USER MOD reduce.3.24.130724 H: found=0, std=0, add=1196, rem=0, adj=26 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 14 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 14 SER OG : rot 180:sc= 0.00214 USER MOD Set 2.2: A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -151:sc= -0.275 (180deg=-1.29!) USER MOD Single : A 8 GLN : amide:sc= -0.0796 X(o=-0.08,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 153:sc= -0.0626 (180deg=-0.387) 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 18 HIS : no HD1:sc= -2.72! C(o=-2.7!,f=-13!) USER MOD Single : A 20 LYS NZ :NH3+ 152:sc= -0.167 (180deg=-0.931) USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= 0.298 (180deg=0.276) USER MOD Single : A 30 SER OG : rot 47:sc= 0.178 USER MOD Single : A 33 HIS : no HD1:sc= -2.35 K(o=-2.3,f=-5.7!) USER MOD Single : A 36 ASN : amide:sc= -1.14 X(o=-1.1,f=-1.3) USER MOD Single : A 37 THR OG1 : rot 127:sc= 0.132 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0742 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.0143 X(o=-0.014,f=-0.31) USER MOD Single : A 64 LYS NZ :NH3+ -122:sc= -0.098 (180deg=-0.615) USER MOD Single : A 67 LYS NZ :NH3+ -162:sc= -0.0129 (180deg=-0.151) USER MOD Single : A 71 ASN : amide:sc= -0.0918 K(o=-0.092,f=-1) USER MOD Single : A 72 SER OG : rot 85:sc= 0.271 USER MOD Single : B 3 LYS NZ :NH3+ -134:sc= -0.271 (180deg=-1.25!) USER MOD Single : B 8 GLN : amide:sc= -0.0698 X(o=-0.07,f=0) USER MOD Single : B 11 LYS NZ :NH3+ 151:sc= -0.0762 (180deg=-0.408) 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 18 HIS : no HD1:sc= -2.6! C(o=-2.6!,f=-13!) USER MOD Single : B 20 LYS NZ :NH3+ 152:sc= -0.196 (180deg=-0.914) USER MOD Single : B 23 LYS NZ :NH3+ 172:sc= 0.32 (180deg=0.296) USER MOD Single : B 30 SER OG : rot 53:sc= 0.22 USER MOD Single : B 33 HIS : no HD1:sc= -2.37 K(o=-2.4,f=-5.7!) USER MOD Single : B 36 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.3) USER MOD Single : B 37 THR OG1 : rot 131:sc= 0.206 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 SER OG : rot 180:sc= -0.029 USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 GLN : amide:sc=-0.00881 X(o=-0.0088,f=-0.43) USER MOD Single : B 64 LYS NZ :NH3+ -152:sc= -0.0871 (180deg=-0.65) USER MOD Single : B 67 LYS NZ :NH3+ -160:sc= -0.0128 (180deg=-0.139) USER MOD Single : B 71 ASN : amide:sc= -0.114 K(o=-0.11,f=-1) USER MOD Single : B 72 SER OG : rot 84:sc= 0.233 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 26.802 -3.993 5.492 1.00 0.00 N ATOM 2 CA ALA A 2 26.453 -2.607 5.065 1.00 0.00 C ATOM 3 C ALA A 2 25.436 -2.012 6.043 1.00 0.00 C ATOM 4 O ALA A 2 24.424 -2.618 6.335 1.00 0.00 O ATOM 5 CB ALA A 2 25.856 -2.612 3.658 1.00 0.00 C ATOM 0 HA ALA A 2 27.362 -2.005 5.060 1.00 0.00 H new ATOM 0 HB1 ALA A 2 25.608 -1.592 3.364 1.00 0.00 H new ATOM 0 HB2 ALA A 2 26.581 -3.025 2.957 1.00 0.00 H new ATOM 0 HB3 ALA A 2 24.953 -3.222 3.648 1.00 0.00 H new ATOM 13 N LYS A 3 25.727 -0.837 6.529 1.00 0.00 N ATOM 14 CA LYS A 3 24.787 -0.187 7.490 1.00 0.00 C ATOM 15 C LYS A 3 23.807 0.721 6.737 1.00 0.00 C ATOM 16 O LYS A 3 23.163 1.566 7.326 1.00 0.00 O ATOM 17 CB LYS A 3 25.592 0.647 8.490 1.00 0.00 C ATOM 18 CG LYS A 3 25.871 -0.189 9.745 1.00 0.00 C ATOM 19 CD LYS A 3 26.682 -1.427 9.355 1.00 0.00 C ATOM 20 CE LYS A 3 27.334 -2.015 10.609 1.00 0.00 C ATOM 21 NZ LYS A 3 28.219 -1.007 11.258 1.00 0.00 N ATOM 0 H LYS A 3 26.566 -0.302 6.306 1.00 0.00 H new ATOM 0 HA LYS A 3 24.221 -0.955 8.017 1.00 0.00 H new ATOM 0 HB2 LYS A 3 26.530 0.969 8.039 1.00 0.00 H new ATOM 0 HB3 LYS A 3 25.040 1.548 8.756 1.00 0.00 H new ATOM 0 HG2 LYS A 3 26.419 0.404 10.477 1.00 0.00 H new ATOM 0 HG3 LYS A 3 24.933 -0.487 10.214 1.00 0.00 H new ATOM 0 HD2 LYS A 3 26.035 -2.168 8.885 1.00 0.00 H new ATOM 0 HD3 LYS A 3 27.445 -1.161 8.624 1.00 0.00 H new ATOM 0 HE2 LYS A 3 26.564 -2.336 11.310 1.00 0.00 H new ATOM 0 HE3 LYS A 3 27.913 -2.900 10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 28.991 -1.493 11.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 28.618 -0.377 10.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 27.666 -0.446 11.937 1.00 0.00 H new ATOM 35 N GLU A 4 23.716 0.524 5.450 1.00 0.00 N ATOM 36 CA GLU A 4 22.784 1.368 4.643 1.00 0.00 C ATOM 37 C GLU A 4 21.437 0.655 4.470 1.00 0.00 C ATOM 38 O GLU A 4 21.367 -0.415 3.897 1.00 0.00 O ATOM 39 CB GLU A 4 23.404 1.628 3.271 1.00 0.00 C ATOM 40 CG GLU A 4 24.746 2.340 3.454 1.00 0.00 C ATOM 41 CD GLU A 4 25.288 2.756 2.085 1.00 0.00 C ATOM 42 OE1 GLU A 4 24.594 3.523 1.439 1.00 0.00 O ATOM 43 OE2 GLU A 4 26.365 2.282 1.763 1.00 0.00 O ATOM 0 H GLU A 4 24.240 -0.176 4.925 1.00 0.00 H new ATOM 0 HA GLU A 4 22.618 2.313 5.160 1.00 0.00 H new ATOM 0 HB2 GLU A 4 23.547 0.688 2.739 1.00 0.00 H new ATOM 0 HB3 GLU A 4 22.734 2.238 2.665 1.00 0.00 H new ATOM 0 HG2 GLU A 4 24.622 3.216 4.091 1.00 0.00 H new ATOM 0 HG3 GLU A 4 25.456 1.681 3.954 1.00 0.00 H new ATOM 50 N LEU A 5 20.396 1.266 4.969 1.00 0.00 N ATOM 51 CA LEU A 5 19.044 0.641 4.846 1.00 0.00 C ATOM 52 C LEU A 5 18.288 1.248 3.657 1.00 0.00 C ATOM 53 O LEU A 5 17.894 2.398 3.695 1.00 0.00 O ATOM 54 CB LEU A 5 18.260 0.894 6.134 1.00 0.00 C ATOM 55 CG LEU A 5 19.006 0.258 7.310 1.00 0.00 C ATOM 56 CD1 LEU A 5 19.404 1.349 8.305 1.00 0.00 C ATOM 57 CD2 LEU A 5 18.085 -0.746 8.007 1.00 0.00 C ATOM 0 H LEU A 5 20.421 2.164 5.453 1.00 0.00 H new ATOM 0 HA LEU A 5 19.154 -0.431 4.682 1.00 0.00 H new ATOM 0 HB2 LEU A 5 18.143 1.965 6.298 1.00 0.00 H new ATOM 0 HB3 LEU A 5 17.258 0.473 6.053 1.00 0.00 H new ATOM 0 HG LEU A 5 19.898 -0.251 6.946 1.00 0.00 H new ATOM 0 HD11 LEU A 5 19.936 0.900 9.144 1.00 0.00 H new ATOM 0 HD12 LEU A 5 20.052 2.073 7.811 1.00 0.00 H new ATOM 0 HD13 LEU A 5 18.509 1.852 8.670 1.00 0.00 H new ATOM 0 HD21 LEU A 5 18.612 -1.202 8.845 1.00 0.00 H new ATOM 0 HD22 LEU A 5 17.197 -0.231 8.373 1.00 0.00 H new ATOM 0 HD23 LEU A 5 17.790 -1.521 7.300 1.00 0.00 H new ATOM 69 N ARG A 6 18.100 0.459 2.628 1.00 0.00 N ATOM 70 CA ARG A 6 17.375 0.976 1.424 1.00 0.00 C ATOM 71 C ARG A 6 15.926 0.472 1.415 1.00 0.00 C ATOM 72 O ARG A 6 15.646 -0.607 0.941 1.00 0.00 O ATOM 73 CB ARG A 6 18.094 0.493 0.163 1.00 0.00 C ATOM 74 CG ARG A 6 19.135 1.538 -0.251 1.00 0.00 C ATOM 75 CD ARG A 6 20.053 0.941 -1.321 1.00 0.00 C ATOM 76 NE ARG A 6 20.294 1.962 -2.380 1.00 0.00 N ATOM 77 CZ ARG A 6 21.183 2.897 -2.181 1.00 0.00 C ATOM 78 NH1 ARG A 6 20.817 3.997 -1.582 1.00 0.00 N ATOM 79 NH2 ARG A 6 22.408 2.701 -2.588 1.00 0.00 N ATOM 0 H ARG A 6 18.413 -0.510 2.568 1.00 0.00 H new ATOM 0 HA ARG A 6 17.364 2.066 1.453 1.00 0.00 H new ATOM 0 HB2 ARG A 6 18.577 -0.466 0.350 1.00 0.00 H new ATOM 0 HB3 ARG A 6 17.377 0.337 -0.643 1.00 0.00 H new ATOM 0 HG2 ARG A 6 18.639 2.429 -0.637 1.00 0.00 H new ATOM 0 HG3 ARG A 6 19.720 1.848 0.615 1.00 0.00 H new ATOM 0 HD2 ARG A 6 20.998 0.631 -0.875 1.00 0.00 H new ATOM 0 HD3 ARG A 6 19.597 0.050 -1.754 1.00 0.00 H new ATOM 0 HE ARG A 6 19.768 1.930 -3.254 1.00 0.00 H new ATOM 0 HH11 ARG A 6 19.850 4.115 -1.278 1.00 0.00 H new ATOM 0 HH12 ARG A 6 21.497 4.739 -1.418 1.00 0.00 H new ATOM 0 HH21 ARG A 6 22.657 1.828 -3.053 1.00 0.00 H new ATOM 0 HH22 ARG A 6 23.116 3.421 -2.441 1.00 0.00 H new ATOM 93 N CYS A 7 15.032 1.280 1.916 1.00 0.00 N ATOM 94 CA CYS A 7 13.601 0.854 1.961 1.00 0.00 C ATOM 95 C CYS A 7 13.085 0.541 0.551 1.00 0.00 C ATOM 96 O CYS A 7 13.484 1.167 -0.411 1.00 0.00 O ATOM 97 CB CYS A 7 12.767 1.980 2.571 1.00 0.00 C ATOM 98 SG CYS A 7 12.804 2.154 4.372 1.00 0.00 S ATOM 0 H CYS A 7 15.226 2.208 2.293 1.00 0.00 H new ATOM 0 HA CYS A 7 13.517 -0.048 2.568 1.00 0.00 H new ATOM 0 HB2 CYS A 7 13.099 2.922 2.134 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.730 1.836 2.267 1.00 0.00 H new ATOM 103 N GLN A 8 12.205 -0.427 0.459 1.00 0.00 N ATOM 104 CA GLN A 8 11.654 -0.790 -0.884 1.00 0.00 C ATOM 105 C GLN A 8 10.864 0.385 -1.466 1.00 0.00 C ATOM 106 O GLN A 8 10.779 0.536 -2.669 1.00 0.00 O ATOM 107 CB GLN A 8 10.721 -1.999 -0.741 1.00 0.00 C ATOM 108 CG GLN A 8 11.546 -3.272 -0.517 1.00 0.00 C ATOM 109 CD GLN A 8 11.396 -4.192 -1.731 1.00 0.00 C ATOM 110 OE1 GLN A 8 12.357 -4.523 -2.396 1.00 0.00 O ATOM 111 NE2 GLN A 8 10.207 -4.625 -2.054 1.00 0.00 N ATOM 0 H GLN A 8 11.849 -0.974 1.243 1.00 0.00 H new ATOM 0 HA GLN A 8 12.481 -1.033 -1.552 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.039 -1.846 0.095 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.109 -2.105 -1.637 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.595 -3.017 -0.367 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.210 -3.783 0.385 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.396 -4.350 -1.499 1.00 0.00 H new ATOM 0 HE22 GLN A 8 10.089 -5.238 -2.861 1.00 0.00 H new ATOM 120 N CYS A 9 10.307 1.190 -0.597 1.00 0.00 N ATOM 121 CA CYS A 9 9.509 2.362 -1.075 1.00 0.00 C ATOM 122 C CYS A 9 10.134 3.672 -0.584 1.00 0.00 C ATOM 123 O CYS A 9 10.343 3.858 0.598 1.00 0.00 O ATOM 124 CB CYS A 9 8.088 2.244 -0.532 1.00 0.00 C ATOM 125 SG CYS A 9 6.984 1.069 -1.352 1.00 0.00 S ATOM 0 H CYS A 9 10.369 1.089 0.416 1.00 0.00 H new ATOM 0 HA CYS A 9 9.498 2.368 -2.165 1.00 0.00 H new ATOM 0 HB2 CYS A 9 8.151 1.970 0.521 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.626 3.230 -0.578 1.00 0.00 H new ATOM 130 N ILE A 10 10.418 4.550 -1.509 1.00 0.00 N ATOM 131 CA ILE A 10 11.023 5.859 -1.123 1.00 0.00 C ATOM 132 C ILE A 10 9.942 6.945 -1.088 1.00 0.00 C ATOM 133 O ILE A 10 9.689 7.540 -0.060 1.00 0.00 O ATOM 134 CB ILE A 10 12.095 6.235 -2.147 1.00 0.00 C ATOM 135 CG1 ILE A 10 13.125 5.105 -2.234 1.00 0.00 C ATOM 136 CG2 ILE A 10 12.791 7.522 -1.701 1.00 0.00 C ATOM 137 CD1 ILE A 10 14.139 5.432 -3.333 1.00 0.00 C ATOM 0 H ILE A 10 10.259 4.420 -2.508 1.00 0.00 H new ATOM 0 HA ILE A 10 11.471 5.774 -0.133 1.00 0.00 H new ATOM 0 HB ILE A 10 11.635 6.389 -3.123 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.633 4.986 -1.277 1.00 0.00 H new ATOM 0 HG13 ILE A 10 12.628 4.160 -2.451 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.556 7.793 -2.429 1.00 0.00 H new ATOM 0 HG22 ILE A 10 12.058 8.326 -1.629 1.00 0.00 H new ATOM 0 HG23 ILE A 10 13.256 7.366 -0.727 1.00 0.00 H new ATOM 0 HD11 ILE A 10 14.875 4.631 -3.399 1.00 0.00 H new ATOM 0 HD12 ILE A 10 13.622 5.530 -4.288 1.00 0.00 H new ATOM 0 HD13 ILE A 10 14.643 6.369 -3.096 1.00 0.00 H new ATOM 149 N LYS A 11 9.326 7.177 -2.216 1.00 0.00 N ATOM 150 CA LYS A 11 8.255 8.217 -2.266 1.00 0.00 C ATOM 151 C LYS A 11 6.895 7.587 -1.941 1.00 0.00 C ATOM 152 O LYS A 11 6.796 6.391 -1.751 1.00 0.00 O ATOM 153 CB LYS A 11 8.215 8.826 -3.667 1.00 0.00 C ATOM 154 CG LYS A 11 9.594 9.399 -4.003 1.00 0.00 C ATOM 155 CD LYS A 11 9.479 10.297 -5.236 1.00 0.00 C ATOM 156 CE LYS A 11 9.532 11.761 -4.796 1.00 0.00 C ATOM 157 NZ LYS A 11 10.893 12.107 -4.298 1.00 0.00 N ATOM 0 H LYS A 11 9.514 6.698 -3.097 1.00 0.00 H new ATOM 0 HA LYS A 11 8.470 8.993 -1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 11 7.934 8.068 -4.399 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.460 9.611 -3.715 1.00 0.00 H new ATOM 0 HG2 LYS A 11 9.980 9.969 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 11 10.301 8.591 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 11 10.290 10.084 -5.933 1.00 0.00 H new ATOM 0 HD3 LYS A 11 8.546 10.096 -5.762 1.00 0.00 H new ATOM 0 HE2 LYS A 11 9.269 12.408 -5.633 1.00 0.00 H new ATOM 0 HE3 LYS A 11 8.796 11.938 -4.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 11.064 13.124 -4.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 10.961 11.877 -3.