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -1.276 24.050 -2.090 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.786 19.243 -3.673 1.00 0.00 N ATOM 2278 CA GLU B 49 -5.193 19.120 -5.102 1.00 0.00 C ATOM 2279 C GLU B 49 -6.441 18.229 -5.177 1.00 0.00 C ATOM 2280 O GLU B 49 -6.366 17.031 -4.986 1.00 0.00 O ATOM 2281 CB GLU B 49 -4.040 18.499 -5.898 1.00 0.00 C ATOM 2282 CG GLU B 49 -4.378 18.481 -7.394 1.00 0.00 C ATOM 2283 CD GLU B 49 -4.210 19.887 -7.975 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -5.085 20.708 -7.752 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -3.210 20.118 -8.635 1.00 0.00 O ATOM 0 H GLU B 49 -4.091 18.563 -3.364 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.423 20.098 -5.525 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.125 19.068 -5.731 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.852 17.484 -5.548 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -3.726 17.781 -7.916 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.401 18.135 -7.542 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.587 18.798 -5.433 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.836 17.978 -5.494 1.00 0.00 C ATOM 2294 C GLN B 50 -8.978 17.282 -6.854 1.00 0.00 C ATOM 2295 O GLN B 50 -9.735 16.342 -6.997 1.00 0.00 O ATOM 2296 CB GLN B 50 -10.045 18.892 -5.273 1.00 0.00 C ATOM 2297 CG GLN B 50 -10.008 20.048 -6.278 1.00 0.00 C ATOM 2298 CD GLN B 50 -11.286 20.879 -6.147 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -12.268 20.612 -6.811 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -11.314 21.883 -5.315 1.00 0.00 N ATOM 0 H GLN B 50 -7.715 19.796 -5.603 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.784 17.214 -4.719 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -10.968 18.325 -5.390 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.037 19.282 -4.255 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -9.134 20.674 -6.096 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -9.917 19.659 -7.292 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -10.489 22.107 -4.758 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -12.160 22.444 -5.221 1.00 0.00 H new ATOM 2309 N GLU B 51 -8.289 17.744 -7.859 1.00 0.00 N ATOM 2310 CA GLU B 51 -8.430 17.112 -9.207 1.00 0.00 C ATOM 2311 C GLU B 51 -7.792 15.717 -9.239 1.00 0.00 C ATOM 2312 O GLU B 51 -8.174 14.885 -10.038 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.799 18.006 -10.275 1.00 0.00 C ATOM 2314 CG GLU B 51 -8.175 17.488 -11.663 1.00 0.00 C ATOM 2315 CD GLU B 51 -7.622 18.436 -12.729 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -8.238 19.464 -12.956 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -6.592 18.118 -13.299 1.00 0.00 O ATOM 0 H GLU B 51 -7.637 18.527 -7.810 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.494 16.999 -9.417 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.143 19.033 -10.153 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.715 18.017 -10.161 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.774 16.485 -11.810 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -9.259 17.414 -11.754 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.860 15.425 -8.379 1.00 0.00 N ATOM 2325 CA VAL B 52 -6.269 14.056 -8.386 1.00 0.00 C ATOM 2326 C VAL B 52 -7.257 13.094 -7.719 1.00 0.00 C ATOM 2327 O VAL B 52 -7.513 12.020 -8.227 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.938 14.050 -7.619 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -3.814 14.555 -8.524 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -5.044 14.958 -6.394 1.00 0.00 C ATOM 0 H VAL B 52 -6.484 16.064 -7.679 1.00 0.00 H new ATOM 0 HA VAL B 52 -6.078 13.743 -9.413 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.718 13.031 -7.301 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -2.873 14.548 -7.974 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.729 13.906 -9.396 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.037 15.571 -8.849 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -4.098 14.951 -5.853 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -5.272 15.975 -6.714 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.838 14.597 -5.741 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.822 13.452 -6.600 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.790 12.527 -5.949 1.00 0.00 C ATOM 2342 C VAL B 53 -10.025 12.393 -6.839 1.00 0.00 C ATOM 2343 O VAL B 53 -10.637 11.348 -6.921 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.202 13.086 -4.586 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.250 12.167 -3.956 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -7.977 13.160 -3.671 1.00 0.00 C ATOM 0 H VAL B 53 -7.658 14.333 -6.113 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.326 11.551 -5.809 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.620 14.084 -4.715 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.545 12.564 -2.985 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.123 12.112 -4.606 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -9.830 