USER MOD reduce.3.24.130724 H: found=0, std=0, add=1196, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1198 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: B 8 GLN : amide:sc= -1.92! C(o=-4.6!,f=-9.1!) USER MOD Set 1.2: B 33 HIS : no HD1:sc= -2.73! C(o=-4.6!,f=-14!) USER MOD Set 2.1: A 8 GLN : amide:sc= -1.89! C(o=-4.7!,f=-8.9!) USER MOD Set 2.2: A 33 HIS : no HD1:sc= -2.79! C(o=-4.7!,f=-14!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 170:sc= -1.26 (180deg=-1.32) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -3.92 K(o=-3.9,f=-15!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 37:sc= 0.433 USER MOD Single : A 36 ASN : amide:sc= -0.707 X(o=-0.71,f=-0.72) USER MOD Single : A 37 THR OG1 : rot 149:sc= 1.04 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -71:sc= -0.0229 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.0175 X(o=-0.017,f=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 158:sc=-0.00711 (180deg=-0.172) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 72 SER OG : rot 81:sc= 0.455 USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 171:sc= -1.14 (180deg=-1.21) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 TYR OH : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 HIS : no HD1:sc= -3.82 K(o=-3.8,f=-15!) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 33:sc= 0.479 USER MOD Single : B 36 ASN : amide:sc= -0.599 X(o=-0.6,f=-0.62) USER MOD Single : B 37 THR OG1 : rot 149:sc= 1.09 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 SER OG : rot 180:sc= -0.0738 USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc=-0.00901 X(o=-0.009,f=0) USER MOD Single : B 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 64 LYS NZ :NH3+ 159:sc= -0.021 (180deg=-0.185) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 ASN : amide:sc= -0.192 X(o=-0.19,f=-0.19) USER MOD Single : B 72 SER OG : rot 82:sc= 0.472 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 22.428 -7.155 -2.602 1.00 0.00 N ATOM 2 CA ALA A 2 22.873 -8.028 -1.477 1.00 0.00 C ATOM 3 C ALA A 2 23.129 -7.168 -0.236 1.00 0.00 C ATOM 4 O ALA A 2 22.745 -7.531 0.859 1.00 0.00 O ATOM 5 CB ALA A 2 24.157 -8.770 -1.847 1.00 0.00 C ATOM 0 HA ALA A 2 22.090 -8.758 -1.272 1.00 0.00 H new ATOM 0 HB1 ALA A 2 24.465 -9.401 -1.014 1.00 0.00 H new ATOM 0 HB2 ALA A 2 23.979 -9.390 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 2 24.944 -8.048 -2.066 1.00 0.00 H new ATOM 13 N LYS A 3 23.773 -6.045 -0.438 1.00 0.00 N ATOM 14 CA LYS A 3 24.071 -5.135 0.713 1.00 0.00 C ATOM 15 C LYS A 3 23.373 -3.785 0.516 1.00 0.00 C ATOM 16 O LYS A 3 23.961 -2.743 0.729 1.00 0.00 O ATOM 17 CB LYS A 3 25.582 -4.918 0.795 1.00 0.00 C ATOM 18 CG LYS A 3 26.271 -6.269 0.994 1.00 0.00 C ATOM 19 CD LYS A 3 27.778 -6.045 1.149 1.00 0.00 C ATOM 20 CE LYS A 3 28.523 -7.269 0.615 1.00 0.00 C ATOM 21 NZ LYS A 3 29.877 -7.366 1.231 1.00 0.00 N ATOM 0 H LYS A 3 24.104 -5.719 -1.346 1.00 0.00 H new ATOM 0 HA LYS A 3 23.706 -5.588 1.635 1.00 0.00 H new ATOM 0 HB2 LYS A 3 25.944 -4.442 -0.116 1.00 0.00 H new ATOM 0 HB3 LYS A 3 25.822 -4.248 1.621 1.00 0.00 H new ATOM 0 HG2 LYS A 3 25.872 -6.768 1.877 1.00 0.00 H new ATOM 0 HG3 LYS A 3 26.073 -6.921 0.143 1.00 0.00 H new ATOM 0 HD2 LYS A 3 28.083 -5.152 0.604 1.00 0.00 H new ATOM 0 HD3 LYS A 3 28.028 -5.880 2.197 1.00 0.00 H new ATOM 0 HE2 LYS A 3 27.953 -8.172 0.832 1.00 0.00 H new ATOM 0 HE3 LYS A 3 28.614 -7.202 -0.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 30.369 -8.203 0.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 30.424 -6.512 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 29.783 -7.452 2.263 1.00 0.00 H new ATOM 35 N GLU A 4 22.131 -3.835 0.114 1.00 0.00 N ATOM 36 CA GLU A 4 21.378 -2.563 -0.103 1.00 0.00 C ATOM 37 C GLU A 4 20.521 -2.238 1.125 1.00 0.00 C ATOM 38 O GLU A 4 19.495 -2.848 1.350 1.00 0.00 O ATOM 39 CB GLU A 4 20.476 -2.720 -1.327 1.00 0.00 C ATOM 40 CG GLU A 4 21.326 -2.609 -2.594 1.00 0.00 C ATOM 41 CD GLU A 4 22.413 -3.686 -2.570 1.00 0.00 C ATOM 42 OE1 GLU A 4 22.069 -4.792 -2.190 1.00 0.00 O ATOM 43 OE2 GLU A 4 23.526 -3.340 -2.931 1.00 0.00 O ATOM 0 H GLU A 4 21.609 -4.691 -0.072 1.00 0.00 H new ATOM 0 HA GLU A 4 22.086 -1.749 -0.263 1.00 0.00 H new ATOM 0 HB2 GLU A 4 19.968 -3.684 -1.298 1.00 0.00 H new ATOM 0 HB3 GLU A 4 19.702 -1.952 -1.325 1.00 0.00 H new ATOM 0 HG2 GLU A 4 20.699 -2.728 -3.478 1.00 0.00 H new ATOM 0 HG3 GLU A 4 21.779 -1.620 -2.656 1.00 0.00 H new ATOM 50 N LEU A 5 20.964 -1.280 1.896 1.00 0.00 N ATOM 51 CA LEU A 5 20.188 -0.900 3.115 1.00 0.00 C ATOM 52 C LEU A 5 19.200 0.226 2.776 1.00 0.00 C ATOM 53 O LEU A 5 19.237 1.285 3.371 1.00 0.00 O ATOM 54 CB LEU A 5 21.165 -0.418 4.198 1.00 0.00 C ATOM 55 CG LEU A 5 21.783 -1.624 4.933 1.00 0.00 C ATOM 56 CD1 LEU A 5 20.712 -2.330 5.789 1.00 0.00 C ATOM 57 CD2 LEU A 5 22.363 -2.612 3.908 1.00 0.00 C ATOM 0 H LEU A 5 21.820 -0.749 1.738 1.00 0.00 H new ATOM 0 HA LEU A 5 19.630 -1.764 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 5 21.953 0.184 3.745 1.00 0.00 H new ATOM 0 HB3 LEU A 5 20.644 0.222 4.909 1.00 0.00 H new ATOM 0 HG LEU A 5 22.581 -1.271 5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 5 21.160 -3.180 6.304 1.00 0.00 H new ATOM 0 HD12 LEU A 5 20.314 -1.630 6.524 1.00 0.00 H new ATOM 0 HD13 LEU A 5 19.904 -2.679 5.146 1.00 0.00 H new ATOM 0 HD21 LEU A 5 22.799 -3.464 4.430 1.00 0.00 H new ATOM 0 HD22 LEU A 5 21.568 -2.959 3.248 1.00 0.00 H new ATOM 0 HD23 LEU A 5 23.133 -2.114 3.319 1.00 0.00 H new ATOM 69 N ARG A 6 18.340 -0.030 1.817 1.00 0.00 N ATOM 70 CA ARG A 6 17.340 1.012 1.417 1.00 0.00 C ATOM 71 C ARG A 6 15.928 0.415 1.395 1.00 0.00 C ATOM 72 O ARG A 6 15.718 -0.671 0.896 1.00 0.00 O ATOM 73 CB ARG A 6 17.686 1.537 0.018 1.00 0.00 C ATOM 74 CG ARG A 6 19.127 2.081 0.006 1.00 0.00 C ATOM 75 CD ARG A 6 19.183 3.452 0.700 1.00 0.00 C ATOM 76 NE ARG A 6 19.587 4.481 -0.299 1.00 0.00 N ATOM 77 CZ ARG A 6 20.781 4.431 -0.823 1.00 0.00 C ATOM 78 NH1 ARG A 6 21.728 3.807 -0.177 1.00 0.00 N ATOM 79 NH2 ARG A 6 20.988 5.008 -1.974 1.00 0.00 N ATOM 0 H ARG A 6 18.287 -0.907 1.299 1.00 0.00 H new ATOM 0 HA ARG A 6 17.371 1.827 2.141 1.00 0.00 H new ATOM 0 HB2 ARG A 6 17.583 0.738 -0.716 1.00 0.00 H new ATOM 0 HB3 ARG A 6 16.988 2.324 -0.268 1.00 0.00 H new ATOM 0 HG2 ARG A 6 19.792 1.381 0.513 1.00 0.00 H new ATOM 0 HG3 ARG A 6 19.481 2.170 -1.021 1.00 0.00 H new ATOM 0 HD2 ARG A 6 18.210 3.700 1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 6 19.894 3.428 1.526 1.00 0.00 H new ATOM 0 HE ARG A 6 18.936 5.218 -0.571 1.00 0.00 H new ATOM 0 HH11 ARG A 6 21.529 3.369 0.722 1.00 0.00 H new ATOM 0 HH12 ARG A 6 22.667 3.758 -0.571 1.00 0.00 H new ATOM 0 HH21 ARG A 6 20.223 5.488 -2.449 1.00 0.00 H new ATOM 0 HH22 ARG A 6 21.915 4.980 -2.399 1.00 0.00 H new ATOM 93 N CYS A 7 14.990 1.147 1.931 1.00 0.00 N ATOM 94 CA CYS A 7 13.585 0.639 1.957 1.00 0.00 C ATOM 95 C CYS A 7 13.061 0.439 0.529 1.00 0.00 C ATOM 96 O CYS A 7 13.432 1.163 -0.374 1.00 0.00 O ATOM 97 CB CYS A 7 12.704 1.655 2.682 1.00 0.00 C ATOM 98 SG CYS A 7 12.821 1.719 4.486 1.00 0.00 S ATOM 0 H CYS A 7 15.131 2.067 2.349 1.00 0.00 H new ATOM 0 HA CYS A 7 13.561 -0.319 2.476 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.942 2.645 2.293 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.666 1.450 2.419 1.00 0.00 H new ATOM 103 N GLN A 8 12.207 -0.541 0.350 1.00 0.00 N ATOM 104 CA GLN A 8 11.652 -0.778 -1.020 1.00 0.00 C ATOM 105 C GLN A 8 10.818 0.429 -1.468 1.00 0.00 C ATOM 106 O GLN A 8 10.740 0.726 -2.645 1.00 0.00 O ATOM 107 CB GLN A 8 10.768 -2.026 -1.009 1.00 0.00 C ATOM 108 CG GLN A 8 11.648 -3.273 -1.112 1.00 0.00 C ATOM 109 CD GLN A 8 10.954 -4.441 -0.408 1.00 0.00 C ATOM 110 OE1 GLN A 8 10.747 -4.424 0.789 1.00 0.00 O ATOM 111 NE2 GLN A 8 10.580 -5.473 -1.114 1.00 0.00 N ATOM 0 H GLN A 8 11.876 -1.175 1.077 1.00 0.00 H new ATOM 0 HA GLN A 8 12.480 -0.920 -1.715 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.178 -2.059 -0.093 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.065 -1.994 -1.841 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.828 -3.519 -2.158 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.620 -3.085 -0.657 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.751 -5.492 -2.119 1.00 0.00 H new ATOM 0 HE22 GLN A 8 10.116 -6.260 -0.660 1.00 0.00 H new ATOM 120 N CYS A 9 10.214 1.097 -0.519 1.00 0.00 N ATOM 121 CA CYS A 9 9.379 2.288 -0.872 1.00 0.00 C ATOM 122 C CYS A 9 10.138 3.581 -0.561 1.00 0.00 C ATOM 123 O CYS A 9 10.554 3.806 0.559 1.00 0.00 O ATOM 124 CB CYS A 9 8.086 2.252 -0.059 1.00 0.00 C ATOM 125 SG CYS A 9 6.761 1.171 -0.650 1.00 0.00 S ATOM 0 H CYS A 9 10.261 0.874 0.475 1.00 0.00 H new ATOM 0 HA CYS A 9 9.152 2.260 -1.938 1.00 0.00 H new ATOM 0 HB2 CYS A 9 8.336 1.953 0.959 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.694 3.267 -0.005 1.00 0.00 H new ATOM 130 N ILE A 10 10.303 4.404 -1.561 1.00 0.00 N ATOM 131 CA ILE A 10 11.027 5.689 -1.342 1.00 0.00 C ATOM 132 C ILE A 10 10.021 6.817 -1.087 1.00 0.00 C ATOM 133 O ILE A 10 9.948 7.354 0.001 1.00 0.00 O ATOM 134 CB ILE A 10 11.861 6.014 -2.582 1.00 0.00 C ATOM 135 CG1 ILE A 10 12.661 4.773 -2.991 1.00 0.00 C ATOM 136 CG2 ILE A 10 12.828 7.152 -2.256 1.00 0.00 C ATOM 137 CD1 ILE A 10 13.621 5.145 -4.123 1.00 0.00 C ATOM 0 H ILE A 10 9.971 4.245 -2.512 1.00 0.00 H new ATOM 0 HA ILE A 10 11.681 5.594 -0.475 1.00 0.00 H new ATOM 0 HB ILE A 10 11.204 6.314 -3.398 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.218 4.387 -2.137 1.00 0.00 H new ATOM 0 HG13 ILE A 10 11.986 3.981 -3.316 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.424 7.387 -3.138 1.00 0.00 H new ATOM 0 HG22 ILE A 10 12.263 8.034 -1.955 1.00 0.00 H new ATOM 0 HG23 ILE A 10 13.487 6.848 -1.443 1.00 0.00 H new ATOM 0 HD11 ILE A 10 14.193 4.266 -4.418 1.00 0.00 H new ATOM 0 HD12 ILE A 10 13.052 5.511 -4.977 1.00 0.00 H new ATOM 0 HD13 ILE A 10 14.303 5.923 -3.781 1.00 0.00 H new ATOM 149 N LYS A 11 9.263 7.149 -2.099 1.00 0.00 N ATOM 150 CA LYS A 11 8.249 8.234 -1.936 1.00 0.00 C ATOM 151 C LYS A 11 6.869 7.621 -1.664 1.00 0.00 C ATOM 152 O LYS A 11 6.749 6.426 -1.484 1.00 0.00 O ATOM 153 CB LYS A 11 8.200 9.068 -3.218 1.00 0.00 C ATOM 154 CG LYS A 11 9.159 10.255 -3.082 1.00 0.00 C ATOM 155 CD LYS A 11 8.477 11.375 -2.288 1.00 0.00 C ATOM 156 CE LYS A 11 7.913 12.409 -3.264 1.00 0.00 C ATOM 157 NZ LYS A 11 7.164 11.735 -4.362 1.00 0.00 N ATOM 0 H LYS A 11 9.301 6.721 -3.024 1.00 0.00 H new ATOM 0 HA LYS A 11 8.525 8.869 -1.094 1.00 0.00 H new ATOM 0 HB2 LYS A 11 8.479 8.456 -4.076 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.185 9.423 -3.397 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.073 9.942 -2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 11 9.448 10.618 -4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 11 7.677 10.965 -1.671 1.00 0.00 H new ATOM 0 HD3 LYS A 11 9.191 11.846 -1.613 1.00 0.00 H new ATOM 0 HE2 LYS A 11 7.253 13.096 -2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 11 8.725 13.005 -3.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 6.648 12.446 -4.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 7.832 11.231 -4.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 6.489 11.056 -3.956 1.00 0.00 H new ATOM 171 N THR A 12 5.858 8.448 -1.637 1.00 0.00 N ATOM 172 CA THR A 12 4.488 7.913 -1.374 1.00 0.00 C ATOM 173 C THR A 12 3.436 8.716 -2.147 1.00 0.00 C ATOM 174 O THR A 12 3.748 9.682 -2.814 1.00 0.00 O ATOM 175 CB THR A 12 4.196 8.000 0.125 1.00 0.00 C ATOM 176 OG1 THR A 12 4.557 9.329 0.490 1.00 0.00 O ATOM 177 CG2 THR A 12 5.124 7.093 0.927 1.00 0.00 C ATOM 0 H THR A 12 5.917 9.456 -1.783 1.00 0.00 H new ATOM 0 HA THR A 12 4.444 6.875 -1.705 1.00 0.00 H new ATOM 0 HB THR A 12 3.160 7.723 0.320 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.394 9.461 1.447 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.889 7.179 1.988 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.988 6.060 0.608 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.159 7.391 0.759 1.00 0.00 H new ATOM 185 N TYR A 13 2.207 8.290 -2.038 1.00 0.00 N ATOM 186 CA TYR A 13 1.108 9.000 -2.758 1.00 0.00 C ATOM 187 C TYR A 13 0.600 10.187 -1.927 1.00 0.00 C ATOM 188 O TYR A 13 0.685 10.177 -0.715 1.00 0.00 O ATOM 189 CB TYR A 13 -0.036 8.010 -2.994 1.00 0.00 C ATOM 190 CG TYR A 13 -0.666 8.255 -4.369 1.00 0.00 C ATOM 191 CD1 TYR A 13 0.087 8.127 -5.518 1.00 0.00 C ATOM 192 CD2 TYR A 13 -1.997 8.602 -4.478 1.00 0.00 C ATOM 193 CE1 TYR A 13 -0.481 8.347 -6.757 1.00 0.00 C ATOM 194 CE2 TYR A 13 -2.565 8.821 -5.716 1.00 0.00 C ATOM 195 CZ TYR A 13 -1.810 8.695 -6.865 1.00 0.00 C ATOM 196 OH TYR A 13 -2.378 8.914 -8.103 1.00 0.00 O ATOM 0 H TYR A 13 1.916 7.484 -1.484 1.00 0.00 H new ATOM 0 HA TYR A 13 1.482 9.381 -3.708 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.338 6.988 -2.933 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.790 8.120 -2.215 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.129 7.852 -5.448 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.599 8.703 -3.587 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.121 8.246 -7.648 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.608 9.093 -5.787 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.323 9.149 -7.992 1.00 0.00 H new ATOM 206 N SER A 14 0.083 11.183 -2.607 1.00 0.00 N ATOM 207 CA SER A 14 -0.444 12.385 -1.885 1.00 0.00 C ATOM 208 C SER A 14 -1.845 12.741 -2.402 1.00 0.00 C ATOM 209 O SER A 14 -2.264 13.880 -2.340 1.00 0.00 O ATOM 210 CB SER A 14 0.501 13.564 -2.122 1.00 0.00 C ATOM 211 OG SER A 14 0.368 13.843 -3.508 1.00 0.00 O ATOM 0 H SER A 14 0.003 11.216 -3.623 1.00 0.00 H new ATOM 0 HA SER A 14 -0.507 12.166 -0.819 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.224 14.425 -1.514 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.529 13.309 -1.864 1.00 0.00 H new ATOM 0 HG SER A 14 0.947 14.597 -3.747 1.00 0.00 H new ATOM 217 N LYS A 15 -2.535 11.752 -2.901 1.00 0.00 N ATOM 218 CA LYS A 15 -3.912 11.995 -3.427 1.00 0.00 C ATOM 219 C LYS A 15 -4.818 10.771 -3.092 1.00 0.00 C ATOM 220 O LYS A 15 -4.695 9.745 -3.724 1.00 0.00 O ATOM 221 CB LYS A 15 -3.833 12.154 -4.944 1.00 0.00 C ATOM 222 CG LYS A 15 -5.248 12.100 -5.527 1.00 0.00 C ATOM 223 CD LYS A 15 -5.320 13.009 -6.755 1.00 0.00 C ATOM 224 CE LYS A 15 -4.292 12.542 -7.787 1.00 0.00 C ATOM 225 NZ LYS A 15 -4.643 13.055 -9.141 1.00 0.00 N ATOM 0 H LYS A 15 -2.208 10.788 -2.968 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.330 12.893 -2.973 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.357 13.101 -5.199 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.219 11.363 -5.374 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.502 11.076 -5.802 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.975 12.419 -4.780 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -6.322 12.982 -7.184 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.123 14.042 -6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -3.299 12.893 -7.505 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.253 11.453 -7.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.935 12.729 -9.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -5.581 12.700 -9.