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 11.605 11.562 -4.826 1.00 0.00 H new ATOM 171 N THR A 12 5.878 8.409 -1.882 1.00 0.00 N ATOM 172 CA THR A 12 4.514 7.876 -1.567 1.00 0.00 C ATOM 173 C THR A 12 3.461 8.538 -2.463 1.00 0.00 C ATOM 174 O THR A 12 3.780 9.362 -3.298 1.00 0.00 O ATOM 175 CB THR A 12 4.187 8.168 -0.098 1.00 0.00 C ATOM 176 OG1 THR A 12 4.585 9.521 0.100 1.00 0.00 O ATOM 177 CG2 THR A 12 5.062 7.347 0.848 1.00 0.00 C ATOM 0 H THR A 12 5.929 9.416 -2.036 1.00 0.00 H new ATOM 0 HA THR A 12 4.503 6.801 -1.747 1.00 0.00 H new ATOM 0 HB THR A 12 3.138 7.949 0.099 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.403 9.783 1.027 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.801 7.581 1.880 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.899 6.285 0.665 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.111 7.588 0.675 1.00 0.00 H new ATOM 185 N TYR A 13 2.227 8.159 -2.265 1.00 0.00 N ATOM 186 CA TYR A 13 1.127 8.744 -3.093 1.00 0.00 C ATOM 187 C TYR A 13 0.384 9.831 -2.300 1.00 0.00 C ATOM 188 O TYR A 13 -0.157 9.569 -1.244 1.00 0.00 O ATOM 189 CB TYR A 13 0.155 7.624 -3.470 1.00 0.00 C ATOM 190 CG TYR A 13 -0.512 7.944 -4.811 1.00 0.00 C ATOM 191 CD1 TYR A 13 0.242 8.048 -5.963 1.00 0.00 C ATOM 192 CD2 TYR A 13 -1.877 8.131 -4.887 1.00 0.00 C ATOM 193 CE1 TYR A 13 -0.361 8.335 -7.171 1.00 0.00 C ATOM 194 CE2 TYR A 13 -2.480 8.417 -6.095 1.00 0.00 C ATOM 195 CZ TYR A 13 -1.726 8.522 -7.246 1.00 0.00 C ATOM 196 OH TYR A 13 -2.329 8.810 -8.454 1.00 0.00 O ATOM 0 H TYR A 13 1.932 7.473 -1.570 1.00 0.00 H new ATOM 0 HA TYR A 13 1.545 9.198 -3.991 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.687 6.675 -3.536 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.603 7.511 -2.694 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.311 7.904 -5.919 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.479 8.053 -3.994 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.240 8.414 -8.065 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.550 8.560 -6.140 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.295 8.909 -8.322 1.00 0.00 H new ATOM 206 N SER A 14 0.374 11.029 -2.832 1.00 0.00 N ATOM 207 CA SER A 14 -0.324 12.150 -2.123 1.00 0.00 C ATOM 208 C SER A 14 -1.695 12.420 -2.760 1.00 0.00 C ATOM 209 O SER A 14 -2.218 13.513 -2.666 1.00 0.00 O ATOM 210 CB SER A 14 0.534 13.410 -2.218 1.00 0.00 C ATOM 211 OG SER A 14 0.662 13.639 -3.614 1.00 0.00 O ATOM 0 H SER A 14 0.814 11.279 -3.718 1.00 0.00 H new ATOM 0 HA SER A 14 -0.472 11.872 -1.079 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.059 14.254 -1.718 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.506 13.266 -1.747 1.00 0.00 H new ATOM 0 HG SER A 14 1.204 14.441 -3.766 1.00 0.00 H new ATOM 217 N LYS A 15 -2.241 11.414 -3.392 1.00 0.00 N ATOM 218 CA LYS A 15 -3.582 11.575 -4.044 1.00 0.00 C ATOM 219 C LYS A 15 -4.522 10.426 -3.580 1.00 0.00 C ATOM 220 O LYS A 15 -4.441 9.336 -4.101 1.00 0.00 O ATOM 221 CB LYS A 15 -3.399 11.485 -5.560 1.00 0.00 C ATOM 222 CG LYS A 15 -3.567 12.879 -6.175 1.00 0.00 C ATOM 223 CD LYS A 15 -2.509 13.823 -5.594 1.00 0.00 C ATOM 224 CE LYS A 15 -2.052 14.794 -6.686 1.00 0.00 C ATOM 225 NZ LYS A 15 -1.171 15.849 -6.110 1.00 0.00 N ATOM 0 H LYS A 15 -1.821 10.489 -3.487 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.017 12.536 -3.770 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.412 11.088 -5.796 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.129 10.797 -5.986 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -3.466 12.825 -7.259 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.566 13.262 -5.967 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -2.920 14.374 -4.748 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -1.660 13.251 -5.219 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.517 14.250 -7.464 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -2.920 15.254 -7.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.870 16.499 -6.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.693 16.379 -5.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.334 15.406 -5.680 1.00 0.00 H new ATOM 239 N PRO A 16 -5.407 10.688 -2.613 1.00 0.00 N ATOM 240 CA PRO A 16 -6.305 9.637 -2.100 1.00 0.00 C ATOM 241 C PRO A 16 -7.166 9.029 -3.213 1.00 0.00 C ATOM 242 O PRO A 16 -7.572 9.711 -4.134 1.00 0.00 O ATOM 243 CB PRO A 16 -7.181 10.326 -1.048 1.00 0.00 C ATOM 244 CG PRO A 16 -6.656 11.784 -0.891 1.00 0.00 C ATOM 245 CD PRO A 16 -5.593 12.010 -1.981 1.00 0.00 C ATOM 0 HA PRO A 16 -5.737 8.807 -1.680 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.226 10.325 -1.358 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.130 9.795 -0.098 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.472 12.499 -0.996 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.227 11.933 0.100 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.924 12.752 -2.708 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.660 12.378 -1.553 1.00 0.00 H new ATOM 253 N PHE A 17 -7.424 7.746 -3.098 1.00 0.00 N ATOM 254 CA PHE A 17 -8.253 7.068 -4.132 1.00 0.00 C ATOM 255 C PHE A 17 -9.179 6.024 -3.481 1.00 0.00 C ATOM 256 O PHE A 17 -9.089 5.756 -2.299 1.00 0.00 O ATOM 257 CB PHE A 17 -7.342 6.408 -5.189 1.00 0.00 C ATOM 258 CG PHE A 17 -6.248 5.547 -4.527 1.00 0.00 C ATOM 259 CD1 PHE A 17 -5.254 6.123 -3.745 1.00 0.00 C ATOM 260 CD2 PHE A 17 -6.234 4.174 -4.712 1.00 0.00 C ATOM 261 CE1 PHE A 17 -4.283 5.337 -3.160 1.00 0.00 C ATOM 262 CE2 PHE A 17 -5.252 3.400 -4.125 1.00 0.00 C ATOM 263 CZ PHE A 17 -4.288 3.978 -3.354 1.00 0.00 C ATOM 0 H PHE A 17 -7.097 7.149 -2.338 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.877 7.812 -4.627 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -7.943 5.788 -5.854 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -6.878 7.179 -5.805 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.242 7.192 -3.594 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.995 3.706 -5.319 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.518 5.791 -2.548 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.248 2.331 -4.278 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.526 3.365 -2.895 1.00 0.00 H new ATOM 273 N HIS A 18 -10.048 5.463 -4.277 1.00 0.00 N ATOM 274 CA HIS A 18 -11.032 4.462 -3.742 1.00 0.00 C ATOM 275 C HIS A 18 -10.514 3.000 -3.946 1.00 0.00 C ATOM 276 O HIS A 18 -9.892 2.712 -4.949 1.00 0.00 O ATOM 277 CB HIS A 18 -12.325 4.654 -4.544 1.00 0.00 C ATOM 278 CG HIS A 18 -13.476 3.940 -3.862 1.00 0.00 C ATOM 279 ND1 HIS A 18 -13.684 2.639 -3.913 1.00 0.00 N ATOM 280 CD2 HIS A 18 -14.496 4.465 -3.079 1.00 0.00 C ATOM 281 CE1 HIS A 18 -14.741 2.365 -3.228 1.00 0.00 C ATOM 282 NE2 HIS A 18 -15.220 3.446 -2.735 1.00 0.00 N ATOM 0 H HIS A 18 -10.124 5.651 -5.277 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.183 4.613 -2.673 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -12.550 5.717 -4.636 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.195 4.267 -5.555 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -14.652 5.500 -2.814 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -15.158 1.378 -3.091 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -16.056 3.498 -2.152 1.00 0.00 H new ATOM 290 N PRO A 19 -10.778 2.094 -2.980 1.00 0.00 N ATOM 291 CA PRO A 19 -10.342 0.689 -3.111 1.00 0.00 C ATOM 292 C PRO A 19 -10.910 0.039 -4.390 1.00 0.00 C ATOM 293 O PRO A 19 -10.487 -1.028 -4.785 1.00 0.00 O ATOM 294 CB PRO A 19 -10.895 -0.026 -1.873 1.00 0.00 C ATOM 295 CG PRO A 19 -11.649 1.032 -1.019 1.00 0.00 C ATOM 296 CD PRO A 19 -11.475 2.393 -1.706 1.00 0.00 C ATOM 0 HA PRO A 19 -9.256 0.622 -3.183 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -11.567 -0.833 -2.165 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -10.086 -0.477 -1.298 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -12.705 0.776 -0.938 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -11.250 1.061 -0.005 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.438 2.870 -1.886 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -10.892 3.075 -1.088 1.00 0.00 H new ATOM 304 N LYS A 20 -11.860 0.694 -4.999 1.00 0.00 N ATOM 305 CA LYS A 20 -12.470 0.124 -6.246 1.00 0.00 C ATOM 306 C LYS A 20 -11.383 -0.219 -7.277 1.00 0.00 C ATOM 307 O LYS A 20 -11.499 -1.187 -8.002 1.00 0.00 O ATOM 308 CB LYS A 20 -13.421 1.161 -6.846 1.00 0.00 C ATOM 309 CG LYS A 20 -14.715 0.486 -7.351 1.00 0.00 C ATOM 310 CD LYS A 20 -15.765 1.565 -7.690 1.00 0.00 C ATOM 311 CE LYS A 20 -15.493 2.129 -9.088 1.00 0.00 C ATOM 312 NZ LYS A 20 -15.632 1.064 -10.120 1.00 0.00 N ATOM 0 H LYS A 20 -12.241 1.590 -4.696 1.00 0.00 H new ATOM 0 HA LYS A 20 -13.008 -0.789 -5.992 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -13.666 1.914 -6.097 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.930 1.679 -7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.502 -0.118 -8.233 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -15.106 -0.189 -6.590 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.767 1.137 -7.649 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.730 2.366 -6.951 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.189 2.941 -9.300 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.489 2.551 -9.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.916 1.492 -11.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.722 0.575 -10.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.355 0.380 -9.818 1.00 0.00 H new ATOM 326 N PHE A 21 -10.352 0.579 -7.320 1.00 0.00 N ATOM 327 CA PHE A 21 -9.259 0.317 -8.309 1.00 0.00 C ATOM 328 C PHE A 21 -8.144 -0.524 -7.679 1.00 0.00 C ATOM 329 O PHE A 21 -7.055 -0.600 -8.208 1.00 0.00 O ATOM 330 CB PHE A 21 -8.681 1.654 -8.768 1.00 0.00 C ATOM 331 CG PHE A 21 -9.820 2.564 -9.230 1.00 0.00 C ATOM 332 CD1 PHE A 21 -10.442 2.348 -10.447 1.00 0.00 C ATOM 333 CD2 PHE A 21 -10.244 3.616 -8.436 1.00 0.00 C ATOM 334 CE1 PHE A 21 -11.469 3.170 -10.862 1.00 0.00 C ATOM 335 CE2 PHE A 21 -11.271 4.436 -8.853 1.00 0.00 C ATOM 336 CZ PHE A 21 -11.883 4.213 -10.065 1.00 0.00 C ATOM 0 H PHE A 21 -10.216 1.394 -6.722 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.672 -0.233 -9.155 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -8.131 2.125 -7.953 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -7.972 1.497 -9.581 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -10.121 1.531 -11.076 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -9.767 3.795 -7.484 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -11.949 2.995 -11.814 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.596 5.254 -8.227 1.00 0.00 H new ATOM 0 HZ PHE A 21 -12.687 4.856 -10.391 1.00 0.00 H new ATOM 346 N ILE A 22 -8.448 -1.144 -6.569 1.00 0.00 N ATOM 347 CA ILE A 22 -7.420 -1.973 -5.869 1.00 0.00 C ATOM 348 C ILE A 22 -7.815 -3.447 -5.932 1.00 0.00 C ATOM 349 O ILE A 22 -8.953 -3.795 -5.683 1.00 0.00 O ATOM 350 CB ILE A 22 -7.322 -1.520 -4.396 1.00 0.00 C ATOM 351 CG1 ILE A 22 -6.509 -0.202 -4.301 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.612 -2.614 -3.582 1.00 0.00 C ATOM 353 CD1 ILE A 22 -7.329 0.976 -4.859 1.00 0.00 C ATOM 0 H ILE A 22 -9.362 -1.113 -6.117 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.453 -1.845 -6.356 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.324 -1.351 -4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -6.240 -0.007 -3.263 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.577 -0.301 -4.858 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.538 -2.302 -2.540 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.182 -3.541 -3.644 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -5.612 -2.775 -3.984 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -6.745 1.893 -4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.575 0.786 -5.904 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.248 1.084 -4.284 1.00 0.00 H new ATOM 365 N LYS A 23 -6.861 -4.281 -6.266 1.00 0.00 N ATOM 366 CA LYS A 23 -7.149 -5.736 -6.359 1.00 0.00 C ATOM 367 C LYS A 23 -6.120 -6.540 -5.559 1.00 0.00 C ATOM 368 O LYS A 23 -6.334 -7.702 -5.273 1.00 0.00 O ATOM 369 CB LYS A 23 -7.103 -6.163 -7.828 1.00 0.00 C ATOM 370 CG LYS A 23 -8.369 -5.664 -8.546 1.00 0.00 C ATOM 371 CD LYS A 23 -9.604 -6.424 -8.033 1.00 0.00 C ATOM 372 CE LYS A 23 -10.443 -6.878 -9.228 1.00 0.00 C ATOM 373 NZ LYS A 23 -11.714 -7.501 -8.764 1.00 0.00 N ATOM 0 H LYS A 23 -5.900 -4.013 -6.477 1.00 0.00 H new ATOM 0 HA LYS A 23 -8.139 -5.929 -5.945 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.214 -5.755 -8.309 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.035 -7.248 -7.901 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.495 -4.595 -8.377 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.266 -5.806 -9.622 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.296 -7.286 -7.440 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.196 -5.783 -7.380 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.662 -6.026 -9.871 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.878 -7.592 -9.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.331 -7.681 -9.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.505 -8.400 -8.