11.170 -3.828 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.272 13.558 -2.700 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.559 12.162 -3.542 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.227 13.813 -4.119 1.00 0.00 H new ATOM 2356 N ASP B 54 -10.398 13.450 -7.506 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.594 13.391 -8.390 1.00 0.00 C ATOM 2358 C ASP B 54 -11.410 12.296 -9.444 1.00 0.00 C ATOM 2359 O ASP B 54 -12.339 11.585 -9.776 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.783 14.740 -9.086 1.00 0.00 C ATOM 2361 CG ASP B 54 -12.298 15.767 -8.076 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -13.185 15.425 -7.312 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -11.797 16.879 -8.086 1.00 0.00 O ATOM 0 H ASP B 54 -9.925 14.353 -7.476 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.473 13.164 -7.786 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.838 15.076 -9.513 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -12.488 14.640 -9.911 1.00 0.00 H new ATOM 2368 N LYS B 55 -10.230 12.158 -9.989 1.00 0.00 N ATOM 2369 CA LYS B 55 -10.023 11.113 -11.033 1.00 0.00 C ATOM 2370 C LYS B 55 -10.063 9.723 -10.395 1.00 0.00 C ATOM 2371 O LYS B 55 -10.448 8.762 -11.031 1.00 0.00 O ATOM 2372 CB LYS B 55 -8.687 11.330 -11.746 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.684 10.572 -13.078 1.00 0.00 C ATOM 2374 CD LYS B 55 -7.247 10.422 -13.584 1.00 0.00 C ATOM 2375 CE LYS B 55 -6.641 11.805 -13.827 1.00 0.00 C ATOM 2376 NZ LYS B 55 -5.401 11.667 -14.642 1.00 0.00 N ATOM 0 H LYS B 55 -9.409 12.718 -9.759 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.824 11.188 -11.769 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -8.526 12.394 -11.921 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.867 10.983 -11.117 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -9.139 9.590 -12.949 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -9.285 11.107 -13.813 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.649 9.875 -12.855 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -7.234 9.841 -14.506 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -7.359 12.443 -14.343 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -6.412 12.286 -12.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -4.988 12.607 -14.808 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -4.716 11.073 -14.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -5.633 11.225 -15.554 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.716 9.594 -9.144 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.794 8.253 -8.498 1.00 0.00 C ATOM 2392 C VAL B 56 -11.257 7.810 -8.505 1.00 0.00 C ATOM 2393 O VAL B 56 -11.596 6.753 -8.999 1.00 0.00 O ATOM 2394 CB VAL B 56 -9.277 8.351 -7.053 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.714 7.122 -6.248 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.748 8.418 -7.071 1.00 0.00 C ATOM 0 H VAL B 56 -9.385 10.351 -8.546 1.00 0.00 H new ATOM 0 HA VAL B 56 -9.183 7.529 -9.037 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.689 9.247 -6.588 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -9.341 7.204 -5.227 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.802 7.065 -6.233 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -9.310 6.222 -6.710 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.375 8.488 -6.049 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -7.350 7.519 -7.542 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.429 9.295 -7.634 1.00 0.00 H new ATOM 2406 N MET B 57 -12.126 8.612 -7.956 1.00 0.00 N ATOM 2407 CA MET B 57 -13.564 8.238 -7.927 1.00 0.00 C ATOM 2408 C MET B 57 -14.030 7.876 -9.337 1.00 0.00 C ATOM 2409 O MET B 57 -14.914 7.062 -9.516 1.00 0.00 O ATOM 2410 CB MET B 57 -14.388 9.413 -7.395 1.00 0.00 C ATOM 2411 CG MET B 57 -14.176 9.551 -5.883 1.00 0.00 C ATOM 2412 SD MET B 57 -15.174 8.312 -5.017 1.00 0.00 S ATOM 2413 CE MET B 57 -14.564 8.654 -3.347 1.00 0.00 C ATOM 0 H MET B 57 -11.901 9.510 -7.527 1.00 0.00 H new ATOM 0 HA MET B 57 -13.701 7.377 -7.273 1.00 0.00 H new ATOM 0 HB2 MET B 57 -14.093 10.334 -7.899 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.445 9.256 -7.611 1.00 0.00 H new ATOM 0 HG2 MET B 57 -13.122 9.419 -5.639 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.456 10.552 -5.556 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.056 7.990 -2.637 1.00 0.00 H new ATOM 0 HE2 MET B 57 -13.487 8.489 -3.312 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.781 9.690 -3.085 1.00 0.00 H new ATOM 2423 N GLU B 58 -13.426 8.452 -10.351 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.818 8.115 -11.753 1.00 0.00 C ATOM 2425 C GLU B 58 -12.999 6.914 -12.229 1.00 0.00 C ATOM 2426 O GLU B 58 -13.499 6.051 -12.924 1.00 0.00 O ATOM 2427 CB GLU B 58 -13.585 9.315 -12.672 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.988 8.948 -14.100 1.00 0.00 C ATOM 2429 CD GLU B 58 -14.019 10.212 -14.961 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -13.412 11.191 -14.562 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -14.651 