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -4.658 14.095 -9.125 1.00 0.00 H new ATOM 239 N PRO A 16 -5.720 10.896 -2.110 1.00 0.00 N ATOM 240 CA PRO A 16 -6.582 9.764 -1.720 1.00 0.00 C ATOM 241 C PRO A 16 -7.415 9.230 -2.892 1.00 0.00 C ATOM 242 O PRO A 16 -7.811 9.970 -3.771 1.00 0.00 O ATOM 243 CB PRO A 16 -7.493 10.307 -0.616 1.00 0.00 C ATOM 244 CG PRO A 16 -7.036 11.763 -0.307 1.00 0.00 C ATOM 245 CD PRO A 16 -5.957 12.136 -1.339 1.00 0.00 C ATOM 0 HA PRO A 16 -5.978 8.921 -1.385 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.535 10.292 -0.936 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.425 9.686 0.277 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.879 12.451 -0.368 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.639 11.834 0.706 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -6.294 12.945 -1.987 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -5.045 12.477 -0.850 1.00 0.00 H new ATOM 253 N PHE A 17 -7.659 7.939 -2.870 1.00 0.00 N ATOM 254 CA PHE A 17 -8.468 7.323 -3.958 1.00 0.00 C ATOM 255 C PHE A 17 -9.248 6.105 -3.427 1.00 0.00 C ATOM 256 O PHE A 17 -8.896 5.521 -2.422 1.00 0.00 O ATOM 257 CB PHE A 17 -7.554 6.913 -5.129 1.00 0.00 C ATOM 258 CG PHE A 17 -6.403 6.013 -4.647 1.00 0.00 C ATOM 259 CD1 PHE A 17 -5.408 6.510 -3.816 1.00 0.00 C ATOM 260 CD2 PHE A 17 -6.338 4.688 -5.045 1.00 0.00 C ATOM 261 CE1 PHE A 17 -4.378 5.695 -3.393 1.00 0.00 C ATOM 262 CE2 PHE A 17 -5.304 3.881 -4.622 1.00 0.00 C ATOM 263 CZ PHE A 17 -4.329 4.383 -3.797 1.00 0.00 C ATOM 0 H PHE A 17 -7.333 7.295 -2.149 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.188 8.058 -4.318 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.139 6.387 -5.884 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -7.147 7.805 -5.606 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.440 7.542 -3.498 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.103 4.284 -5.692 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.610 6.089 -2.744 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.261 2.850 -4.941 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.522 3.746 -3.465 1.00 0.00 H new ATOM 273 N HIS A 18 -10.293 5.763 -4.127 1.00 0.00 N ATOM 274 CA HIS A 18 -11.163 4.613 -3.702 1.00 0.00 C ATOM 275 C HIS A 18 -10.477 3.247 -4.026 1.00 0.00 C ATOM 276 O HIS A 18 -9.811 3.128 -5.035 1.00 0.00 O ATOM 277 CB HIS A 18 -12.459 4.734 -4.513 1.00 0.00 C ATOM 278 CG HIS A 18 -13.541 3.850 -3.920 1.00 0.00 C ATOM 279 ND1 HIS A 18 -13.628 2.548 -4.108 1.00 0.00 N ATOM 280 CD2 HIS A 18 -14.616 4.198 -3.113 1.00 0.00 C ATOM 281 CE1 HIS A 18 -14.667 2.112 -3.480 1.00 0.00 C ATOM 282 NE2 HIS A 18 -15.248 3.088 -2.891 1.00 0.00 N ATOM 0 H HIS A 18 -10.590 6.230 -4.984 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.345 4.645 -2.628 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -12.793 5.771 -4.523 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.275 4.449 -5.549 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -14.871 5.182 -2.748 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -14.995 1.083 -3.455 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -16.092 3.004 -2.325 1.00 0.00 H new ATOM 290 N PRO A 19 -10.650 2.228 -3.158 1.00 0.00 N ATOM 291 CA PRO A 19 -10.048 0.905 -3.410 1.00 0.00 C ATOM 292 C PRO A 19 -10.572 0.292 -4.721 1.00 0.00 C ATOM 293 O PRO A 19 -10.028 -0.676 -5.214 1.00 0.00 O ATOM 294 CB PRO A 19 -10.467 0.031 -2.223 1.00 0.00 C ATOM 295 CG PRO A 19 -11.392 0.890 -1.317 1.00 0.00 C ATOM 296 CD PRO A 19 -11.397 2.319 -1.881 1.00 0.00 C ATOM 0 HA PRO A 19 -8.965 0.981 -3.509 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -10.989 -0.861 -2.569 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -9.592 -0.307 -1.668 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -12.402 0.480 -1.303 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -11.032 0.886 -0.288 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.414 2.676 -2.043 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -10.920 3.017 -1.193 1.00 0.00 H new ATOM 304 N LYS A 20 -11.623 0.860 -5.246 1.00 0.00 N ATOM 305 CA LYS A 20 -12.193 0.319 -6.521 1.00 0.00 C ATOM 306 C LYS A 20 -11.061 0.041 -7.514 1.00 0.00 C ATOM 307 O LYS A 20 -11.143 -0.862 -8.323 1.00 0.00 O ATOM 308 CB LYS A 20 -13.139 1.361 -7.118 1.00 0.00 C ATOM 309 CG LYS A 20 -14.406 0.691 -7.666 1.00 0.00 C ATOM 310 CD LYS A 20 -15.420 1.785 -8.017 1.00 0.00 C ATOM 311 CE LYS A 20 -14.864 2.654 -9.150 1.00 0.00 C ATOM 312 NZ LYS A 20 -15.976 3.317 -9.887 1.00 0.00 N ATOM 0 H LYS A 20 -12.110 1.667 -4.855 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.732 -0.607 -6.319 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -13.409 2.093 -6.357 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.633 1.903 -7.917 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.169 0.097 -8.548 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.825 0.009 -6.926 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.366 1.335 -8.320 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.626 2.400 -7.141 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.189 3.407 -8.742 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.280 2.040 -9.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.585 3.903 -10.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -16.604 2.594 -10.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.516 3.918 -9.233 1.00 0.00 H new ATOM 326 N PHE A 21 -10.028 0.828 -7.422 1.00 0.00 N ATOM 327 CA PHE A 21 -8.869 0.648 -8.347 1.00 0.00 C ATOM 328 C PHE A 21 -7.891 -0.393 -7.793 1.00 0.00 C ATOM 329 O PHE A 21 -7.155 -1.016 -8.534 1.00 0.00 O ATOM 330 CB PHE A 21 -8.147 1.986 -8.479 1.00 0.00 C ATOM 331 CG PHE A 21 -9.139 3.051 -8.954 1.00 0.00 C ATOM 332 CD1 PHE A 21 -9.635 3.020 -10.246 1.00 0.00 C ATOM 333 CD2 PHE A 21 -9.555 4.059 -8.099 1.00 0.00 C ATOM 334 CE1 PHE A 21 -10.529 3.978 -10.675 1.00 0.00 C ATOM 335 CE2 PHE A 21 -10.450 5.016 -8.532 1.00 0.00 C ATOM 336 CZ PHE A 21 -10.936 4.976 -9.818 1.00 0.00 C ATOM 0 H PHE A 21 -9.933 1.588 -6.748 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.232 0.304 -9.315 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -7.716 2.276 -7.521 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -7.322 1.899 -9.186 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -9.319 2.240 -10.923 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -9.177 4.096 -7.088 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -10.911 3.946 -11.685 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.770 5.798 -7.859 1.00 0.00 H new ATOM 0 HZ PHE A 21 -11.636 5.726 -10.155 1.00 0.00 H new ATOM 346 N ILE A 22 -7.908 -0.556 -6.505 1.00 0.00 N ATOM 347 CA ILE A 22 -6.974 -1.531 -5.872 1.00 0.00 C ATOM 348 C ILE A 22 -7.557 -2.944 -5.861 1.00 0.00 C ATOM 349 O ILE A 22 -8.702 -3.146 -5.506 1.00 0.00 O ATOM 350 CB ILE A 22 -6.703 -1.072 -4.457 1.00 0.00 C ATOM 351 CG1 ILE A 22 -5.844 0.187 -4.541 1.00 0.00 C ATOM 352 CG2 ILE A 22 -5.949 -2.163 -3.692 1.00 0.00 C ATOM 353 CD1 ILE A 22 -6.052 1.035 -3.294 1.00 0.00 C ATOM 0 H ILE A 22 -8.524 -0.060 -5.861 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.051 -1.568 -6.450 1.00 0.00 H new ATOM 0 HB ILE A 22 -7.637 -0.868 -3.933 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.793 -0.084 -4.637 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -6.108 0.760 -5.430 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -5.757 -1.826 -2.673 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.551 -3.072 -3.666 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -5.002 -2.369 -4.191 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.437 1.933 -3.358 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.102 1.319 -3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -5.766 0.461 -2.412 1.00 0.00 H new ATOM 365 N LYS A 23 -6.742 -3.892 -6.260 1.00 0.00 N ATOM 366 CA LYS A 23 -7.195 -5.309 -6.276 1.00 0.00 C ATOM 367 C LYS A 23 -6.176 -6.196 -5.549 1.00 0.00 C ATOM 368 O LYS A 23 -6.480 -7.312 -5.177 1.00 0.00 O ATOM 369 CB LYS A 23 -7.339 -5.787 -7.726 1.00 0.00 C ATOM 370 CG LYS A 23 -8.517 -5.067 -8.395 1.00 0.00 C ATOM 371 CD LYS A 23 -8.931 -5.844 -9.649 1.00 0.00 C ATOM 372 CE LYS A 23 -10.145 -5.164 -10.283 1.00 0.00 C ATOM 373 NZ LYS A 23 -10.568 -5.892 -11.512 1.00 0.00 N ATOM 0 H LYS A 23 -5.784 -3.740 -6.574 1.00 0.00 H new ATOM 0 HA LYS A 23 -8.157 -5.378 -5.769 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.420 -5.589 -8.277 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.499 -6.865 -7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.356 -4.995 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.234 -4.048 -8.660 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.105 -5.878 -10.360 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.171 -6.875 -9.390 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.968 -5.136 -9.569 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.902 -4.131 -10.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -11.393 -5.417 -11.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -9.787 -5.897 -12.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.819 -6.871 -11.266 1.00 0.00 H new ATOM 387 N GLU A 24 -4.983 -5.676 -5.365 1.00 0.00 N ATOM 388 CA GLU A 24 -3.928 -6.472 -4.659 1.00 0.00 C ATOM 389 C GLU A 24 -3.235 -5.603 -3.599 1.00 0.00 C ATOM 390 O GLU A 24 -2.679 -4.570 -3.914 1.00 0.00 O ATOM 391 CB GLU A 24 -2.894 -6.947 -5.680 1.00 0.00 C ATOM 392 CG GLU A 24 -1.653 -7.452 -4.941 1.00 0.00 C ATOM 393 CD GLU A 24 -0.869 -8.395 -5.857 1.00 0.00 C ATOM 394 OE1 GLU A 24 -0.695 -8.015 -7.004 1.00 0.00 O ATOM 395 OE2 GLU A 24 -0.488 -9.441 -5.360 1.00 0.00 O ATOM 0 H GLU A 24 -4.697 -4.745 -5.670 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.390 -7.329 -4.170 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.313 -7.742 -6.297 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -2.626 -6.131 -6.351 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -1.026 -6.612 -4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -1.945 -7.972 -4.029 1.00 0.00 H new ATOM 402 N LEU A 25 -3.283 -6.044 -2.367 1.00 0.00 N ATOM 403 CA LEU A 25 -2.639 -5.255 -1.275 1.00 0.00 C ATOM 404 C LEU A 25 -1.290 -5.870 -0.897 1.00 0.00 C ATOM 405 O LEU A 25 -1.093 -7.063 -1.018 1.00 0.00 O ATOM 406 CB LEU A 25 -3.552 -5.256 -0.052 1.00 0.00 C ATOM 407 CG LEU A 25 -3.202 -4.061 0.838 1.00 0.00 C ATOM 408 CD1 LEU A 25 -4.054 -2.856 0.429 1.00 0.00 C ATOM 409 CD2 LEU A 25 -3.500 -4.416 2.294 1.00 0.00 C ATOM 0 H LEU A 25 -3.736 -6.909 -2.072 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.477 -4.235 -1.623 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.595 -5.200 -0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.434 -6.186 0.504 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.146 -3.817 0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.806 -2.004 1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.853 -2.605 -0.613 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.110 -3.100 0.546 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.253 -3.568 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.558 -4.655 2.401 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.902 -5.279 2.588 1.00 0.00 H new ATOM 421 N ARG A 26 -0.391 -5.042 -0.441 1.00 0.00 N ATOM 422 CA ARG A 26 0.950 -5.562 -0.047 1.00 0.00 C ATOM 423 C ARG A 26 1.494 -4.779 1.151 1.00 0.00 C ATOM 424 O ARG A 26 1.515 -3.563 1.140 1.00 0.00 O ATOM 425 CB ARG A 26 1.903 -5.419 -1.222 1.00 0.00 C ATOM 426 CG ARG A 26 1.995 -6.752 -1.962 1.00 0.00 C ATOM 427 CD ARG A 26 2.596 -6.523 -3.351 1.00 0.00 C ATOM 428 NE ARG A 26 3.765 -5.609 -3.232 1.00 0.00 N ATOM 429 CZ ARG A 26 4.909 -5.962 -3.753 1.00 0.00 C ATOM 430 NH1 ARG A 26 5.066 -5.875 -5.045 1.00 0.00 N ATOM 431 NH2 ARG A 26 5.855 -6.395 -2.964 1.00 0.00 N ATOM 0 H ARG A 26 -0.524 -4.037 -0.325 1.00 0.00 H new ATOM 0 HA ARG A 26 0.859 -6.611 0.233 1.00 0.00 H new ATOM 0 HB2 ARG A 26 1.552 -4.639 -1.897 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.889 -5.116 -0.870 1.00 0.00 H new ATOM 0 HG2 ARG A 26 2.612 -7.452 -1.398 1.00 0.00 H new ATOM 0 HG3 ARG A 26 1.005 -7.200 -2.051 1.00 0.00 H new ATOM 0 HD2 ARG A 26 2.904 -7.473 -3.788 1.00 0.00 H new ATOM 0 HD3 ARG A 26 1.849 -6.093 -4.018 1.00 0.00 H new ATOM 0 HE ARG A 26 3.673 -4.716 -2.748 1.00 0.00 H new ATOM 0 HH11 ARG A 26 4.302 -5.536 -5.630 1.00 0.00 H new ATOM 0 HH12 ARG A 26 5.953 -6.146 -5.470 1.00 0.00 H new ATOM 0 HH21 ARG A 26 5.694 -6.453 -1.959 1.00 0.00 H new ATOM 0 HH22 ARG A 26 6.755 -6.675 -3.353 1.00 0.00 H new ATOM 445 N VAL A 27 1.921 -5.497 2.159 1.00 0.00 N ATOM 446 CA VAL A 27 2.474 -4.822 3.374 1.00 0.00 C ATOM 447 C VAL A 27 3.829 -5.433 3.740 1.00 0.00 C ATOM 448 O VAL A 27 3.925 -6.614 4.011 1.00 0.00 O ATOM 449 CB VAL A 27 1.501 -5.007 4.536 1.00 0.00 C ATOM 450 CG1 VAL A 27 1.917 -4.094 5.691 1.00 0.00 C ATOM 451 CG2 VAL A 27 0.091 -4.627 4.078 1.00 0.00 C ATOM 0 H VAL A 27 1.911 -6.516 2.194 1.00 0.00 H new ATOM 0 HA VAL A 27 2.607 -3.760 3.169 1.00 0.00 H new ATOM 0 HB VAL A 27 1.514 -6.046 4.864 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.225 -4.222 6.524 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.925 -4.352 6.014 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.897 -3.056 5.359 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.608 -4.758 4.904 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.081 -3.586 3.756 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.206 -5.267 3.247 1.00 0.00 H new ATOM 461 N ILE A 28 4.845 -4.607 3.738 1.00 0.00 N ATOM 462 CA ILE A 28 6.216 -5.107 4.073 1.00 0.00 C ATOM 463 C ILE A 28 6.708 -4.468 5.376 1.00 0.00 C ATOM 464 O ILE A 28 6.971 -3.283 5.431 1.00 0.00 O ATOM 465 CB ILE A 28 7.162 -4.741 2.927 1.00 0.00 C ATOM 466 CG1 ILE A 28 6.839 -5.617 1.714 1.00 0.00 C ATOM 467 CG2 ILE A 28 8.608 -4.987 3.354 1.00 0.00 C ATOM 468 CD1 ILE A 28 6.988 -4.783 0.441 1.00 0.00 C ATOM 0 H ILE A 28 4.786 -3.612 3.520 1.00 0.00 H new ATOM 0 HA ILE A 28 6.190 -6.188 4.207 1.00 0.00 H new ATOM 0 HB ILE A 28 7.035 -3.689 2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.509 -6.476 1.681 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.824 -6.007 1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.279 -4.725 2.536 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.840 -4.373 4.224 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.738 -6.039 3.608 1.00 0.00 H new ATOM 0 HD11 ILE A 28 6.759 -5.401 -0.427 1.00 0.00 H new ATOM 0 HD12 ILE A 28 6.300 -3.938 0.477 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.011 -4.415 0.365 1.00 0.00 H new ATOM 480 N GLU A 29 6.819 -5.273 6.397 1.00 0.00 N ATOM 481 CA GLU A 29 7.289 -4.741 7.710 1.00 0.00 C ATOM 482 C GLU A 29 8.805 -4.493 7.660 1.00 0.00 C ATOM 483 O GLU A 29 9.479 -4.981 6.775 1.00 0.00 O ATOM 484 CB GLU A 29 6.961 -5.774 8.799 1.00 0.00 C ATOM 485 CG GLU A 29 7.245 -5.188 10.192 1.00 0.00 C ATOM 486 CD GLU A 29 8.542 -5.786 10.741 1.00 0.00 C ATOM 487 OE1 GLU A 29 9.425 -5.999 9.928 1.00 0.00 O ATOM 488 OE2 GLU A 29 8.576 -5.995 11.942 1.00 0.00 O ATOM 0 H GLU A 29 6.606 -6.270 6.381 1.00 0.00 H new ATOM 0 HA GLU A 29 6.791 -3.797 7.931 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.914 -6.068 8.727 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.556 -6.674 8.647 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.329 -4.103 10.132 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.417 -5.407 10.866 1.00 0.00 H new ATOM 495 N SER A 30 9.300 -3.729 8.605 1.00 0.00 N ATOM 496 CA SER A 30 10.771 -3.435 8.633 1.00 0.00 C ATOM 497 C SER A 30 11.582 -4.678 8.249 1.00 0.00 C ATOM 498 O SER A 30 11.529 -5.688 8.921 1.00 0.00 O ATOM 499 CB SER A 30 11.169 -2.996 10.040 1.00 0.00 C ATOM 500 OG SER A 30 10.637 -4.008 10.882 1.00 0.00 O ATOM 0 H SER A 30 8.756 -3.299 9.353 1.00 0.00 H new ATOM 0 HA SER A 30 10.981 -2.643 7.914 1.00 0.00 H new ATOM 0 HB2 SER A 30 12.252 -2.920 10.143 1.00 0.00 H new ATOM 0 HB3 SER A 30 10.756 -2.017 10.284 1.00 0.00 H new ATOM 0 HG SER A 30 10.721 -4.879 10.440 1.00 0.00 H new ATOM 506 N GLY A 31 12.320 -4.565 7.176 1.00 0.00 N ATOM 507 CA GLY A 31 13.147 -5.722 6.712 1.00 0.00 C ATOM 508 C GLY A 31 14.638 -5.380 6.828 1.00 0.00 C ATOM 509 O GLY A 31 15.003 -4.343 7.347 1.00 0.00 O ATOM 0 H GLY A 31 12.387 -3.725 6.601 1.00 0.00 H new ATOM 0 HA2 GLY A 31 12.920 -6.605 7.310 1.00 0.00 H new ATOM 0 HA3 GLY A 31 12.900 -5.965 5.678 1.00 0.00 H new ATOM 513 N PRO A 32 15.475 -6.271 6.338 1.00 0.00 N ATOM 514 CA PRO A 32 16.928 -6.068 6.382 1.00 0.00 C ATOM 515 C PRO A 32 17.309 -4.855 5.530 1.00 0.00 C ATOM 516 O PRO A 32 18.459 -4.469 5.467 1.00 0.00 O ATOM 517 CB PRO A 32 17.532 -7.349 5.796 1.00 0.00 C ATOM 518 CG PRO A 32 16.346 -8.281 5.394 1.00 0.00 C ATOM 519 CD PRO A 32 15.040 -7.527 5.708 1.00 0.00 C ATOM 0 HA PRO A 32 17.290 -5.879 7.393 1.00 0.00 H new ATOM 0 HB2 PRO A 32 18.151 -7.120 4.929 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.175 -7.839 6.527 1.00 0.00 H new ATOM 0 HG2 PRO A 32 16.398 -8.533 4.335 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.390 -9.219 5.948 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.465 -7.337 4.802 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.401 -8.104 6.376 1.00 0.00 H new ATOM 527 N HIS A 33 16.319 -4.289 4.898 1.00 0.00 N ATOM 528 CA HIS A 33 16.559 -3.097 4.032 1.00 0.00 C ATOM 529 C HIS A 33 15.745 -1.911 4.548 1.00 0.00 C ATOM 530 O HIS A 33 16.033 -0.773 4.234 1.00 0.00 O ATOM 531 CB HIS A 33 16.103 -3.431 2.617 1.00 0.00 C ATOM 532 CG HIS A 33 14.577 -3.537 2.611 1.00 0.00 C ATOM 533 ND1 HIS A 33 13.888 -4.307 3.388 1.00 0.00 N ATOM 534 CD2 HIS A 33 13.634 -2.854 1.839 1.00 0.00 C ATOM 535 CE1 HIS A 33 12.635 -4.167 3.173 1.00 0.00 C ATOM 536 NE2 HIS A 33 12.451 -3.285 2.234 1.00 0.00 N ATOM 0 H HIS A 33 15.349 -4.601 4.943 1.00 0.00 H new ATOM 0 HA HIS A 33 17.618 -2.839 4.044 1.00 0.00 H new ATOM 0 HB2 HIS A 33 16.432 -2.659 1.921 1.00 0.00 H new ATOM 0 HB3 HIS A 33 16.549 -4.369 2.287 1.00 0.00 H new ATOM 0 HD2 HIS A 33 13.833 -2.120 1.072 1.00 0.00 H new ATOM 0 HE1 HIS A 33 11.851 -4.699 3.691 1.00 0.00 H new ATOM 0 HE2 HIS A 33 11.549 -2.980 1.867 1.00 0.00 H new ATOM 544 N CYS A 34 14.738 -2.211 5.332 1.00 0.00 N ATOM 545 CA CYS A 34 13.869 -1.125 5.877 1.00 0.00 C ATOM 546 C CYS A 34 13.698 -1.284 7.391 1.00 0.00 C ATOM 547 O CYS A 34 13.327 -2.336 7.870 1.00 0.00 O ATOM 548 CB CYS A 34 12.501 -1.207 5.203 1.00 0.00 C ATOM 549 SG CYS A 34 11.516 0.312 5.118 1.00 0.00 S ATOM 0 H CYS A 34 14.482 -3.157 5.616 1.00 0.00 H new ATOM 0 HA CYS A 34 14.334 -0.159 5.678 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.649 -1.569 4.186 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.913 -1.960 5.727 1.00 0.00 H new ATOM 554 N ALA A 35 13.973 -0.230 8.109 1.00 0.00 N ATOM 555 CA ALA A 35 13.825 -0.288 9.589 1.00 0.00 C ATOM 556 C ALA A 35 12.464 0.285 9.995 1.00 0.00 C ATOM 557 O ALA A 35 12.287 0.755 11.102 1.00 0.00 O ATOM 558 CB ALA A 35 14.940 0.533 10.237 1.00 0.00 C ATOM 0 H ALA A 35 14.292 0.664 7.737 1.00 0.00 H new ATOM 0 HA ALA A 35 13.890 -1.324 9.922 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.837 0.494 11.321 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.908 0.123 9.950 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.871 1.568 9.903 1.00 0.00 H new ATOM 564 N ASN A 36 11.531 0.232 9.084 1.00 0.00 N ATOM 565 CA ASN A 36 10.173 0.774 9.385 1.00 0.00 C ATOM 566 C ASN A 36 9.095 -0.095 8.740 1.00 0.00 C ATOM 567 O ASN A 36 9.232 -1.294 8.638 1.00 0.00 O ATOM 568 CB ASN A 36 10.074 2.196 8.834 1.00 0.00 C ATOM 569 CG ASN A 36 11.284 3.006 9.302 1.00 0.00 C ATOM 570 OD1 ASN A 36 11.360 3.431 10.437 1.00 0.00 O ATOM 571 ND2 ASN A 36 12.251 3.244 8.458 1.00 0.00 N ATOM 0 H ASN A 36 11.648 -0.160 8.150 1.00 0.00 H new ATOM 0 HA ASN A 36 10.020 0.776 10.464 1.00 0.00 H new ATOM 0 HB2 ASN A 36 10.036 2.174 7.745 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.152 2.667 9.176 1.00 0.00 H new ATOM 0 HD21 ASN A 36 13.064 3.784 8.753 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.193 2.890 7.503 1.00 0.00 H new ATOM 578 N THR A 37 8.043 0.539 8.338 1.00 0.00 N ATOM 579 CA THR A 