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.194 -6.858 -8.102 1.00 0.00 H new ATOM 387 N GLU A 24 -5.022 -5.911 -5.216 1.00 0.00 N ATOM 388 CA GLU A 24 -3.978 -6.647 -4.428 1.00 0.00 C ATOM 389 C GLU A 24 -3.357 -5.719 -3.372 1.00 0.00 C ATOM 390 O GLU A 24 -2.891 -4.644 -3.689 1.00 0.00 O ATOM 391 CB GLU A 24 -2.896 -7.152 -5.394 1.00 0.00 C ATOM 392 CG GLU A 24 -1.589 -7.433 -4.634 1.00 0.00 C ATOM 393 CD GLU A 24 -1.885 -8.225 -3.359 1.00 0.00 C ATOM 394 OE1 GLU A 24 -2.778 -9.051 -3.426 1.00 0.00 O ATOM 395 OE2 GLU A 24 -1.194 -7.964 -2.392 1.00 0.00 O ATOM 0 H GLU A 24 -4.804 -4.940 -5.441 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.434 -7.492 -3.912 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.238 -8.060 -5.891 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -2.719 -6.410 -6.173 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -0.903 -7.993 -5.269 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -1.096 -6.494 -4.382 1.00 0.00 H new ATOM 402 N LEU A 25 -3.367 -6.164 -2.135 1.00 0.00 N ATOM 403 CA LEU A 25 -2.790 -5.326 -1.035 1.00 0.00 C ATOM 404 C LEU A 25 -1.498 -5.947 -0.505 1.00 0.00 C ATOM 405 O LEU A 25 -1.450 -7.125 -0.216 1.00 0.00 O ATOM 406 CB LEU A 25 -3.797 -5.237 0.105 1.00 0.00 C ATOM 407 CG LEU A 25 -3.445 -4.043 0.988 1.00 0.00 C ATOM 408 CD1 LEU A 25 -4.200 -2.814 0.487 1.00 0.00 C ATOM 409 CD2 LEU A 25 -3.864 -4.339 2.429 1.00 0.00 C ATOM 0 H LEU A 25 -3.747 -7.064 -1.842 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.571 -4.334 -1.430 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.806 -5.127 -0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.784 -6.156 0.691 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.371 -3.859 0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.954 -1.956 1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.913 -2.606 -0.544 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.273 -3.002 0.534 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.614 -3.488 3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.939 -4.516 2.466 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.338 -5.224 2.786 1.00 0.00 H new ATOM 421 N ARG A 26 -0.482 -5.132 -0.376 1.00 0.00 N ATOM 422 CA ARG A 26 0.824 -5.646 0.137 1.00 0.00 C ATOM 423 C ARG A 26 1.299 -4.804 1.327 1.00 0.00 C ATOM 424 O ARG A 26 1.066 -3.613 1.379 1.00 0.00 O ATOM 425 CB ARG A 26 1.853 -5.579 -0.977 1.00 0.00 C ATOM 426 CG ARG A 26 1.403 -6.474 -2.134 1.00 0.00 C ATOM 427 CD ARG A 26 2.590 -6.718 -3.069 1.00 0.00 C ATOM 428 NE ARG A 26 3.363 -5.452 -3.208 1.00 0.00 N ATOM 429 CZ ARG A 26 4.029 -5.226 -4.308 1.00 0.00 C ATOM 430 NH1 ARG A 26 5.166 -5.838 -4.493 1.00 0.00 N ATOM 431 NH2 ARG A 26 3.534 -4.397 -5.185 1.00 0.00 N ATOM 0 H ARG A 26 -0.500 -4.138 -0.602 1.00 0.00 H new ATOM 0 HA ARG A 26 0.699 -6.677 0.468 1.00 0.00 H new ATOM 0 HB2 ARG A 26 1.968 -4.551 -1.320 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.826 -5.903 -0.609 1.00 0.00 H new ATOM 0 HG2 ARG A 26 1.025 -7.422 -1.751 1.00 0.00 H new ATOM 0 HG3 ARG A 26 0.586 -6.002 -2.679 1.00 0.00 H new ATOM 0 HD2 ARG A 26 3.228 -7.507 -2.671 1.00 0.00 H new ATOM 0 HD3 ARG A 26 2.239 -7.054 -4.045 1.00 0.00 H new ATOM 0 HE ARG A 26 3.372 -4.768 -2.451 1.00 0.00 H new ATOM 0 HH11 ARG A 26 5.521 -6.480 -3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 26 5.700 -5.674 -5.346 1.00 0.00 H new ATOM 0 HH21 ARG A 26 2.641 -3.938 -5.006 1.00 0.00 H new ATOM 0 HH22 ARG A 26 4.040 -4.208 -6.050 1.00 0.00 H new ATOM 445 N VAL A 27 1.958 -5.443 2.258 1.00 0.00 N ATOM 446 CA VAL A 27 2.454 -4.696 3.454 1.00 0.00 C ATOM 447 C VAL A 27 3.817 -5.242 3.897 1.00 0.00 C ATOM 448 O VAL A 27 3.925 -6.378 4.315 1.00 0.00 O ATOM 449 CB VAL A 27 1.451 -4.857 4.596 1.00 0.00 C ATOM 450 CG1 VAL A 27 1.829 -3.911 5.737 1.00 0.00 C ATOM 451 CG2 VAL A 27 0.052 -4.502 4.091 1.00 0.00 C ATOM 0 H VAL A 27 2.173 -6.440 2.244 1.00 0.00 H new ATOM 0 HA VAL A 27 2.563 -3.643 3.195 1.00 0.00 H new ATOM 0 HB VAL A 27 1.463 -5.887 4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.116 -4.023 6.554 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.830 -4.153 6.094 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.811 -2.882 5.378 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.667 -4.615 4.902 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.043 -3.470 3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.218 -5.167 3.271 1.00 0.00 H new ATOM 461 N ILE A 28 4.827 -4.415 3.796 1.00 0.00 N ATOM 462 CA ILE A 28 6.196 -4.860 4.207 1.00 0.00 C ATOM 463 C ILE A 28 6.579 -4.217 5.544 1.00 0.00 C ATOM 464 O ILE A 28 6.589 -3.009 5.677 1.00 0.00 O ATOM 465 CB ILE A 28 7.202 -4.437 3.131 1.00 0.00 C ATOM 466 CG1 ILE A 28 6.884 -5.186 1.826 1.00 0.00 C ATOM 467 CG2 ILE A 28 8.615 -4.802 3.589 1.00 0.00 C ATOM 468 CD1 ILE A 28 7.701 -4.596 0.666 1.00 0.00 C ATOM 0 H ILE A 28 4.765 -3.458 3.450 1.00 0.00 H new ATOM 0 HA ILE A 28 6.205 -5.944 4.321 1.00 0.00 H new ATOM 0 HB ILE A 28 7.137 -3.361 2.967 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.113 -6.245 1.941 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.819 -5.112 1.605 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.334 -4.503 2.826 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.840 -4.285 4.522 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.680 -5.879 3.746 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.468 -5.134 -0.253 1.00 0.00 H new ATOM 0 HD12 ILE A 28 7.450 -3.542 0.544 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.765 -4.693 0.884 1.00 0.00 H new ATOM 480 N GLU A 29 6.885 -5.042 6.506 1.00 0.00 N ATOM 481 CA GLU A 29 7.268 -4.505 7.845 1.00 0.00 C ATOM 482 C GLU A 29 8.769 -4.174 7.873 1.00 0.00 C ATOM 483 O GLU A 29 9.535 -4.720 7.105 1.00 0.00 O ATOM 484 CB GLU A 29 6.949 -5.567 8.905 1.00 0.00 C ATOM 485 CG GLU A 29 7.205 -4.998 10.307 1.00 0.00 C ATOM 486 CD GLU A 29 8.427 -5.684 10.922 1.00 0.00 C ATOM 487 OE1 GLU A 29 9.360 -5.907 10.169 1.00 0.00 O ATOM 488 OE2 GLU A 29 8.360 -5.945 12.112 1.00 0.00 O ATOM 0 H GLU A 29 6.887 -6.059 6.426 1.00 0.00 H new ATOM 0 HA GLU A 29 6.709 -3.592 8.050 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.910 -5.882 8.815 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.566 -6.451 8.744 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.369 -3.922 10.250 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.331 -5.154 10.939 1.00 0.00 H new ATOM 495 N SER A 30 9.145 -3.272 8.752 1.00 0.00 N ATOM 496 CA SER A 30 10.592 -2.882 8.862 1.00 0.00 C ATOM 497 C SER A 30 11.502 -4.097 8.648 1.00 0.00 C ATOM 498 O SER A 30 11.419 -5.071 9.369 1.00 0.00 O ATOM 499 CB SER A 30 10.843 -2.304 10.253 1.00 0.00 C ATOM 500 OG SER A 30 10.175 -3.202 11.127 1.00 0.00 O ATOM 0 H SER A 30 8.517 -2.791 9.395 1.00 0.00 H new ATOM 0 HA SER A 30 10.817 -2.141 8.095 1.00 0.00 H new ATOM 0 HB2 SER A 30 11.909 -2.250 10.476 1.00 0.00 H new ATOM 0 HB3 SER A 30 10.447 -1.292 10.342 1.00 0.00 H new ATOM 0 HG SER A 30 10.405 -4.124 10.887 1.00 0.00 H new ATOM 506 N GLY A 31 12.352 -4.001 7.657 1.00 0.00 N ATOM 507 CA GLY A 31 13.283 -5.131 7.356 1.00 0.00 C ATOM 508 C GLY A 31 14.741 -4.656 7.455 1.00 0.00 C ATOM 509 O GLY A 31 15.015 -3.574 7.935 1.00 0.00 O ATOM 0 H GLY A 31 12.442 -3.190 7.044 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.111 -5.950 8.055 1.00 0.00 H new ATOM 0 HA3 GLY A 31 13.086 -5.518 6.356 1.00 0.00 H new ATOM 513 N PRO A 32 15.650 -5.490 6.994 1.00 0.00 N ATOM 514 CA PRO A 32 17.083 -5.170 7.026 1.00 0.00 C ATOM 515 C PRO A 32 17.381 -4.041 6.039 1.00 0.00 C ATOM 516 O PRO A 32 18.501 -3.588 5.916 1.00 0.00 O ATOM 517 CB PRO A 32 17.790 -6.462 6.598 1.00 0.00 C ATOM 518 CG PRO A 32 16.680 -7.499 6.235 1.00 0.00 C ATOM 519 CD PRO A 32 15.320 -6.798 6.413 1.00 0.00 C ATOM 0 HA PRO A 32 17.415 -4.836 8.009 1.00 0.00 H new ATOM 0 HB2 PRO A 32 18.440 -6.279 5.742 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.421 -6.840 7.403 1.00 0.00 H new ATOM 0 HG2 PRO A 32 16.801 -7.848 5.209 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.748 -8.375 6.880 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.803 -6.689 5.460 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.663 -7.369 7.069 1.00 0.00 H new ATOM 527 N HIS A 33 16.352 -3.623 5.360 1.00 0.00 N ATOM 528 CA HIS A 33 16.497 -2.529 4.360 1.00 0.00 C ATOM 529 C HIS A 33 15.604 -1.353 4.761 1.00 0.00 C ATOM 530 O HIS A 33 15.778 -0.245 4.293 1.00 0.00 O ATOM 531 CB HIS A 33 16.050 -3.063 3.007 1.00 0.00 C ATOM 532 CG HIS A 33 14.525 -3.180 3.013 1.00 0.00 C ATOM 533 ND1 HIS A 33 13.841 -3.861 3.874 1.00 0.00 N ATOM 534 CD2 HIS A 33 13.579 -2.597 2.169 1.00 0.00 C ATOM 535 CE1 HIS A 33 12.586 -3.754 3.648 1.00 0.00 C ATOM 536 NE2 HIS A 33 12.396 -2.987 2.612 1.00 0.00 N ATOM 0 H HIS A 33 15.407 -3.995 5.455 1.00 0.00 H new ATOM 0 HA HIS A 33 17.533 -2.192 4.313 1.00 0.00 H new ATOM 0 HB2 HIS A 33 16.376 -2.395 2.209 1.00 0.00 H new ATOM 0 HB3 HIS A 33 16.504 -4.035 2.814 1.00 0.00 H new ATOM 0 HD2 HIS A 33 13.774 -1.955 1.323 1.00 0.00 H new ATOM 0 HE1 HIS A 33 11.806 -4.226 4.226 1.00 0.00 H new ATOM 0 HE2 HIS A 33 11.493 -2.732 2.213 1.00 0.00 H new ATOM 544 N CYS A 34 14.663 -1.630 5.624 1.00 0.00 N ATOM 545 CA CYS A 34 13.735 -0.556 6.081 1.00 0.00 C ATOM 546 C CYS A 34 13.489 -0.684 7.588 1.00 0.00 C ATOM 547 O CYS A 34 13.225 -1.760 8.086 1.00 0.00 O ATOM 548 CB CYS A 34 12.408 -0.697 5.334 1.00 0.00 C ATOM 549 SG CYS A 34 11.446 0.811 5.031 1.00 0.00 S ATOM 0 H CYS A 34 14.497 -2.551 6.031 1.00 0.00 H new ATOM 0 HA CYS A 34 14.177 0.419 5.876 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.614 -1.163 4.370 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.779 -1.389 5.895 1.00 0.00 H new ATOM 554 N ALA A 35 13.580 0.421 8.278 1.00 0.00 N ATOM 555 CA ALA A 35 13.360 0.389 9.753 1.00 0.00 C ATOM 556 C ALA A 35 11.942 0.865 10.090 1.00 0.00 C ATOM 557 O ALA A 35 11.693 1.359 11.172 1.00 0.00 O ATOM 558 CB ALA A 35 14.378 1.307 10.428 1.00 0.00 C ATOM 0 H ALA A 35 13.796 1.338 7.888 1.00 0.00 H new ATOM 0 HA ALA A 35 13.482 -0.633 10.112 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.224 1.290 11.507 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.386 0.962 10.200 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.250 2.325 10.060 1.00 0.00 H new ATOM 564 N ASN A 36 11.043 0.705 9.157 1.00 0.00 N ATOM 565 CA ASN A 36 9.640 1.148 9.412 1.00 0.00 C ATOM 566 C ASN A 36 8.643 0.248 8.672 1.00 0.00 C ATOM 567 O ASN A 36 8.971 -0.837 8.258 1.00 0.00 O ATOM 568 CB ASN A 36 9.477 2.588 8.926 1.00 0.00 C ATOM 569 CG ASN A 36 10.474 3.487 9.660 1.00 0.00 C ATOM 570 OD1 ASN A 36 11.547 3.774 9.168 1.00 0.00 O ATOM 571 ND2 ASN A 36 10.158 3.954 10.838 1.00 0.00 N ATOM 0 H ASN A 36 11.214 0.292 8.240 1.00 0.00 H new ATOM 0 HA ASN A 36 9.439 1.084 10.481 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.645 2.642 7.850 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.459 2.932 9.107 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.811 4.556 11.340 1.00 0.00 H new ATOM 0 HD22 ASN A 36 9.259 3.717 11.256 1.00 0.00 H new ATOM 578 N THR A 37 7.446 0.730 8.535 1.00 0.00 N ATOM 579 CA THR A 37 6.393 -0.063 7.827 1.00 0.00 C ATOM 580 C THR A 37 5.968 0.654 6.541 1.00 0.00 C ATOM 581 O THR A 37 5.954 1.868 6.480 1.00 0.00 O ATOM 582 CB THR A 37 5.190 -0.223 8.753 1.00 0.00 C ATOM 583 OG1 THR A 37 5.315 -1.539 9.282 1.00 0.00 O ATOM 584 CG2 THR A 37 3.866 -0.221 7.988 1.00 0.00 C ATOM 0 H THR A 37 7.143 1.640 8.881 1.00 0.00 H new ATOM 0 HA THR A 37 6.790 -1.043 7.563 1.00 0.00 H new ATOM 0 HB THR A 37 5.180 0.588 9.482 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.275 -1.503 10.261 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.040 -0.337 8.690 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.757 0.722 7.452 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.856 -1.046 7.276 1.00 0.00 H new ATOM 592 N GLU A 38 5.632 -0.117 5.541 1.00 0.00 N ATOM 593 CA GLU A 38 5.204 0.496 4.247 1.00 0.00 C ATOM 594 C GLU A 38 4.026 -0.287 3.659 1.00 0.00 C ATOM 595 O GLU A 38 4.157 -1.445 3.317 1.00 0.00 O ATOM 596 CB GLU A 38 6.376 0.467 3.267 1.00 0.00 C ATOM 597 CG GLU A 38 7.657 0.859 4.006 1.00 0.00 C ATOM 598 CD GLU A 38 8.764 1.136 2.987 1.00 0.00 C ATOM 599 OE1 GLU A 38 9.246 0.161 2.433 1.00 0.00 O ATOM 600 OE2 GLU A 38 9.066 2.306 2.820 1.00 0.00 O ATOM 0 H GLU A 38 5.635 -1.137 5.562 1.00 0.00 H new ATOM 0 HA GLU A 38 4.893 1.526 4.422 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.481 -0.528 2.835 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.193 1.155 2.441 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.481 1.743 4.618 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.960 0.059 4.681 1.00 0.00 H new ATOM 607 N ILE A 39 2.900 0.364 3.553 1.00 0.00 N ATOM 608 CA ILE A 39 1.704 -0.330 2.992 1.00 0.00 C ATOM 609 C ILE A 39 1.669 -0.182 1.468 1.00 0.00 C ATOM 610 O ILE A 39 1.208 0.815 0.949 1.00 0.00 O ATOM 611 CB ILE A 39 0.439 0.287 3.589 1.00 0.00 C ATOM 612 CG1 ILE A 39 0.373 -0.052 5.083 1.00 0.00 C ATOM 613 CG2 ILE A 39 -0.786 -0.295 2.880 1.00 0.00 C ATOM 614 CD1 ILE A 39 -0.422 1.033 5.815 1.00 0.00 C ATOM 0 H ILE A 39 2.756 1.336 3.827 1.00 0.00 H new ATOM 0 HA ILE A 39 1.758 -1.389 3.243 1.00 0.00 H new ATOM 0 HB ILE A 39 0.456 1.369 3.459 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -0.099 -1.024 5.226 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.379 -0.123 