10.179 -16.004 1.00 0.00 O ATOM 0 H GLU B 58 -12.679 9.141 -10.265 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.878 7.864 -11.782 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -14.167 10.170 -12.327 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.536 9.611 -12.643 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.282 8.229 -14.515 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -14.967 8.470 -14.101 1.00 0.00 H new ATOM 2438 N THR B 59 -11.750 6.837 -11.854 1.00 0.00 N ATOM 2439 CA THR B 59 -10.927 5.674 -12.285 1.00 0.00 C ATOM 2440 C THR B 59 -11.448 4.435 -11.563 1.00 0.00 C ATOM 2441 O THR B 59 -11.564 3.375 -12.146 1.00 0.00 O ATOM 2442 CB THR B 59 -9.451 5.911 -11.946 1.00 0.00 C ATOM 2443 OG1 THR B 59 -9.105 7.252 -12.263 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.573 4.953 -12.754 1.00 0.00 C ATOM 0 H THR B 59 -11.269 7.523 -11.273 1.00 0.00 H new ATOM 0 HA THR B 59 -11.002 5.538 -13.364 1.00 0.00 H new ATOM 0 HB THR B 59 -9.292 5.733 -10.883 1.00 0.00 H new ATOM 0 HG1 THR B 59 -9.417 7.848 -11.550 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.525 5.126 -12.509 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.838 3.924 -12.511 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.730 5.126 -13.819 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.811 4.558 -10.319 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.375 3.394 -9.591 1.00 0.00 C ATOM 2454 C LEU B 60 -13.759 3.093 -10.171 1.00 0.00 C ATOM 2455 O LEU B 60 -14.020 2.003 -10.640 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.495 3.756 -8.103 1.00 0.00 C ATOM 2457 CG LEU B 60 -13.341 2.715 -7.358 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -12.822 1.305 -7.663 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -13.248 2.979 -5.852 1.00 0.00 C ATOM 0 H LEU B 60 -11.741 5.418 -9.775 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.734 2.518 -9.697 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -11.502 3.812 -7.656 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -12.948 4.742 -7.999 1.00 0.00 H new ATOM 0 HG LEU B 60 -14.378 2.790 -7.684 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -13.427 0.571 -7.131 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.885 1.118 -8.735 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.784 1.222 -7.340 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -13.847 2.243 -5.316 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -12.209 2.903 -5.533 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -13.622 3.979 -5.634 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.649 4.048 -10.149 1.00 0.00 N ATOM 2472 CA ASP B 61 -16.010 3.805 -10.707 1.00 0.00 C ATOM 2473 C ASP B 61 -15.883 3.171 -12.095 1.00 0.00 C ATOM 2474 O ASP B 61 -16.819 2.592 -12.611 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.760 5.134 -10.819 1.00 0.00 C ATOM 2476 CG ASP B 61 -18.115 4.902 -11.491 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -18.592 3.780 -11.445 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -18.652 5.850 -12.040 1.00 0.00 O ATOM 0 H ASP B 61 -14.494 4.982 -9.770 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.560 3.133 -10.048 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.903 5.567 -9.829 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -16.173 5.847 -11.398 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.728 3.279 -12.704 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.521 2.688 -14.064 1.00 0.00 C ATOM 2485 C GLU B 62 -13.739 1.389 -13.943 1.00 0.00 C ATOM 2486 O GLU B 62 -12.839 1.100 -14.707 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.727 3.648 -14.906 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.594 4.849 -15.292 1.00 0.00 C ATOM 2489 CD GLU B 62 -13.704 5.962 -15.849 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -12.496 5.802 -15.809 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -14.247 6.954 -16.306 1.00 0.00 O ATOM 0 H GLU B 62 -13.914 3.754 -12.315 1.00 0.00 H new ATOM 0 HA GLU B 62 -15.491 2.496 -14.523 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.848 3.985 -14.356 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -13.368 3.145 -15.804 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -15.333 4.553 -16.036 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -15.144 5.209 -14.422 1.00 0.00 H new ATOM 2498 N ASP B 63 -14.094 0.624 -12.987 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.417 -0.690 -12.744 1.00 0.00 C ATOM 2500 C ASP B 63 -13.219 -1.416 -14.074 1.00 0.00 C ATOM 2501 O ASP B 63 -12.191 -2.016 -14.321 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.333 -1.546 -11.873 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.706 -2.926 -11.674 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -12.498 -3.032 -11.814 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -14.443 -3.853 -11.383 1.00 0.00 O ATOM 0 H ASP B 63 -14.845 0.840 -12.332 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.454 -0.524 -12.262 