37 6.926 -0.206 7.683 1.00 0.00 C ATOM 580 C THR A 37 6.464 0.538 6.427 1.00 0.00 C ATOM 581 O THR A 37 6.368 1.750 6.421 1.00 0.00 O ATOM 582 CB THR A 37 5.766 -0.333 8.669 1.00 0.00 C ATOM 583 OG1 THR A 37 5.862 -1.662 9.172 1.00 0.00 O ATOM 584 CG2 THR A 37 4.404 -0.265 7.972 1.00 0.00 C ATOM 0 H THR A 37 7.899 1.544 8.431 1.00 0.00 H new ATOM 0 HA THR A 37 7.271 -1.198 7.393 1.00 0.00 H new ATOM 0 HB THR A 37 5.828 0.465 9.409 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.533 -1.687 10.095 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.611 -0.360 8.713 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.306 0.690 7.456 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.324 -1.077 7.249 1.00 0.00 H new ATOM 592 N GLU A 38 6.190 -0.207 5.390 1.00 0.00 N ATOM 593 CA GLU A 38 5.729 0.431 4.118 1.00 0.00 C ATOM 594 C GLU A 38 4.567 -0.368 3.521 1.00 0.00 C ATOM 595 O GLU A 38 4.686 -1.553 3.280 1.00 0.00 O ATOM 596 CB GLU A 38 6.891 0.463 3.125 1.00 0.00 C ATOM 597 CG GLU A 38 7.925 -0.588 3.528 1.00 0.00 C ATOM 598 CD GLU A 38 8.888 -0.825 2.363 1.00 0.00 C ATOM 599 OE1 GLU A 38 8.488 -1.552 1.469 1.00 0.00 O ATOM 600 OE2 GLU A 38 9.970 -0.264 2.433 1.00 0.00 O ATOM 0 H GLU A 38 6.264 -1.224 5.366 1.00 0.00 H new ATOM 0 HA GLU A 38 5.390 1.446 4.325 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.529 0.266 2.116 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.347 1.453 3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.476 -0.254 4.407 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.427 -1.519 3.798 1.00 0.00 H new ATOM 607 N ILE A 39 3.466 0.297 3.297 1.00 0.00 N ATOM 608 CA ILE A 39 2.289 -0.417 2.722 1.00 0.00 C ATOM 609 C ILE A 39 2.262 -0.263 1.198 1.00 0.00 C ATOM 610 O ILE A 39 1.877 0.767 0.683 1.00 0.00 O ATOM 611 CB ILE A 39 1.004 0.170 3.309 1.00 0.00 C ATOM 612 CG1 ILE A 39 0.851 -0.307 4.760 1.00 0.00 C ATOM 613 CG2 ILE A 39 -0.191 -0.319 2.485 1.00 0.00 C ATOM 614 CD1 ILE A 39 0.020 0.712 5.547 1.00 0.00 C ATOM 0 H ILE A 39 3.330 1.290 3.484 1.00 0.00 H new ATOM 0 HA ILE A 39 2.364 -1.476 2.970 1.00 0.00 H new ATOM 0 HB ILE A 39 1.047 1.259 3.284 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.367 -1.283 4.784 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.832 -0.426 5.220 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.111 0.095 2.897 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.078 0.007 1.451 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.236 -1.408 2.520 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.089 0.374 6.578 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.522 1.679 5.534 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.965 0.808 5.090 1.00 0.00 H new ATOM 626 N ILE A 40 2.673 -1.291 0.510 1.00 0.00 N ATOM 627 CA ILE A 40 2.661 -1.222 -0.978 1.00 0.00 C ATOM 628 C ILE A 40 1.312 -1.724 -1.500 1.00 0.00 C ATOM 629 O ILE A 40 0.660 -2.526 -0.860 1.00 0.00 O ATOM 630 CB ILE A 40 3.790 -2.090 -1.537 1.00 0.00 C ATOM 631 CG1 ILE A 40 5.120 -1.339 -1.370 1.00 0.00 C ATOM 632 CG2 ILE A 40 3.531 -2.355 -3.023 1.00 0.00 C ATOM 633 CD1 ILE A 40 6.297 -2.262 -1.729 1.00 0.00 C ATOM 0 H ILE A 40 3.013 -2.167 0.907 1.00 0.00 H new ATOM 0 HA ILE A 40 2.809 -0.191 -1.298 1.00 0.00 H new ATOM 0 HB ILE A 40 3.835 -3.039 -1.004 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.131 -0.457 -2.010 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.222 -0.989 -0.343 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.332 -2.973 -3.427 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.579 -2.873 -3.140 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.497 -1.408 -3.561 1.00 0.00 H new ATOM 0 HD11 ILE A 40 7.235 -1.720 -1.607 1.00 0.00 H new ATOM 0 HD12 ILE A 40 6.292 -3.131 -1.071 1.00 0.00 H new ATOM 0 HD13 ILE A 40 6.199 -2.590 -2.764 1.00 0.00 H new ATOM 645 N VAL A 41 0.922 -1.242 -2.649 1.00 0.00 N ATOM 646 CA VAL A 41 -0.389 -1.673 -3.217 1.00 0.00 C ATOM 647 C VAL A 41 -0.279 -1.852 -4.734 1.00 0.00 C ATOM 648 O VAL A 41 0.673 -1.407 -5.345 1.00 0.00 O ATOM 649 CB VAL A 41 -1.432 -0.601 -2.896 1.00 0.00 C ATOM 650 CG1 VAL A 41 -1.297 0.552 -3.896 1.00 0.00 C ATOM 651 CG2 VAL A 41 -2.835 -1.202 -3.000 1.00 0.00 C ATOM 0 H VAL A 41 1.448 -0.575 -3.214 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.683 -2.627 -2.780 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.272 -0.230 -1.884 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -2.039 1.318 -3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.298 0.982 -3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.458 0.178 -4.907 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.577 -0.437 -2.771 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.998 -1.574 -4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.932 -2.025 -2.291 1.00 0.00 H new ATOM 661 N LYS A 42 -1.260 -2.504 -5.308 1.00 0.00 N ATOM 662 CA LYS A 42 -1.230 -2.727 -6.786 1.00 0.00 C ATOM 663 C LYS A 42 -2.625 -2.531 -7.391 1.00 0.00 C ATOM 664 O LYS A 42 -3.594 -3.133 -6.953 1.00 0.00 O ATOM 665 CB LYS A 42 -0.752 -4.150 -7.068 1.00 0.00 C ATOM 666 CG LYS A 42 0.621 -4.093 -7.742 1.00 0.00 C ATOM 667 CD LYS A 42 1.097 -5.517 -8.034 1.00 0.00 C ATOM 668 CE LYS A 42 2.373 -5.456 -8.877 1.00 0.00 C ATOM 669 NZ LYS A 42 2.037 -5.309 -10.322 1.00 0.00 N ATOM 0 H LYS A 42 -2.071 -2.887 -4.823 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.550 -2.005 -7.237 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.692 -4.717 -6.139 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.465 -4.666 -7.711 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.562 -3.520 -8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.336 -3.583 -7.096 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.288 -6.048 -7.102 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.322 -6.071 -8.564 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.990 -4.617 -8.554 1.00 0.00 H new ATOM 0 HE3 LYS A 42 2.961 -6.361 -8.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.914 -5.269 -10.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 1.467 -6.122 -10.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.496 -4.433 -10.465 1.00 0.00 H new ATOM 683 N LEU A 43 -2.696 -1.689 -8.390 1.00 0.00 N ATOM 684 CA LEU A 43 -4.008 -1.437 -9.051 1.00 0.00 C ATOM 685 C LEU A 43 -4.150 -2.331 -10.285 1.00 0.00 C ATOM 686 O LEU A 43 -3.184 -2.599 -10.973 1.00 0.00 O ATOM 687 CB LEU A 43 -4.088 0.032 -9.465 1.00 0.00 C ATOM 688 CG LEU A 43 -4.412 0.884 -8.235 1.00 0.00 C ATOM 689 CD1 LEU A 43 -3.314 0.693 -7.186 1.00 0.00 C ATOM 690 CD2 LEU A 43 -4.466 2.358 -8.643 1.00 0.00 C ATOM 0 H LEU A 43 -1.907 -1.169 -8.773 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.815 -1.665 -8.355 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.143 0.351 -9.904 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.855 0.166 -10.228 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.374 0.581 -7.821 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.540 1.298 -6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.263 -0.357 -6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.355 1.002 -7.602 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.697 2.969 -7.770 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.501 2.658 -9.051 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.239 2.498 -9.398 1.00 0.00 H new ATOM 702 N SER A 44 -5.354 -2.771 -10.535 1.00 0.00 N ATOM 703 CA SER A 44 -5.596 -3.665 -11.711 1.00 0.00 C ATOM 704 C SER A 44 -4.979 -3.084 -12.988 1.00 0.00 C ATOM 705 O SER A 44 -4.564 -3.817 -13.865 1.00 0.00 O ATOM 706 CB SER A 44 -7.102 -3.823 -11.907 1.00 0.00 C ATOM 707 OG SER A 44 -7.434 -2.819 -12.855 1.00 0.00 O ATOM 0 H SER A 44 -6.181 -2.552 -9.979 1.00 0.00 H new ATOM 0 HA SER A 44 -5.129 -4.631 -11.516 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.354 -4.818 -12.275 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.643 -3.682 -10.971 1.00 0.00 H new ATOM 0 HG SER A 44 -7.368 -1.937 -12.434 1.00 0.00 H new ATOM 713 N ASP A 45 -4.927 -1.785 -13.071 1.00 0.00 N ATOM 714 CA ASP A 45 -4.344 -1.159 -14.295 1.00 0.00 C ATOM 715 C ASP A 45 -2.894 -1.617 -14.481 1.00 0.00 C ATOM 716 O ASP A 45 -2.268 -1.320 -15.479 1.00 0.00 O ATOM 717 CB ASP A 45 -4.389 0.361 -14.152 1.00 0.00 C ATOM 718 CG ASP A 45 -3.898 0.751 -12.758 1.00 0.00 C ATOM 719 OD1 ASP A 45 -3.154 -0.042 -12.204 1.00 0.00 O ATOM 720 OD2 ASP A 45 -4.295 1.820 -12.325 1.00 0.00 O ATOM 0 H ASP A 45 -5.257 -1.135 -12.357 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.924 -1.464 -15.166 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.765 0.828 -14.914 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.406 0.723 -14.307 1.00 0.00 H new ATOM 725 N GLY A 46 -2.393 -2.331 -13.512 1.00 0.00 N ATOM 726 CA GLY A 46 -0.988 -2.818 -13.610 1.00 0.00 C ATOM 727 C GLY A 46 -0.029 -1.788 -13.015 1.00 0.00 C ATOM 728 O GLY A 46 1.113 -1.699 -13.420 1.00 0.00 O ATOM 0 H GLY A 46 -2.891 -2.597 -12.662 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.887 -3.767 -13.083 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -0.732 -3.004 -14.653 1.00 0.00 H new ATOM 732 N ARG A 47 -0.517 -1.034 -12.059 1.00 0.00 N ATOM 733 CA ARG A 47 0.348 0.013 -11.425 1.00 0.00 C ATOM 734 C ARG A 47 0.652 -0.357 -9.968 1.00 0.00 C ATOM 735 O ARG A 47 -0.136 -1.010 -9.315 1.00 0.00 O ATOM 736 CB ARG A 47 -0.381 1.367 -11.455 1.00 0.00 C ATOM 737 CG ARG A 47 -0.864 1.685 -12.884 1.00 0.00 C ATOM 738 CD ARG A 47 0.302 2.221 -13.724 1.00 0.00 C ATOM 739 NE ARG A 47 0.131 3.691 -13.902 1.00 0.00 N ATOM 740 CZ ARG A 47 0.711 4.286 -14.908 1.00 0.00 C ATOM 741 NH1 ARG A 47 1.975 4.598 -14.813 1.00 0.00 N ATOM 742 NH2 ARG A 47 0.007 4.550 -15.975 1.00 0.00 N ATOM 0 H ARG A 47 -1.467 -1.096 -11.693 1.00 0.00 H new ATOM 0 HA ARG A 47 1.283 0.078 -11.981 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.231 1.345 -10.773 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.287 2.155 -11.106 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.274 0.787 -13.347 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -1.667 2.421 -12.850 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.251 2.009 -13.231 1.00 0.00 H new ATOM 0 HD3 ARG A 47 0.328 1.724 -14.694 1.00 0.00 H new ATOM 0 HE ARG A 47 -0.434 4.227 -13.243 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.492 4.376 -13.962 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.445 5.063 -15.589 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -0.979 4.292 -16.012 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.443 5.015 -16.772 1.00 0.00 H new ATOM 756 N GLU A 48 1.796 0.076 -9.500 1.00 0.00 N ATOM 757 CA GLU A 48 2.189 -0.217 -8.084 1.00 0.00 C ATOM 758 C GLU A 48 2.564 1.091 -7.375 1.00 0.00 C ATOM 759 O GLU A 48 3.450 1.800 -7.810 1.00 0.00 O ATOM 760 CB GLU A 48 3.387 -1.172 -8.077 1.00 0.00 C ATOM 761 CG GLU A 48 4.523 -0.584 -8.924 1.00 0.00 C ATOM 762 CD GLU A 48 5.687 -0.197 -8.009 1.00 0.00 C ATOM 763 OE1 GLU A 48 5.623 0.907 -7.491 1.00 0.00 O ATOM 764 OE2 GLU A 48 6.573 -1.025 -7.881 1.00 0.00 O ATOM 0 H GLU A 48 2.475 0.619 -10.034 1.00 0.00 H new ATOM 0 HA GLU A 48 1.353 -0.682 -7.561 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.729 -1.334 -7.055 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.092 -2.144 -8.472 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.854 -1.312 -9.665 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.169 0.290 -9.471 1.00 0.00 H new ATOM 771 N LEU A 49 1.874 1.381 -6.297 1.00 0.00 N ATOM 772 CA LEU A 49 2.160 2.651 -5.550 1.00 0.00 C ATOM 773 C LEU A 49 2.426 2.363 -4.067 1.00 0.00 C ATOM 774 O LEU A 49 1.983 1.364 -3.536 1.00 0.00 O ATOM 775 CB LEU A 49 0.952 3.577 -5.670 1.00 0.00 C ATOM 776 CG LEU A 49 0.798 4.022 -7.125 1.00 0.00 C ATOM 777 CD1 LEU A 49 -0.681 4.285 -7.417 1.00 0.00 C ATOM 778 CD2 LEU A 49 1.588 5.312 -7.343 1.00 0.00 C ATOM 0 H LEU A 49 1.133 0.801 -5.904 1.00 0.00 H new ATOM 0 HA LEU A 49 3.046 3.120 -5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.050 3.062 -5.338 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.080 4.445 -5.024 1.00 0.00 H new ATOM 0 HG LEU A 49 1.173 3.243 -7.789 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.796 4.603 -8.453 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.253 3.372 -7.252 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.049 5.068 -6.754 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.481 5.633 -8.379 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.206 6.089 -6.681 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.641 5.135 -7.125 1.00 0.00 H new ATOM 790 N CYS A 50 3.148 3.257 -3.435 1.00 0.00 N ATOM 791 CA CYS A 50 3.454 3.079 -1.982 1.00 0.00 C ATOM 792 C CYS A 50 2.636 4.077 -1.154 1.00 0.00 C ATOM 793 O CYS A 50 2.719 5.273 -1.358 1.00 0.00 O ATOM 794 CB CYS A 50 4.946 3.329 -1.749 1.00 0.00 C ATOM 795 SG CYS A 50 6.103 2.067 -2.337 1.00 0.00 S ATOM 0 H CYS A 50 3.537 4.098 -3.861 1.00 0.00 H new ATOM 0 HA CYS A 50 3.197 2.064 -1.678 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.208 4.274 -2.225 1.00 0.00 H new ATOM 0 HB3 CYS A 50 5.103 3.457 -0.678 1.00 0.00 H new ATOM 800 N LEU A 51 1.860 3.563 -0.237 1.00 0.00 N ATOM 801 CA LEU A 51 1.023 4.466 0.609 1.00 0.00 C ATOM 802 C LEU A 51 1.704 4.724 1.955 1.00 0.00 C ATOM 803 O LEU A 51 2.472 3.912 2.433 1.00 0.00 O ATOM 804 CB LEU A 51 -0.336 3.811 0.845 1.00 0.00 C ATOM 805 CG LEU A 51 -0.855 3.237 -0.476 1.00 0.00 C ATOM 806 CD1 LEU A 51 -2.291 2.747 -0.280 1.00 0.00 C ATOM 807 CD2 LEU A 51 -0.836 4.333 -1.543 1.00 0.00 C ATOM 0 H LEU A 51 1.769 2.567 -0.038 1.00 0.00 H new ATOM 0 HA LEU A 51 0.896 5.418 0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.247 3.020 1.589 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.042 4.542 1.240 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.223 2.407 -0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.667 2.337 -1.217 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.310 1.974 0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.921 3.581 0.029 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.205 3.929 -2.486 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.474 5.159 -1.228 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.184 4.693 -1.677 1.00 0.00 H new ATOM 819 N ASP A 52 1.400 5.854 2.538 1.00 0.00 N ATOM 820 CA ASP A 52 2.009 6.197 3.857 1.00 0.00 C ATOM 821 C ASP A 52 0.962 5.988 4.993 1.00 0.00 C ATOM 822 O ASP A 52 -0.050 6.660 5.007 1.00 0.00 O ATOM 823 CB ASP A 52 2.418 7.670 3.828 1.00 0.00 C ATOM 824 CG ASP A 52 3.494 7.917 4.887 1.00 0.00 C ATOM 825 OD1 ASP A 52 3.277 7.460 5.997 1.00 0.00 O ATOM 826 OD2 ASP A 52 4.474 8.548 4.526 1.00 0.00 O ATOM 0 H ASP A 52 0.759 6.552 2.160 1.00 0.00 H new ATOM 0 HA ASP A 52 2.873 5.559 4.042 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.796 7.935 2.841 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.552 8.304 4.018 1.00 0.00 H new ATOM 831 N PRO A 53 1.209 5.064 5.933 1.00 0.00 N ATOM 832 CA PRO A 53 0.248 4.830 7.024 1.00 0.00 C ATOM 833 C PRO A 53 0.113 6.085 7.894 1.00 0.00 C ATOM 834 O PRO A 53 -0.639 6.105 8.849 1.00 0.00 O ATOM 835 CB PRO A 53 0.834 3.677 7.846 1.00 0.00 C ATOM 836 CG PRO A 53 2.216 3.315 7.225 1.00 0.00 C ATOM 837 CD PRO A 53 2.416 4.210 5.990 1.00 0.00 C ATOM 0 HA PRO A 53 -0.746 4.594 6.643 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.947 3.969 8.890 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.167 2.815 7.827 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.015 3.476 7.948 1.00 0.00 H new ATOM 0 HG3 PRO A 53 2.247 2.262 6.945 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.320 4.811 6.081 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.520 3.614 5.084 1.00 0.00 H new ATOM 845 N LYS A 54 0.846 7.104 7.542 1.00 0.00 N ATOM 846 CA LYS A 54 0.788 8.359 8.333 1.00 0.00 C ATOM 847 C LYS A 54 -0.451 9.184 7.958 1.00 0.00 C ATOM 848 O LYS A 54 -0.804 10.116 8.654 1.00 0.00 O ATOM 849 CB LYS A 54 2.051 9.177 8.053 1.00 0.00 C ATOM 850 CG LYS A 54 2.195 10.279 9.113 1.00 0.00 C ATOM 851 CD LYS A 54 3.367 9.939 10.038 1.00 0.00 C ATOM 852 CE LYS A 54 4.683 10.140 9.280 1.00 0.00 C ATOM 853 NZ LYS A 54 5.400 11.342 9.789 1.00 0.00 N ATOM 0 H LYS A 54 1.480 7.120 6.743 1.00 0.00 H new ATOM 0 HA LYS A 54 0.725 8.109 9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 54 2.927 8.529 8.066 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.997 9.620 7.058 1.00 0.00 H new ATOM 0 HG2 LYS A 54 2.364 11.243 8.632 1.00 0.00 H new ATOM 0 HG3 LYS A 54 1.275 10.367 9.690 1.00 0.00 H new ATOM 0 HD2 LYS A 54 3.343 10.574 10.923 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.286 8.908 10.383 1.00 0.00 H new ATOM 0 HE2 LYS A 54 5.313 9.258 9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.482 10.253 8.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 6.290 11.464 9.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 4.803 12.184 9.