5.496 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.692 0.141 3.301 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.734 -0.065 1.816 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.806 -1.376 3.017 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.470 0.794 6.877 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.070 1.997 5.682 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.432 1.081 5.408 1.00 0.00 H new ATOM 626 N ILE A 40 2.160 -1.178 0.785 1.00 0.00 N ATOM 627 CA ILE A 40 2.157 -1.114 -0.705 1.00 0.00 C ATOM 628 C ILE A 40 0.859 -1.716 -1.250 1.00 0.00 C ATOM 629 O ILE A 40 0.263 -2.572 -0.628 1.00 0.00 O ATOM 630 CB ILE A 40 3.351 -1.901 -1.245 1.00 0.00 C ATOM 631 CG1 ILE A 40 4.633 -1.102 -0.997 1.00 0.00 C ATOM 632 CG2 ILE A 40 3.175 -2.120 -2.748 1.00 0.00 C ATOM 633 CD1 ILE A 40 5.784 -2.074 -0.738 1.00 0.00 C ATOM 0 H ILE A 40 2.560 -2.026 1.188 1.00 0.00 H new ATOM 0 HA ILE A 40 2.228 -0.074 -1.022 1.00 0.00 H new ATOM 0 HB ILE A 40 3.414 -2.865 -0.740 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.858 -0.474 -1.859 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.503 -0.437 -0.143 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.025 -2.681 -3.136 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.258 -2.680 -2.929 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.117 -1.155 -3.252 1.00 0.00 H new ATOM 0 HD11 ILE A 40 6.701 -1.513 -0.560 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.556 -2.683 0.137 1.00 0.00 H new ATOM 0 HD13 ILE A 40 5.917 -2.720 -1.606 1.00 0.00 H new ATOM 645 N VAL A 41 0.449 -1.255 -2.399 1.00 0.00 N ATOM 646 CA VAL A 41 -0.806 -1.791 -2.998 1.00 0.00 C ATOM 647 C VAL A 41 -0.667 -1.885 -4.519 1.00 0.00 C ATOM 648 O VAL A 41 0.131 -1.187 -5.113 1.00 0.00 O ATOM 649 CB VAL A 41 -1.967 -0.858 -2.648 1.00 0.00 C ATOM 650 CG1 VAL A 41 -1.720 0.517 -3.275 1.00 0.00 C ATOM 651 CG2 VAL A 41 -3.268 -1.440 -3.206 1.00 0.00 C ATOM 0 H VAL A 41 0.924 -0.536 -2.946 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.997 -2.787 -2.599 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.043 -0.759 -1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -2.546 1.184 -3.027 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.790 0.932 -2.887 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.648 0.416 -4.358 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.098 -0.778 -2.959 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.189 -1.534 -4.289 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.444 -2.422 -2.768 1.00 0.00 H new ATOM 661 N LYS A 42 -1.451 -2.752 -5.112 1.00 0.00 N ATOM 662 CA LYS A 42 -1.394 -2.913 -6.598 1.00 0.00 C ATOM 663 C LYS A 42 -2.774 -2.659 -7.206 1.00 0.00 C ATOM 664 O LYS A 42 -3.752 -3.297 -6.837 1.00 0.00 O ATOM 665 CB LYS A 42 -0.943 -4.331 -6.936 1.00 0.00 C ATOM 666 CG LYS A 42 0.370 -4.269 -7.718 1.00 0.00 C ATOM 667 CD LYS A 42 0.863 -5.692 -7.984 1.00 0.00 C ATOM 668 CE LYS A 42 1.688 -5.705 -9.273 1.00 0.00 C ATOM 669 NZ LYS A 42 0.806 -5.920 -10.455 1.00 0.00 N ATOM 0 H LYS A 42 -2.124 -3.352 -4.635 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.686 -2.193 -7.009 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.809 -4.910 -6.022 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.707 -4.838 -7.525 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.222 -3.740 -8.660 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.118 -3.712 -7.154 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.467 -6.043 -7.147 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.016 -6.373 -8.073 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.224 -4.762 -9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 42 2.438 -6.494 -9.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.382 -5.926 -11.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.314 -6.831 -10.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 0.106 -5.153 -10.510 1.00 0.00 H new ATOM 683 N LEU A 43 -2.823 -1.731 -8.124 1.00 0.00 N ATOM 684 CA LEU A 43 -4.122 -1.410 -8.774 1.00 0.00 C ATOM 685 C LEU A 43 -4.383 -2.376 -9.935 1.00 0.00 C ATOM 686 O LEU A 43 -3.472 -2.759 -10.643 1.00 0.00 O ATOM 687 CB LEU A 43 -4.079 0.025 -9.297 1.00 0.00 C ATOM 688 CG LEU A 43 -4.286 0.992 -8.128 1.00 0.00 C ATOM 689 CD1 LEU A 43 -3.194 0.760 -7.083 1.00 0.00 C ATOM 690 CD2 LEU A 43 -4.194 2.430 -8.642 1.00 0.00 C ATOM 0 H LEU A 43 -2.024 -1.186 -8.449 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.926 -1.512 -8.045 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.122 0.220 -9.781 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.853 0.174 -10.050 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.265 0.823 -7.680 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.337 1.446 -6.249 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.248 -0.267 -6.722 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.217 0.935 -7.533 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.341 3.123 -7.813 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.212 2.596 -9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.964 2.597 -9.395 1.00 0.00 H new ATOM 702 N SER A 44 -5.628 -2.740 -10.102 1.00 0.00 N ATOM 703 CA SER A 44 -5.985 -3.692 -11.200 1.00 0.00 C ATOM 704 C SER A 44 -5.392 -3.236 -12.538 1.00 0.00 C ATOM 705 O SER A 44 -5.087 -4.048 -13.390 1.00 0.00 O ATOM 706 CB SER A 44 -7.506 -3.760 -11.322 1.00 0.00 C ATOM 707 OG SER A 44 -7.823 -2.763 -12.283 1.00 0.00 O ATOM 0 H SER A 44 -6.410 -2.422 -9.530 1.00 0.00 H new ATOM 0 HA SER A 44 -5.576 -4.673 -10.958 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.836 -4.746 -11.648 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.992 -3.561 -10.367 1.00 0.00 H new ATOM 0 HG SER A 44 -8.793 -2.741 -12.424 1.00 0.00 H new ATOM 713 N ASP A 45 -5.239 -1.953 -12.697 1.00 0.00 N ATOM 714 CA ASP A 45 -4.674 -1.442 -13.981 1.00 0.00 C ATOM 715 C ASP A 45 -3.276 -2.026 -14.210 1.00 0.00 C ATOM 716 O ASP A 45 -2.676 -1.823 -15.247 1.00 0.00 O ATOM 717 CB ASP A 45 -4.590 0.082 -13.920 1.00 0.00 C ATOM 718 CG ASP A 45 -3.936 0.499 -12.603 1.00 0.00 C ATOM 719 OD1 ASP A 45 -3.281 -0.356 -12.031 1.00 0.00 O ATOM 720 OD2 ASP A 45 -4.129 1.648 -12.242 1.00 0.00 O ATOM 0 H ASP A 45 -5.476 -1.242 -12.006 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.321 -1.743 -14.805 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -4.011 0.460 -14.763 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.587 0.516 -13.998 1.00 0.00 H new ATOM 725 N GLY A 46 -2.789 -2.740 -13.233 1.00 0.00 N ATOM 726 CA GLY A 46 -1.436 -3.346 -13.372 1.00 0.00 C ATOM 727 C GLY A 46 -0.367 -2.378 -12.865 1.00 0.00 C ATOM 728 O GLY A 46 0.774 -2.443 -13.278 1.00 0.00 O ATOM 0 H GLY A 46 -3.265 -2.929 -12.351 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.388 -4.279 -12.810 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.246 -3.594 -14.416 1.00 0.00 H new ATOM 732 N ARG A 47 -0.764 -1.500 -11.976 1.00 0.00 N ATOM 733 CA ARG A 47 0.213 -0.502 -11.430 1.00 0.00 C ATOM 734 C ARG A 47 0.516 -0.803 -9.959 1.00 0.00 C ATOM 735 O ARG A 47 -0.204 -1.534 -9.310 1.00 0.00 O ATOM 736 CB ARG A 47 -0.383 0.910 -11.539 1.00 0.00 C ATOM 737 CG ARG A 47 -0.897 1.169 -12.971 1.00 0.00 C ATOM 738 CD ARG A 47 0.283 1.466 -13.904 1.00 0.00 C ATOM 739 NE ARG A 47 1.057 2.618 -13.360 1.00 0.00 N ATOM 740 CZ ARG A 47 2.196 2.943 -13.908 1.00 0.00 C ATOM 741 NH1 ARG A 47 2.571 2.328 -14.996 1.00 0.00 N ATOM 742 NH2 ARG A 47 2.921 3.873 -13.349 1.00 0.00 N ATOM 0 H ARG A 47 -1.712 -1.430 -11.607 1.00 0.00 H new ATOM 0 HA ARG A 47 1.136 -0.564 -12.006 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.200 1.022 -10.827 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.372 1.651 -11.277 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.447 0.300 -13.332 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -1.592 2.009 -12.971 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.925 0.589 -13.990 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -0.079 1.696 -14.906 1.00 0.00 H new ATOM 0 HE ARG A 47 0.699 3.148 -12.566 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.977 1.606 -15.404 1.00 0.00 H new ATOM 0 HH12 ARG A 47 3.458 2.569 -15.438 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.595 4.332 -12.499 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.814 4.141 -13.762 1.00 0.00 H new ATOM 756 N GLU A 48 1.583 -0.226 -9.469 1.00 0.00 N ATOM 757 CA GLU A 48 1.959 -0.454 -8.041 1.00 0.00 C ATOM 758 C GLU A 48 2.434 0.858 -7.410 1.00 0.00 C ATOM 759 O GLU A 48 3.323 1.508 -7.924 1.00 0.00 O ATOM 760 CB GLU A 48 3.082 -1.489 -7.977 1.00 0.00 C ATOM 761 CG GLU A 48 4.311 -0.943 -8.705 1.00 0.00 C ATOM 762 CD GLU A 48 5.182 -2.111 -9.172 1.00 0.00 C ATOM 763 OE1 GLU A 48 5.691 -2.791 -8.295 1.00 0.00 O ATOM 764 OE2 GLU A 48 5.290 -2.258 -10.378 1.00 0.00 O ATOM 0 H GLU A 48 2.207 0.389 -9.992 1.00 0.00 H new ATOM 0 HA GLU A 48 1.091 -0.818 -7.492 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.329 -1.712 -6.939 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.758 -2.423 -8.435 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.004 -0.339 -9.559 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.881 -0.291 -8.042 1.00 0.00 H new ATOM 771 N LEU A 49 1.826 1.216 -6.307 1.00 0.00 N ATOM 772 CA LEU A 49 2.221 2.490 -5.623 1.00 0.00 C ATOM 773 C LEU A 49 2.375 2.262 -4.114 1.00 0.00 C ATOM 774 O LEU A 49 1.826 1.327 -3.566 1.00 0.00 O ATOM 775 CB LEU A 49 1.140 3.541 -5.872 1.00 0.00 C ATOM 776 CG LEU A 49 0.961 3.727 -7.380 1.00 0.00 C ATOM 777 CD1 LEU A 49 -0.272 2.946 -7.841 1.00 0.00 C ATOM 778 CD2 LEU A 49 0.758 5.212 -7.685 1.00 0.00 C ATOM 0 H LEU A 49 1.080 0.689 -5.853 1.00 0.00 H new ATOM 0 HA LEU A 49 3.176 2.831 -6.023 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.200 3.229 -5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.420 4.486 -5.407 1.00 0.00 H new ATOM 0 HG LEU A 49 1.845 3.362 -7.902 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.404 3.075 -8.915 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.137 1.888 -7.617 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.154 3.318 -7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.630 5.349 -8.759 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.130 5.572 -7.165 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.629 5.775 -7.349 1.00 0.00 H new ATOM 790 N CYS A 50 3.123 3.132 -3.478 1.00 0.00 N ATOM 791 CA CYS A 50 3.337 2.993 -2.002 1.00 0.00 C ATOM 792 C CYS A 50 2.545 4.066 -1.244 1.00 0.00 C ATOM 793 O CYS A 50 2.510 5.214 -1.646 1.00 0.00 O ATOM 794 CB CYS A 50 4.826 3.156 -1.702 1.00 0.00 C ATOM 795 SG CYS A 50 5.984 2.190 -2.701 1.00 0.00 S ATOM 0 H CYS A 50 3.592 3.927 -3.913 1.00 0.00 H new ATOM 0 HA CYS A 50 2.992 2.010 -1.680 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.080 4.210 -1.816 1.00 0.00 H new ATOM 0 HB3 CYS A 50 4.989 2.900 -0.655 1.00 0.00 H new ATOM 800 N LEU A 51 1.927 3.663 -0.157 1.00 0.00 N ATOM 801 CA LEU A 51 1.124 4.640 0.650 1.00 0.00 C ATOM 802 C LEU A 51 1.781 4.875 2.014 1.00 0.00 C ATOM 803 O LEU A 51 2.599 4.091 2.456 1.00 0.00 O ATOM 804 CB LEU A 51 -0.281 4.078 0.870 1.00 0.00 C ATOM 805 CG LEU A 51 -0.824 3.515 -0.446 1.00 0.00 C ATOM 806 CD1 LEU A 51 -2.245 2.992 -0.214 1.00 0.00 C ATOM 807 CD2 LEU A 51 -0.862 4.628 -1.498 1.00 0.00 C ATOM 0 H LEU A 51 1.943 2.709 0.204 1.00 0.00 H new ATOM 0 HA LEU A 51 1.075 5.585 0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.255 3.295 1.628 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.942 4.861 1.242 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.182 2.706 -0.794 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.641 2.589 -1.146 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.225 2.207 0.542 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.882 3.808 0.128 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.248 4.229 -2.436 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.510 5.434 -1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.145 5.014 -1.656 1.00 0.00 H new ATOM 819 N ASP A 52 1.400 5.956 2.648 1.00 0.00 N ATOM 820 CA ASP A 52 1.972 6.277 3.991 1.00 0.00 C ATOM 821 C ASP A 52 0.858 6.163 5.078 1.00 0.00 C ATOM 822 O ASP A 52 -0.111 6.893 5.022 1.00 0.00 O ATOM 823 CB ASP A 52 2.484 7.717 3.964 1.00 0.00 C ATOM 824 CG ASP A 52 3.513 7.909 5.080 1.00 0.00 C ATOM 825 OD1 ASP A 52 3.197 7.499 6.184 1.00 0.00 O ATOM 826 OD2 ASP A 52 4.557 8.456 4.764 1.00 0.00 O ATOM 0 H ASP A 52 0.719 6.628 2.294 1.00 0.00 H new ATOM 0 HA ASP A 52 2.780 5.583 4.224 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.935 7.937 2.996 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.655 8.412 4.095 1.00 0.00 H new ATOM 831 N PRO A 53 1.002 5.253 6.053 1.00 0.00 N ATOM 832 CA PRO A 53 -0.025 5.110 7.099 1.00 0.00 C ATOM 833 C PRO A 53 -0.162 6.411 7.897 1.00 0.00 C ATOM 834 O PRO A 53 -0.960 6.504 8.809 1.00 0.00 O ATOM 835 CB PRO A 53 0.468 3.978 8.007 1.00 0.00 C ATOM 836 CG PRO A 53 1.838 3.493 7.446 1.00 0.00 C ATOM 837 CD PRO A 53 2.150 4.332 6.194 1.00 0.00 C ATOM 0 HA PRO A 53 -1.005 4.891 6.674 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.576 4.329 9.033 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -0.251 3.159 8.024 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.622 3.614 8.193 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.796 2.433 7.196 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.084 4.881 6.310 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.259 3.700 5.313 1.00 0.00 H new ATOM 845 N LYS A 54 0.623 7.388 7.535 1.00 0.00 N ATOM 846 CA LYS A 54 0.563 8.683 8.256 1.00 0.00 C ATOM 847 C LYS A 54 -0.667 9.489 7.816 1.00 0.00 C ATOM 848 O LYS A 54 -1.042 10.448 8.461 1.00 0.00 O ATOM 849 CB LYS A 54 1.834 9.480 7.950 1.00 0.00 C ATOM 850 CG LYS A 54 1.852 10.763 8.790 1.00 0.00 C ATOM 851 CD LYS A 54 1.694 11.972 7.864 1.00 0.00 C ATOM 852 CE LYS A 54 2.951 12.115 7.002 1.00 0.00 C ATOM 853 NZ LYS A 54 3.678 13.370 7.345 1.00 0.00 N ATOM 0 H LYS A 54 1.300 7.343 6.773 1.00 0.00 H new ATOM 0 HA LYS A 54 0.487 8.493 9.327 1.00 0.00 H new ATOM 0 HB2 LYS A 54 2.715 8.877 8.170 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.874 9.727 6.889 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.046 10.743 9.523 1.00 0.00 H new ATOM 0 HG3 LYS A 54 2.787 10.835 9.346 1.00 0.00 H new ATOM 0 HD2 LYS A 54 0.816 11.847 7.230 1.00 0.00 H new ATOM 0 HD3 LYS A 54 1.537 12.877 8.451 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.604 11.256 7.155 1.00 0.00 H new ATOM 0 HE3 LYS A 54 2.677 12.123 5.