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -14.490 -1.064 -10.908 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -15.312 -1.644 -12.343 1.00 0.00 H new ATOM 2510 N GLY B 64 -14.188 -1.328 -14.937 1.00 0.00 N ATOM 2511 CA GLY B 64 -14.085 -1.977 -16.275 1.00 0.00 C ATOM 2512 C GLY B 64 -13.686 -3.461 -16.166 1.00 0.00 C ATOM 2513 O GLY B 64 -13.652 -4.158 -17.161 1.00 0.00 O ATOM 0 H GLY B 64 -15.061 -0.827 -14.772 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -15.041 -1.895 -16.792 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -13.349 -1.447 -16.880 1.00 0.00 H new ATOM 2517 N ASP B 65 -13.373 -3.955 -14.985 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.965 -5.400 -14.838 1.00 0.00 C ATOM 2519 C ASP B 65 -14.050 -6.254 -14.124 1.00 0.00 C ATOM 2520 O ASP B 65 -13.937 -7.464 -14.090 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.673 -5.470 -14.021 1.00 0.00 C ATOM 2522 CG ASP B 65 -10.521 -4.880 -14.835 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -10.665 -3.763 -15.305 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -9.514 -5.555 -14.975 1.00 0.00 O ATOM 0 H ASP B 65 -13.382 -3.421 -14.116 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.826 -5.806 -15.840 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.791 -4.921 -13.087 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -11.453 -6.504 -13.757 1.00 0.00 H new ATOM 2529 N GLY B 66 -15.099 -5.684 -13.570 1.00 0.00 N ATOM 2530 CA GLY B 66 -16.137 -6.526 -12.908 1.00 0.00 C ATOM 2531 C GLY B 66 -15.677 -6.942 -11.507 1.00 0.00 C ATOM 2532 O GLY B 66 -16.486 -7.140 -10.621 1.00 0.00 O ATOM 0 H GLY B 66 -15.275 -4.680 -13.551 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -17.074 -5.973 -12.840 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.333 -7.413 -13.511 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.390 -7.072 -11.288 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.897 -7.475 -9.928 1.00 0.00 C ATOM 2538 C GLU B 67 -12.551 -6.800 -9.643 1.00 0.00 C ATOM 2539 O GLU B 67 -11.644 -6.854 -10.450 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.715 -9.000 -9.875 1.00 0.00 C ATOM 2541 CG GLU B 67 -15.074 -9.697 -9.742 1.00 0.00 C ATOM 2542 CD GLU B 67 -15.678 -9.394 -8.369 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -14.938 -9.419 -7.400 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -16.870 -9.143 -8.311 1.00 0.00 O ATOM 0 H GLU B 67 -13.662 -6.918 -11.986 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.627 -7.165 -9.180 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.210 -9.344 -10.778 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.078 -9.267 -9.032 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.747 -9.356 -10.529 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -14.955 -10.773 -9.868 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.404 -6.180 -8.496 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.105 -5.516 -8.151 1.00 0.00 C ATOM 2553 C CYS B 68 -10.340 -6.407 -7.166 1.00 0.00 C ATOM 2554 O CYS B 68 -10.854 -6.790 -6.134 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.379 -4.155 -7.506 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.424 -3.167 -8.605 1.00 0.00 S ATOM 0 H CYS B 68 -13.129 -6.105 -7.782 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.513 -5.370 -9.054 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.871 -4.289 -6.543 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.440 -3.635 -7.315 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.006 -3.292 -9.830 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.121 -6.751 -7.483 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.327 -7.632 -6.574 1.00 0.00 C ATOM 2564 C ASP B 69 -7.651 -6.796 -5.482 1.00 0.00 C ATOM 2565 O ASP B 69 -7.872 -5.607 -5.366 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.257 -8.361 -7.387 1.00 0.00 C ATOM 2567 CG ASP B 69 -7.929 -9.272 -8.416 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -9.136 -9.430 -8.340 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -7.224 -9.797 -9.263 1.00 0.00 O ATOM 0 H ASP B 69 -8.639 -6.460 -8.333 1.00 0.00 H new ATOM 0 HA ASP B 69 -8.996 -8.354 -6.105 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.613 -7.639 -7.890 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -6.621 -8.949 -6.726 1.00 0.00 H new ATOM 2574 N PHE B 70 -6.816 -7.416 -4.689 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.107 -6.670 -3.609 1.00 0.00 C ATOM 2576 C PHE B 70 -5.001 -5.821 -4.245 1.00 0.00 C ATOM 2577 O PHE B 70 -4.643 -4.777 -3.735 1.00 0.00 O ATOM 2578 CB PHE B 70 -5.510 -7.673 -2.611 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.183 -6.996 -1.296 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.086 -6.129 -1.205 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -5.970 -7.247 -0.164 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.778 -5.514 0.015 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.660 -6.632 1.055 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.566 -5.765 1.144 1.00 0.00 C ATOM 0 H PHE B 70 -6.595 -8.410 -4.744 1.00 0.00 H new ATOM 0 HA PHE B 70 -6.799 -6.017 -3.076 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.215 -8.486 -2.441 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -4.607 -8.117 -3.031 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.478 -5.935 -2.076 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -6.816 -7.915 -0.232 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.932 -4.846 0.085 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.266 -6.827 1.927 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.329 -5.289 2.084 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.468 -6.238 -5.361 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.403 -5.424 -6.014 1.00 0.00 C ATOM 2596 C GLN B 71 -4.015 -4.100 -6.483 1.00 0.00 C ATOM 2597 O GLN B 71 -3.408 -3.053 -6.379 1.00 0.00 O ATOM 2598 CB GLN B 71 -2.838 -6.189 -7.216 1.00 0.00 C ATOM 2599 CG GLN B 71 -1.659 -5.418 -7.818 1.00 0.00 C ATOM 2600 CD GLN B 71 -0.498 -5.395 -6.822 1.00 0.00 C ATOM 2601 OE1 GLN B 71 0.121 -4.370 -6.619 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.172 -6.491 -6.192 1.00 0.00 N ATOM 0 H GLN B 71 -4.721 -7.099 -5.846 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.596 -5.228 -5.308 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -2.514 -7.182 -6.906 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -3.615 -6.327 -7.968 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.343 -5.887 -8.750 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -1.963 -4.400 -8.061 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.692 -7.352 -6.363 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.603 -6.487 -5.529 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.218 -4.137 -6.990 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.874 -2.881 -7.454 1.00 0.00 C ATOM 2613 C GLU B 72 -6.239 -2.020 -6.241 1.00 0.00 C ATOM 2614 O GLU B 72 -6.363 -0.816 -6.331 1.00 0.00 O ATOM 2615 CB GLU B 72 -7.134 -3.215 -8.257 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.754 -4.050 -9.482 1.00 0.00 C ATOM 2617 CD GLU B 72 -8.023 -4.466 -10.229 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -8.857 -3.608 -10.463 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -8.138 -5.637 -10.555 1.00 0.00 O ATOM 0 H GLU B 72 -5.775 -4.984 -7.103 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.186 -2.329 -8.095 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.840 -3.765 -7.634 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.632 -2.297 -8.570 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.104 -3.474 -10.141 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -6.194 -4.933 -9.174 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.379 -2.634 -5.102 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.698 -1.870 -3.861 1.00 0.00 C ATOM 2628 C PHE B 73 -5.435 -1.154 -3.367 1.00 0.00 C ATOM 2629 O PHE B 73 -5.495 -0.007 -2.978 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.247 -2.823 -2.792 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.374 -2.117 -1.457 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -8.177 -0.976 -1.340 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -6.702 -2.614 -0.330 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -8.308 -0.332 -0.103 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -6.835 -1.971 0.907 1.00 0.00 C ATOM 2636 CZ PHE B 73 -7.637 -0.830 1.020 1.00 0.00 C ATOM 0 H PHE B 73 -6.286 -3.642 -4.974 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.461 -1.121 -4.071 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.221 -3.203 -3.102 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.586 -3.684 -2.692 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.696 -0.592 -2.205 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.081 -3.494 -0.417 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -8.927 0.549 -0.016 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -6.318 -2.356 1.774 1.00 0.00 H new ATOM 0 HZ PHE B 73 -7.738 -0.334 1.974 1.00 0.00 H new ATOM 2646 N MET B 74 -4.294 -1.773 -3.394 1.00 0.00 N ATOM 2647 CA MET B 74 -3.080 -1.035 -2.932 1.00 0.00 C ATOM 2648 C MET B 74 -2.809 0.120 -3.909 1.00 0.00 C ATOM 2649 O MET B 74 -2.730 1.262 -3.503 1.00 0.00 O ATOM 2650 CB MET B 74 -1.873 -1.992 -2.863 1.00 0.00 C ATOM 2651 CG MET B 74 -1.729 -2.552 -1.443 1.00 0.00 C ATOM 2652 SD MET B 74 -0.972 -1.293 -0.376 1.00 0.00 S ATOM 2653 CE MET B 74 -2.297 -1.160 0.854 1.00 0.00 C ATOM 0 H MET B 74 -4.144 -2.732 -3.706 1.00 0.00 H new ATOM 0 HA MET B 74 -3.243 -0.632 -1.932 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.005 -2.808 -3.573 1.00 0.00 H new ATOM 0 HB3 MET B 74 -0.963 -1.464 -3.149 1.00 0.00 H new ATOM 0 HG2 MET B 74 -2.705 -2.838 -1.052 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.115 -3.452 -1.455 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.945 -0.578 1.706 1.00 0.00 H new ATOM 0 HE2 MET B 74 -3.159 -0.665 0.408 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.584 -2.157 1.189 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.663 -0.138 -5.175 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.396 0.983 -6.124 1.00 0.00 C ATOM 2665 C ALA B 75 -3.420 2.110 -5.936 1.00 0.00 C ATOM 2666 O ALA B 75 -3.073 3.274 -5.947 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.481 0.460 -7.559 1.00 0.00 C ATOM 0 H ALA B 75 -2.716 -1.066 -5.595 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.400 1.379 -5.925 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.287 1.276 -8.256 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.740 -0.326 -7.704 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.477 0.057 -7.741 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.673 1.789 -5.775 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.695 2.868 -5.602 1.00 0.00 C ATOM 2675 C PHE B 76 -5.546 3.516 -4.217 1.00 0.00 C ATOM 2676 O PHE B 76 -5.696 4.713 -4.065 1.00 0.00 O ATOM 2677 CB PHE B 76 -7.106 2.267 -5.764 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.530 2.337 -7.219 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -6.871 1.558 -8.179 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -8.575 3.186 -7.607 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.256 1.629 -9.523 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -8.959 3.255 -8.950 1.00 0.00 C ATOM 2683 CZ PHE B 76 -8.299 2.477 -9.909 1.00 0.00 C ATOM 0 H PHE B 76 -5.035 0.836 -5.755 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.545 3.636 -6.361 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.112 1.232 -5.423 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.817 2.811 -5.142 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.066 0.902 -7.882 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -9.084 3.787 -6.869 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -6.747 1.028 -10.262 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.765 3.909 -9.248 1.00 0.00 H new ATOM 0 HZ PHE B 76 -8.595 2.532 -10.946 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.247 2.744 -3.214 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.084 3.333 -1.853 1.00 0.00 C ATOM 2695 C VAL B 77 -3.951 4.363 -1.893 1.00 0.00 C ATOM 2696 O VAL B 77 -3.979 5.358 -1.197 1.00 0.00 O ATOM 2697 CB VAL B 77 -4.744 2.216 -0.851 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.191 2.820 0.450 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.008 1.399 -0.535 1.00 0.00 C ATOM 0 H VAL B 77 -5.108 1.735 -3.273 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.008 3.820 -1.541 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.989 1.566 -1.294 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.954 2.020 1.151 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.288 3.390 0.231 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.938 3.479 0.891 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.763 0.609 0.175 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -6.765 2.053 -0.103 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.393 0.955 -1.453 1.00 0.00 H new ATOM 2709 N SER B 78 -2.951 4.130 -2.696 1.00 0.00 N ATOM 2710 CA SER B 78 -1.818 5.093 -2.771 1.00 0.00 C ATOM 2711 C SER B 78 -2.269 6.384 -3.465 1.00 0.00 C ATOM 2712 O SER B 78 -2.053 7.470 -2.973 1.00 0.00 O ATOM 2713 CB SER B 78 -0.668 4.462 -3.557 1.00 0.00 C ATOM 2714 OG SER B 78 0.534 5.168 -3.277 1.00 0.00 O ATOM 0 H SER B 78 -2.869 3.315 -3.303 1.00 0.00 H new ATOM 0 HA SER B 78 -1.484 5.333 -1.761 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.559 3.412 -3.285 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.882 4.494 -4.625 1.00 0.00 H new ATOM 0 HG SER B 78 1.274 4.766 -3.778 1.00 0.00 H new ATOM 2720 N MET B 79 -2.871 6.274 -4.616 1.00 0.00 N ATOM 2721 CA MET B 79 -3.308 7.497 -5.351 1.00 0.00 C ATOM 2722 C MET B 79 -4.086 8.432 -4.423 1.00 0.00 C ATOM 2723 O MET B 79 -3.941 9.637 -4.479 1.00 0.00 O ATOM 2724 CB MET B 79 -4.204 7.090 -6.522 1.00 0.00 C ATOM 2725 CG MET B 79 -3.369 6.357 -7.574 1.00 0.00 C ATOM 2726 SD MET B 79 -4.470 5.548 -8.762 1.00 0.00 S ATOM 2727 CE MET B 79 -4.591 6.923 -9.931 1.00 0.00 C ATOM 0 H MET B 79 -3.080 5.391 -5.081 1.00 0.00 H new ATOM 0 HA MET B 79 -2.425 8.020 -5.718 1.00 0.00 H new ATOM 0 HB2 MET B 79 -5.011 6.447 -6.170 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.669 7.972 -6.962 1.00 0.00 H new ATOM 0 HG2 MET B 79 -2.715 7.060 -8.089 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.728 5.618 -7.094 1.00 0.00 H new ATOM 0 HE1 MET B 79 -5.236 6.638 -10.762 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.011 7.793 -9.427 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.598 7.167 -10.310 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.909 7.893 -3.570 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.690 8.763 -2.645 1.00 0.00 C ATOM 2739 C VAL B 80 -4.768 9.307 -1.551 1.00 0.00 C ATOM 2740 O VAL B 80 -4.792 10.479 -1.232 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.815 7.948 -2.002 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.535 8.802 -0.956 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.814 7.519 -3.081 1.00 