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 5.609 11.219 10.800 1.00 0.00 H new ATOM 867 N GLU A 55 -1.092 8.824 6.871 1.00 0.00 N ATOM 868 CA GLU A 55 -2.301 9.600 6.449 1.00 0.00 C ATOM 869 C GLU A 55 -3.580 8.873 6.880 1.00 0.00 C ATOM 870 O GLU A 55 -3.715 7.682 6.697 1.00 0.00 O ATOM 871 CB GLU A 55 -2.296 9.773 4.932 1.00 0.00 C ATOM 872 CG GLU A 55 -0.951 10.357 4.487 1.00 0.00 C ATOM 873 CD GLU A 55 -0.826 11.792 5.005 1.00 0.00 C ATOM 874 OE1 GLU A 55 -1.530 12.627 4.459 1.00 0.00 O ATOM 875 OE2 GLU A 55 -0.036 11.973 5.916 1.00 0.00 O ATOM 0 H GLU A 55 -0.837 8.042 6.268 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.275 10.579 6.928 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.466 8.812 4.446 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.109 10.432 4.628 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.132 9.747 4.870 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.877 10.343 3.400 1.00 0.00 H new ATOM 882 N ASN A 56 -4.493 9.616 7.438 1.00 0.00 N ATOM 883 CA ASN A 56 -5.766 8.992 7.905 1.00 0.00 C ATOM 884 C ASN A 56 -6.564 8.411 6.731 1.00 0.00 C ATOM 885 O ASN A 56 -7.138 7.346 6.846 1.00 0.00 O ATOM 886 CB ASN A 56 -6.606 10.052 8.613 1.00 0.00 C ATOM 887 CG ASN A 56 -7.160 9.470 9.916 1.00 0.00 C ATOM 888 OD1 ASN A 56 -7.041 10.060 10.972 1.00 0.00 O ATOM 889 ND2 ASN A 56 -7.771 8.318 9.885 1.00 0.00 N ATOM 0 H ASN A 56 -4.416 10.622 7.591 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.524 8.177 8.587 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -5.999 10.933 8.823 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.424 10.375 7.969 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.146 7.916 10.744 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -7.874 7.819 9.001 1.00 0.00 H new ATOM 896 N TRP A 57 -6.591 9.111 5.626 1.00 0.00 N ATOM 897 CA TRP A 57 -7.374 8.584 4.468 1.00 0.00 C ATOM 898 C TRP A 57 -6.807 7.243 4.001 1.00 0.00 C ATOM 899 O TRP A 57 -7.519 6.433 3.446 1.00 0.00 O ATOM 900 CB TRP A 57 -7.367 9.596 3.312 1.00 0.00 C ATOM 901 CG TRP A 57 -5.932 9.915 2.861 1.00 0.00 C ATOM 902 CD1 TRP A 57 -5.241 10.974 3.272 1.00 0.00 C ATOM 903 CD2 TRP A 57 -5.248 9.233 1.957 1.00 0.00 C ATOM 904 NE1 TRP A 57 -4.100 10.904 2.568 1.00 0.00 N ATOM 905 CE2 TRP A 57 -4.024 9.835 1.713 1.00 0.00 C ATOM 906 CE3 TRP A 57 -5.582 8.077 1.277 1.00 0.00 C ATOM 907 CZ2 TRP A 57 -3.149 9.290 0.796 1.00 0.00 C ATOM 908 CZ3 TRP A 57 -4.702 7.530 0.363 1.00 0.00 C ATOM 909 CH2 TRP A 57 -3.487 8.137 0.123 1.00 0.00 C ATOM 0 H TRP A 57 -6.118 10.002 5.476 1.00 0.00 H new ATOM 0 HA TRP A 57 -8.403 8.430 4.792 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -7.935 9.196 2.472 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -7.865 10.514 3.625 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -5.530 11.716 4.001 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -3.351 11.590 2.662 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -6.533 7.600 1.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -2.199 9.768 0.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -4.966 6.625 -0.165 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -2.801 7.708 -0.592 1.00 0.00 H new ATOM 920 N VAL A 58 -5.544 7.028 4.236 1.00 0.00 N ATOM 921 CA VAL A 58 -4.943 5.732 3.807 1.00 0.00 C ATOM 922 C VAL A 58 -5.486 4.612 4.684 1.00 0.00 C ATOM 923 O VAL A 58 -5.757 3.524 4.217 1.00 0.00 O ATOM 924 CB VAL A 58 -3.416 5.808 3.957 1.00 0.00 C ATOM 925 CG1 VAL A 58 -2.844 4.401 4.149 1.00 0.00 C ATOM 926 CG2 VAL A 58 -2.811 6.436 2.704 1.00 0.00 C ATOM 0 H VAL A 58 -4.910 7.679 4.698 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.197 5.534 2.766 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.170 6.419 4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.761 4.460 4.255 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.272 3.953 5.046 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.091 3.787 3.283 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.728 6.490 2.811 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.060 5.827 1.835 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.213 7.440 2.570 1.00 0.00 H new ATOM 936 N GLN A 59 -5.634 4.906 5.940 1.00 0.00 N ATOM 937 CA GLN A 59 -6.164 3.880 6.869 1.00 0.00 C ATOM 938 C GLN A 59 -7.628 3.584 6.535 1.00 0.00 C ATOM 939 O GLN A 59 -8.133 2.531 6.846 1.00 0.00 O ATOM 940 CB GLN A 59 -6.068 4.412 8.300 1.00 0.00 C ATOM 941 CG GLN A 59 -6.230 3.253 9.288 1.00 0.00 C ATOM 942 CD GLN A 59 -7.197 3.670 10.397 1.00 0.00 C ATOM 943 OE1 GLN A 59 -8.397 3.516 10.281 1.00 0.00 O ATOM 944 NE2 GLN A 59 -6.717 4.201 11.489 1.00 0.00 N ATOM 0 H GLN A 59 -5.412 5.808 6.362 1.00 0.00 H new ATOM 0 HA GLN A 59 -5.583 2.963 6.771 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.107 4.903 8.453 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -6.840 5.162 8.473 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.608 2.370 8.773 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.263 2.984 9.714 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.711 4.333 11.592 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -7.348 4.484 12.239 1.00 0.00 H new ATOM 953 N ARG A 60 -8.271 4.523 5.891 1.00 0.00 N ATOM 954 CA ARG A 60 -9.712 4.326 5.549 1.00 0.00 C ATOM 955 C ARG A 60 -9.880 3.548 4.235 1.00 0.00 C ATOM 956 O ARG A 60 -10.528 2.520 4.209 1.00 0.00 O ATOM 957 CB ARG A 60 -10.381 5.692 5.419 1.00 0.00 C ATOM 958 CG ARG A 60 -11.200 5.966 6.681 1.00 0.00 C ATOM 959 CD ARG A 60 -11.815 7.364 6.589 1.00 0.00 C ATOM 960 NE ARG A 60 -12.395 7.724 7.913 1.00 0.00 N ATOM 961 CZ ARG A 60 -13.586 7.296 8.229 1.00 0.00 C ATOM 962 NH1 ARG A 60 -14.621 7.807 7.621 1.00 0.00 N ATOM 963 NH2 ARG A 60 -13.703 6.370 9.142 1.00 0.00 N ATOM 0 H ARG A 60 -7.866 5.409 5.589 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.178 3.744 6.344 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.628 6.469 5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.025 5.714 4.540 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -11.985 5.217 6.789 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.565 5.893 7.564 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -11.056 8.091 6.299 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -12.588 7.386 5.820 1.00 0.00 H new ATOM 0 HE ARG A 60 -11.865 8.300 8.567 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -14.491 8.529 6.912 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -15.560 7.485 7.855 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.871 5.993 9.596 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -14.627 6.024 9.402 1.00 0.00 H new ATOM 977 N VAL A 61 -9.302 4.044 3.170 1.00 0.00 N ATOM 978 CA VAL A 61 -9.458 3.330 1.876 1.00 0.00 C ATOM 979 C VAL A 61 -8.911 1.903 1.997 1.00 0.00 C ATOM 980 O VAL A 61 -9.384 0.994 1.343 1.00 0.00 O ATOM 981 CB VAL A 61 -8.712 4.104 0.790 1.00 0.00 C ATOM 982 CG1 VAL A 61 -9.132 5.571 0.846 1.00 0.00 C ATOM 983 CG2 VAL A 61 -7.204 3.997 1.034 1.00 0.00 C ATOM 0 H VAL A 61 -8.741 4.895 3.143 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.513 3.268 1.611 1.00 0.00 H new ATOM 0 HB VAL A 61 -8.951 3.689 -0.189 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -8.604 6.130 0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.206 5.648 0.679 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -8.886 5.983 1.825 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -6.670 4.549 0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.963 4.417 2.011 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.904 2.949 1.005 1.00 0.00 H new ATOM 993 N VAL A 62 -7.934 1.730 2.841 1.00 0.00 N ATOM 994 CA VAL A 62 -7.369 0.363 3.016 1.00 0.00 C ATOM 995 C VAL A 62 -8.346 -0.498 3.824 1.00 0.00 C ATOM 996 O VAL A 62 -8.580 -1.644 3.496 1.00 0.00 O ATOM 997 CB VAL A 62 -6.031 0.457 3.746 1.00 0.00 C ATOM 998 CG1 VAL A 62 -5.560 -0.953 4.111 1.00 0.00 C ATOM 999 CG2 VAL A 62 -5.000 1.105 2.819 1.00 0.00 C ATOM 0 H VAL A 62 -7.507 2.462 3.409 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.214 -0.096 2.040 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.144 1.055 4.650 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.605 -0.894 4.633 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.298 -1.427 4.758 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.441 -1.544 3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.042 1.176 3.334 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.886 0.498 1.921 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.337 2.104 2.541 1.00 0.00 H new ATOM 1009 N GLU A 63 -8.901 0.070 4.869 1.00 0.00 N ATOM 1010 CA GLU A 63 -9.879 -0.714 5.683 1.00 0.00 C ATOM 1011 C GLU A 63 -11.001 -1.214 4.776 1.00 0.00 C ATOM 1012 O GLU A 63 -11.485 -2.317 4.929 1.00 0.00 O ATOM 1013 CB GLU A 63 -10.470 0.176 6.775 1.00 0.00 C ATOM 1014 CG GLU A 63 -10.841 -0.687 7.984 1.00 0.00 C ATOM 1015 CD GLU A 63 -11.677 -1.879 7.520 1.00 0.00 C ATOM 1016 OE1 GLU A 63 -12.746 -1.620 6.995 1.00 0.00 O ATOM 1017 OE2 GLU A 63 -11.199 -2.985 7.717 1.00 0.00 O ATOM 0 H GLU A 63 -8.723 1.023 5.187 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.371 -1.561 6.144 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.750 0.941 7.067 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.352 0.695 6.400 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.939 -1.035 8.487 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.401 -0.096 8.708 1.00 0.00 H new ATOM 1024 N LYS A 64 -11.392 -0.384 3.844 1.00 0.00 N ATOM 1025 CA LYS A 64 -12.477 -0.795 2.913 1.00 0.00 C ATOM 1026 C LYS A 64 -12.035 -2.024 2.118 1.00 0.00 C ATOM 1027 O LYS A 64 -12.777 -2.977 1.982 1.00 0.00 O ATOM 1028 CB LYS A 64 -12.778 0.357 1.953 1.00 0.00 C ATOM 1029 CG LYS A 64 -14.150 0.947 2.292 1.00 0.00 C ATOM 1030 CD LYS A 64 -14.463 2.087 1.319 1.00 0.00 C ATOM 1031 CE LYS A 64 -15.335 1.551 0.182 1.00 0.00 C ATOM 1032 NZ LYS A 64 -16.729 1.319 0.659 1.00 0.00 N ATOM 0 H LYS A 64 -11.010 0.549 3.690 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.373 -1.041 3.482 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -12.008 1.125 2.034 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.766 0.001 0.923 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.917 0.176 2.226 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.157 1.316 3.318 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -14.978 2.894 1.839 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.539 2.504 0.919 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -15.341 2.260 -0.646 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -14.915 0.620 -0.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -17.379 1.322 -0.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.782 0.400 1.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -17.000 2.074 1.321 1.00 0.00 H new ATOM 1046 N PHE A 65 -10.832 -1.978 1.606 1.00 0.00 N ATOM 1047 CA PHE A 65 -10.334 -3.147 0.824 1.00 0.00 C ATOM 1048 C PHE A 65 -10.426 -4.422 1.667 1.00 0.00 C ATOM 1049 O PHE A 65 -10.803 -5.467 1.178 1.00 0.00 O ATOM 1050 CB PHE A 65 -8.887 -2.916 0.431 1.00 0.00 C ATOM 1051 CG PHE A 65 -8.392 -4.127 -0.366 1.00 0.00 C ATOM 1052 CD1 PHE A 65 -8.871 -4.372 -1.642 1.00 0.00 C ATOM 1053 CD2 PHE A 65 -7.460 -4.994 0.179 1.00 0.00 C ATOM 1054 CE1 PHE A 65 -8.425 -5.467 -2.357 1.00 0.00 C ATOM 1055 CE2 PHE A 65 -7.018 -6.087 -0.539 1.00 0.00 C ATOM 1056 CZ PHE A 65 -7.500 -6.323 -1.805 1.00 0.00 C ATOM 0 H PHE A 65 -10.183 -1.196 1.693 1.00 0.00 H new ATOM 0 HA PHE A 65 -10.948 -3.260 -0.070 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.799 -2.009 -0.167 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.273 -2.773 1.320 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.597 -3.704 -2.081 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -7.076 -4.814 1.172 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.803 -5.651 -3.352 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.292 -6.758 -0.105 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.153 -7.179 -2.365 1.00 0.00 H new ATOM 1066 N LEU A 66 -10.076 -4.306 2.920 1.00 0.00 N ATOM 1067 CA LEU A 66 -10.135 -5.501 3.812 1.00 0.00 C ATOM 1068 C LEU A 66 -11.589 -5.934 4.023 1.00 0.00 C ATOM 1069 O LEU A 66 -11.896 -7.110 4.019 1.00 0.00 O ATOM 1070 CB LEU A 66 -9.507 -5.148 5.160 1.00 0.00 C ATOM 1071 CG LEU A 66 -7.997 -5.385 5.090 1.00 0.00 C ATOM 1072 CD1 LEU A 66 -7.297 -4.472 6.099 1.00 0.00 C ATOM 1073 CD2 LEU A 66 -7.699 -6.843 5.439 1.00 0.00 C ATOM 0 H LEU A 66 -9.755 -3.445 3.362 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.588 -6.322 3.349 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.712 -4.107 5.409 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.946 -5.757 5.950 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.637 -5.167 4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.221 -4.637 6.053 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.515 -3.431 5.860 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.656 -4.697 7.103 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.624 -7.016 5.390 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.056 -7.056 6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.205 -7.498 4.729 1.00 0.00 H new ATOM 1085 N LYS A 67 -12.452 -4.973 4.206 1.00 0.00 N ATOM 1086 CA LYS A 67 -13.890 -5.312 4.421 1.00 0.00 C ATOM 1087 C LYS A 67 -14.484 -5.937 3.154 1.00 0.00 C ATOM 1088 O LYS A 67 -15.365 -6.770 3.226 1.00 0.00 O ATOM 1089 CB LYS A 67 -14.656 -4.038 4.770 1.00 0.00 C ATOM 1090 CG LYS A 67 -15.411 -4.252 6.083 1.00 0.00 C ATOM 1091 CD LYS A 67 -16.276 -3.023 6.370 1.00 0.00 C ATOM 1092 CE LYS A 67 -16.780 -3.091 7.813 1.00 0.00 C ATOM 1093 NZ LYS A 67 -18.152 -2.520 7.914 1.00 0.00 N ATOM 0 H LYS A 67 -12.229 -3.978 4.216 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.971 -6.030 5.237 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.967 -3.199 4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -15.354 -3.788 3.971 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -16.035 -5.143 6.017 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.707 -4.415 6.899 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -15.698 -2.112 6.216 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -17.118 -2.986 5.679 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -16.785 -4.126 8.154 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -16.102 -2.543 8.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -18.479 -2.574 8.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -18.138 -1.526 7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -18.799 -3.061 7.305 1.00 0.00 H new ATOM 1107 N ARG A 68 -13.990 -5.520 2.020 1.00 0.00 N ATOM 1108 CA ARG A 68 -14.519 -6.082 0.743 1.00 0.00 C ATOM 1109 C ARG A 68 -13.875 -7.443 0.456 1.00 0.00 C ATOM 1110 O ARG A 68 -14.545 -8.384 0.083 1.00 0.00 O ATOM 1111 CB ARG A 68 -14.202 -5.117 -0.398 1.00 0.00 C ATOM 1112 CG ARG A 68 -14.689 -5.723 -1.715 1.00 0.00 C ATOM 1113 CD ARG A 68 -15.028 -4.596 -2.692 1.00 0.00 C ATOM 1114 NE ARG A 68 -13.928 -3.592 -2.671 1.00 0.00 N ATOM 1115 CZ ARG A 68 -14.117 -2.424 -3.221 1.00 0.00 C ATOM 1116 NH1 ARG A 68 -14.270 -2.353 -4.516 1.00 0.00 N ATOM 1117 NH2 ARG A 68 -14.146 -1.365 -2.459 1.00 0.00 N ATOM 0 H ARG A 68 -13.252 -4.823 1.921 1.00 0.00 H new ATOM 0 HA ARG A 68 -15.598 -6.214 0.829 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -14.687 -4.156 -0.224 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -13.129 -4.929 -0.444 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -13.920 -6.369 -2.139 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -15.567 -6.345 -1.540 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -15.155 -4.995 -3.698 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -15.972 -4.127 -2.414 1.00 0.00 H new ATOM 0 HE ARG A 68 -13.035 -3.815 -2.231 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.241 -3.202 -5.080 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -14.419 -1.448 -4.963 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.022 -1.459 -1.451 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -14.293 -0.444 -2.872 1.00 0.00 H new ATOM 1131 N ALA A 69 -12.584 -7.516 0.639 1.00 0.00 N ATOM 1132 CA ALA A 69 -11.879 -8.806 0.383 1.00 0.00 C ATOM 1133 C ALA A 69 -12.286 -9.845 1.434 1.00 0.00 C ATOM 1134 O ALA A 69 -12.236 -11.034 1.189 1.00 0.00 O ATOM 1135 CB ALA A 69 -10.369 -8.574 0.449 1.00 0.00 C ATOM 0 H ALA A 69 -11.992 -6.747 0.952 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.153 -9.177 -0.605 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.848 -9.513 0.263 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.080 -7.843 -0.306 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.101 -8.200 1.437 1.00 0.00 H new ATOM 1141 N GLU A 70 -12.683 -9.372 2.584 1.00 0.00 N ATOM 1142 CA GLU A 70 -13.099 -10.315 3.660 1.00 0.00 C ATOM 1143 C GLU A 70 -14.555 -10.749 3.450 1.00 0.00 C ATOM 1144 O GLU A 70 -14.915 -11.875 3.726 1.00 0.00 O ATOM 1145 CB GLU A 70 -12.966 -9.621 5.015 1.00 0.00 C ATOM 1146 CG GLU A 70 -13.352 -10.604 6.122 1.00 0.00 C ATOM 1147 CD GLU A 70 -14.635 -10.123 6.801 1.00 0.00 C ATOM 1148 OE1 GLU A 70 -15.672 -10.289 6.179 1.00 0.00 O ATOM 1149 OE2 GLU A 70 -14.507 -9.616 7.904 1.00 0.00 O ATOM 0 H GLU A 70 -12.737 -8.382 2.824 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.459 -11.197 3.630 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.943 -9.274 5.161 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.609 -8.742 5.052 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.499 -11.600 5.704 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.547 -10.681 6.853 1.00 0.00 H new ATOM 1156 N ASN A 71 -15.358 -9.842 2.964 1.00 0.00 N ATOM 1157 CA ASN A 71 -16.792 -10.183 2.728 1.00 0.00 C ATOM 1158 C ASN A 71 -16.955 -10.872 1.370 1.00 0.00 C ATOM 1159 O ASN A 71 -17.945 -11.530 1.120 1.00 0.00 O ATOM 1160 CB ASN A 71 -17.622 -8.899 2.751 1.00 0.00 C ATOM 1161 CG ASN A 71 -19.072 -9.228 2.389 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -19.636 -8.669 1.470 1.00 0.00 O ATOM 1163 ND2 ASN A 71 -19.711 -10.129 3.086 1.00 0.00 N ATOM 0 H ASN A 71 -15.088 -8.889 2.722 1.00 0.00 H new ATOM 0 HA ASN A 71 -17.133 -10.861 3.510 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -17.577 -8.441 3.739 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -17.214 -8.176 2.045 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -20.678 -10.360 2.857 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -19.243 -10.602 3.859 1.00 0.00 H new ATOM 1170 N SER A 72 -15.977 -10.707 0.522 1.00 0.00 N ATOM 1171 CA SER A 72 -16.057 -11.346 -0.824 1.00 0.00 C ATOM 1172 C SER A 72 -16.196 -12.865 -0.681 1.00 0.00 C ATOM 1173 O SER A 72 -17.040 -13.400 -1.382 1.00 0.00 O ATOM 1174 CB SER A 72 -14.787 -11.021 -1.607 1.00 0.00 C ATOM 1175 OG SER A 72 -15.120 -9.853 -2.342 1.00 0.00 O ATOM 1176 OXT SER A 72 -15.450 -13.404 0.120 1.00 0.00 O ATOM 0 H SER A 72 -15.133 -10.163 0.699 1.00 0.00 H new ATOM 0 HA SER A 72 -16.929 -10.962 -1.353 1.00 0.00 H new ATOM 0 HB2 SER A 72 -13.943 -10.845 -0.941 1.00 0.00 H new ATOM 0 HB3 SER A 72 -14.506 -11.841 -2.268 1.00 0.00 H new ATOM 0 HG SER A 72 -15.043 -9.068 -1.761 1.00 0.00 H new TER 1182 SER A 72 ATOM 1183 N ALA B 2 -3.384 -15.725 -20.152 1.00 0.00 N ATOM 1184 CA ALA B 2 -4.297 -14.669 -20.679 1.00 0.00 C ATOM 1185 C ALA B 2 -5.749 -15.059 -20.388 1.00 0.00 C ATOM 1186 O ALA B 2 -6.542 -14.234 -19.978 1.00 0.00 O ATOM 1187 CB ALA B 2 -4.112 -14.501 -22.187 1.00 0.00 C ATOM 0 HA ALA B 2 -4.059 -13.725 -20.188 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -4.787 -13.727 -22.552 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -3.082 -14.214 -22.397 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -4.336 -15.443 -22.688 1.00 0.00 H new ATOM 1195 N LYS B 3 -6.060 -16.312 -20.611 1.00 0.00 N ATOM 1196 CA LYS B 3 -7.457 -16.792 -20.359 1.00 0.00 C ATOM 1197 C LYS B 3 -7.458 -17.868 -19.267 1.00 0.00 C ATOM 1198 O LYS B 3 -8.111 -18.884 -19.395 1.00 0.00 O ATOM 1199 CB LYS B 3 -8.021 -17.380 -21.651 1.00 0.00 C ATOM 1200 CG LYS B 3 -8.019 -16.300 -22.735 1.00 0.00 C ATOM 1201 CD LYS B 3 -8.650 -16.866 -24.009 1.00 0.00 C ATOM 1202 CE LYS B 3 -8.028 -16.178 -25.225 1.00 0.00 C ATOM 1203 NZ LYS B 3 -8.950 -16.250 -26.394 1.00 0.00 N ATOM 0 H LYS B 3 -5.412 -17.021 -20.955 1.00 0.00 H new ATOM 0 HA LYS B 3 -8.072 -15.954 -20.029 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.422 -18.233 -21.969 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -9.034 -17.746 -21.487 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -8.576 -15.426 -22.396 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.000 -15.970 -22.935 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -8.488 -17.943 -24.062 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.728 -16.706 -23.997 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -7.811 -15.136 -24.989 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.079 -16.653 -25.