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 4.528 13.452 6.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 3.058 14.188 7.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 3.956 13.347 8.347 1.00 0.00 H new ATOM 867 N GLU A 55 -1.273 9.080 6.728 1.00 0.00 N ATOM 868 CA GLU A 55 -2.474 9.825 6.237 1.00 0.00 C ATOM 869 C GLU A 55 -3.758 9.103 6.659 1.00 0.00 C ATOM 870 O GLU A 55 -3.845 7.893 6.598 1.00 0.00 O ATOM 871 CB GLU A 55 -2.422 9.927 4.715 1.00 0.00 C ATOM 872 CG GLU A 55 -1.084 10.539 4.291 1.00 0.00 C ATOM 873 CD GLU A 55 -1.031 12.001 4.740 1.00 0.00 C ATOM 874 OE1 GLU A 55 -2.087 12.612 4.718 1.00 0.00 O ATOM 875 OE2 GLU A 55 0.062 12.424 5.078 1.00 0.00 O ATOM 0 H GLU A 55 -0.994 8.276 6.166 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.473 10.824 6.673 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.540 8.939 4.269 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.246 10.541 4.352 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.259 9.981 4.734 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.968 10.475 3.209 1.00 0.00 H new ATOM 882 N ASN A 56 -4.732 9.865 7.069 1.00 0.00 N ATOM 883 CA ASN A 56 -6.013 9.244 7.511 1.00 0.00 C ATOM 884 C ASN A 56 -6.737 8.581 6.333 1.00 0.00 C ATOM 885 O ASN A 56 -7.277 7.501 6.471 1.00 0.00 O ATOM 886 CB ASN A 56 -6.909 10.325 8.114 1.00 0.00 C ATOM 887 CG ASN A 56 -7.031 10.096 9.621 1.00 0.00 C ATOM 888 OD1 ASN A 56 -8.046 9.644 10.112 1.00 0.00 O ATOM 889 ND2 ASN A 56 -6.019 10.393 10.391 1.00 0.00 N ATOM 0 H ASN A 56 -4.699 10.883 7.118 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.792 8.477 8.254 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -6.491 11.312 7.917 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.895 10.298 7.649 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -6.084 10.245 11.398 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -5.164 10.773 9.985 1.00 0.00 H new ATOM 896 N TRP A 57 -6.739 9.232 5.199 1.00 0.00 N ATOM 897 CA TRP A 57 -7.443 8.627 4.030 1.00 0.00 C ATOM 898 C TRP A 57 -6.809 7.286 3.657 1.00 0.00 C ATOM 899 O TRP A 57 -7.424 6.476 3.002 1.00 0.00 O ATOM 900 CB TRP A 57 -7.401 9.583 2.827 1.00 0.00 C ATOM 901 CG TRP A 57 -5.952 9.887 2.423 1.00 0.00 C ATOM 902 CD1 TRP A 57 -5.278 10.964 2.816 1.00 0.00 C ATOM 903 CD2 TRP A 57 -5.223 9.156 1.594 1.00 0.00 C ATOM 904 NE1 TRP A 57 -4.100 10.854 2.182 1.00 0.00 N ATOM 905 CE2 TRP A 57 -3.983 9.740 1.388 1.00 0.00 C ATOM 906 CE3 TRP A 57 -5.528 7.963 0.959 1.00 0.00 C ATOM 907 CZ2 TRP A 57 -3.060 9.140 0.555 1.00 0.00 C ATOM 908 CZ3 TRP A 57 -4.600 7.364 0.128 1.00 0.00 C ATOM 909 CH2 TRP A 57 -3.369 7.953 -0.074 1.00 0.00 C ATOM 0 H TRP A 57 -6.295 10.135 5.033 1.00 0.00 H new ATOM 0 HA TRP A 57 -8.483 8.456 4.307 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -7.932 9.139 1.985 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -7.916 10.511 3.076 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -5.603 11.745 3.488 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -3.353 11.541 2.282 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -6.492 7.501 1.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -2.096 9.600 0.396 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -4.839 6.433 -0.364 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -2.647 7.484 -0.726 1.00 0.00 H new ATOM 920 N VAL A 58 -5.598 7.071 4.083 1.00 0.00 N ATOM 921 CA VAL A 58 -4.940 5.774 3.749 1.00 0.00 C ATOM 922 C VAL A 58 -5.473 4.680 4.665 1.00 0.00 C ATOM 923 O VAL A 58 -5.647 3.550 4.255 1.00 0.00 O ATOM 924 CB VAL A 58 -3.428 5.909 3.940 1.00 0.00 C ATOM 925 CG1 VAL A 58 -2.817 4.527 4.168 1.00 0.00 C ATOM 926 CG2 VAL A 58 -2.816 6.528 2.690 1.00 0.00 C ATOM 0 H VAL A 58 -5.042 7.721 4.638 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.155 5.513 2.713 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.226 6.544 4.803 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.740 4.623 4.304 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.256 4.077 5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.018 3.893 3.304 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.739 6.626 2.823 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.019 5.889 1.831 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.252 7.513 2.521 1.00 0.00 H new ATOM 936 N GLN A 59 -5.722 5.041 5.886 1.00 0.00 N ATOM 937 CA GLN A 59 -6.247 4.041 6.849 1.00 0.00 C ATOM 938 C GLN A 59 -7.697 3.692 6.502 1.00 0.00 C ATOM 939 O GLN A 59 -8.175 2.632 6.833 1.00 0.00 O ATOM 940 CB GLN A 59 -6.190 4.637 8.255 1.00 0.00 C ATOM 941 CG GLN A 59 -6.227 3.508 9.284 1.00 0.00 C ATOM 942 CD GLN A 59 -6.473 4.100 10.674 1.00 0.00 C ATOM 943 OE1 GLN A 59 -7.368 4.898 10.871 1.00 0.00 O ATOM 944 NE2 GLN A 59 -5.703 3.738 11.663 1.00 0.00 N ATOM 0 H GLN A 59 -5.586 5.980 6.259 1.00 0.00 H new ATOM 0 HA GLN A 59 -5.644 3.134 6.801 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.281 5.225 8.376 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.030 5.314 8.410 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -7.015 2.798 9.034 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.286 2.958 9.272 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.950 3.069 11.504 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.854 4.124 12.595 1.00 0.00 H new ATOM 953 N ARG A 60 -8.359 4.591 5.826 1.00 0.00 N ATOM 954 CA ARG A 60 -9.786 4.335 5.473 1.00 0.00 C ATOM 955 C ARG A 60 -9.915 3.568 4.148 1.00 0.00 C ATOM 956 O ARG A 60 -10.563 2.541 4.096 1.00 0.00 O ATOM 957 CB ARG A 60 -10.516 5.672 5.355 1.00 0.00 C ATOM 958 CG ARG A 60 -11.403 5.869 6.587 1.00 0.00 C ATOM 959 CD ARG A 60 -12.009 7.274 6.549 1.00 0.00 C ATOM 960 NE ARG A 60 -13.434 7.198 6.977 1.00 0.00 N ATOM 961 CZ ARG A 60 -14.378 7.281 6.080 1.00 0.00 C ATOM 962 NH1 ARG A 60 -14.775 8.461 5.689 1.00 0.00 N ATOM 963 NH2 ARG A 60 -14.894 6.181 5.604 1.00 0.00 N ATOM 0 H ARG A 60 -7.980 5.482 5.506 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.227 3.723 6.259 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.797 6.487 5.275 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.121 5.691 4.449 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -12.194 5.119 6.605 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.818 5.737 7.497 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -11.453 7.942 7.207 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -11.939 7.687 5.543 1.00 0.00 H new ATOM 0 HE ARG A 60 -13.670 7.082 7.963 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -14.348 9.299 6.084 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -15.512 8.545 4.989 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -14.559 5.276 5.934 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -15.633 6.226 4.902 1.00 0.00 H new ATOM 977 N VAL A 61 -9.302 4.068 3.102 1.00 0.00 N ATOM 978 CA VAL A 61 -9.427 3.361 1.800 1.00 0.00 C ATOM 979 C VAL A 61 -8.847 1.948 1.925 1.00 0.00 C ATOM 980 O VAL A 61 -9.355 1.009 1.345 1.00 0.00 O ATOM 981 CB VAL A 61 -8.685 4.158 0.724 1.00 0.00 C ATOM 982 CG1 VAL A 61 -9.249 5.586 0.680 1.00 0.00 C ATOM 983 CG2 VAL A 61 -7.192 4.194 1.069 1.00 0.00 C ATOM 0 H VAL A 61 -8.734 4.915 3.096 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.477 3.279 1.518 1.00 0.00 H new ATOM 0 HB VAL A 61 -8.817 3.689 -0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -8.726 6.161 -0.084 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.312 5.550 0.442 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.110 6.062 1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -6.656 4.760 0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.054 4.671 2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.803 3.177 1.106 1.00 0.00 H new ATOM 993 N VAL A 62 -7.799 1.822 2.689 1.00 0.00 N ATOM 994 CA VAL A 62 -7.202 0.471 2.873 1.00 0.00 C ATOM 995 C VAL A 62 -8.110 -0.364 3.780 1.00 0.00 C ATOM 996 O VAL A 62 -8.318 -1.538 3.545 1.00 0.00 O ATOM 997 CB VAL A 62 -5.821 0.607 3.511 1.00 0.00 C ATOM 998 CG1 VAL A 62 -5.296 -0.786 3.869 1.00 0.00 C ATOM 999 CG2 VAL A 62 -4.867 1.265 2.510 1.00 0.00 C ATOM 0 H VAL A 62 -7.336 2.582 3.187 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.104 -0.022 1.906 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.887 1.219 4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.310 -0.697 4.325 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.979 -1.263 4.572 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.224 -1.391 2.965 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.879 1.365 2.960 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.797 0.648 1.614 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.245 2.252 2.242 1.00 0.00 H new ATOM 1009 N GLU A 63 -8.635 0.263 4.804 1.00 0.00 N ATOM 1010 CA GLU A 63 -9.545 -0.479 5.724 1.00 0.00 C ATOM 1011 C GLU A 63 -10.715 -1.055 4.930 1.00 0.00 C ATOM 1012 O GLU A 63 -11.149 -2.164 5.171 1.00 0.00 O ATOM 1013 CB GLU A 63 -10.082 0.477 6.789 1.00 0.00 C ATOM 1014 CG GLU A 63 -11.242 -0.194 7.527 1.00 0.00 C ATOM 1015 CD GLU A 63 -11.255 0.276 8.983 1.00 0.00 C ATOM 1016 OE1 GLU A 63 -11.411 1.473 9.164 1.00 0.00 O ATOM 1017 OE2 GLU A 63 -11.107 -0.587 9.832 1.00 0.00 O ATOM 0 H GLU A 63 -8.475 1.243 5.039 1.00 0.00 H new ATOM 0 HA GLU A 63 -8.994 -1.289 6.202 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.291 0.739 7.492 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -10.418 1.405 6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.187 0.054 7.044 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.137 -1.278 7.484 1.00 0.00 H new ATOM 1024 N LYS A 64 -11.201 -0.286 3.994 1.00 0.00 N ATOM 1025 CA LYS A 64 -12.341 -0.771 3.172 1.00 0.00 C ATOM 1026 C LYS A 64 -11.927 -2.021 2.392 1.00 0.00 C ATOM 1027 O LYS A 64 -12.643 -3.003 2.366 1.00 0.00 O ATOM 1028 CB LYS A 64 -12.758 0.328 2.198 1.00 0.00 C ATOM 1029 CG LYS A 64 -14.096 0.917 2.649 1.00 0.00 C ATOM 1030 CD LYS A 64 -14.382 2.185 1.843 1.00 0.00 C ATOM 1031 CE LYS A 64 -15.865 2.538 1.972 1.00 0.00 C ATOM 1032 NZ LYS A 64 -16.706 1.518 1.286 1.00 0.00 N ATOM 0 H LYS A 64 -10.861 0.648 3.766 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.178 -1.022 3.824 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.997 1.108 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.846 -0.077 1.190 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.895 0.190 2.503 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.066 1.147 3.714 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.767 3.008 2.207 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -14.122 2.031 0.796 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.141 2.597 3.025 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.050 3.521 1.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -17.287 1.980 0.