0.00 C ATOM 0 H VAL B 80 -5.076 6.891 -3.472 1.00 0.00 H new ATOM 0 HA VAL B 80 -6.117 9.594 -3.207 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.393 7.065 -1.522 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -8.336 8.220 -0.499 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.826 9.110 -0.187 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.957 9.685 -1.435 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.616 6.938 -2.624 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -8.234 8.403 -3.560 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -7.304 6.909 -3.827 1.00 0.00 H new ATOM 2753 N THR B 81 -3.947 8.469 -0.982 1.00 0.00 N ATOM 2754 CA THR B 81 -3.014 8.940 0.081 1.00 0.00 C ATOM 2755 C THR B 81 -1.919 9.808 -0.552 1.00 0.00 C ATOM 2756 O THR B 81 -1.582 10.865 -0.056 1.00 0.00 O ATOM 2757 CB THR B 81 -2.378 7.726 0.766 1.00 0.00 C ATOM 2758 OG1 THR B 81 -3.379 6.751 1.018 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.736 8.153 2.086 1.00 0.00 C ATOM 0 H THR B 81 -3.881 7.476 -1.207 1.00 0.00 H new ATOM 0 HA THR B 81 -3.560 9.529 0.818 1.00 0.00 H new ATOM 0 HB THR B 81 -1.611 7.304 0.116 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.440 6.140 0.254 1.00 0.00 H new ATOM 0 HG21 THR B 81 -1.285 7.286 2.569 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.967 8.901 1.892 1.00 0.00 H new ATOM 0 HG23 THR B 81 -2.497 8.578 2.740 1.00 0.00 H new ATOM 2767 N THR B 82 -1.358 9.356 -1.641 1.00 0.00 N ATOM 2768 CA THR B 82 -0.277 10.129 -2.320 1.00 0.00 C ATOM 2769 C THR B 82 -0.854 11.381 -2.986 1.00 0.00 C ATOM 2770 O THR B 82 -0.144 12.331 -3.252 1.00 0.00 O ATOM 2771 CB THR B 82 0.386 9.251 -3.384 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.600 8.788 -4.297 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.063 8.057 -2.711 1.00 0.00 C ATOM 0 H THR B 82 -1.605 8.476 -2.094 1.00 0.00 H new ATOM 0 HA THR B 82 0.460 10.431 -1.575 1.00 0.00 H new ATOM 0 HB THR B 82 1.133 9.834 -3.923 1.00 0.00 H new ATOM 0 HG1 THR B 82 -1.426 8.585 -3.811 1.00 0.00 H new ATOM 0 HG21 THR B 82 1.535 7.432 -3.469 1.00 0.00 H new ATOM 0 HG22 THR B 82 1.820 8.414 -2.012 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.318 7.473 -2.171 1.00 0.00 H new ATOM 2781 N ALA B 83 -2.131 11.400 -3.258 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.726 12.605 -3.904 1.00 0.00 C ATOM 2783 C ALA B 83 -2.390 13.834 -3.057 1.00 0.00 C ATOM 2784 O ALA B 83 -2.014 14.870 -3.569 1.00 0.00 O ATOM 2785 CB ALA B 83 -4.250 12.437 -4.006 1.00 0.00 C ATOM 0 H ALA B 83 -2.783 10.640 -3.063 1.00 0.00 H new ATOM 0 HA ALA B 83 -2.319 12.729 -4.908 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.682 13.319 -4.478 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.480 11.555 -4.604 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.670 12.317 -3.008 1.00 0.00 H new ATOM 2791 N CYS B 84 -2.513 13.722 -1.763 1.00 0.00 N ATOM 2792 CA CYS B 84 -2.192 14.877 -0.875 1.00 0.00 C ATOM 2793 C CYS B 84 -0.708 14.828 -0.504 1.00 0.00 C ATOM 2794 O CYS B 84 -0.347 14.495 0.607 1.00 0.00 O ATOM 2795 CB CYS B 84 -3.037 14.791 0.398 1.00 0.00 C ATOM 2796 SG CYS B 84 -2.670 13.243 1.260 1.00 0.00 S ATOM 0 H CYS B 84 -2.823 12.878 -1.280 1.00 0.00 H new ATOM 0 HA CYS B 84 -2.411 15.810 -1.393 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.824 15.641 1.047 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -4.097 14.838 0.148 1.00 0.00 H new ATOM 0 HG CYS B 84 -1.992 12.460 0.475 1.00 0.00 H new ATOM 2802 N HIS B 85 0.156 15.157 -1.427 1.00 0.00 N ATOM 2803 CA HIS B 85 1.616 15.128 -1.127 1.00 0.00 C ATOM 2804 C HIS B 85 1.884 15.872 0.183 1.00 0.00 C ATOM 2805 O HIS B 85 2.963 15.805 0.738 1.00 0.00 O ATOM 2806 CB HIS B 85 2.383 15.804 -2.265 1.00 0.00 C ATOM 2807 CG HIS B 85 2.115 15.073 -3.553 1.00 0.00 C ATOM 2808 ND1 HIS B 85 2.486 13.751 -3.744 1.00 0.00 N ATOM 2809 CD2 HIS B 85 1.510 15.465 -4.722 1.00 0.00 C ATOM 2810 CE1 HIS B 85 2.104 13.398 -4.985 1.00 0.00 C ATOM 2811 NE2 HIS B 85 1.504 14.405 -5.624 1.00 0.00 N ATOM 0 H HIS B 85 -0.087 15.444 -2.375 1.00 0.00 H new ATOM 0 HA HIS B 85 1.947 14.094 -1.030 1.00 0.00 H new ATOM 0 HB2 HIS B 85 2.077 16.846 -2.355 1.00 0.00 H new ATOM 0 HB3 HIS B 85 3.451 15.803 -2.049 1.00 0.00 H new ATOM 0 HD2 HIS B 85 1.101 16.446 -4.912 1.00 0.00 H new ATOM 0 HE1 HIS B 85 2.263 12.419 -5.412 1.00 0.00 H new ATOM 0 HE2 HIS B 85 1.123 14.399 -6.570 1.00 0.00 H new ATOM 2819 N GLU B 86 0.910 16.580 0.682 1.00 0.00 N ATOM 2820 CA GLU B 86 1.107 17.326 1.954 1.00 0.00 C ATOM 2821 C GLU B 86 1.101 16.342 3.129 1.00 0.00 C ATOM 2822 O GLU B 86 1.135 16.735 4.278 1.00 0.00 O ATOM 2823 CB GLU B 86 -0.031 18.343 2.120 1.00 0.00 C ATOM 2824 CG GLU B 86 0.373 19.422 3.129 1.00 0.00 C ATOM 2825 CD GLU B 86 -0.706 20.506 3.173 1.00 0.00 C ATOM 2826 OE1 GLU B 86 -1.790 20.215 3.651 1.00 0.00 O ATOM 2827 OE2 GLU B 86 -0.430 21.608 2.728 1.00 0.00 O ATOM 0 H GLU B 86 -0.015 16.674 0.263 1.00 0.00 H new ATOM 0 HA GLU B 86 2.063 17.850 1.932 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -0.263 18.801 1.159 