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -8.512 -15.778 -27.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -9.136 -17.246 -26.628 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.846 -15.776 -26.160 1.00 0.00 H new ATOM 1217 N GLU B 4 -6.722 -17.620 -18.216 1.00 0.00 N ATOM 1218 CA GLU B 4 -6.667 -18.619 -17.106 1.00 0.00 C ATOM 1219 C GLU B 4 -7.643 -18.226 -15.991 1.00 0.00 C ATOM 1220 O GLU B 4 -7.386 -17.314 -15.230 1.00 0.00 O ATOM 1221 CB GLU B 4 -5.246 -18.665 -16.548 1.00 0.00 C ATOM 1222 CG GLU B 4 -4.357 -19.459 -17.507 1.00 0.00 C ATOM 1223 CD GLU B 4 -4.384 -18.797 -18.886 1.00 0.00 C ATOM 1224 OE1 GLU B 4 -4.323 -17.578 -18.903 1.00 0.00 O ATOM 1225 OE2 GLU B 4 -4.464 -19.546 -19.845 1.00 0.00 O ATOM 0 H GLU B 4 -6.162 -16.779 -18.077 1.00 0.00 H new ATOM 0 HA GLU B 4 -6.949 -19.600 -17.489 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -4.857 -17.654 -16.425 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -5.244 -19.129 -15.562 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -3.336 -19.496 -17.128 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -4.708 -20.489 -17.578 1.00 0.00 H new ATOM 1232 N LEU B 5 -8.743 -18.926 -15.920 1.00 0.00 N ATOM 1233 CA LEU B 5 -9.747 -18.609 -14.861 1.00 0.00 C ATOM 1234 C LEU B 5 -9.473 -19.455 -13.609 1.00 0.00 C ATOM 1235 O LEU B 5 -10.328 -20.195 -13.160 1.00 0.00 O ATOM 1236 CB LEU B 5 -11.153 -18.923 -15.395 1.00 0.00 C ATOM 1237 CG LEU B 5 -11.665 -17.758 -16.268 1.00 0.00 C ATOM 1238 CD1 LEU B 5 -11.947 -16.523 -15.390 1.00 0.00 C ATOM 1239 CD2 LEU B 5 -10.610 -17.410 -17.332 1.00 0.00 C ATOM 0 H LEU B 5 -8.989 -19.696 -16.542 1.00 0.00 H new ATOM 0 HA LEU B 5 -9.677 -17.554 -14.598 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -11.131 -19.843 -15.980 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -11.837 -19.091 -14.563 1.00 0.00 H new ATOM 0 HG LEU B 5 -12.590 -18.060 -16.760 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -12.308 -15.707 -16.016 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -12.703 -16.771 -14.645 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -11.030 -16.217 -14.887 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -10.972 -16.587 -17.948 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -9.682 -17.115 -16.842 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -10.427 -18.281 -17.961 1.00 0.00 H new ATOM 1251 N ARG B 6 -8.279 -19.330 -13.078 1.00 0.00 N ATOM 1252 CA ARG B 6 -7.922 -20.121 -11.855 1.00 0.00 C ATOM 1253 C ARG B 6 -7.333 -19.201 -10.779 1.00 0.00 C ATOM 1254 O ARG B 6 -6.511 -18.355 -11.063 1.00 0.00 O ATOM 1255 CB ARG B 6 -6.884 -21.188 -12.228 1.00 0.00 C ATOM 1256 CG ARG B 6 -7.434 -22.081 -13.355 1.00 0.00 C ATOM 1257 CD ARG B 6 -8.471 -23.068 -12.793 1.00 0.00 C ATOM 1258 NE ARG B 6 -7.959 -24.455 -12.968 1.00 0.00 N ATOM 1259 CZ ARG B 6 -7.803 -24.935 -14.172 1.00 0.00 C ATOM 1260 NH1 ARG B 6 -8.487 -24.413 -15.153 1.00 0.00 N ATOM 1261 NH2 ARG B 6 -6.967 -25.920 -14.354 1.00 0.00 N ATOM 0 H ARG B 6 -7.542 -18.721 -13.434 1.00 0.00 H new ATOM 0 HA ARG B 6 -8.823 -20.594 -11.464 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -5.958 -20.711 -12.549 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -6.644 -21.795 -11.355 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -7.891 -21.463 -14.128 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -6.618 -22.629 -13.826 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -8.653 -22.864 -11.738 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -9.423 -22.949 -13.310 1.00 0.00 H new ATOM 0 HE ARG B 6 -7.732 -25.026 -12.154 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -9.131 -23.643 -14.973 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -8.378 -24.775 -16.100 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -6.449 -26.302 -13.563 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -6.832 -26.308 -15.287 1.00 0.00 H new ATOM 1275 N CYS B 7 -7.765 -19.395 -9.563 1.00 0.00 N ATOM 1276 CA CYS B 7 -7.248 -18.541 -8.453 1.00 0.00 C ATOM 1277 C CYS B 7 -5.734 -18.729 -8.292 1.00 0.00 C ATOM 1278 O CYS B 7 -5.214 -19.801 -8.528 1.00 0.00 O ATOM 1279 CB CYS B 7 -7.949 -18.937 -7.154 1.00 0.00 C ATOM 1280 SG CYS B 7 -9.655 -18.379 -6.926 1.00 0.00 S ATOM 0 H CYS B 7 -8.448 -20.102 -9.290 1.00 0.00 H new ATOM 0 HA CYS B 7 -7.448 -17.495 -8.685 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -7.938 -20.025 -7.083 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -7.356 -18.557 -6.322 1.00 0.00 H new ATOM 1285 N GLN B 8 -5.053 -17.681 -7.892 1.00 0.00 N ATOM 1286 CA GLN B 8 -3.573 -17.807 -7.705 1.00 0.00 C ATOM 1287 C GLN B 8 -3.264 -18.808 -6.583 1.00 0.00 C ATOM 1288 O GLN B 8 -2.247 -19.473 -6.609 1.00 0.00 O ATOM 1289 CB GLN B 8 -2.983 -16.444 -7.341 1.00 0.00 C ATOM 1290 CG GLN B 8 -2.787 -15.618 -8.613 1.00 0.00 C ATOM 1291 CD GLN B 8 -2.908 -14.131 -8.276 1.00 0.00 C ATOM 1292 OE1 GLN B 8 -3.951 -13.658 -7.871 1.00 0.00 O ATOM 1293 NE2 GLN B 8 -1.866 -13.360 -8.424 1.00 0.00 N ATOM 0 H GLN B 8 -5.448 -16.762 -7.691 1.00 0.00 H new ATOM 0 HA GLN B 8 -3.131 -18.163 -8.635 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -3.647 -15.920 -6.653 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -2.030 -16.573 -6.828 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -1.809 -15.825 -9.048 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -3.532 -15.895 -9.358 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -0.987 -13.750 -8.764 1.00 0.00 H new ATOM 0 HE22 GLN B 8 -1.930 -12.367 -8.200 1.00 0.00 H new ATOM 1302 N CYS B 9 -4.151 -18.891 -5.625 1.00 0.00 N ATOM 1303 CA CYS B 9 -3.926 -19.843 -4.494 1.00 0.00 C ATOM 1304 C CYS B 9 -4.790 -21.096 -4.672 1.00 0.00 C ATOM 1305 O CYS B 9 -5.998 -21.011 -4.778 1.00 0.00 O ATOM 1306 CB CYS B 9 -4.296 -19.156 -3.179 1.00 0.00 C ATOM 1307 SG CYS B 9 -3.074 -18.035 -2.455 1.00 0.00 S ATOM 0 H CYS B 9 -5.013 -18.348 -5.576 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.877 -20.137 -4.480 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -5.216 -18.594 -3.339 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.520 -19.930 -2.445 1.00 0.00 H new ATOM 1312 N ILE B 10 -4.150 -22.234 -4.701 1.00 0.00 N ATOM 1313 CA ILE B 10 -4.917 -23.503 -4.865 1.00 0.00 C ATOM 1314 C ILE B 10 -5.182 -24.132 -3.493 1.00 0.00 C ATOM 1315 O ILE B 10 -6.310 -24.199 -3.045 1.00 0.00 O ATOM 1316 CB ILE B 10 -4.106 -24.472 -5.728 1.00 0.00 C ATOM 1317 CG1 ILE B 10 -3.611 -23.738 -6.978 1.00 0.00 C ATOM 1318 CG2 ILE B 10 -4.999 -25.638 -6.149 1.00 0.00 C ATOM 1319 CD1 ILE B 10 -2.947 -24.745 -7.921 1.00 0.00 C ATOM 0 H ILE B 10 -3.139 -22.340 -4.619 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.871 -23.292 -5.348 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.255 -24.848 -5.160 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -4.444 -23.246 -7.480 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -2.901 -22.959 -6.700 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -4.426 -26.332 -6.764 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -5.363 -26.156 -5.262 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -5.846 -25.260 -6.722 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -2.592 -24.229 -8.813 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -2.104 -25.216 -7.415 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -3.671 -25.508 -8.207 1.00 0.00 H new ATOM 1331 N LYS B 11 -4.132 -24.579 -2.854 1.00 0.00 N ATOM 1332 CA LYS B 11 -4.299 -25.202 -1.506 1.00 0.00 C ATOM 1333 C LYS B 11 -3.987 -24.170 -0.414 1.00 0.00 C ATOM 1334 O LYS B 11 -3.781 -23.008 -0.701 1.00 0.00 O ATOM 1335 CB LYS B 11 -3.345 -26.390 -1.384 1.00 0.00 C ATOM 1336 CG LYS B 11 -4.074 -27.667 -1.814 1.00 0.00 C ATOM 1337 CD LYS B 11 -4.923 -28.187 -0.649 1.00 0.00 C ATOM 1338 CE LYS B 11 -4.159 -29.300 0.071 1.00 0.00 C ATOM 1339 NZ LYS B 11 -2.751 -28.885 0.326 1.00 0.00 N ATOM 0 H LYS B 11 -3.174 -24.541 -3.203 1.00 0.00 H new ATOM 0 HA LYS B 11 -5.327 -25.544 -1.385 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.466 -26.231 -2.008 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.994 -26.486 -0.357 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -4.708 -27.464 -2.677 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -3.353 -28.425 -2.119 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -5.147 -27.376 0.044 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -5.877 -28.564 -1.018 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -4.651 -29.536 1.014 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -4.173 -30.208 -0.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.290 -29.582 0.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -2.237 -28.830 -0.576 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -2.742 -27.953 0.787 1.00 0.00 H new ATOM 1353 N THR B 12 -3.956 -24.614 0.815 1.00 0.00 N ATOM 1354 CA THR B 12 -3.660 -23.658 1.924 1.00 0.00 C ATOM 1355 C THR B 12 -2.878 -24.354 3.044 1.00 0.00 C ATOM 1356 O THR B 12 -2.628 -25.542 2.989 1.00 0.00 O ATOM 1357 CB THR B 12 -4.976 -23.114 2.484 1.00 0.00 C ATOM 1358 OG1 THR B 12 -5.786 -24.267 2.693 1.00 0.00 O ATOM 1359 CG2 THR B 12 -5.720 -22.279 1.446 1.00 0.00 C ATOM 0 H THR B 12 -4.120 -25.581 1.097 1.00 0.00 H new ATOM 0 HA THR B 12 -3.054 -22.841 1.532 1.00 0.00 H new ATOM 0 HB THR B 12 -4.783 -22.507 3.368 1.00 0.00 H new ATOM 0 HG1 THR B 12 -6.655 -23.995 3.057 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.650 -21.908 1.876 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.098 -21.436 1.144 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.944 -22.896 0.575 1.00 0.00 H new ATOM 1367 N TYR B 13 -2.511 -23.591 4.036 1.00 0.00 N ATOM 1368 CA TYR B 13 -1.739 -24.174 5.175 1.00 0.00 C ATOM 1369 C TYR B 13 -2.689 -24.788 6.211 1.00 0.00 C ATOM 1370 O TYR B 13 -3.823 -24.369 6.340 1.00 0.00 O ATOM 1371 CB TYR B 13 -0.920 -23.056 5.828 1.00 0.00 C ATOM 1372 CG TYR B 13 0.451 -23.591 6.255 1.00 0.00 C ATOM 1373 CD1 TYR B 13 1.327 -24.102 5.320 1.00 0.00 C ATOM 1374 CD2 TYR B 13 0.831 -23.566 7.582 1.00 0.00 C ATOM 1375 CE1 TYR B 13 2.562 -24.583 5.705 1.00 0.00 C ATOM 1376 CE2 TYR B 13 2.066 -24.045 7.967 1.00 0.00 C ATOM 1377 CZ TYR B 13 2.940 -24.559 7.031 1.00 0.00 C ATOM 1378 OH TYR B 13 4.175 -25.038 7.415 1.00 0.00 O ATOM 0 H TYR B 13 -2.710 -22.593 4.110 1.00 0.00 H new ATOM 0 HA TYR B 13 -1.082 -24.960 4.804 1.00 0.00 H new ATOM 0 HB2 TYR B 13 -0.795 -22.229 5.128 1.00 0.00 H new ATOM 0 HB3 TYR B 13 -1.452 -22.663 6.694 1.00 0.00 H new ATOM 0 HD1 TYR B 13 1.044 -24.126 4.278 1.00 0.00 H new ATOM 0 HD2 TYR B 13 0.156 -23.168 8.325 1.00 0.00 H new ATOM 0 HE1 TYR B 13 3.237 -24.981 4.962 1.00 0.00 H new ATOM 0 HE2 TYR B 13 2.351 -24.018 9.008 1.00 0.00 H new ATOM 0 HH TYR B 13 4.275 -24.943 8.385 1.00 0.00 H new ATOM 1388 N SER B 14 -2.199 -25.774 6.926 1.00 0.00 N ATOM 1389 CA SER B 14 -3.050 -26.438 7.966 1.00 0.00 C ATOM 1390 C SER B 14 -2.278 -26.546 9.288 1.00 0.00 C ATOM 1391 O SER B 14 -2.537 -27.420 10.092 1.00 0.00 O ATOM 1392 CB SER B 14 -3.431 -27.836 7.482 1.00 0.00 C ATOM 1393 OG SER B 14 -2.201 -28.545 7.464 1.00 0.00 O ATOM 0 H SER B 14 -1.253 -26.146 6.836 1.00 0.00 H new ATOM 0 HA SER B 14 -3.949 -25.844 8.129 1.00 0.00 H new ATOM 0 HB2 SER B 14 -4.152 -28.306 8.151 1.00 0.00 H new ATOM 0 HB3 SER B 14 -3.887 -27.804 6.493 1.00 0.00 H new ATOM 0 HG SER B 14 -2.358 -29.464 7.163 1.00 0.00 H new ATOM 1399 N LYS B 15 -1.348 -25.651 9.480 1.00 0.00 N ATOM 1400 CA LYS B 15 -0.543 -25.669 10.739 1.00 0.00 C ATOM 1401 C LYS B 15 -0.250 -24.206 11.187 1.00 0.00 C ATOM 1402 O LYS B 15 0.582 -23.555 10.597 1.00 0.00 O ATOM 1403 CB LYS B 15 0.780 -26.379 10.460 1.00 0.00 C ATOM 1404 CG LYS B 15 1.731 -26.143 11.637 1.00 0.00 C ATOM 1405 CD LYS B 15 2.623 -27.373 11.818 1.00 0.00 C ATOM 1406 CE LYS B 15 3.408 -27.617 10.528 1.00 0.00 C ATOM 1407 NZ LYS B 15 4.605 -28.461 10.799 1.00 0.00 N ATOM 0 H LYS B 15 -1.109 -24.909 8.822 1.00 0.00 H new ATOM 0 HA LYS B 15 -1.093 -26.187 11.525 1.00 0.00 H new ATOM 0 HB2 LYS B 15 0.612 -27.447 10.320 1.00 0.00 H new ATOM 0 HB3 LYS B 15 1.222 -26.002 9.538 1.00 0.00 H new ATOM 0 HG2 LYS B 15 2.342 -25.259 11.454 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.162 -25.954 12.547 1.00 0.00 H new ATOM 0 HD2 LYS B 15 3.308 -27.221 12.652 1.00 0.00 H new ATOM 0 HD3 LYS B 15 2.016 -28.245 12.059 1.00 0.00 H new ATOM 0 HE2 LYS B 15 2.769 -28.107 9.793 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.717 -26.665 10.097 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 5.127 -28.617 9.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 5.222 -27.979 11.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 4.303 -29.377 11.189 1.00 0.00 H new ATOM 1421 N PRO B 16 -0.930 -23.712 12.231 1.00 0.00 N ATOM 1422 CA PRO B 16 -0.726 -22.322 12.681 1.00 0.00 C ATOM 1423 C PRO B 16 0.734 -22.034 13.050 1.00 0.00 C ATOM 1424 O PRO B 16 1.444 -22.897 13.528 1.00 0.00 O ATOM 1425 CB PRO B 16 -1.632 -22.152 13.904 1.00 0.00 C ATOM 1426 CG PRO B 16 -2.454 -23.465 14.061 1.00 0.00 C ATOM 1427 CD PRO B 16 -1.920 -24.470 13.025 1.00 0.00 C ATOM 0 HA PRO B 16 -0.968 -21.622 11.882 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -1.038 -21.962 14.798 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -2.296 -21.297 13.774 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -2.351 -23.863 15.070 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -3.515 -23.275 13.900 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -1.460 -25.331 13.511 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -2.723 -24.851 12.394 1.00 0.00 H new ATOM 1435 N PHE B 17 1.146 -20.808 12.814 1.00 0.00 N ATOM 1436 CA PHE B 17 2.545 -20.424 13.146 1.00 0.00 C ATOM 1437 C PHE B 17 2.621 -18.929 13.517 1.00 0.00 C ATOM 1438 O PHE B 17 1.764 -18.147 13.158 1.00 0.00 O ATOM 1439 CB PHE B 17 3.476 -20.736 11.958 1.00 0.00 C ATOM 1440 CG PHE B 17 2.961 -20.086 10.662 1.00 0.00 C ATOM 1441 CD1 PHE B 17 1.777 -20.508 10.073 1.00 0.00 C ATOM 1442 CD2 PHE B 17 3.679 -19.067 10.058 1.00 0.00 C ATOM 1443 CE1 PHE B 17 1.327 -19.921 8.910 1.00 0.00 C ATOM 1444 CE2 PHE B 17 3.225 -18.487 8.894 1.00 0.00 C ATOM 1445 CZ PHE B 17 2.051 -18.912 8.323 1.00 0.00 C ATOM 0 H PHE B 17 0.574 -20.067 12.409 1.00 0.00 H new ATOM 0 HA PHE B 17 2.873 -21.006 14.007 1.00 0.00 H new ATOM 0 HB2 PHE B 17 4.481 -20.374 12.175 1.00 0.00 H new ATOM 0 HB3 PHE B 17 3.548 -21.815 11.823 1.00 0.00 H new ATOM 0 HD1 PHE B 17 1.204 -21.302 10.529 1.00 0.00 H new ATOM 0 HD2 PHE B 17 4.602 -18.725 10.503 1.00 0.00 H new ATOM 0 HE1 PHE B 17 0.404 -20.255 8.460 1.00 0.00 H new ATOM 0 HE2 PHE B 17 3.794 -17.696 8.429 1.00 0.00 H new ATOM 0 HZ PHE B 17 1.697 -18.453 7.412 1.00 0.00 H new ATOM 1455 N HIS B 18 3.656 -18.584 14.231 1.00 0.00 N ATOM 1456 CA HIS B 18 3.836 -17.164 14.689 1.00 0.00 C ATOM 1457 C HIS B 18 4.323 -16.256 13.513 1.00 0.00 C ATOM 1458 O HIS B 18 5.091 -16.701 12.685 1.00 0.00 O ATOM 1459 CB HIS B 18 4.912 -17.198 15.780 1.00 0.00 C ATOM 1460 CG HIS B 18 4.924 -15.895 16.558 1.00 0.00 C ATOM 1461 ND1 HIS B 18 5.486 -14.779 16.137 1.00 0.00 N ATOM 1462 CD2 HIS B 18 4.389 -15.613 17.809 1.00 0.00 C ATOM 1463 CE1 HIS B 18 5.326 -13.873 17.042 1.00 0.00 C ATOM 1464 NE2 HIS B 18 4.677 -14.368 18.029 1.00 0.00 N ATOM 0 H HIS B 18 4.394 -19.225 14.523 1.00 0.00 H new ATOM 0 HA HIS B 18 2.893 -16.756 15.053 1.00 0.00 H new ATOM 0 HB2 HIS B 18 4.724 -18.031 16.458 1.00 0.00 H new ATOM 0 HB3 HIS B 18 5.890 -17.368 15.329 1.00 0.00 H new ATOM 0 HD2 HIS B 18 3.849 -16.286 18.459 1.00 0.00 H new ATOM 0 HE1 HIS B 18 5.684 -12.856 16.977 1.00 0.00 H new ATOM 0 HE2 HIS B 18 4.422 -13.854 18.872 1.00 0.00 H new ATOM 1472 N PRO B 19 3.861 -14.990 13.456 1.00 0.00 N ATOM 1473 CA PRO B 19 4.294 -14.072 12.385 1.00 0.00 C ATOM 1474 C PRO B 19 5.815 -13.849 12.419 1.00 0.00 C ATOM 1475 O PRO B 19 6.386 -13.319 11.486 1.00 0.00 O ATOM 1476 CB PRO B 19 3.569 -12.749 12.660 1.00 0.00 C ATOM 1477 CG PRO B 19 2.759 -12.929 13.975 1.00 0.00 C ATOM 1478 CD PRO B 19 2.876 -14.402 14.394 1.00 0.00 C ATOM 0 HA PRO B 19 4.058 -14.481 11.402 1.00 0.00 H new ATOM 0 HB2 PRO B 19 4.284 -11.932 12.758 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.907 -12.495 11.833 1.00 0.00 H new ATOM 0 HG2 PRO B 19 3.148 -12.276 14.757 1.00 0.00 H new ATOM 0 HG3 PRO B 19 1.715 -12.656 13.822 1.00 0.00 H new ATOM 0 HD2 PRO B 19 3.212 -14.493 15.427 1.00 0.00 H new ATOM 0 HD3 PRO B 19 1.914 -14.910 14.325 1.00 0.00 H new ATOM 1486 N LYS B 20 6.435 -14.249 13.495 1.00 0.00 N ATOM 1487 CA LYS B 20 7.917 -14.066 13.603 1.00 0.00 C ATOM 1488 C LYS B 20 8.586 -14.491 12.292 1.00 0.00 C ATOM 1489 O LYS B 20 9.605 -13.956 11.903 1.00 0.00 O ATOM 1490 CB LYS B 20 8.442 -14.941 14.741 1.00 0.00 C ATOM 1491 CG LYS B 20 9.490 -14.187 15.566 1.00 0.00 C ATOM 1492 CD LYS B 20 9.792 -15.002 16.828 1.00 0.00 C ATOM 1493 CE LYS B 20 10.430 -16.338 16.436 1.00 0.00 C ATOM 1494 NZ LYS B 20 11.235 -16.880 17.565 1.00 0.00 N ATOM 0 H LYS B 20 5.988 -14.691 14.299 1.00 0.00 H new ATOM 0 HA LYS B 20 8.143 -13.018 13.801 1.00 0.00 H new ATOM 0 HB2 LYS B 20 7.616 -15.244 15.384 1.00 0.00 H new ATOM 0 HB3 LYS B 20 8.880 -15.852 14.333 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.399 -14.042 14.982 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.121 -13.197 15.834 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.463 -14.445 17.481 1.00 0.00 H new ATOM 0 HD3 LYS B 20 8.874 -15.177 17.389 1.00 0.00 H new ATOM 0 HE2 LYS B 20 9.654 -17.051 16.159 1.00 0.00 H new ATOM 0 HE3 LYS B 20 11.065 -16.202 15.