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.093 0.806 0.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -17.326 1.055 1.981 1.00 0.00 H new ATOM 1046 N PHE A 65 -10.777 -1.962 1.769 1.00 0.00 N ATOM 1047 CA PHE A 65 -10.315 -3.151 0.996 1.00 0.00 C ATOM 1048 C PHE A 65 -10.369 -4.403 1.874 1.00 0.00 C ATOM 1049 O PHE A 65 -10.728 -5.469 1.417 1.00 0.00 O ATOM 1050 CB PHE A 65 -8.889 -2.935 0.527 1.00 0.00 C ATOM 1051 CG PHE A 65 -8.435 -4.168 -0.265 1.00 0.00 C ATOM 1052 CD1 PHE A 65 -8.903 -4.392 -1.549 1.00 0.00 C ATOM 1053 CD2 PHE A 65 -7.553 -5.074 0.295 1.00 0.00 C ATOM 1054 CE1 PHE A 65 -8.493 -5.507 -2.259 1.00 0.00 C ATOM 1055 CE2 PHE A 65 -7.145 -6.186 -0.416 1.00 0.00 C ATOM 1056 CZ PHE A 65 -7.615 -6.403 -1.691 1.00 0.00 C ATOM 0 H PHE A 65 -10.150 -1.158 1.762 1.00 0.00 H new ATOM 0 HA PHE A 65 -10.970 -3.284 0.135 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.828 -2.043 -0.096 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.232 -2.772 1.381 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.592 -3.692 -1.999 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -7.180 -4.911 1.296 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.862 -5.675 -3.260 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.455 -6.887 0.030 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.296 -7.274 -2.245 1.00 0.00 H new ATOM 1066 N LEU A 66 -10.008 -4.247 3.120 1.00 0.00 N ATOM 1067 CA LEU A 66 -10.035 -5.421 4.041 1.00 0.00 C ATOM 1068 C LEU A 66 -11.481 -5.863 4.285 1.00 0.00 C ATOM 1069 O LEU A 66 -11.803 -7.030 4.181 1.00 0.00 O ATOM 1070 CB LEU A 66 -9.389 -5.031 5.369 1.00 0.00 C ATOM 1071 CG LEU A 66 -7.879 -5.264 5.280 1.00 0.00 C ATOM 1072 CD1 LEU A 66 -7.166 -4.312 6.242 1.00 0.00 C ATOM 1073 CD2 LEU A 66 -7.568 -6.708 5.677 1.00 0.00 C ATOM 0 H LEU A 66 -9.699 -3.369 3.536 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.484 -6.246 3.590 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.595 -3.985 5.594 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.813 -5.622 6.181 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.538 -5.082 4.261 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.090 -4.474 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.394 -3.281 5.970 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.506 -4.502 7.260 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.493 -6.879 5.615 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -7.905 -6.885 6.698 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.083 -7.390 5.001 1.00 0.00 H new ATOM 1085 N LYS A 67 -12.322 -4.918 4.605 1.00 0.00 N ATOM 1086 CA LYS A 67 -13.751 -5.264 4.857 1.00 0.00 C ATOM 1087 C LYS A 67 -14.389 -5.820 3.580 1.00 0.00 C ATOM 1088 O LYS A 67 -15.354 -6.556 3.635 1.00 0.00 O ATOM 1089 CB LYS A 67 -14.499 -4.007 5.296 1.00 0.00 C ATOM 1090 CG LYS A 67 -14.633 -4.009 6.820 1.00 0.00 C ATOM 1091 CD LYS A 67 -15.254 -2.685 7.270 1.00 0.00 C ATOM 1092 CE LYS A 67 -16.138 -2.936 8.493 1.00 0.00 C ATOM 1093 NZ LYS A 67 -17.413 -3.593 8.090 1.00 0.00 N ATOM 0 H LYS A 67 -12.086 -3.931 4.702 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.808 -6.021 5.639 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.963 -3.117 4.967 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -15.485 -3.975 4.832 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -15.255 -4.844 7.142 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -13.655 -4.142 7.283 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -14.471 -1.966 7.513 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -15.844 -2.253 6.462 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -15.609 -3.565 9.209 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -16.351 -1.992 8.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -18.115 -3.484 8.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -17.772 -3.150 7.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -17.243 -4.605 7.919 1.00 0.00 H new ATOM 1107 N ARG A 68 -13.835 -5.454 2.456 1.00 0.00 N ATOM 1108 CA ARG A 68 -14.395 -5.952 1.167 1.00 0.00 C ATOM 1109 C ARG A 68 -13.854 -7.353 0.861 1.00 0.00 C ATOM 1110 O ARG A 68 -14.604 -8.258 0.555 1.00 0.00 O ATOM 1111 CB ARG A 68 -13.994 -4.994 0.046 1.00 0.00 C ATOM 1112 CG ARG A 68 -14.919 -5.210 -1.153 1.00 0.00 C ATOM 1113 CD ARG A 68 -16.100 -4.243 -1.057 1.00 0.00 C ATOM 1114 NE ARG A 68 -17.092 -4.583 -2.114 1.00 0.00 N ATOM 1115 CZ ARG A 68 -16.755 -4.468 -3.370 1.00 0.00 C ATOM 1116 NH1 ARG A 68 -15.963 -3.493 -3.723 1.00 0.00 N ATOM 1117 NH2 ARG A 68 -17.220 -5.332 -4.230 1.00 0.00 N ATOM 0 H ARG A 68 -13.026 -4.838 2.374 1.00 0.00 H new ATOM 0 HA ARG A 68 -15.481 -6.003 1.242 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -14.061 -3.962 0.391 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -12.957 -5.167 -0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -14.374 -5.046 -2.082 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -15.277 -6.239 -1.171 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -16.562 -4.309 -0.072 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -15.756 -3.216 -1.179 1.00 0.00 H new ATOM 0 HE ARG A 68 -18.026 -4.903 -1.859 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -15.618 -2.837 -3.022 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -15.689 -3.387 -4.700 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -17.836 -6.082 -3.917 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -16.967 -5.257 -5.215 1.00 0.00 H new ATOM 1131 N ALA A 69 -12.560 -7.499 0.951 1.00 0.00 N ATOM 1132 CA ALA A 69 -11.951 -8.832 0.670 1.00 0.00 C ATOM 1133 C ALA A 69 -12.363 -9.836 1.750 1.00 0.00 C ATOM 1134 O ALA A 69 -12.310 -11.032 1.544 1.00 0.00 O ATOM 1135 CB ALA A 69 -10.429 -8.694 0.655 1.00 0.00 C ATOM 0 H ALA A 69 -11.903 -6.761 1.204 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.300 -9.191 -0.298 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.978 -9.665 0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.135 -7.986 -0.120 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.087 -8.332 1.625 1.00 0.00 H new ATOM 1141 N GLU A 70 -12.764 -9.324 2.881 1.00 0.00 N ATOM 1142 CA GLU A 70 -13.184 -10.230 3.986 1.00 0.00 C ATOM 1143 C GLU A 70 -14.679 -10.546 3.870 1.00 0.00 C ATOM 1144 O GLU A 70 -15.102 -11.659 4.114 1.00 0.00 O ATOM 1145 CB GLU A 70 -12.909 -9.546 5.324 1.00 0.00 C ATOM 1146 CG GLU A 70 -13.030 -10.576 6.448 1.00 0.00 C ATOM 1147 CD GLU A 70 -13.652 -9.912 7.677 1.00 0.00 C ATOM 1148 OE1 GLU A 70 -12.895 -9.270 8.387 1.00 0.00 O ATOM 1149 OE2 GLU A 70 -14.850 -10.083 7.838 1.00 0.00 O ATOM 0 H GLU A 70 -12.819 -8.326 3.087 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.621 -11.161 3.922 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.912 -9.106 5.323 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.616 -8.732 5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.645 -11.415 6.123 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.048 -10.978 6.696 1.00 0.00 H new ATOM 1156 N ASN A 71 -15.446 -9.558 3.498 1.00 0.00 N ATOM 1157 CA ASN A 71 -16.915 -9.782 3.360 1.00 0.00 C ATOM 1158 C ASN A 71 -17.197 -10.724 2.184 1.00 0.00 C ATOM 1159 O ASN A 71 -18.208 -11.397 2.154 1.00 0.00 O ATOM 1160 CB ASN A 71 -17.604 -8.441 3.114 1.00 0.00 C ATOM 1161 CG ASN A 71 -19.093 -8.677 2.856 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -19.706 -9.546 3.444 1.00 0.00 O ATOM 1163 ND2 ASN A 71 -19.712 -7.926 1.987 1.00 0.00 N ATOM 0 H ASN A 71 -15.124 -8.614 3.285 1.00 0.00 H new ATOM 0 HA ASN A 71 -17.297 -10.235 4.275 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -17.472 -7.788 3.976 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -17.151 -7.937 2.260 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -20.705 -8.070 1.804 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -19.203 -7.195 1.490 1.00 0.00 H new ATOM 1170 N SER A 72 -16.295 -10.750 1.242 1.00 0.00 N ATOM 1171 CA SER A 72 -16.494 -11.642 0.061 1.00 0.00 C ATOM 1172 C SER A 72 -16.789 -13.073 0.523 1.00 0.00 C ATOM 1173 O SER A 72 -16.247 -13.431 1.556 1.00 0.00 O ATOM 1174 CB SER A 72 -15.227 -11.632 -0.791 1.00 0.00 C ATOM 1175 OG SER A 72 -14.903 -10.255 -0.917 1.00 0.00 O ATOM 1176 OXT SER A 72 -17.539 -13.726 -0.184 1.00 0.00 O ATOM 0 H SER A 72 -15.437 -10.199 1.236 1.00 0.00 H new ATOM 0 HA SER A 72 -17.339 -11.280 -0.525 1.00 0.00 H new ATOM 0 HB2 SER A 72 -14.421 -12.189 -0.313 1.00 0.00 H new ATOM 0 HB3 SER A 72 -15.398 -12.092 -1.764 1.00 0.00 H new ATOM 0 HG SER A 72 -14.374 -9.971 -0.142 1.00 0.00 H new TER 1182 SER A 72 ATOM 1183 N ALA B 2 -12.937 -16.866 -21.628 1.00 0.00 N ATOM 1184 CA ALA B 2 -12.835 -18.155 -20.885 1.00 0.00 C ATOM 1185 C ALA B 2 -13.611 -18.047 -19.568 1.00 0.00 C ATOM 1186 O ALA B 2 -13.422 -17.119 -18.807 1.00 0.00 O ATOM 1187 CB ALA B 2 -11.374 -18.488 -20.582 1.00 0.00 C ATOM 0 HA ALA B 2 -13.256 -18.948 -21.503 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -11.321 -19.432 -20.040 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -10.819 -18.575 -21.516 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -10.939 -17.695 -19.974 1.00 0.00 H new ATOM 1195 N LYS B 3 -14.470 -19.001 -19.329 1.00 0.00 N ATOM 1196 CA LYS B 3 -15.267 -18.970 -18.067 1.00 0.00 C ATOM 1197 C LYS B 3 -14.553 -19.773 -16.972 1.00 0.00 C ATOM 1198 O LYS B 3 -15.148 -20.133 -15.976 1.00 0.00 O ATOM 1199 CB LYS B 3 -16.646 -19.579 -18.332 1.00 0.00 C ATOM 1200 CG LYS B 3 -17.641 -18.463 -18.671 1.00 0.00 C ATOM 1201 CD LYS B 3 -17.166 -17.729 -19.927 1.00 0.00 C ATOM 1202 CE LYS B 3 -18.336 -16.938 -20.519 1.00 0.00 C ATOM 1203 NZ LYS B 3 -19.464 -17.851 -20.856 1.00 0.00 N ATOM 0 H LYS B 3 -14.654 -19.793 -19.945 1.00 0.00 H new ATOM 0 HA LYS B 3 -15.375 -17.938 -17.733 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -16.589 -20.292 -19.155 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -16.986 -20.130 -17.456 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -18.634 -18.882 -18.834 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -17.722 -17.766 -17.837 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -16.344 -17.057 -19.681 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -16.786 -18.443 -20.658 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -18.671 -16.184 -19.807 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -18.009 -16.408 -21.414 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -19.824 -17.623 -21.805 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -19.130 -18.836 -20.840 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -20.227 -17.732 -20.159 1.00 0.00 H new ATOM 1217 N GLU B 4 -13.292 -20.035 -17.182 1.00 0.00 N ATOM 1218 CA GLU B 4 -12.525 -20.813 -16.164 1.00 0.00 C ATOM 1219 C GLU B 4 -11.784 -19.862 -15.215 1.00 0.00 C ATOM 1220 O GLU B 4 -10.939 -19.096 -15.635 1.00 0.00 O ATOM 1221 CB GLU B 4 -11.515 -21.711 -16.877 1.00 0.00 C ATOM 1222 CG GLU B 4 -12.263 -22.656 -17.820 1.00 0.00 C ATOM 1223 CD GLU B 4 -11.278 -23.670 -18.405 1.00 0.00 C ATOM 1224 OE1 GLU B 4 -10.704 -24.391 -17.605 1.00 0.00 O ATOM 1225 OE2 GLU B 4 -11.154 -23.667 -19.619 1.00 0.00 O ATOM 0 H GLU B 4 -12.763 -19.748 -18.005 1.00 0.00 H new ATOM 0 HA GLU B 4 -13.218 -21.421 -15.582 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -10.804 -21.105 -17.438 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -10.941 -22.284 -16.148 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -13.057 -23.172 -17.281 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -12.738 -22.089 -18.621 1.00 0.00 H new ATOM 1232 N LEU B 5 -12.119 -19.934 -13.955 1.00 0.00 N ATOM 1233 CA LEU B 5 -11.448 -19.042 -12.961 1.00 0.00 C ATOM 1234 C LEU B 5 -10.314 -19.797 -12.255 1.00 0.00 C ATOM 1235 O LEU B 5 -10.559 -20.696 -11.475 1.00 0.00 O ATOM 1236 CB LEU B 5 -12.478 -18.585 -11.928 1.00 0.00 C ATOM 1237 CG LEU B 5 -13.589 -17.806 -12.637 1.00 0.00 C ATOM 1238 CD1 LEU B 5 -14.921 -18.532 -12.437 1.00 0.00 C ATOM 1239 CD2 LEU B 5 -13.686 -16.404 -12.033 1.00 0.00 C ATOM 0 H LEU B 5 -12.822 -20.566 -13.571 1.00 0.00 H new ATOM 0 HA LEU B 5 -11.028 -18.178 -13.476 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -12.896 -19.447 -11.408 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -12.002 -17.958 -11.174 1.00 0.00 H new ATOM 0 HG LEU B 5 -13.365 -17.734 -13.701 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -15.715 -17.981 -12.940 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -14.855 -19.536 -12.856 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -15.143 -18.597 -11.372 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -14.476 -15.845 -12.535 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -13.915 -16.481 -10.970 