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -0.935 17.837 2.459 1.00 0.00 H new ATOM 0 HG2 GLU B 86 0.502 18.981 4.118 1.00 0.00 H new ATOM 0 HG3 GLU B 86 1.331 19.858 2.847 1.00 0.00 H new ATOM 2834 N PHE B 87 1.056 15.063 2.858 1.00 0.00 N ATOM 2835 CA PHE B 87 1.046 14.076 3.975 1.00 0.00 C ATOM 2836 C PHE B 87 2.376 14.147 4.730 1.00 0.00 C ATOM 2837 O PHE B 87 2.443 13.877 5.913 1.00 0.00 O ATOM 2838 CB PHE B 87 0.804 12.660 3.433 1.00 0.00 C ATOM 2839 CG PHE B 87 2.026 12.144 2.707 1.00 0.00 C ATOM 2840 CD1 PHE B 87 3.073 11.556 3.427 1.00 0.00 C ATOM 2841 CD2 PHE B 87 2.102 12.236 1.311 1.00 0.00 C ATOM 2842 CE1 PHE B 87 4.197 11.063 2.751 1.00 0.00 C ATOM 2843 CE2 PHE B 87 3.224 11.740 0.636 1.00 0.00 C ATOM 2844 CZ PHE B 87 4.271 11.154 1.356 1.00 0.00 C ATOM 0 H PHE B 87 1.026 14.663 1.920 1.00 0.00 H new ATOM 0 HA PHE B 87 0.236 14.317 4.663 1.00 0.00 H new ATOM 0 HB2 PHE B 87 0.554 11.989 4.255 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -0.050 12.666 2.756 1.00 0.00 H new ATOM 0 HD1 PHE B 87 3.014 11.482 4.503 1.00 0.00 H new ATOM 0 HD2 PHE B 87 1.295 12.690 0.755 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.006 10.613 3.306 1.00 0.00 H new ATOM 0 HE2 PHE B 87 3.281 11.810 -0.440 1.00 0.00 H new ATOM 0 HZ PHE B 87 5.137 10.772 0.835 1.00 0.00 H new ATOM 2854 N PHE B 88 3.432 14.535 4.065 1.00 0.00 N ATOM 2855 CA PHE B 88 4.746 14.652 4.761 1.00 0.00 C ATOM 2856 C PHE B 88 4.704 15.911 5.635 1.00 0.00 C ATOM 2857 O PHE B 88 5.263 15.952 6.713 1.00 0.00 O ATOM 2858 CB PHE B 88 5.883 14.740 3.708 1.00 0.00 C ATOM 2859 CG PHE B 88 6.906 13.639 3.933 1.00 0.00 C ATOM 2860 CD1 PHE B 88 7.773 13.703 5.030 1.00 0.00 C ATOM 2861 CD2 PHE B 88 6.979 12.556 3.048 1.00 0.00 C ATOM 2862 CE1 PHE B 88 8.713 12.687 5.241 1.00 0.00 C ATOM 2863 CE2 PHE B 88 7.918 11.539 3.259 1.00 0.00 C ATOM 2864 CZ PHE B 88 8.786 11.605 4.355 1.00 0.00 C ATOM 0 H PHE B 88 3.441 14.775 3.074 1.00 0.00 H new ATOM 0 HA PHE B 88 4.938 13.781 5.388 1.00 0.00 H new ATOM 0 HB2 PHE B 88 5.465 14.656 2.705 1.00 0.00 H new ATOM 0 HB3 PHE B 88 6.369 15.714 3.770 1.00 0.00 H new ATOM 0 HD1 PHE B 88 7.717 14.537 5.714 1.00 0.00 H new ATOM 0 HD2 PHE B 88 6.310 12.505 2.202 1.00 0.00 H new ATOM 0 HE1 PHE B 88 9.382 12.738 6.087 1.00 0.00 H new ATOM 0 HE2 PHE B 88 7.972 10.704 2.576 1.00 0.00 H new ATOM 0 HZ PHE B 88 9.512 10.822 4.517 1.00 0.00 H new ATOM 2874 N GLU B 89 4.031 16.935 5.175 1.00 0.00 N ATOM 2875 CA GLU B 89 3.928 18.197 5.966 1.00 0.00 C ATOM 2876 C GLU B 89 2.578 18.223 6.686 1.00 0.00 C ATOM 2877 O GLU B 89 1.637 18.851 6.241 1.00 0.00 O ATOM 2878 CB GLU B 89 4.025 19.398 5.023 1.00 0.00 C ATOM 2879 CG GLU B 89 4.149 20.686 5.841 1.00 0.00 C ATOM 2880 CD GLU B 89 5.530 20.745 6.496 1.00 0.00 C ATOM 2881 OE1 GLU B 89 6.484 21.039 5.795 1.00 0.00 O ATOM 2882 OE2 GLU B 89 5.610 20.496 7.688 1.00 0.00 O ATOM 0 H GLU B 89 3.545 16.950 4.278 1.00 0.00 H new ATOM 0 HA GLU B 89 4.737 18.244 6.695 1.00 0.00 H new ATOM 0 HB2 GLU B 89 4.888 19.288 4.366 1.00 0.00 H new ATOM 0 HB3 GLU B 89 3.142 19.444 4.385 1.00 0.00 H new ATOM 0 HG2 GLU B 89 4.003 21.553 5.197 1.00 0.00 H new ATOM 0 HG3 GLU B 89 3.371 20.721 6.604 1.00 0.00 H new ATOM 2889 N HIS B 90 2.474 17.546 7.798 1.00 0.00 N ATOM 2890 CA HIS B 90 1.186 17.530 8.548 1.00 0.00 C ATOM 2891 C HIS B 90 1.088 18.783 9.421 1.00 0.00 C ATOM 2892 O HIS B 90 1.857 18.972 10.342 1.00 0.00 O ATOM 2893 CB HIS B 90 1.130 16.285 9.436 1.00 0.00 C ATOM 2894 CG HIS B 90 -0.256 16.132 9.999 1.00 0.00 C ATOM 2895 ND1 HIS B 90 -1.275 15.508 9.297 1.00 0.00 N ATOM 2896 CD2 HIS B 90 -0.808 16.518 11.196 1.00 0.00 C ATOM 2897 CE1 HIS B 90 -2.376 15.536 10.069 1.00 0.00 C ATOM 2898 NE2 HIS B 90 -2.147 16.140 11.238 1.00 0.00 N ATOM 0 H HIS B 90 3.227 17.003 8.220 1.00 0.00 H new ATOM 0 HA HIS B 90 0.355 17.513 7.843 1.00 0.00 H new ATOM 0 HB2 HIS B 90 1.399 15.401 8.858 1.00 0.00 H new ATOM 0 HB3 HIS B 90 1.855 16.370 10.245 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -0.283 17.036 11.985 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -3.330 15.120 9.779 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -2.810 16.292 11.998 1.00 0.00 H new ATOM 2906 N GLU B 91 0.147 19.642 9.138 1.00 0.00 N ATOM 2907 CA GLU B 91 -0.001 20.882 9.952 1.00 0.00 C ATOM 2908 C GLU B 91 -0.341 20.506 11.396 1.00 0.00 C ATOM 2909 O GLU B 91 0.501 20.714 12.254 1.00 0.00 O ATOM 2910 CB GLU B 91 -1.125 21.744 9.371 1.00 0.00 C ATOM 2911 CG GLU B 91 -0.866 21.990 7.883 1.00 0.00 C ATOM 2912 CD GLU B 91 -2.066 22.713 7.267 1.00 0.00 C ATOM 2913 OE1 GLU B 91 -2.334 23.830 7.679 1.00 0.00 O ATOM 2914 OE2 GLU B 91 -2.695 22.138 6.394 1.00 0.00 O ATOM 2915 OXT GLU B 91 -1.436 20.016 11.618 1.00 0.00 O ATOM 0 H GLU B 91 -0.526 19.539 8.378 1.00 0.00 H new ATOM 0 HA GLU B 91 0.933 21.443 9.932 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -2.085 21.246 9.506 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -1.181 22.694 9.903 1.00 0.00 H new ATOM 0 HG2 GLU B 91 0.037 22.587 7.754 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -0.697 21.043 7.371 1.00 0.00 H new TER 2922 GLU B 91