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 11.661 -17.786 17.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 11.987 -16.205 17.811 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 10.620 -17.028 18.390 1.00 0.00 H new ATOM 1508 N PHE B 21 7.988 -15.449 11.644 1.00 0.00 N ATOM 1509 CA PHE B 21 8.558 -15.947 10.357 1.00 0.00 C ATOM 1510 C PHE B 21 8.067 -15.096 9.182 1.00 0.00 C ATOM 1511 O PHE B 21 8.711 -15.015 8.154 1.00 0.00 O ATOM 1512 CB PHE B 21 8.100 -17.389 10.151 1.00 0.00 C ATOM 1513 CG PHE B 21 8.516 -18.228 11.362 1.00 0.00 C ATOM 1514 CD1 PHE B 21 9.851 -18.525 11.581 1.00 0.00 C ATOM 1515 CD2 PHE B 21 7.567 -18.702 12.253 1.00 0.00 C ATOM 1516 CE1 PHE B 21 10.228 -19.282 12.672 1.00 0.00 C ATOM 1517 CE2 PHE B 21 7.948 -19.457 13.343 1.00 0.00 C ATOM 1518 CZ PHE B 21 9.278 -19.747 13.551 1.00 0.00 C ATOM 0 H PHE B 21 7.130 -15.910 11.947 1.00 0.00 H new ATOM 0 HA PHE B 21 9.645 -15.887 10.400 1.00 0.00 H new ATOM 0 HB2 PHE B 21 7.018 -17.425 10.023 1.00 0.00 H new ATOM 0 HB3 PHE B 21 8.542 -17.797 9.242 1.00 0.00 H new ATOM 0 HD1 PHE B 21 10.601 -18.162 10.894 1.00 0.00 H new ATOM 0 HD2 PHE B 21 6.522 -18.479 12.093 1.00 0.00 H new ATOM 0 HE1 PHE B 21 11.271 -19.510 12.836 1.00 0.00 H new ATOM 0 HE2 PHE B 21 7.202 -19.821 14.034 1.00 0.00 H new ATOM 0 HZ PHE B 21 9.575 -20.339 14.404 1.00 0.00 H new ATOM 1528 N ILE B 22 6.935 -14.483 9.361 1.00 0.00 N ATOM 1529 CA ILE B 22 6.365 -13.650 8.265 1.00 0.00 C ATOM 1530 C ILE B 22 6.916 -12.225 8.293 1.00 0.00 C ATOM 1531 O ILE B 22 6.971 -11.596 9.332 1.00 0.00 O ATOM 1532 CB ILE B 22 4.860 -13.627 8.427 1.00 0.00 C ATOM 1533 CG1 ILE B 22 4.342 -15.019 8.077 1.00 0.00 C ATOM 1534 CG2 ILE B 22 4.252 -12.593 7.475 1.00 0.00 C ATOM 1535 CD1 ILE B 22 3.018 -15.267 8.787 1.00 0.00 C ATOM 0 H ILE B 22 6.379 -14.521 10.215 1.00 0.00 H new ATOM 0 HA ILE B 22 6.645 -14.083 7.305 1.00 0.00 H new ATOM 0 HB ILE B 22 4.586 -13.358 9.447 1.00 0.00 H new ATOM 0 HG12 ILE B 22 4.210 -15.108 6.999 1.00 0.00 H new ATOM 0 HG13 ILE B 22 5.071 -15.774 8.372 1.00 0.00 H new ATOM 0 HG21 ILE B 22 3.169 -12.580 7.595 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.654 -11.606 7.705 1.00 0.00 H new ATOM 0 HG23 ILE B 22 4.500 -12.855 6.446 1.00 0.00 H new ATOM 0 HD11 ILE B 22 2.651 -16.262 8.535 1.00 0.00 H new ATOM 0 HD12 ILE B 22 3.164 -15.196 9.865 1.00 0.00 H new ATOM 0 HD13 ILE B 22 2.290 -14.520 8.470 1.00 0.00 H new ATOM 1547 N LYS B 23 7.317 -11.754 7.136 1.00 0.00 N ATOM 1548 CA LYS B 23 7.859 -10.371 7.040 1.00 0.00 C ATOM 1549 C LYS B 23 7.151 -9.607 5.913 1.00 0.00 C ATOM 1550 O LYS B 23 7.210 -8.394 5.856 1.00 0.00 O ATOM 1551 CB LYS B 23 9.363 -10.427 6.749 1.00 0.00 C ATOM 1552 CG LYS B 23 10.108 -10.977 7.973 1.00 0.00 C ATOM 1553 CD LYS B 23 11.592 -10.620 7.855 1.00 0.00 C ATOM 1554 CE LYS B 23 12.328 -11.112 9.104 1.00 0.00 C ATOM 1555 NZ LYS B 23 13.779 -10.786 9.016 1.00 0.00 N ATOM 0 H LYS B 23 7.290 -12.271 6.257 1.00 0.00 H new ATOM 0 HA LYS B 23 7.688 -9.856 7.986 1.00 0.00 H new ATOM 0 HB2 LYS B 23 9.552 -11.060 5.882 1.00 0.00 H new ATOM 0 HB3 LYS B 23 9.733 -9.431 6.504 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.691 -10.556 8.888 1.00 0.00 H new ATOM 0 HG3 LYS B 23 9.985 -12.058 8.034 1.00 0.00 H new ATOM 0 HD2 LYS B 23 12.019 -11.078 6.963 1.00 0.00 H new ATOM 0 HD3 LYS B 23 11.712 -9.542 7.749 1.00 0.00 H new ATOM 0 HE2 LYS B 23 11.898 -10.649 9.993 1.00 0.00 H new ATOM 0 HE3 LYS B 23 12.197 -12.189 9.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 14.264 -11.126 9.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 14.188 -11.248 8.179 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 13.899 -9.756 8.937 1.00 0.00 H new ATOM 1569 N GLU B 24 6.499 -10.338 5.038 1.00 0.00 N ATOM 1570 CA GLU B 24 5.776 -9.672 3.906 1.00 0.00 C ATOM 1571 C GLU B 24 4.364 -10.260 3.767 1.00 0.00 C ATOM 1572 O GLU B 24 4.204 -11.449 3.573 1.00 0.00 O ATOM 1573 CB GLU B 24 6.553 -9.906 2.611 1.00 0.00 C ATOM 1574 CG GLU B 24 5.667 -9.540 1.420 1.00 0.00 C ATOM 1575 CD GLU B 24 6.549 -9.251 0.203 1.00 0.00 C ATOM 1576 OE1 GLU B 24 7.445 -10.049 -0.019 1.00 0.00 O ATOM 1577 OE2 GLU B 24 6.278 -8.247 -0.436 1.00 0.00 O ATOM 0 H GLU B 24 6.436 -11.356 5.058 1.00 0.00 H new ATOM 0 HA GLU B 24 5.698 -8.603 4.105 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.461 -9.303 2.603 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.863 -10.949 2.542 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.979 -10.356 1.199 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.059 -8.667 1.659 1.00 0.00 H new ATOM 1584 N LEU B 25 3.372 -9.411 3.866 1.00 0.00 N ATOM 1585 CA LEU B 25 1.966 -9.902 3.748 1.00 0.00 C ATOM 1586 C LEU B 25 1.410 -9.597 2.356 1.00 0.00 C ATOM 1587 O LEU B 25 1.801 -8.634 1.726 1.00 0.00 O ATOM 1588 CB LEU B 25 1.103 -9.205 4.797 1.00 0.00 C ATOM 1589 CG LEU B 25 -0.147 -10.047 5.059 1.00 0.00 C ATOM 1590 CD1 LEU B 25 0.131 -11.027 6.203 1.00 0.00 C ATOM 1591 CD2 LEU B 25 -1.299 -9.124 5.458 1.00 0.00 C ATOM 0 H LEU B 25 3.473 -8.408 4.022 1.00 0.00 H new ATOM 0 HA LEU B 25 1.952 -10.980 3.906 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.667 -9.073 5.720 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.821 -8.211 4.451 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.411 -10.601 4.158 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.759 -11.628 6.391 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.959 -11.681 5.929 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.390 -10.471 7.104 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.193 -9.718 5.646 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.030 -8.577 6.362 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.496 -8.418 4.651 1.00 0.00 H new ATOM 1603 N ARG B 26 0.504 -10.423 1.907 1.00 0.00 N ATOM 1604 CA ARG B 26 -0.090 -10.195 0.559 1.00 0.00 C ATOM 1605 C ARG B 26 -1.563 -10.615 0.549 1.00 0.00 C ATOM 1606 O ARG B 26 -1.901 -11.706 0.965 1.00 0.00 O ATOM 1607 CB ARG B 26 0.678 -11.013 -0.467 1.00 0.00 C ATOM 1608 CG ARG B 26 1.703 -10.117 -1.158 1.00 0.00 C ATOM 1609 CD ARG B 26 2.743 -10.989 -1.868 1.00 0.00 C ATOM 1610 NE ARG B 26 2.045 -12.088 -2.591 1.00 0.00 N ATOM 1611 CZ ARG B 26 2.298 -12.281 -3.857 1.00 0.00 C ATOM 1612 NH1 ARG B 26 3.415 -12.867 -4.194 1.00 0.00 N ATOM 1613 NH2 ARG B 26 1.430 -11.879 -4.742 1.00 0.00 N ATOM 0 H ARG B 26 0.152 -11.238 2.410 1.00 0.00 H new ATOM 0 HA ARG B 26 -0.026 -9.135 0.314 1.00 0.00 H new ATOM 0 HB2 ARG B 26 1.178 -11.851 0.019 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -0.008 -11.434 -1.202 1.00 0.00 H new ATOM 0 HG2 ARG B 26 1.207 -9.465 -1.877 1.00 0.00 H new ATOM 0 HG3 ARG B 26 2.191 -9.472 -0.427 1.00 0.00 H new ATOM 0 HD2 ARG B 26 3.323 -10.388 -2.568 1.00 0.00 H new ATOM 0 HD3 ARG B 26 3.445 -11.402 -1.144 1.00 0.00 H new ATOM 0 HE ARG B 26 1.376 -12.683 -2.102 1.00 0.00 H new ATOM 0 HH11 ARG B 26 4.072 -13.165 -3.473 1.00 0.00 H new ATOM 0 HH12 ARG B 26 3.630 -13.027 -5.178 1.00 0.00 H new ATOM 0 HH21 ARG B 26 0.569 -11.422 -4.441 1.00 0.00 H new ATOM 0 HH22 ARG B 26 1.611 -12.022 -5.736 1.00 0.00 H new ATOM 1627 N VAL B 27 -2.407 -9.733 0.075 1.00 0.00 N ATOM 1628 CA VAL B 27 -3.868 -10.052 0.020 1.00 0.00 C ATOM 1629 C VAL B 27 -4.415 -9.758 -1.379 1.00 0.00 C ATOM 1630 O VAL B 27 -4.360 -8.636 -1.845 1.00 0.00 O ATOM 1631 CB VAL B 27 -4.606 -9.197 1.048 1.00 0.00 C ATOM 1632 CG1 VAL B 27 -6.039 -9.712 1.194 1.00 0.00 C ATOM 1633 CG2 VAL B 27 -3.892 -9.304 2.398 1.00 0.00 C ATOM 0 H VAL B 27 -2.150 -8.810 -0.275 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.017 -11.108 0.243 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.620 -8.157 0.721 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.571 -9.105 1.927 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -6.548 -9.649 0.232 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.021 -10.750 1.527 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.415 -8.695 3.136 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -3.885 -10.344 2.725 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -2.866 -8.949 2.296 1.00 0.00 H new ATOM 1643 N ILE B 28 -4.933 -10.778 -2.014 1.00 0.00 N ATOM 1644 CA ILE B 28 -5.488 -10.598 -3.392 1.00 0.00 C ATOM 1645 C ILE B 28 -7.001 -10.837 -3.388 1.00 0.00 C ATOM 1646 O ILE B 28 -7.460 -11.946 -3.195 1.00 0.00 O ATOM 1647 CB ILE B 28 -4.808 -11.602 -4.328 1.00 0.00 C ATOM 1648 CG1 ILE B 28 -3.358 -11.166 -4.555 1.00 0.00 C ATOM 1649 CG2 ILE B 28 -5.540 -11.634 -5.668 1.00 0.00 C ATOM 1650 CD1 ILE B 28 -2.466 -12.407 -4.613 1.00 0.00 C ATOM 0 H ILE B 28 -4.996 -11.725 -1.641 1.00 0.00 H new ATOM 0 HA ILE B 28 -5.299 -9.580 -3.733 1.00 0.00 H new ATOM 0 HB ILE B 28 -4.834 -12.595 -3.880 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -3.276 -10.600 -5.483 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -3.033 -10.507 -3.750 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.054 -12.349 -6.331 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -6.576 -11.933 -5.509 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.513 -10.643 -6.121 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -1.431 -12.104 -4.775 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -2.542 -12.954 -3.673 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -2.788 -13.049 -5.433 1.00 0.00 H new ATOM 1662 N GLU B 29 -7.743 -9.784 -3.602 1.00 0.00 N ATOM 1663 CA GLU B 29 -9.230 -9.918 -3.615 1.00 0.00 C ATOM 1664 C GLU B 29 -9.682 -10.582 -4.924 1.00 0.00 C ATOM 1665 O GLU B 29 -8.925 -10.656 -5.872 1.00 0.00 O ATOM 1666 CB GLU B 29 -9.846 -8.515 -3.497 1.00 0.00 C ATOM 1667 CG GLU B 29 -11.368 -8.617 -3.306 1.00 0.00 C ATOM 1668 CD GLU B 29 -12.070 -8.252 -4.614 1.00 0.00 C ATOM 1669 OE1 GLU B 29 -11.516 -8.601 -5.640 1.00 0.00 O ATOM 1670 OE2 GLU B 29 -13.122 -7.643 -4.511 1.00 0.00 O ATOM 0 H GLU B 29 -7.388 -8.842 -3.767 1.00 0.00 H new ATOM 0 HA GLU B 29 -9.557 -10.538 -2.781 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -9.401 -7.984 -2.655 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -9.623 -7.935 -4.393 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.641 -9.628 -3.004 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -11.691 -7.948 -2.508 1.00 0.00 H new ATOM 1677 N SER B 30 -10.903 -11.062 -4.940 1.00 0.00 N ATOM 1678 CA SER B 30 -11.429 -11.728 -6.179 1.00 0.00 C ATOM 1679 C SER B 30 -10.957 -10.986 -7.436 1.00 0.00 C ATOM 1680 O SER B 30 -11.276 -9.831 -7.633 1.00 0.00 O ATOM 1681 CB SER B 30 -12.956 -11.724 -6.142 1.00 0.00 C ATOM 1682 OG SER B 30 -13.293 -10.370 -5.871 1.00 0.00 O ATOM 0 H SER B 30 -11.555 -11.023 -4.157 1.00 0.00 H new ATOM 0 HA SER B 30 -11.053 -12.751 -6.212 1.00 0.00 H new ATOM 0 HB2 SER B 30 -13.379 -12.058 -7.090 1.00 0.00 H new ATOM 0 HB3 SER B 30 -13.338 -12.392 -5.370 1.00 0.00 H new ATOM 0 HG SER B 30 -12.630 -9.779 -6.285 1.00 0.00 H new ATOM 1688 N GLY B 31 -10.214 -11.678 -8.257 1.00 0.00 N ATOM 1689 CA GLY B 31 -9.698 -11.048 -9.512 1.00 0.00 C ATOM 1690 C GLY B 31 -10.324 -11.729 -10.737 1.00 0.00 C ATOM 1691 O GLY B 31 -11.193 -12.567 -10.609 1.00 0.00 O ATOM 0 H GLY B 31 -9.941 -12.651 -8.116 1.00 0.00 H new ATOM 0 HA2 GLY B 31 -9.933 -9.984 -9.518 1.00 0.00 H new ATOM 0 HA3 GLY B 31 -8.612 -11.135 -9.553 1.00 0.00 H new ATOM 1695 N PRO B 32 -9.860 -11.348 -11.909 1.00 0.00 N ATOM 1696 CA PRO B 32 -10.369 -11.920 -13.160 1.00 0.00 C ATOM 1697 C PRO B 32 -10.038 -13.413 -13.223 1.00 0.00 C ATOM 1698 O PRO B 32 -10.412 -14.102 -14.150 1.00 0.00 O ATOM 1699 CB PRO B 32 -9.644 -11.159 -14.277 1.00 0.00 C ATOM 1700 CG PRO B 32 -8.677 -10.143 -13.593 1.00 0.00 C ATOM 1701 CD PRO B 32 -8.807 -10.333 -12.071 1.00 0.00 C ATOM 0 HA PRO B 32 -11.451 -11.827 -13.247 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -9.090 -11.848 -14.914 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -10.359 -10.640 -14.915 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -7.650 -10.315 -13.914 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -8.932 -9.121 -13.875 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -7.866 -10.665 -11.632 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -9.078 -9.400 -11.577 1.00 0.00 H new ATOM 1709 N HIS B 33 -9.336 -13.866 -12.220 1.00 0.00 N ATOM 1710 CA HIS B 33 -8.945 -15.304 -12.163 1.00 0.00 C ATOM 1711 C HIS B 33 -9.520 -15.946 -10.900 1.00 0.00 C ATOM 1712 O HIS B 33 -9.633 -17.153 -10.810 1.00 0.00 O ATOM 1713 CB HIS B 33 -7.424 -15.388 -12.111 1.00 0.00 C ATOM 1714 CG HIS B 33 -6.957 -14.868 -10.750 1.00 0.00 C ATOM 1715 ND1 HIS B 33 -7.257 -13.709 -10.260 1.00 0.00 N ATOM 1716 CD2 HIS B 33 -6.174 -15.488 -9.773 1.00 0.00 C ATOM 1717 CE1 HIS B 33 -6.745 -13.559 -9.096 1.00 0.00 C ATOM 1718 NE2 HIS B 33 -6.079 -14.630 -8.774 1.00 0.00 N ATOM 0 H HIS B 33 -9.015 -13.300 -11.434 1.00 0.00 H new ATOM 0 HA HIS B 33 -9.329 -15.826 -13.040 1.00 0.00 H new ATOM 0 HB2 HIS B 33 -7.096 -16.417 -12.256 1.00 0.00 H new ATOM 0 HB3 HIS B 33 -6.984 -14.797 -12.914 1.00 0.00 H new ATOM 0 HD2 HIS B 33 -5.734 -16.473 -9.825 1.00 0.00 H new ATOM 0 HE1 HIS B 33 -6.850 -12.680 -8.477 1.00 0.00 H new ATOM 0 HE2 HIS B 33 -5.572 -14.780 -7.902 1.00 0.00 H new ATOM 1726 N CYS B 34 -9.868 -15.115 -9.949 1.00 0.00 N ATOM 1727 CA CYS B 34 -10.428 -15.642 -8.668 1.00 0.00 C ATOM 1728 C CYS B 34 -11.724 -14.908 -8.306 1.00 0.00 C ATOM 1729 O CYS B 34 -11.763 -13.695 -8.260 1.00 0.00 O ATOM 1730 CB CYS B 34 -9.400 -15.427 -7.559 1.00 0.00 C ATOM 1731 SG CYS B 34 -9.468 -16.533 -6.125 1.00 0.00 S ATOM 0 H CYS B 34 -9.789 -14.100 -10.004 1.00 0.00 H new ATOM 0 HA CYS B 34 -10.649 -16.703 -8.782 1.00 0.00 H new ATOM 0 HB2 CYS B 34 -8.407 -15.511 -8.001 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -9.504 -14.403 -7.199 1.00 0.00 H new ATOM 1736 N ALA B 35 -12.755 -15.666 -8.055 1.00 0.00 N ATOM 1737 CA ALA B 35 -14.055 -15.040 -7.684 1.00 0.00 C ATOM 1738 C ALA B 35 -14.203 -15.023 -6.158 1.00 0.00 C ATOM 1739 O ALA B 35 -15.300 -14.994 -5.637 1.00 0.00 O ATOM 1740 CB ALA B 35 -15.195 -15.852 -8.298 1.00 0.00 C ATOM 0 H ALA B 35 -12.755 -16.685 -8.090 1.00 0.00 H new ATOM 0 HA ALA B 35 -14.088 -14.017 -8.059 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -16.150 -15.399 -8.030 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -15.090 -15.863 -9.383 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -15.159 -16.873 -7.919 1.00 0.00 H new ATOM 1746 N ASN B 36 -13.088 -15.041 -5.480 1.00 0.00 N ATOM 1747 CA ASN B 36 -13.131 -15.034 -3.989 1.00 0.00 C ATOM 1748 C ASN B 36 -11.990 -14.190 -3.424 1.00 0.00 C ATOM 1749 O ASN B 36 -11.599 -13.198 -3.999 1.00 0.00 O ATOM 1750 CB ASN B 36 -12.997 -16.470 -3.482 1.00 0.00 C ATOM 1751 CG ASN B 36 -13.996 -17.363 -4.220 1.00 0.00 C ATOM 1752 OD1 ASN B 36 -15.178 -17.354 -3.941 1.00 0.00 O ATOM 1753 ND2 ASN B 36 -13.563 -18.149 -5.168 1.00 0.00 N ATOM 0 H ASN B 36 -12.154 -15.060 -5.890 1.00 0.00 H new ATOM 0 HA ASN B 36 -14.078 -14.605 -3.662 1.00 0.00 H new ATOM 0 HB2 ASN B 36 -11.981 -16.831 -3.643 1.00 0.00 H new ATOM 0 HB3 ASN B 36 -13.182 -16.507 -2.409 1.00 0.00 H new ATOM 0 HD21 ASN B 36 -14.216 -18.751 -5.670 1.00 0.00 H new ATOM 0 HD22 ASN B 36 -12.572 -18.161 -5.407 1.00 0.00 H new ATOM 1760 N THR B 37 -11.501 -14.604 -2.301 1.00 0.00 N ATOM 1761 CA THR B 37 -10.375 -13.862 -1.657 1.00 0.00 C ATOM 1762 C THR B 37 -9.302 -14.846 -1.184 1.00 0.00 C ATOM 1763 O THR B 37 -9.610 -15.901 -0.661 1.00 0.00 O ATOM 1764 CB THR B 37 -10.916 -13.069 -0.468 1.00 0.00 C ATOM 1765 OG1 THR B 37 -11.031 -11.733 -0.947 1.00 0.00 O ATOM 1766 CG2 THR B 37 -9.910 -12.998 0.684 1.00 0.00 C ATOM 0 H THR B 37 -11.827 -15.426 -1.792 1.00 0.00 H new ATOM 0 HA THR B 37 -9.927 -13.179 -2.379 1.00 0.00 H new ATOM 0 HB THR B 37 -11.837 -13.530 -0.110 1.00 0.00 H new ATOM 0 HG1 THR B 37 -11.776 -11.286 -0.494 1.00 0.00 H new ATOM 0 HG21 THR B 37 -10.338 -12.425 1.506 1.00 0.00 H new ATOM 0 HG22 THR B 37 -9.678 -14.006 1.027 1.00 0.00 H new ATOM 0 HG23 THR B 37 -8.997 -12.512 0.340 1.00 0.00 H new ATOM 1774 N GLU B 38 -8.063 -14.478 -1.380 1.00 0.00 N ATOM 1775 CA GLU B 38 -6.947 -15.375 -0.949 1.00 0.00 C ATOM 1776 C GLU B 38 -5.846 -14.550 -0.274 1.00 0.00 C ATOM 1777 O GLU B 38 -5.325 -13.617 -0.850 1.00 0.00 O ATOM 1778 CB GLU B 38 -6.373 -16.085 -2.175 1.00 0.00 C ATOM 1779 CG GLU B 38 -6.741 -15.294 -3.431 1.00 0.00 C ATOM 1780 CD GLU B 38 -5.880 -15.774 -4.600 1.00 0.00 C ATOM 1781 OE1 GLU B 38 -4.742 -15.335 -4.650 1.00 0.00 O ATOM 1782 OE2 GLU B 38 -6.407 -16.551 -5.379 1.00 0.00 O ATOM 0 H GLU B 38 -7.775 -13.602 -1.816 1.00 0.00 H new ATOM 0 HA GLU B 38 -7.326 -16.110 -0.240 1.00 0.00 H new ATOM 0 HB2 GLU B 38 -5.290 -16.169 -2.088 1.00 0.00 H new ATOM 0 HB3 GLU B 38 -6.767 -17.099 -2.241 1.00 0.00 H new ATOM 0 HG2 GLU B 38 -7.797 -15.429 -3.663 1.00 0.00 H new ATOM 0 HG3 GLU B 38 -6.585 -14.228 -3.263 1.00 0.00 H new ATOM 1789 N ILE B 39 -5.514 -14.913 0.936 1.00 0.00 N ATOM 1790 CA ILE B 39 -4.453 -14.156 1.659 1.00 0.00 C ATOM 1791 C ILE B 39 -3.092 -14.832 1.475 1.00 0.00 C ATOM 1792 O ILE B 39 -2.799 -15.826 2.109 1.00 0.00 O ATOM 1793 CB ILE B 39 -4.792 -14.105 3.150 1.00 0.00 C ATOM 1794 CG1 ILE B 39 -5.946 -13.117 3.371 1.00 0.00 C ATOM 1795 CG2 ILE B 39 -3.561 -13.631 3.927 1.00 0.00 C ATOM 1796 CD1 ILE B 39 -6.719 -13.509 4.636 1.00 0.00 C ATOM 0 H ILE B 39 -5.926 -15.692 1.450 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.404 -13.146 1.252 1.00 0.00 H new ATOM 0 HB ILE B 39 -5.087 -15.095 3.498 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -5.557 -12.103 3.469 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -6.613 -13.121 2.509 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -3.795 -13.592 4.991 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -2.737 -14.325 3.762 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -3.273 -12.638 3.582 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.539 -12.808 4.794 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -7.120 -14.516 4.520 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.049 -13.482 5.495 1.00 0.00 H new ATOM 1808 N ILE B 40 -2.288 -14.279 0.609 1.00 0.00 N ATOM 1809 CA ILE B 40 -0.940 -14.872 0.388 1.00 0.00 C ATOM 1810 C ILE B 40 0.062 -14.234 1.354 1.00 0.00 C ATOM 1811 O ILE B 40 -0.115 -13.108 1.774 1.00 0.00 O ATOM 1812 CB ILE B 40 -0.504 -14.617 -1.056 1.00 0.00 C ATOM 1813 CG1 ILE B 40 -1.244 -15.600 -1.978 1.00 0.00 C ATOM 1814 CG2 ILE B 40 1.008 -14.843 -1.171 1.00 0.00 C ATOM 1815 CD1 ILE B 40 -0.988 -15.236 -3.450 1.00 0.00 C ATOM 0 H ILE B 40 -2.503 -13.452 0.051 1.00 0.00 H new ATOM 0 HA ILE B 40 -0.977 -15.946 0.568 1.00 0.00 H new ATOM 0 HB ILE B 40 -0.740 -13.593 -1.345 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -0.907 -16.618 -1.783 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.313 -15.573 -1.769 1.00 0.00 H new ATOM 0 HG21 ILE B 40 1.326 -14.663 -2.198 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.530 -14.157 -0.504 1.00 0.00 H new ATOM 0 HG23 ILE B 40 1.245 -15.870 -0.893 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -1.516 -15.938 -4.095 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.347 -14.225 -3.643 1.00 0.00 H new ATOM 0 HD13 ILE B 40 0.081 -15.287 -3.657 1.00 0.00 H new ATOM 1827 N VAL B 41 1.090 -14.966 1.686 1.00 0.00 N ATOM 1828 CA VAL B 41 2.104 -14.420 2.635 1.00 0.00 C ATOM 1829 C VAL B 41 3.514 -14.835 2.206 1.00 0.00 C ATOM 1830 O VAL B 41 3.679 -15.719 1.387 1.00 0.00 O ATOM 1831 CB VAL B 41 1.804 -14.965 4.032 1.00 0.00 C ATOM 1832 CG1 VAL B 41 2.359 -16.388 4.148 1.00 0.00 C ATOM 1833 CG2 VAL B 41 2.466 -14.074 5.085 1.00 0.00 C ATOM 0 H VAL B 41 1.272 -15.910 1.345 1.00 0.00 H new ATOM 0 HA VAL B 41 2.054 -13.331 2.638 1.00 0.00 H new ATOM 0 HB VAL B 41 0.726 -14.976 4.195 1.00 0.00 H new ATOM 0 HG11 VAL B 41 2.148 -16.781 5.142 1.00 0.00 H new ATOM 0 HG12 VAL B 41 1.888 -17.024 3.399 1.00 0.00 H new ATOM 0 HG13 VAL B 41 3.437 -16.373 3.986 1.00 0.00 H new ATOM 0 HG21 VAL B 41 2.251 -14.465 6.080 1.00 0.00 H new ATOM 0 HG22 VAL B 41 3.544 -14.062 4.926 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.075 -13.060 5.001 1.00 0.00 H new ATOM 1843 N LYS B 42 4.502 -14.187 2.773 1.00 0.00 N ATOM 1844 CA LYS B 42 5.910 -14.527 2.409 1.00 0.00 C ATOM 1845 C LYS B 42 6.806 -14.528 3.655 1.00 0.00 C ATOM 1846 O LYS B 42 6.848 -13.562 4.402 1.00 0.00 O ATOM 1847 CB LYS B 42 6.434 -13.496 1.410 1.00 0.00 C ATOM 1848 CG LYS B 42 6.646 -14.174 0.055 1.00 0.00 C ATOM 1849 CD LYS B 42 7.181 -13.145 -0.944 1.00 0.00 C ATOM 1850 CE LYS B 42 7.574 -13.861 -2.237 1.00 0.00 C ATOM 1851 NZ LYS B 42 8.953 -14.415 -2.128 1.00 0.00 N ATOM 0 H LYS B 42 4.395 -13.445 3.465 1.00 0.00 H new ATOM 0 HA LYS B 42 5.928 -15.522 1.965 1.00 0.00 H new ATOM 0 HB2 LYS B 42 5.725 -12.674 1.312 1.00 0.00 H new ATOM 0 HB3 LYS B 42 7.371 -13.069 1.767 1.00 0.00 H new ATOM 0 HG2 LYS B 42 7.349 -15.001 0.155 1.00 0.00 H new ATOM 0 HG3 LYS B 42 5.707 -14.595 -0.305 1.00 0.00 H new ATOM 0 HD2 LYS B 42 6.422 -12.389 -1.148 1.00 0.00 H new ATOM 0 HD3 LYS B 42 8.043 -12.626 -0.524 1.00 0.00 H new ATOM 0 HE2 LYS B 42 6.868 -14.665 -2.443 1.00 0.00 H new ATOM 0 HE3 LYS B 42 7.520 -13.166 -3.075 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 9.204 -14.898 -3.014 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 9.625 -13.641 -1.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 8.993 -15.093 -1.341 1.00 0.00 H new ATOM 1865 N LEU B 43 7.505 -15.616 3.849 1.00 0.00 N ATOM 1866 CA LEU B 43 8.412 -15.710 5.027 1.00 0.00 C ATOM 1867 C LEU B 43 9.836 -15.316 4.622 1.00 0.00 C ATOM 1868 O LEU B 43 10.268 -15.597 3.521 1.00 0.00 O ATOM 1869 CB LEU B 43 8.403 -17.142 5.557 1.00 0.00 C ATOM 1870 CG LEU B 43 7.127 -17.368 6.373 1.00 0.00 C ATOM 1871 CD1 LEU B 43 5.908 -17.129 5.479 1.00 0.00 C ATOM 1872 CD2 LEU B 43 7.102 -18.811 6.881 1.00 0.00 C ATOM 0 H LEU B 43 7.486 -16.438 3.246 1.00 0.00 H new ATOM 0 HA LEU B 43 8.066 -15.031 5.806 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.450 -17.849 4.729 1.00 0.00 H new ATOM 0 HB3 LEU B 43 9.282 -17.319 6.177 1.00 0.00 H new ATOM 0 HG LEU B 43 7.105 -16.680 7.218 1.00 0.00 H new ATOM 0 HD11 LEU B 43 4.997 -17.289 6.056 1.00 0.00 H new ATOM 0 HD12 LEU B 43 5.926 -16.105 5.105 1.00 0.00 H new ATOM 0 HD13 LEU B 43 5.932 -17.823 4.638 1.00 0.00 H new ATOM 0 HD21 LEU B 43 6.195 -18.976 7.463 1.00 0.00 H new ATOM 0 HD22 LEU B 43 7.119 -19.496 6.033 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.974 -18.991 7.510 1.00 0.00 H new ATOM 1884 N SER B 44 10.530 -14.678 5.526 1.00 0.00 N ATOM 1885 CA SER B 44 11.927 -14.235 5.223 1.00 0.00 C ATOM 1886 C SER B 44 12.760 -15.385 4.643 1.00 0.00 C ATOM 1887 O SER B 44 13.652 -15.164 3.849 1.00 0.00 O ATOM 1888 CB SER B 44 12.578 -13.743 6.512 1.00 0.00 C ATOM 1889 OG SER B 44 13.259 -14.884 7.013 1.00 0.00 O ATOM 0 H SER B 44 10.193 -14.444 6.460 1.00 0.00 H new ATOM 0 HA SER B 44 11.887 -13.436 4.483 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.266 -12.919 6.322 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.834 -13.380 7.221 1.00 0.00 H new ATOM 0 HG SER B 44 13.712 -14.653 7.850 1.00 0.00 H new ATOM 1895 N ASP B 45 12.457 -16.585 5.048 1.00 0.00 N ATOM 1896 CA ASP B 45 13.240 -17.745 4.527 1.00 0.00 C ATOM 1897 C ASP B 45 13.126 -17.813 3.000 1.00 0.00 C ATOM 1898 O ASP B 45 13.782 -18.611 2.360 1.00 0.00 O ATOM 1899 CB ASP B 45 12.694 -19.034 5.138 1.00 0.00 C ATOM 1900 CG ASP B 45 11.166 -19.019 5.070 1.00 0.00 C ATOM 1901 OD1 ASP B 45 10.671 -18.324 4.199 1.00 0.00 O ATOM 1902 OD2 ASP B 45 10.581 -19.703 5.893 1.00 0.00 O ATOM 0 H ASP B 45 11.713 -16.814 5.707 1.00 0.00 H new ATOM 0 HA ASP B 45 14.289 -17.623 4.798 1.00 0.00 H new ATOM 0 HB2 ASP B 45 13.085 -19.898 4.601 1.00 0.00 H new ATOM 0 HB3 ASP B 45 13.022 -19.127 6.173 1.00 0.00 H new ATOM 1907 N GLY B 46 12.297 -16.969 2.452 1.00 0.00 N ATOM 1908 CA GLY B 46 12.126 -16.965 0.972 1.00 0.00 C ATOM 1909 C GLY B 46 11.018 -17.937 0.566 1.00 0.00 C ATOM 1910 O GLY B 46 11.042 -18.483 -0.521 1.00 0.00 O ATOM 0 H GLY B 46 11.734 -16.287 2.960 1.00 0.00 H new ATOM 0 HA2 GLY B 46 11.881 -15.960 0.630 1.00 0.00 H new ATOM 0 HA3 GLY B 46 13.062 -17.247 0.490 1.00 0.00 H new ATOM 1914 N ARG B 47 10.070 -18.129 1.449 1.00 0.00 N ATOM 1915 CA ARG B 47 8.949 -19.075 1.142 1.00 0.00 C ATOM 1916 C ARG B 47 7.630 -18.308 0.984 1.00 0.00 C ATOM 1917 O ARG B 47 7.437 -17.271 1.584 1.00 0.00 O ATOM 1918 CB ARG B 47 8.801 -20.086 2.292 1.00 0.00 C ATOM 1919 CG ARG B 47 10.161 -20.747 2.601 1.00 0.00 C ATOM 1920 CD ARG B 47 10.450 -21.853 1.579 1.00 0.00 C ATOM 1921 NE ARG B 47 10.248 -23.177 2.233 1.00 0.00 N ATOM 1922 CZ ARG B 47 10.840 -24.231 1.741 1.00 0.00 C ATOM 1923 NH1 ARG B 47 10.307 -24.829 0.711 1.00 0.00 N ATOM 1924 NH2 ARG B 47 11.943 -24.652 2.296 1.00 0.00 N ATOM 0 H ARG B 47 10.022 -17.677 2.362 1.00 0.00 H new ATOM 0 HA ARG B 47 9.177 -19.594 0.211 1.00 0.00 H new ATOM 0 HB2 ARG B 47 8.423 -19.583 3.182 1.00 0.00 H new ATOM 0 HB3 ARG B 47 8.071 -20.849 2.023 1.00 0.00 H new ATOM 0 HG2 ARG B 47 10.953 -19.999 2.573 1.00 0.00 H new ATOM 0 HG3 ARG B 47 10.152 -21.164 3.608 1.00 0.00 H new ATOM 0 HD2 ARG B 47 9.789 -21.753 0.718 1.00 0.00 H new ATOM 0 HD3 ARG B 47 11.472 -21.767 1.209 1.00 0.00 H new ATOM 0 HE ARG B 47 9.653 -23.259 3.057 1.00 0.00 H new ATOM 0 HH11 ARG B 47 9.443 -24.471 0.305 1.00 0.00 H new ATOM 0 HH12 ARG B 47 10.755 -25.654 0.312 1.00 0.00 H new ATOM 0 HH21 ARG B 47 12.329 -24.159 3.101 1.00 0.00 H new ATOM 0 HH22 ARG B 47 12.419 -25.474 1.925 1.00 0.00 H new ATOM 1938 N GLU B 48 6.755 -18.847 0.171 1.00 0.00 N ATOM 1939 CA GLU B 48 5.429 -18.188 -0.050 1.00 0.00 C ATOM 1940 C GLU B 48 4.304 -19.201 0.199 1.00 0.00 C ATOM 1941 O GLU B 48 4.252 -20.237 -0.435 1.00 0.00 O ATOM 1942 CB GLU B 48 5.351 -17.671 -1.491 1.00 0.00 C ATOM 1943 CG GLU B 48 5.640 -18.817 -2.468 1.00 0.00 C ATOM 1944 CD GLU B 48 4.362 -19.160 -3.237 1.00 0.00 C ATOM 1945 OE1 GLU B 48 3.596 -19.938 -2.693 1.00 0.00 O ATOM 1946 OE2 GLU B 48 4.226 -18.626 -4.325 1.00 0.00 O ATOM 0 H GLU B 48 6.900 -19.713 -0.348 1.00 0.00 H new ATOM 0 HA GLU B 48 5.318 -17.352 0.640 1.00 0.00 H new ATOM 0 HB2 GLU B 48 4.362 -17.255 -1.685 1.00 0.00 H new ATOM 0 HB3 GLU B 48 6.070 -16.865 -1.638 1.00 0.00 H new ATOM 0 HG2 GLU B 48 6.429 -18.528 -3.162 1.00 0.00 H new ATOM 0 HG3 GLU B 48 5.997 -19.692 -1.925 1.00 0.00 H new ATOM 1953 N LEU B 49 3.430 -18.879 1.123 1.00 0.00 N ATOM 1954 CA LEU B 49 2.306 -19.820 1.445 1.00 0.00 C ATOM 1955 C LEU B 49 0.952 -19.106 1.356 1.00 0.00 C ATOM 1956 O LEU B 49 0.871 -17.902 1.497 1.00 0.00 O ATOM 1957 CB LEU B 49 2.500 -20.348 2.867 1.00 0.00 C ATOM 1958 CG LEU B 49 3.753 -21.225 2.915 1.00 0.00 C ATOM 1959 CD1 LEU B 49 4.365 -21.149 4.315 1.00 0.00 C ATOM 1960 CD2 LEU B 49 3.366 -22.672 2.615 1.00 0.00 C ATOM 0 H LEU B 49 3.444 -18.015 1.664 1.00 0.00 H new ATOM 0 HA LEU B 49 2.314 -20.638 0.725 1.00 0.00 H new ATOM 0 HB2 LEU B 49 2.597 -19.517 3.566 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.627 -20.924 3.176 1.00 0.00 H new ATOM 0 HG LEU B 49 4.475 -20.876 2.177 1.00 0.00 H new ATOM 0 HD11 LEU B 49 5.258 -21.772 4.356 1.00 0.00 H new ATOM 0 HD12 LEU B 49 4.632 -20.116 4.540 1.00 0.00 H new ATOM 0 HD13 LEU B 49 3.641 -21.504 5.048 1.00 0.00 H new ATOM 0 HD21 LEU B 49 4.256 -23.301 2.648 1.00 0.00 H new ATOM 0 HD22 LEU B 49 2.649 -23.019 3.359 1.00 0.00 H new ATOM 0 HD23 LEU B 49 2.917 -22.730 1.624 1.00 0.00 H new ATOM 1972 N CYS B 50 -0.082 -19.878 1.125 1.00 0.00 N ATOM 1973 CA CYS B 50 -1.452 -19.283 1.031 1.00 0.00 C ATOM 1974 C CYS B 50 -2.260 -19.644 2.284 1.00 0.00 C ATOM 1975 O CYS B 50 -2.432 -20.806 2.602 1.00 0.00 O ATOM 1976 CB CYS B 50 -2.158 -19.841 -0.206 1.00 0.00 C ATOM 1977 SG CYS B 50 -1.592 -19.254 -1.822 1.00 0.00 S ATOM 0 H CYS B 50 -0.037 -20.889 0.998 1.00 0.00 H new ATOM 0 HA CYS B 50 -1.373 -18.199 0.954 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -2.061 -20.927 -0.189 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -3.221 -19.615 -0.118 1.00 0.00 H new ATOM 1982 N LEU B 51 -2.735 -18.639 2.969 1.00 0.00 N ATOM 1983 CA LEU B 51 -3.528 -18.905 4.208 1.00 0.00 C ATOM 1984 C LEU B 51 -5.029 -18.841 3.910 1.00 0.00 C ATOM 1985 O LEU B 51 -5.456 -18.163 2.996 1.00 0.00 O ATOM 1986 CB LEU B 51 -3.175 -17.855 5.260 1.00 0.00 C ATOM 1987 CG LEU B 51 -1.657 -17.673 5.300 1.00 0.00 C ATOM 1988 CD1 LEU B 51 -1.292 -16.764 6.476 1.00 0.00 C ATOM 1989 CD2 LEU B 51 -0.991 -19.037 5.492 1.00 0.00 C ATOM 0 H LEU B 51 -2.611 -17.655 2.730 1.00 0.00 H new ATOM 0 HA LEU B 51 -3.288 -19.902 4.576 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.661 -16.908 5.023 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.542 -18.166 6.238 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.314 -17.225 4.367 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -0.211 -16.630 6.510 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.774 -15.795 6.350 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.631 -17.219 7.407 1.00 0.00 H new ATOM 0 HD21 LEU B 51 0.091 -18.912 5.521 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -1.331 -19.479 6.429 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -1.259 -19.692 4.663 1.00 0.00 H new ATOM 2001 N ASP B 52 -5.794 -19.552 4.695 1.00 0.00 N ATOM 2002 CA ASP B 52 -7.271 -19.556 4.488 1.00 0.00 C ATOM 2003 C ASP B 52 -7.959 -18.668 5.571 1.00 0.00 C ATOM 2004 O ASP B 52 -7.874 -18.976 6.743 1.00 0.00 O ATOM 2005 CB ASP B 52 -7.775 -20.991 4.637 1.00 0.00 C ATOM 2006 CG ASP B 52 -9.121 -21.133 3.922 1.00 0.00 C ATOM 2007 OD1 ASP B 52 -9.949 -20.266 4.150 1.00 0.00 O ATOM 2008 OD2 ASP B 52 -9.245 -22.100 3.188 1.00 0.00 O ATOM 0 H ASP B 52 -5.461 -20.128 5.468 1.00 0.00 H new ATOM 0 HA ASP B 52 -7.505 -19.165 3.498 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -7.051 -21.688 4.215 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -7.883 -21.243 5.692 1.00 0.00 H new ATOM 2013 N PRO B 53 -8.632 -17.576 5.175 1.00 0.00 N ATOM 2014 CA PRO B 53 -9.294 -16.708 6.161 1.00 0.00 C ATOM 2015 C PRO B 53 -10.406 -17.472 6.887 1.00 0.00 C ATOM 2016 O PRO B 53 -11.074 -16.936 7.749 1.00 0.00 O ATOM 2017 CB PRO B 53 -9.890 -15.549 5.352 1.00 0.00 C ATOM 2018 CG PRO B 53 -9.610 -15.838 3.848 1.00 0.00 C ATOM 2019 CD PRO B 53 -8.785 -17.135 3.771 1.00 0.00 C ATOM 0 HA PRO B 53 -8.596 -16.358 6.922 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -10.961 -15.465 5.534 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -9.441 -14.602 5.651 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -10.545 -15.945 3.298 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -9.066 -15.010 3.393 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -9.294 -17.891 3.173 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -7.816 -16.959 3.305 1.00 0.00 H new ATOM 2027 N LYS B 54 -10.576 -18.712 6.519 1.00 0.00 N ATOM 2028 CA LYS B 54 -11.637 -19.528 7.160 1.00 0.00 C ATOM 2029 C LYS B 54 -11.175 -20.050 8.528 1.00 0.00 C ATOM 2030 O LYS B 54 -11.975 -20.530 9.307 1.00 0.00 O ATOM 2031 CB LYS B 54 -11.969 -20.712 6.248 1.00 0.00 C ATOM 2032 CG LYS B 54 -13.291 -21.352 6.695 1.00 0.00 C ATOM 2033 CD LYS B 54 -14.376 -21.046 5.658 1.00 0.00 C ATOM 2034 CE LYS B 54 -14.110 -21.866 4.392 1.00 0.00 C ATOM 2035 NZ LYS B 54 -15.117 -22.956 4.256 1.00 0.00 N ATOM 0 H LYS B 54 -10.027 -19.191 5.805 1.00 0.00 H new ATOM 0 HA LYS B 54 -12.519 -18.906 7.311 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -12.047 -20.377 5.214 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -11.166 -21.448 6.285 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -13.169 -22.430 6.803 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -13.584 -20.965 7.671 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -15.359 -21.287 6.062 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -14.380 -19.982 5.422 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -14.147 -21.217 3.517 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -13.107 -22.292 4.431 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -14.923 -23.503 3.393 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -15.063 -23.584 5.083 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -16.070 -22.543 4.197 1.00 0.00 H new ATOM 2049 N GLU B 55 -9.896 -19.940 8.798 1.00 0.00 N ATOM 2050 CA GLU B 55 -9.384 -20.443 10.113 1.00 0.00 C ATOM 2051 C GLU B 55 -9.214 -19.283 11.098 1.00 0.00 C ATOM 2052 O GLU B 55 -8.672 -18.249 10.762 1.00 0.00 O ATOM 2053 CB GLU B 55 -8.043 -21.143 9.907 1.00 0.00 C ATOM 2054 CG GLU B 55 -8.180 -22.201 8.806 1.00 0.00 C ATOM 2055 CD GLU B 55 -9.093 -23.327 9.297 1.00 0.00 C ATOM 2056 OE1 GLU B 55 -8.627 -24.068 10.147 1.00 0.00 O ATOM 2057 OE2 GLU B 55 -10.203 -23.382 8.794 1.00 0.00 O ATOM 0 H GLU B 55 -9.196 -19.532 8.178 1.00 0.00 H new ATOM 0 HA GLU B 55 -10.105 -21.150 10.524 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.279 -20.415 9.633 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.719 -21.611 10.837 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -8.592 -21.751 7.903 