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -12.736 -15.885 -12.163 1.00 0.00 H new ATOM 1251 N ARG B 6 -9.096 -19.412 -12.544 1.00 0.00 N ATOM 1252 CA ARG B 6 -7.931 -20.100 -11.902 1.00 0.00 C ATOM 1253 C ARG B 6 -7.371 -19.248 -10.756 1.00 0.00 C ATOM 1254 O ARG B 6 -6.554 -18.380 -10.970 1.00 0.00 O ATOM 1255 CB ARG B 6 -6.843 -20.325 -12.954 1.00 0.00 C ATOM 1256 CG ARG B 6 -7.051 -21.696 -13.604 1.00 0.00 C ATOM 1257 CD ARG B 6 -6.162 -21.807 -14.846 1.00 0.00 C ATOM 1258 NE ARG B 6 -5.545 -23.164 -14.884 1.00 0.00 N ATOM 1259 CZ ARG B 6 -6.242 -24.174 -15.328 1.00 0.00 C ATOM 1260 NH1 ARG B 6 -6.996 -24.836 -14.494 1.00 0.00 N ATOM 1261 NH2 ARG B 6 -6.161 -24.491 -16.593 1.00 0.00 N ATOM 0 H ARG B 6 -8.858 -18.659 -13.190 1.00 0.00 H new ATOM 0 HA ARG B 6 -8.260 -21.056 -11.495 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -6.883 -19.541 -13.710 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -5.857 -20.273 -12.492 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -6.807 -22.488 -12.896 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -8.098 -21.826 -13.879 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -6.751 -21.636 -15.747 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -5.386 -21.042 -14.823 1.00 0.00 H new ATOM 0 HE ARG B 6 -4.586 -23.302 -14.566 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -7.034 -24.561 -13.512 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -7.548 -25.628 -14.824 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -5.560 -23.952 -17.216 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -6.699 -25.277 -16.957 1.00 0.00 H new ATOM 1275 N CYS B 7 -7.804 -19.536 -9.560 1.00 0.00 N ATOM 1276 CA CYS B 7 -7.320 -18.739 -8.393 1.00 0.00 C ATOM 1277 C CYS B 7 -5.793 -18.822 -8.277 1.00 0.00 C ATOM 1278 O CYS B 7 -5.199 -19.836 -8.584 1.00 0.00 O ATOM 1279 CB CYS B 7 -7.960 -19.287 -7.118 1.00 0.00 C ATOM 1280 SG CYS B 7 -9.671 -18.806 -6.777 1.00 0.00 S ATOM 0 H CYS B 7 -8.465 -20.280 -9.339 1.00 0.00 H new ATOM 0 HA CYS B 7 -7.599 -17.695 -8.535 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -7.917 -20.375 -7.160 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -7.347 -18.976 -6.272 1.00 0.00 H new ATOM 1285 N GLN B 8 -5.188 -17.746 -7.834 1.00 0.00 N ATOM 1286 CA GLN B 8 -3.699 -17.750 -7.691 1.00 0.00 C ATOM 1287 C GLN B 8 -3.271 -18.783 -6.646 1.00 0.00 C ATOM 1288 O GLN B 8 -2.186 -19.326 -6.722 1.00 0.00 O ATOM 1289 CB GLN B 8 -3.226 -16.361 -7.245 1.00 0.00 C ATOM 1290 CG GLN B 8 -3.308 -15.379 -8.421 1.00 0.00 C ATOM 1291 CD GLN B 8 -1.894 -14.954 -8.823 1.00 0.00 C ATOM 1292 OE1 GLN B 8 -1.464 -15.167 -9.939 1.00 0.00 O ATOM 1293 NE2 GLN B 8 -1.140 -14.350 -7.945 1.00 0.00 N ATOM 0 H GLN B 8 -5.653 -16.878 -7.569 1.00 0.00 H new ATOM 0 HA GLN B 8 -3.253 -18.006 -8.652 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -3.842 -16.005 -6.419 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -2.201 -16.417 -6.877 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -3.814 -15.847 -9.266 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -3.897 -14.506 -8.140 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -1.496 -14.168 -7.006 1.00 0.00 H new ATOM 0 HE22 GLN B 8 -0.195 -14.060 -8.198 1.00 0.00 H new ATOM 1302 N CYS B 9 -4.135 -19.029 -5.694 1.00 0.00 N ATOM 1303 CA CYS B 9 -3.801 -20.021 -4.624 1.00 0.00 C ATOM 1304 C CYS B 9 -4.795 -21.186 -4.641 1.00 0.00 C ATOM 1305 O CYS B 9 -5.991 -20.986 -4.562 1.00 0.00 O ATOM 1306 CB CYS B 9 -3.863 -19.322 -3.270 1.00 0.00 C ATOM 1307 SG CYS B 9 -2.469 -18.260 -2.822 1.00 0.00 S ATOM 0 H CYS B 9 -5.052 -18.590 -5.610 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.801 -20.416 -4.801 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -4.770 -18.718 -3.243 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -3.966 -20.086 -2.500 1.00 0.00 H new ATOM 1312 N ILE B 10 -4.274 -22.379 -4.746 1.00 0.00 N ATOM 1313 CA ILE B 10 -5.167 -23.576 -4.765 1.00 0.00 C ATOM 1314 C ILE B 10 -5.197 -24.226 -3.376 1.00 0.00 C ATOM 1315 O ILE B 10 -6.236 -24.316 -2.752 1.00 0.00 O ATOM 1316 CB ILE B 10 -4.636 -24.580 -5.789 1.00 0.00 C ATOM 1317 CG1 ILE B 10 -4.531 -23.894 -7.155 1.00 0.00 C ATOM 1318 CG2 ILE B 10 -5.604 -25.760 -5.888 1.00 0.00 C ATOM 1319 CD1 ILE B 10 -3.902 -24.865 -8.157 1.00 0.00 C ATOM 0 H ILE B 10 -3.276 -22.577 -4.819 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.178 -23.271 -5.037 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.654 -24.938 -5.480 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -5.519 -23.587 -7.498 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -3.926 -22.991 -7.076 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -5.229 -26.478 -6.617 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -5.690 -26.243 -4.914 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -6.584 -25.401 -6.203 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -3.824 -24.383 -9.131 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -2.908 -25.150 -7.813 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.525 -25.755 -8.241 1.00 0.00 H new ATOM 1331 N LYS B 11 -4.053 -24.665 -2.923 1.00 0.00 N ATOM 1332 CA LYS B 11 -3.996 -25.307 -1.577 1.00 0.00 C ATOM 1333 C LYS B 11 -3.732 -24.248 -0.500 1.00 0.00 C ATOM 1334 O LYS B 11 -3.543 -23.087 -0.805 1.00 0.00 O ATOM 1335 CB LYS B 11 -2.871 -26.341 -1.564 1.00 0.00 C ATOM 1336 CG LYS B 11 -3.114 -27.359 -2.680 1.00 0.00 C ATOM 1337 CD LYS B 11 -2.203 -28.569 -2.466 1.00 0.00 C ATOM 1338 CE LYS B 11 -3.032 -29.729 -1.912 1.00 0.00 C ATOM 1339 NZ LYS B 11 -3.971 -30.241 -2.949 1.00 0.00 N ATOM 0 H LYS B 11 -3.164 -24.608 -3.420 1.00 0.00 H new ATOM 0 HA LYS B 11 -4.949 -25.793 -1.368 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -1.908 -25.851 -1.706 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.834 -26.844 -0.598 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -4.158 -27.671 -2.682 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.915 -26.906 -3.651 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -1.734 -28.858 -3.407 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -1.400 -28.317 -1.774 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -2.371 -30.531 -1.583 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.592 -29.398 -1.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -4.153 -31.252 -2.784 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -4.867 -29.715 -2.896 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -3.550 -30.114 -3.891 1.00 0.00 H new ATOM 1353 N THR B 12 -3.729 -24.672 0.739 1.00 0.00 N ATOM 1354 CA THR B 12 -3.483 -23.702 1.852 1.00 0.00 C ATOM 1355 C THR B 12 -2.548 -24.317 2.901 1.00 0.00 C ATOM 1356 O THR B 12 -2.104 -25.439 2.760 1.00 0.00 O ATOM 1357 CB THR B 12 -4.819 -23.342 2.511 1.00 0.00 C ATOM 1358 OG1 THR B 12 -5.493 -24.587 2.668 1.00 0.00 O ATOM 1359 CG2 THR B 12 -5.703 -22.518 1.578 1.00 0.00 C ATOM 0 H THR B 12 -3.885 -25.638 1.027 1.00 0.00 H new ATOM 0 HA THR B 12 -3.014 -22.806 1.445 1.00 0.00 H new ATOM 0 HB THR B 12 -4.641 -22.781 3.428 1.00 0.00 H new ATOM 0 HG1 THR B 12 -6.365 -24.436 3.090 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.641 -22.282 2.080 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.190 -21.593 1.314 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.909 -23.090 0.673 1.00 0.00 H new ATOM 1367 N TYR B 13 -2.273 -23.561 3.931 1.00 0.00 N ATOM 1368 CA TYR B 13 -1.367 -24.071 5.006 1.00 0.00 C ATOM 1369 C TYR B 13 -2.189 -24.544 6.216 1.00 0.00 C ATOM 1370 O TYR B 13 -2.931 -23.780 6.800 1.00 0.00 O ATOM 1371 CB TYR B 13 -0.432 -22.936 5.430 1.00 0.00 C ATOM 1372 CG TYR B 13 0.897 -23.515 5.924 1.00 0.00 C ATOM 1373 CD1 TYR B 13 1.711 -24.232 5.070 1.00 0.00 C ATOM 1374 CD2 TYR B 13 1.301 -23.324 7.230 1.00 0.00 C ATOM 1375 CE1 TYR B 13 2.909 -24.753 5.517 1.00 0.00 C ATOM 1376 CE2 TYR B 13 2.499 -23.844 7.676 1.00 0.00 C ATOM 1377 CZ TYR B 13 3.312 -24.562 6.823 1.00 0.00 C ATOM 1378 OH TYR B 13 4.509 -25.083 7.270 1.00 0.00 O ATOM 0 H TYR B 13 -2.633 -22.618 4.076 1.00 0.00 H new ATOM 0 HA TYR B 13 -0.790 -24.916 4.630 1.00 0.00 H new ATOM 0 HB2 TYR B 13 -0.256 -22.264 4.590 1.00 0.00 H new ATOM 0 HB3 TYR B 13 -0.897 -22.345 6.219 1.00 0.00 H new ATOM 0 HD1 TYR B 13 1.409 -24.387 4.045 1.00 0.00 H new ATOM 0 HD2 TYR B 13 0.675 -22.763 7.908 1.00 0.00 H new ATOM 0 HE1 TYR B 13 3.535 -25.314 4.839 1.00 0.00 H new ATOM 0 HE2 TYR B 13 2.803 -23.688 8.701 1.00 0.00 H new ATOM 0 HH TYR B 13 4.634 -24.852 8.214 1.00 0.00 H new ATOM 1388 N SER B 14 -2.034 -25.799 6.563 1.00 0.00 N ATOM 1389 CA SER B 14 -2.801 -26.345 7.729 1.00 0.00 C ATOM 1390 C SER B 14 -1.905 -26.429 8.973 1.00 0.00 C ATOM 1391 O SER B 14 -2.150 -27.222 9.861 1.00 0.00 O ATOM 1392 CB SER B 14 -3.311 -27.742 7.378 1.00 0.00 C ATOM 1393 OG SER B 14 -2.131 -28.483 7.101 1.00 0.00 O ATOM 0 H SER B 14 -1.417 -26.463 6.096 1.00 0.00 H new ATOM 0 HA SER B 14 -3.638 -25.681 7.946 1.00 0.00 H new ATOM 0 HB2 SER B 14 -3.872 -28.180 8.203 1.00 0.00 H new ATOM 0 HB3 SER B 14 -3.978 -27.718 6.516 1.00 0.00 H new ATOM 0 HG SER B 14 -2.371 -29.404 6.865 1.00 0.00 H new ATOM 1399 N LYS B 15 -0.888 -25.608 9.003 1.00 0.00 N ATOM 1400 CA LYS B 15 0.044 -25.608 10.176 1.00 0.00 C ATOM 1401 C LYS B 15 0.207 -24.155 10.706 1.00 0.00 C ATOM 1402 O LYS B 15 0.968 -23.394 10.149 1.00 0.00 O ATOM 1403 CB LYS B 15 1.408 -26.124 9.714 1.00 0.00 C ATOM 1404 CG LYS B 15 1.628 -27.539 10.262 1.00 0.00 C ATOM 1405 CD LYS B 15 0.531 -28.467 9.732 1.00 0.00 C ATOM 1406 CE LYS B 15 1.130 -29.852 9.473 1.00 0.00 C ATOM 1407 NZ LYS B 15 0.057 -30.831 9.144 1.00 0.00 N ATOM 0 H LYS B 15 -0.660 -24.938 8.269 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.354 -26.243 10.967 1.00 0.00 H new ATOM 0 HB2 LYS B 15 1.457 -26.132 8.625 1.00 0.00 H new ATOM 0 HB3 LYS B 15 2.198 -25.460 10.064 1.00 0.00 H new ATOM 0 HG2 LYS B 15 2.608 -27.909 9.962 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.613 -27.525 11.352 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -0.283 -28.538 10.454 1.00 0.00 H new ATOM 0 HD3 LYS B 15 0.108 -28.062 8.813 1.00 0.00 H new ATOM 0 HE2 LYS B 15 1.845 -29.798 8.652 1.00 0.00 H new ATOM 0 HE3 LYS B 15 1.679 -30.187 10.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 0.480 -31.765 8.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -0.610 -30.895 9.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -0.450 -30.517 8.291 1.00 0.00 H new ATOM 1421 N PRO B 16 -0.503 -23.792 11.780 1.00 0.00 N ATOM 1422 CA PRO B 16 -0.424 -22.420 12.314 1.00 0.00 C ATOM 1423 C PRO B 16 1.012 -22.037 12.692 1.00 0.00 C ATOM 1424 O PRO B 16 1.779 -22.860 13.150 1.00 0.00 O ATOM 1425 CB PRO B 16 -1.334 -22.410 13.547 1.00 0.00 C ATOM 1426 CG PRO B 16 -2.036 -23.798 13.617 1.00 0.00 C ATOM 1427 CD PRO B 16 -1.401 -24.689 12.535 1.00 0.00 C ATOM 0 HA PRO B 16 -0.737 -21.690 11.568 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -0.754 -22.227 14.451 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -2.071 -21.610 13.474 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -1.909 -24.243 14.604 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -3.108 -23.695 13.449 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -0.849 -25.517 12.980 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -2.161 -25.124 11.886 1.00 0.00 H new ATOM 1435 N PHE B 17 1.339 -20.781 12.488 1.00 0.00 N ATOM 1436 CA PHE B 17 2.712 -20.316 12.824 1.00 0.00 C ATOM 1437 C PHE B 17 2.670 -18.893 13.412 1.00 0.00 C ATOM 1438 O PHE B 17 1.636 -18.255 13.437 1.00 0.00 O ATOM 1439 CB PHE B 17 3.609 -20.364 11.570 1.00 0.00 C ATOM 1440 CG PHE B 17 2.934 -19.668 10.371 1.00 0.00 C ATOM 1441 CD1 PHE B 17 1.773 -20.179 9.803 1.00 0.00 C ATOM 1442 CD2 PHE B 17 3.484 -18.515 9.833 1.00 0.00 C ATOM 1443 CE1 PHE B 17 1.183 -19.542 8.731 1.00 0.00 C ATOM 1444 CE2 PHE B 17 2.885 -17.892 8.756 1.00 0.00 C ATOM 1445 CZ PHE B 17 1.743 -18.400 8.214 1.00 0.00 C ATOM 0 H PHE B 17 0.717 -20.068 12.107 1.00 0.00 H new ATOM 0 HA PHE B 17 3.134 -20.981 13.577 1.00 0.00 H new ATOM 0 HB2 PHE B 17 4.563 -19.881 11.784 1.00 0.00 H new ATOM 0 HB3 PHE B 17 3.827 -21.401 11.316 1.00 0.00 H new ATOM 0 HD1 PHE B 17 1.330 -21.079 10.203 1.00 0.00 H new ATOM 0 HD2 PHE B 17 4.386 -18.101 10.259 1.00 0.00 H new ATOM 0 HE1 PHE B 17 0.279 -19.943 8.297 1.00 0.00 H new ATOM 0 HE2 PHE B 17 3.324 -16.997 8.341 1.00 0.00 H new ATOM 0 HZ PHE B 17 1.277 -17.903 7.376 1.00 0.00 H new ATOM 1455 N HIS B 18 3.804 -18.435 13.868 1.00 0.00 N ATOM 1456 CA HIS B 18 3.873 -17.075 14.504 1.00 0.00 C ATOM 1457 C HIS B 18 4.323 -15.994 13.468 1.00 0.00 C ATOM 1458 O HIS B 18 5.148 -16.272 12.621 1.00 0.00 O ATOM 1459 CB HIS B 18 4.920 -17.172 15.620 1.00 0.00 C ATOM 1460 CG HIS B 18 4.821 -15.967 