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.200 -22.600 8.545 1.00 0.00 H new ATOM 2064 N ASN B 56 -9.674 -19.486 12.300 1.00 0.00 N ATOM 2065 CA ASN B 56 -9.567 -18.406 13.323 1.00 0.00 C ATOM 2066 C ASN B 56 -8.102 -18.086 13.643 1.00 0.00 C ATOM 2067 O ASN B 56 -7.745 -16.936 13.808 1.00 0.00 O ATOM 2068 CB ASN B 56 -10.276 -18.858 14.598 1.00 0.00 C ATOM 2069 CG ASN B 56 -11.150 -17.719 15.122 1.00 0.00 C ATOM 2070 OD1 ASN B 56 -12.317 -17.897 15.408 1.00 0.00 O ATOM 2071 ND2 ASN B 56 -10.625 -16.531 15.262 1.00 0.00 N ATOM 0 H ASN B 56 -10.117 -20.348 12.619 1.00 0.00 H new ATOM 0 HA ASN B 56 -10.033 -17.504 12.926 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -10.888 -19.737 14.395 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -9.544 -19.146 15.352 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -11.194 -15.760 15.610 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -9.646 -16.375 15.024 1.00 0.00 H new ATOM 2078 N TRP B 57 -7.277 -19.098 13.728 1.00 0.00 N ATOM 2079 CA TRP B 57 -5.846 -18.827 14.056 1.00 0.00 C ATOM 2080 C TRP B 57 -5.201 -17.961 12.974 1.00 0.00 C ATOM 2081 O TRP B 57 -4.264 -17.237 13.240 1.00 0.00 O ATOM 2082 CB TRP B 57 -5.071 -20.143 14.213 1.00 0.00 C ATOM 2083 CG TRP B 57 -5.153 -20.993 12.934 1.00 0.00 C ATOM 2084 CD1 TRP B 57 -6.024 -21.982 12.751 1.00 0.00 C ATOM 2085 CD2 TRP B 57 -4.327 -20.903 11.904 1.00 0.00 C ATOM 2086 NE1 TRP B 57 -5.682 -22.493 11.558 1.00 0.00 N ATOM 2087 CE2 TRP B 57 -4.618 -21.870 10.957 1.00 0.00 C ATOM 2088 CE3 TRP B 57 -3.284 -20.024 11.678 1.00 0.00 C ATOM 2089 CZ2 TRP B 57 -3.873 -21.960 9.799 1.00 0.00 C ATOM 2090 CZ3 TRP B 57 -2.542 -20.113 10.516 1.00 0.00 C ATOM 2091 CH2 TRP B 57 -2.836 -21.080 9.578 1.00 0.00 C ATOM 0 H TRP B 57 -7.524 -20.078 13.588 1.00 0.00 H new ATOM 0 HA TRP B 57 -5.810 -18.286 15.002 1.00 0.00 H new ATOM 0 HB2 TRP B 57 -4.028 -19.928 14.444 1.00 0.00 H new ATOM 0 HB3 TRP B 57 -5.474 -20.707 15.054 1.00 0.00 H new ATOM 0 HD1 TRP B 57 -6.820 -22.299 13.409 1.00 0.00 H new ATOM 0 HE1 TRP B 57 -6.173 -23.280 11.133 1.00 0.00 H new ATOM 0 HE3 TRP B 57 -3.049 -19.267 12.411 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 -4.103 -22.720 9.066 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 -1.729 -19.423 10.342 1.00 0.00 H new ATOM 0 HH2 TRP B 57 -2.254 -21.148 8.671 1.00 0.00 H new ATOM 2102 N VAL B 58 -5.714 -18.039 11.779 1.00 0.00 N ATOM 2103 CA VAL B 58 -5.127 -17.207 10.688 1.00 0.00 C ATOM 2104 C VAL B 58 -5.462 -15.744 10.936 1.00 0.00 C ATOM 2105 O VAL B 58 -4.652 -14.867 10.712 1.00 0.00 O ATOM 2106 CB VAL B 58 -5.718 -17.651 9.341 1.00 0.00 C ATOM 2107 CG1 VAL B 58 -5.661 -16.490 8.344 1.00 0.00 C ATOM 2108 CG2 VAL B 58 -4.917 -18.829 8.794 1.00 0.00 C ATOM 0 H VAL B 58 -6.500 -18.631 11.511 1.00 0.00 H new ATOM 0 HA VAL B 58 -4.044 -17.332 10.669 1.00 0.00 H new ATOM 0 HB VAL B 58 -6.755 -17.952 9.487 1.00 0.00 H new ATOM 0 HG11 VAL B 58 -6.081 -16.809 7.390 1.00 0.00 H new ATOM 0 HG12 VAL B 58 -6.237 -15.649 8.731 1.00 0.00 H new ATOM 0 HG13 VAL B 58 -4.625 -16.184 8.200 1.00 0.00 H new ATOM 0 HG21 VAL B 58 -5.338 -19.143 7.839 1.00 0.00 H new ATOM 0 HG22 VAL B 58 -3.879 -18.529 8.652 1.00 0.00 H new ATOM 0 HG23 VAL B 58 -4.962 -19.658 9.500 1.00 0.00 H new ATOM 2118 N GLN B 59 -6.655 -15.512 11.394 1.00 0.00 N ATOM 2119 CA GLN B 59 -7.069 -14.117 11.673 1.00 0.00 C ATOM 2120 C GLN B 59 -6.264 -13.563 12.851 1.00 0.00 C ATOM 2121 O GLN B 59 -6.111 -12.372 12.990 1.00 0.00 O ATOM 2122 CB GLN B 59 -8.558 -14.104 12.024 1.00 0.00 C ATOM 2123 CG GLN B 59 -9.092 -12.672 11.927 1.00 0.00 C ATOM 2124 CD GLN B 59 -9.953 -12.372 13.156 1.00 0.00 C ATOM 2125 OE1 GLN B 59 -9.463 -11.940 14.181 1.00 0.00 O ATOM 2126 NE2 GLN B 59 -11.238 -12.587 13.096 1.00 0.00 N ATOM 0 H GLN B 59 -7.358 -16.225 11.586 1.00 0.00 H new ATOM 0 HA GLN B 59 -6.887 -13.498 10.794 1.00 0.00 H new ATOM 0 HB2 GLN B 59 -9.108 -14.756 11.345 1.00 0.00 H new ATOM 0 HB3 GLN B 59 -8.709 -14.492 13.031 1.00 0.00 H new ATOM 0 HG2 GLN B 59 -8.264 -11.966 11.867 1.00 0.00 H new ATOM 0 HG3 GLN B 59 -9.681 -12.551 11.018 1.00 0.00 H new ATOM 0 HE21 GLN B 59 -11.655 -12.949 12.239 1.00 0.00 H new ATOM 0 HE22 GLN B 59 -11.826 -12.393 13.907 1.00 0.00 H new ATOM 2135 N ARG B 60 -5.756 -14.449 13.666 1.00 0.00 N ATOM 2136 CA ARG B 60 -4.978 -13.992 14.858 1.00 0.00 C ATOM 2137 C ARG B 60 -3.508 -13.724 14.505 1.00 0.00 C ATOM 2138 O ARG B 60 -3.011 -12.636 14.725 1.00 0.00 O ATOM 2139 CB ARG B 60 -5.053 -15.066 15.939 1.00 0.00 C ATOM 2140 CG ARG B 60 -6.055 -14.627 17.009 1.00 0.00 C ATOM 2141 CD ARG B 60 -6.189 -15.732 18.058 1.00 0.00 C ATOM 2142 NE ARG B 60 -7.340 -15.414 18.948 1.00 0.00 N ATOM 2143 CZ ARG B 60 -7.172 -14.585 19.942 1.00 0.00 C ATOM 2144 NH1 ARG B 60 -6.465 -14.967 20.970 1.00 0.00 N ATOM 2145 NH2 ARG B 60 -7.717 -13.400 19.875 1.00 0.00 N ATOM 0 H ARG B 60 -5.844 -15.460 13.561 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.412 -13.058 15.215 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -5.359 -16.017 15.504 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -4.070 -15.221 16.384 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -5.721 -13.702 17.479 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -7.024 -14.422 16.554 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -6.343 -16.696 17.573 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -5.272 -15.811 18.641 1.00 0.00 H new ATOM 0 HE ARG B 60 -8.252 -15.840 18.782 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -6.054 -15.900 20.988 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -6.323 -14.332 21.756 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -8.263 -13.136 19.055 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -7.596 -12.739 20.642 1.00 0.00 H new ATOM 2159 N VAL B 61 -2.834 -14.710 13.968 1.00 0.00 N ATOM 2160 CA VAL B 61 -1.402 -14.496 13.632 1.00 0.00 C ATOM 2161 C VAL B 61 -1.268 -13.336 12.638 1.00 0.00 C ATOM 2162 O VAL B 61 -0.278 -12.629 12.632 1.00 0.00 O ATOM 2163 CB VAL B 61 -0.836 -15.785 13.036 1.00 0.00 C ATOM 2164 CG1 VAL B 61 -1.180 -16.952 13.959 1.00 0.00 C ATOM 2165 CG2 VAL B 61 -1.456 -16.024 11.658 1.00 0.00 C ATOM 0 H VAL B 61 -3.208 -15.634 13.753 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.842 -14.240 14.531 1.00 0.00 H new ATOM 0 HB VAL B 61 0.246 -15.701 12.935 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.780 -17.876 13.542 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -0.743 -16.779 14.943 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.263 -17.035 14.053 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -1.053 -16.943 11.232 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -2.538 -16.114 11.756 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -1.219 -15.186 11.002 1.00 0.00 H new ATOM 2175 N VAL B 62 -2.269 -13.154 11.826 1.00 0.00 N ATOM 2176 CA VAL B 62 -2.207 -12.033 10.847 1.00 0.00 C ATOM 2177 C VAL B 62 -2.429 -10.702 11.574 1.00 0.00 C ATOM 2178 O VAL B 62 -1.740 -9.734 11.319 1.00 0.00 O ATOM 2179 CB VAL B 62 -3.282 -12.229 9.780 1.00 0.00 C ATOM 2180 CG1 VAL B 62 -3.354 -10.975 8.905 1.00 0.00 C ATOM 2181 CG2 VAL B 62 -2.905 -13.429 8.906 1.00 0.00 C ATOM 0 H VAL B 62 -3.116 -13.722 11.796 1.00 0.00 H new ATOM 0 HA VAL B 62 -1.227 -12.019 10.370 1.00 0.00 H new ATOM 0 HB VAL B 62 -4.248 -12.404 10.254 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -4.120 -11.108 8.141 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -3.605 -10.113 9.524 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -2.389 -10.809 8.426 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -3.668 -13.576 8.141 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -1.943 -13.243 8.428 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -2.836 -14.323 9.526 1.00 0.00 H new ATOM 2191 N GLU B 63 -3.389 -10.676 12.468 1.00 0.00 N ATOM 2192 CA GLU B 63 -3.638 -9.411 13.223 1.00 0.00 C ATOM 2193 C GLU B 63 -2.349 -8.977 13.916 1.00 0.00 C ATOM 2194 O GLU B 63 -2.042 -7.803 13.990 1.00 0.00 O ATOM 2195 CB GLU B 63 -4.723 -9.645 14.275 1.00 0.00 C ATOM 2196 CG GLU B 63 -5.484 -8.339 14.515 1.00 0.00 C ATOM 2197 CD GLU B 63 -4.486 -7.209 14.772 1.00 0.00 C ATOM 2198 OE1 GLU B 63 -3.775 -7.329 15.756 1.00 0.00 O ATOM 2199 OE2 GLU B 63 -4.492 -6.289 13.971 1.00 0.00 O ATOM 0 H GLU B 63 -3.999 -11.459 12.703 1.00 0.00 H new ATOM 0 HA GLU B 63 -3.965 -8.634 12.532 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -5.409 -10.423 13.940 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -4.275 -9.994 15.205 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -6.104 -8.102 13.650 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -6.155 -8.447 15.367 1.00 0.00 H new ATOM 2206 N LYS B 64 -1.617 -9.940 14.412 1.00 0.00 N ATOM 2207 CA LYS B 64 -0.340 -9.606 15.097 1.00 0.00 C ATOM 2208 C LYS B 64 0.609 -8.921 14.113 1.00 0.00 C ATOM 2209 O LYS B 64 1.212 -7.913 14.428 1.00 0.00 O ATOM 2210 CB LYS B 64 0.301 -10.890 15.622 1.00 0.00 C ATOM 2211 CG LYS B 64 0.215 -10.909 17.150 1.00 0.00 C ATOM 2212 CD LYS B 64 0.875 -12.185 17.677 1.00 0.00 C ATOM 2213 CE LYS B 64 2.314 -11.870 18.088 1.00 0.00 C ATOM 2214 NZ LYS B 64 2.338 -11.103 19.365 1.00 0.00 N ATOM 0 H LYS B 64 -1.847 -10.933 14.372 1.00 0.00 H new ATOM 0 HA LYS B 64 -0.539 -8.931 15.929 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -0.207 -11.760 15.207 1.00 0.00 H new ATOM 0 HB3 LYS B 64 1.342 -10.947 15.304 1.00 0.00 H new ATOM 0 HG2 LYS B 64 0.711 -10.031 17.565 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -0.827 -10.867 17.468 1.00 0.00 H new ATOM 0 HD2 LYS B 64 0.317 -12.573 18.529 1.00 0.00 H new ATOM 0 HD3 LYS B 64 0.864 -12.959 16.910 1.00 0.00 H new ATOM 0 HE2 LYS B 64 2.876 -12.797 18.203 1.00 0.00 H new ATOM 0 HE3 LYS B 64 2.805 -11.295 17.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 3.272 -11.201 19.811 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 2.151 -10.099 19.170 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 1.608 -11.473 20.006 1.00 0.00 H new ATOM 2228 N PHE B 65 0.725 -9.483 12.938 1.00 0.00 N ATOM 2229 CA PHE B 65 1.629 -8.863 11.925 1.00 0.00 C ATOM 2230 C PHE B 65 1.240 -7.401 11.698 1.00 0.00 C ATOM 2231 O PHE B 65 2.089 -6.540 11.583 1.00 0.00 O ATOM 2232 CB PHE B 65 1.516 -9.617 10.613 1.00 0.00 C ATOM 2233 CG PHE B 65 2.445 -8.964 9.586 1.00 0.00 C ATOM 2234 CD1 PHE B 65 3.820 -9.069 9.716 1.00 0.00 C ATOM 2235 CD2 PHE B 65 1.925 -8.258 8.515 1.00 0.00 C ATOM 2236 CE1 PHE B 65 4.658 -8.477 8.790 1.00 0.00 C ATOM 2237 CE2 PHE B 65 2.765 -7.667 7.593 1.00 0.00 C ATOM 2238 CZ PHE B 65 4.129 -7.776 7.731 1.00 0.00 C ATOM 0 H PHE B 65 0.242 -10.330 12.639 1.00 0.00 H new ATOM 0 HA PHE B 65 2.654 -8.911 12.292 1.00 0.00 H new ATOM 0 HB2 PHE B 65 1.786 -10.663 10.755 1.00 0.00 H new ATOM 0 HB3 PHE B 65 0.487 -9.600 10.255 1.00 0.00 H new ATOM 0 HD1 PHE B 65 4.240 -9.617 10.546 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.855 -8.169 8.400 1.00 0.00 H new ATOM 0 HE1 PHE B 65 5.729 -8.565 8.898 1.00 0.00 H new ATOM 0 HE2 PHE B 65 2.350 -7.117 6.761 1.00 0.00 H new ATOM 0 HZ PHE B 65 4.784 -7.312 7.009 1.00 0.00 H new ATOM 2248 N LEU B 66 -0.041 -7.152 11.636 1.00 0.00 N ATOM 2249 CA LEU B 66 -0.507 -5.751 11.415 1.00 0.00 C ATOM 2250 C LEU B 66 -0.167 -4.881 12.629 1.00 0.00 C ATOM 2251 O LEU B 66 0.254 -3.750 12.488 1.00 0.00 O ATOM 2252 CB LEU B 66 -2.020 -5.757 11.200 1.00 0.00 C ATOM 2253 CG LEU B 66 -2.316 -5.996 9.718 1.00 0.00 C ATOM 2254 CD1 LEU B 66 -3.696 -6.642 9.579 1.00 0.00 C ATOM 2255 CD2 LEU B 66 -2.311 -4.655 8.981 1.00 0.00 C ATOM 0 H LEU B 66 -0.779 -7.850 11.728 1.00 0.00 H new ATOM 0 HA LEU B 66 -0.007 -5.340 10.538 1.00 0.00 H new ATOM 0 HB2 LEU B 66 -2.482 -6.536 11.806 1.00 0.00 H new ATOM 0 HB3 LEU B 66 -2.449 -4.807 11.520 1.00 0.00 H new ATOM 0 HG LEU B 66 -1.557 -6.653 9.292 1.00 0.00 H new ATOM 0 HD11 LEU B 66 -3.912 -6.815 8.525 1.00 0.00 H new ATOM 0 HD12 LEU B 66 -3.708 -7.593 10.112 1.00 0.00 H new ATOM 0 HD13 LEU B 66 -4.452 -5.980 10.001 1.00 0.00 H new ATOM 0 HD21 LEU B 66 -2.521 -4.820 7.924 1.00 0.00 H new ATOM 0 HD22 LEU B 66 -3.075 -4.004 9.406 1.00 0.00 H new ATOM 0 HD23 LEU B 66 -1.333 -4.185 9.087 1.00 0.00 H new ATOM 2267 N LYS B 67 -0.359 -5.428 13.798 1.00 0.00 N ATOM 2268 CA LYS B 67 -0.055 -4.646 15.032 1.00 0.00 C ATOM 2269 C LYS B 67 1.451 -4.378 15.134 1.00 0.00 C ATOM 2270 O LYS B 67 1.869 -3.363 15.655 1.00 0.00 O ATOM 2271 CB LYS B 67 -0.515 -5.440 16.252 1.00 0.00 C ATOM 2272 CG LYS B 67 -1.445 -4.565 17.096 1.00 0.00 C ATOM 2273 CD LYS B 67 -1.809 -5.313 18.380 1.00 0.00 C ATOM 2274 CE LYS B 67 -2.970 -4.592 19.067 1.00 0.00 C ATOM 2275 NZ LYS B 67 -2.834 -4.680 20.548 1.00 0.00 N ATOM 0 H LYS B 67 -0.710 -6.373 13.953 1.00 0.00 H new ATOM 0 HA LYS B 67 -0.579 -3.691 14.989 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.033 -6.346 15.938 1.00 0.00 H new ATOM 0 HB3 LYS B 67 0.345 -5.754 16.843 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -0.957 -3.621 17.337 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -2.347 -4.323 16.533 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -2.088 -6.341 18.150 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -0.947 -5.358 19.046 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -2.990 -3.547 18.759 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -3.916 -5.034 18.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.630 -4.186 21.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -2.837 -5.679 20.838 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -1.940 -4.237 20.841 1.00 0.00 H new ATOM 2289 N ARG B 68 2.234 -5.295 14.633 1.00 0.00 N ATOM 2290 CA ARG B 68 3.713 -5.106 14.695 1.00 0.00 C ATOM 2291 C ARG B 68 4.175 -4.179 13.566 1.00 0.00 C ATOM 2292 O ARG B 68 4.973 -3.287 13.779 1.00 0.00 O ATOM 2293 CB ARG B 68 4.399 -6.463 14.552 1.00 0.00 C ATOM 2294 CG ARG B 68 5.915 -6.260 14.555 1.00 0.00 C ATOM 2295 CD ARG B 68 6.590 -7.519 15.101 1.00 0.00 C ATOM 2296 NE ARG B 68 5.977 -8.714 14.456 1.00 0.00 N ATOM 2297 CZ ARG B 68 6.207 -9.898 14.954 1.00 0.00 C ATOM 2298 NH1 ARG B 68 7.417 -10.382 14.895 1.00 0.00 N ATOM 2299 NH2 ARG B 68 5.219 -10.559 15.493 1.00 0.00 N ATOM 0 H ARG B 68 1.919 -6.157 14.188 1.00 0.00 H new ATOM 0 HA ARG B 68 3.977 -4.656 15.652 1.00 0.00 H new ATOM 0 HB2 ARG B 68 4.106 -7.121 15.370 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.086 -6.947 13.627 1.00 0.00 H new ATOM 0 HG2 ARG B 68 6.268 -6.053 13.545 1.00 0.00 H new ATOM 0 HG3 ARG B 68 6.177 -5.397 15.168 1.00 0.00 H new ATOM 0 HD2 ARG B 68 7.661 -7.490 14.900 1.00 0.00 H new ATOM 0 HD3 ARG B 68 6.470 -7.572 16.183 1.00 0.00 H new ATOM 0 HE ARG B 68 5.383 -8.608 13.633 1.00 0.00 H new ATOM 0 HH11 ARG B 68 8.164 -9.837 14.465 1.00 0.00 H new ATOM 0 HH12 ARG B 68 7.616 -11.306 15.279 1.00 0.00 H new ATOM 0 HH21 ARG B 68 4.286 -10.149 15.520 1.00 0.00 H new ATOM 0 HH22 ARG B 68 5.380 -11.486 15.887 1.00 0.00 H new ATOM 2313 N ALA B 69 3.663 -4.410 12.388 1.00 0.00 N ATOM 2314 CA ALA B 69 4.060 -3.551 11.234 1.00 0.00 C ATOM 2315 C ALA B 69 3.504 -2.135 11.416 1.00 0.00 C ATOM 2316 O ALA B 69 4.049 -1.179 10.900 1.00 0.00 O ATOM 2317 CB ALA B 69 3.508 -4.159 9.943 1.00 0.00 C ATOM 0 H ALA B 69 2.993 -5.149 12.175 1.00 0.00 H new ATOM 0 HA ALA B 69 5.147 -3.497 11.181 1.00 0.00 H new ATOM 0 HB1 ALA B 69 3.795 -3.536 9.096 1.00 0.00 H new ATOM 0 HB2 ALA B 69 3.915 -5.162 9.810 1.00 0.00 H new ATOM 0 HB3 ALA B 69 2.421 -4.213 10.002 1.00 0.00 H new ATOM 2323 N GLU B 70 2.429 -2.032 12.148 1.00 0.00 N ATOM 2324 CA GLU B 70 1.825 -0.688 12.378 1.00 0.00 C ATOM 2325 C GLU B 70 2.551 0.030 13.520 1.00 0.00 C ATOM 2326 O GLU B 70 2.717 1.233 13.494 1.00 0.00 O ATOM 2327 CB GLU B 70 0.350 -0.858 12.739 1.00 0.00 C ATOM 2328 CG GLU B 70 -0.280 0.524 12.932 1.00 0.00 C ATOM 2329 CD GLU B 70 -0.675 0.700 14.400 1.00 0.00 C ATOM 2330 OE1 GLU B 70 0.236 0.915 15.183 1.00 0.00 O ATOM 2331 OE2 GLU B 70 -1.865 0.609 14.656 1.00 0.00 O ATOM 0 H GLU B 70 1.946 -2.812 12.593 1.00 0.00 H new ATOM 0 HA GLU B 70 1.920 -0.092 11.471 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -0.170 -1.402 11.950 1.00 0.00 H new ATOM 0 HB3 GLU B 70 0.251 -1.447 13.651 1.00 0.00 H new ATOM 0 HG2 GLU B 70 0.425 1.302 12.637 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -1.156 0.629 12.293 1.00 0.00 H new ATOM 2338 N ASN B 71 2.970 -0.727 14.499 1.00 0.00 N ATOM 2339 CA ASN B 71 3.688 -0.104 15.651 1.00 0.00 C ATOM 2340 C ASN B 71 5.173 0.067 15.317 1.00 0.00 C ATOM 2341 O ASN B 71 5.868 0.841 15.945 1.00 0.00 O ATOM 2342 CB ASN B 71 3.542 -1.006 16.877 1.00 0.00 C ATOM 2343 CG ASN B 71 4.377 -0.436 18.026 1.00 0.00 C ATOM 2344 OD1 ASN B 71 5.223 -1.105 18.584 1.00 0.00 O ATOM 2345 ND2 ASN B 71 4.172 0.795 18.408 1.00 0.00 N ATOM 0 H ASN B 71 2.849 -1.738 14.552 1.00 0.00 H new ATOM 0 HA ASN B 71 3.257 0.876 15.856 1.00 0.00 H new ATOM 0 HB2 ASN B 71 2.495 -1.072 17.171 1.00 0.00 H new ATOM 0 HB3 ASN B 71 3.871 -2.018 16.640 1.00 0.00 H new ATOM 0 HD21 ASN B 71 4.721 1.190 19.171 1.00 0.00 H new ATOM 0 HD22 ASN B 71 3.463 1.362 17.943 1.00 0.00 H new ATOM 2352 N SER B 72 5.627 -0.659 14.333 1.00 0.00 N ATOM 2353 CA SER B 72 7.064 -0.552 13.944 1.00 0.00 C ATOM 2354 C SER B 72 7.399 0.891 13.549 1.00 0.00 C ATOM 2355 O SER B 72 8.431 1.351 14.010 1.00 0.00 O ATOM 2356 CB SER B 72 7.331 -1.478 12.759 1.00 0.00 C ATOM 2357 OG SER B 72 7.771 -2.688 13.358 1.00 0.00 O ATOM 2358 OXT SER B 72 6.604 1.449 12.811 1.00 0.00 O ATOM 0 H SER B 72 5.072 -1.316 13.785 1.00 0.00 H new ATOM 0 HA SER B 72 7.688 -0.840 14.790 1.00 0.00 H new ATOM 0 HB2 SER B 72 6.432 -1.632 12.163 1.00 0.00 H new ATOM 0 HB3 SER B 72 8.088 -1.065 12.093 1.00 0.00 H new ATOM 0 HG SER B 72 6.995 -3.206 13.656 1.00 0.00 H new TER 2364 SER B 72