16.537 1.00 0.00 C ATOM 1461 ND1 HIS B 18 5.293 -14.770 16.251 1.00 0.00 N ATOM 1462 CD2 HIS B 18 4.245 -15.867 17.796 1.00 0.00 C ATOM 1463 CE1 HIS B 18 5.041 -13.983 17.241 1.00 0.00 C ATOM 1464 NE2 HIS B 18 4.421 -14.633 18.154 1.00 0.00 N ATOM 0 H HIS B 18 4.690 -18.939 13.831 1.00 0.00 H new ATOM 0 HA HIS B 18 2.894 -16.782 14.883 1.00 0.00 H new ATOM 0 HB2 HIS B 18 4.768 -18.087 16.192 1.00 0.00 H new ATOM 0 HB3 HIS B 18 5.919 -17.228 15.188 1.00 0.00 H new ATOM 0 HD2 HIS B 18 3.755 -16.649 18.357 1.00 0.00 H new ATOM 0 HE1 HIS B 18 5.311 -12.938 17.292 1.00 0.00 H new ATOM 0 HE2 HIS B 18 4.109 -14.235 19.040 1.00 0.00 H new ATOM 1472 N PRO B 19 3.767 -14.766 13.552 1.00 0.00 N ATOM 1473 CA PRO B 19 4.157 -13.685 12.625 1.00 0.00 C ATOM 1474 C PRO B 19 5.674 -13.407 12.690 1.00 0.00 C ATOM 1475 O PRO B 19 6.216 -12.718 11.851 1.00 0.00 O ATOM 1476 CB PRO B 19 3.379 -12.448 13.089 1.00 0.00 C ATOM 1477 CG PRO B 19 2.513 -12.871 14.309 1.00 0.00 C ATOM 1478 CD PRO B 19 2.712 -14.379 14.519 1.00 0.00 C ATOM 0 HA PRO B 19 3.933 -13.955 11.593 1.00 0.00 H new ATOM 0 HB2 PRO B 19 4.063 -11.646 13.364 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.749 -12.068 12.285 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.810 -12.318 15.200 1.00 0.00 H new ATOM 0 HG3 PRO B 19 1.462 -12.645 14.129 1.00 0.00 H new ATOM 0 HD2 PRO B 19 3.016 -14.598 15.543 1.00 0.00 H new ATOM 0 HD3 PRO B 19 1.788 -14.928 14.336 1.00 0.00 H new ATOM 1486 N LYS B 20 6.318 -13.941 13.692 1.00 0.00 N ATOM 1487 CA LYS B 20 7.794 -13.710 13.830 1.00 0.00 C ATOM 1488 C LYS B 20 8.528 -14.080 12.532 1.00 0.00 C ATOM 1489 O LYS B 20 9.497 -13.447 12.165 1.00 0.00 O ATOM 1490 CB LYS B 20 8.323 -14.581 14.971 1.00 0.00 C ATOM 1491 CG LYS B 20 9.341 -13.798 15.828 1.00 0.00 C ATOM 1492 CD LYS B 20 9.647 -14.585 17.120 1.00 0.00 C ATOM 1493 CE LYS B 20 10.693 -15.666 16.830 1.00 0.00 C ATOM 1494 NZ LYS B 20 11.979 -15.049 16.397 1.00 0.00 N ATOM 0 H LYS B 20 5.896 -14.522 14.417 1.00 0.00 H new ATOM 0 HA LYS B 20 7.969 -12.655 14.039 1.00 0.00 H new ATOM 0 HB2 LYS B 20 7.494 -14.914 15.596 1.00 0.00 H new ATOM 0 HB3 LYS B 20 8.794 -15.475 14.564 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.259 -13.637 15.263 1.00 0.00 H new ATOM 0 HG3 LYS B 20 8.942 -12.814 16.076 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.014 -13.908 17.892 1.00 0.00 H new ATOM 0 HD3 LYS B 20 8.735 -15.042 17.504 1.00 0.00 H new ATOM 0 HE2 LYS B 20 10.856 -16.271 17.722 1.00 0.00 H new ATOM 0 HE3 LYS B 20 10.325 -16.336 16.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 12.768 -15.675 16.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 11.968 -14.911 15.366 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 12.099 -14.130 16.868 1.00 0.00 H new ATOM 1508 N PHE B 21 8.051 -15.096 11.865 1.00 0.00 N ATOM 1509 CA PHE B 21 8.723 -15.525 10.598 1.00 0.00 C ATOM 1510 C PHE B 21 8.064 -14.864 9.382 1.00 0.00 C ATOM 1511 O PHE B 21 8.263 -15.292 8.265 1.00 0.00 O ATOM 1512 CB PHE B 21 8.604 -17.042 10.469 1.00 0.00 C ATOM 1513 CG PHE B 21 9.095 -17.698 11.760 1.00 0.00 C ATOM 1514 CD1 PHE B 21 10.448 -17.768 12.042 1.00 0.00 C ATOM 1515 CD2 PHE B 21 8.192 -18.230 12.664 1.00 0.00 C ATOM 1516 CE1 PHE B 21 10.889 -18.360 13.208 1.00 0.00 C ATOM 1517 CE2 PHE B 21 8.636 -18.821 13.829 1.00 0.00 C ATOM 1518 CZ PHE B 21 9.983 -18.886 14.100 1.00 0.00 C ATOM 0 H PHE B 21 7.235 -15.644 12.136 1.00 0.00 H new ATOM 0 HA PHE B 21 9.770 -15.223 10.632 1.00 0.00 H new ATOM 0 HB2 PHE B 21 7.568 -17.322 10.276 1.00 0.00 H new ATOM 0 HB3 PHE B 21 9.193 -17.394 9.622 1.00 0.00 H new ATOM 0 HD1 PHE B 21 11.163 -17.357 11.345 1.00 0.00 H new ATOM 0 HD2 PHE B 21 7.133 -18.182 12.456 1.00 0.00 H new ATOM 0 HE1 PHE B 21 11.947 -18.410 13.421 1.00 0.00 H new ATOM 0 HE2 PHE B 21 7.925 -19.233 14.529 1.00 0.00 H new ATOM 0 HZ PHE B 21 10.329 -19.349 15.012 1.00 0.00 H new ATOM 1528 N ILE B 22 7.307 -13.828 9.630 1.00 0.00 N ATOM 1529 CA ILE B 22 6.607 -13.127 8.511 1.00 0.00 C ATOM 1530 C ILE B 22 7.190 -11.727 8.333 1.00 0.00 C ATOM 1531 O ILE B 22 7.381 -11.008 9.295 1.00 0.00 O ATOM 1532 CB ILE B 22 5.101 -13.029 8.839 1.00 0.00 C ATOM 1533 CG1 ILE B 22 4.414 -14.396 8.584 1.00 0.00 C ATOM 1534 CG2 ILE B 22 4.460 -11.962 7.935 1.00 0.00 C ATOM 1535 CD1 ILE B 22 4.827 -15.415 9.662 1.00 0.00 C ATOM 0 H ILE B 22 7.143 -13.436 10.557 1.00 0.00 H new ATOM 0 HA ILE B 22 6.744 -13.687 7.586 1.00 0.00 H new ATOM 0 HB ILE B 22 4.975 -12.756 9.887 1.00 0.00 H new ATOM 0 HG12 ILE B 22 3.331 -14.272 8.588 1.00 0.00 H new ATOM 0 HG13 ILE B 22 4.689 -14.770 7.597 1.00 0.00 H new ATOM 0 HG21 ILE B 22 3.396 -11.886 8.160 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.938 -10.999 8.113 1.00 0.00 H new ATOM 0 HG23 ILE B 22 4.591 -12.244 6.890 1.00 0.00 H new ATOM 0 HD11 ILE B 22 4.336 -16.369 9.468 1.00 0.00 H new ATOM 0 HD12 ILE B 22 5.908 -15.552 9.638 1.00 0.00 H new ATOM 0 HD13 ILE B 22 4.530 -15.047 10.644 1.00 0.00 H new ATOM 1547 N LYS B 23 7.460 -11.373 7.100 1.00 0.00 N ATOM 1548 CA LYS B 23 8.035 -10.030 6.825 1.00 0.00 C ATOM 1549 C LYS B 23 7.236 -9.316 5.731 1.00 0.00 C ATOM 1550 O LYS B 23 7.360 -8.120 5.559 1.00 0.00 O ATOM 1551 CB LYS B 23 9.489 -10.191 6.375 1.00 0.00 C ATOM 1552 CG LYS B 23 10.366 -10.537 7.591 1.00 0.00 C ATOM 1553 CD LYS B 23 10.458 -9.329 8.539 1.00 0.00 C ATOM 1554 CE LYS B 23 11.919 -9.119 8.939 1.00 0.00 C ATOM 1555 NZ LYS B 23 12.029 -8.040 9.960 1.00 0.00 N ATOM 0 H LYS B 23 7.306 -11.957 6.278 1.00 0.00 H new ATOM 0 HA LYS B 23 7.989 -9.431 7.734 1.00 0.00 H new ATOM 0 HB2 LYS B 23 9.564 -10.977 5.624 1.00 0.00 H new ATOM 0 HB3 LYS B 23 9.841 -9.271 5.909 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.946 -11.393 8.120 1.00 0.00 H new ATOM 0 HG3 LYS B 23 11.363 -10.825 7.259 1.00 0.00 H new ATOM 0 HD2 LYS B 23 10.070 -8.436 8.049 1.00 0.00 H new ATOM 0 HD3 LYS B 23 9.846 -9.498 9.425 1.00 0.00 H new ATOM 0 HE2 LYS B 23 12.331 -10.047 9.336 1.00 0.00 H new ATOM 0 HE3 LYS B 23 12.509 -8.858 8.060 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 13.004 -8.001 10.320 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 11.783 -7.127 9.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 11.377 -8.238 10.746 1.00 0.00 H new ATOM 1569 N GLU B 24 6.433 -10.062 5.010 1.00 0.00 N ATOM 1570 CA GLU B 24 5.621 -9.417 3.925 1.00 0.00 C ATOM 1571 C GLU B 24 4.217 -10.038 3.872 1.00 0.00 C ATOM 1572 O GLU B 24 4.074 -11.240 3.776 1.00 0.00 O ATOM 1573 CB GLU B 24 6.343 -9.619 2.584 1.00 0.00 C ATOM 1574 CG GLU B 24 5.355 -9.463 1.416 1.00 0.00 C ATOM 1575 CD GLU B 24 4.492 -8.217 1.624 1.00 0.00 C ATOM 1576 OE1 GLU B 24 5.037 -7.255 2.134 1.00 0.00 O ATOM 1577 OE2 GLU B 24 3.336 -8.296 1.251 1.00 0.00 O ATOM 0 H GLU B 24 6.305 -11.068 5.120 1.00 0.00 H new ATOM 0 HA GLU B 24 5.514 -8.352 4.129 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.150 -8.894 2.485 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.798 -10.609 2.554 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.900 -9.385 0.475 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.721 -10.347 1.344 1.00 0.00 H new ATOM 1584 N LEU B 25 3.211 -9.196 3.935 1.00 0.00 N ATOM 1585 CA LEU B 25 1.804 -9.708 3.898 1.00 0.00 C ATOM 1586 C LEU B 25 1.126 -9.328 2.581 1.00 0.00 C ATOM 1587 O LEU B 25 1.177 -8.189 2.164 1.00 0.00 O ATOM 1588 CB LEU B 25 1.018 -9.095 5.050 1.00 0.00 C ATOM 1589 CG LEU B 25 -0.227 -9.940 5.310 1.00 0.00 C ATOM 1590 CD1 LEU B 25 0.101 -11.002 6.357 1.00 0.00 C ATOM 1591 CD2 LEU B 25 -1.347 -9.041 5.837 1.00 0.00 C ATOM 0 H LEU B 25 3.303 -8.183 4.010 1.00 0.00 H new ATOM 0 HA LEU B 25 1.826 -10.794 3.986 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.637 -9.051 5.946 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.734 -8.071 4.809 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.548 -10.419 4.385 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.783 -11.610 6.548 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.906 -11.638 5.990 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.415 -10.517 7.281 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.238 -9.641 6.024 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.027 -8.568 6.765 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.575 -8.273 5.098 1.00 0.00 H new ATOM 1603 N ARG B 26 0.491 -10.293 1.965 1.00 0.00 N ATOM 1604 CA ARG B 26 -0.205 -10.018 0.671 1.00 0.00 C ATOM 1605 C ARG B 26 -1.668 -10.474 0.744 1.00 0.00 C ATOM 1606 O ARG B 26 -1.984 -11.450 1.396 1.00 0.00 O ATOM 1607 CB ARG B 26 0.506 -10.766 -0.441 1.00 0.00 C ATOM 1608 CG ARG B 26 1.946 -10.259 -0.551 1.00 0.00 C ATOM 1609 CD ARG B 26 2.535 -10.711 -1.888 1.00 0.00 C ATOM 1610 NE ARG B 26 2.089 -12.106 -2.167 1.00 0.00 N ATOM 1611 CZ ARG B 26 2.846 -12.888 -2.886 1.00 0.00 C ATOM 1612 NH1 ARG B 26 2.865 -12.730 -4.181 1.00 0.00 N ATOM 1613 NH2 ARG B 26 3.557 -13.803 -2.286 1.00 0.00 N ATOM 0 H ARG B 26 0.424 -11.254 2.300 1.00 0.00 H new ATOM 0 HA ARG B 26 -0.184 -8.946 0.473 1.00 0.00 H new ATOM 0 HB2 ARG B 26 0.500 -11.837 -0.237 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -0.017 -10.619 -1.386 1.00 0.00 H new ATOM 0 HG2 ARG B 26 1.968 -9.172 -0.479 1.00 0.00 H new ATOM 0 HG3 ARG B 26 2.545 -10.646 0.274 1.00 0.00 H new ATOM 0 HD2 ARG B 26 2.210 -10.045 -2.687 1.00 0.00 H new ATOM 0 HD3 ARG B 26 3.623 -10.663 -1.856 1.00 0.00 H new ATOM 0 HE ARG B 26 1.200 -12.446 -1.799 1.00 0.00 H new ATOM 0 HH11 ARG B 26 2.294 -12.004 -4.615 1.00 0.00 H new ATOM 0 HH12 ARG B 26 3.451 -13.332 -4.760 1.00 0.00 H new ATOM 0 HH21 ARG B 26 3.515 -13.898 -1.271 1.00 0.00 H new ATOM 0 HH22 ARG B 26 4.155 -14.424 -2.832 1.00 0.00 H new ATOM 1627 N VAL B 27 -2.529 -9.755 0.072 1.00 0.00 N ATOM 1628 CA VAL B 27 -3.976 -10.131 0.092 1.00 0.00 C ATOM 1629 C VAL B 27 -4.614 -9.869 -1.277 1.00 0.00 C ATOM 1630 O VAL B 27 -4.709 -8.738 -1.711 1.00 0.00 O ATOM 1631 CB VAL B 27 -4.693 -9.295 1.152 1.00 0.00 C ATOM 1632 CG1 VAL B 27 -6.113 -9.834 1.343 1.00 0.00 C ATOM 1633 CG2 VAL B 27 -3.934 -9.400 2.475 1.00 0.00 C ATOM 0 H VAL B 27 -2.298 -8.932 -0.485 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.066 -11.192 0.325 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.734 -8.254 0.833 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.629 -9.241 2.098 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -6.656 -9.772 0.400 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.067 -10.874 1.667 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.442 -8.805 3.234 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -3.900 -10.442 2.793 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -2.918 -9.028 2.342 1.00 0.00 H new ATOM 1643 N ILE B 28 -5.040 -10.925 -1.923 1.00 0.00 N ATOM 1644 CA ILE B 28 -5.680 -10.766 -3.267 1.00 0.00 C ATOM 1645 C ILE B 28 -7.195 -10.965 -3.155 1.00 0.00 C ATOM 1646 O ILE B 28 -7.658 -11.996 -2.708 1.00 0.00 O ATOM 1647 CB ILE B 28 -5.096 -11.811 -4.224 1.00 0.00 C ATOM 1648 CG1 ILE B 28 -3.600 -11.524 -4.427 1.00 0.00 C ATOM 1649 CG2 ILE B 28 -5.814 -11.719 -5.571 1.00 0.00 C ATOM 1650 CD1 ILE B 28 -2.932 -12.695 -5.165 1.00 0.00 C ATOM 0 H ILE B 28 -4.974 -11.884 -1.582 1.00 0.00 H new ATOM 0 HA ILE B 28 -5.483 -9.763 -3.646 1.00 0.00 H new ATOM 0 HB ILE B 28 -5.228 -12.809 -3.806 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -3.473 -10.604 -4.998 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -3.117 -11.370 -3.462 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.401 -12.461 -6.255 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -6.878 -11.908 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.675 -10.722 -5.990 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -1.872 -12.481 -5.303 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -3.044 -13.607 -4.578 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -3.405 -12.829 -6.138 1.00 0.00 H new ATOM 1662 N GLU B 29 -7.932 -9.972 -3.567 1.00 0.00 N ATOM 1663 CA GLU B 29 -9.419 -10.076 -3.493 1.00 0.00 C ATOM 1664 C GLU B 29 -9.962 -10.783 -4.745 1.00 0.00 C ATOM 1665 O GLU B 29 -9.322 -10.788 -5.777 1.00 0.00 O ATOM 1666 CB GLU B 29 -10.003 -8.661 -3.398 1.00 0.00 C ATOM 1667 CG GLU B 29 -11.521 -8.736 -3.185 1.00 0.00 C ATOM 1668 CD GLU B 29 -12.239 -8.248 -4.447 1.00 0.00 C ATOM 1669 OE1 GLU B 29 -11.749 -8.582 -5.512 1.00 0.00 O ATOM 1670 OE2 GLU B 29 -13.237 -7.570 -4.272 1.00 0.00 O ATOM 0 H GLU B 29 -7.574 -9.097 -3.950 1.00 0.00 H new ATOM 0 HA GLU B 29 -9.705 -10.657 -2.617 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -9.538 -8.121 -2.574 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -9.782 -8.105 -4.309 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.817 -9.760 -2.959 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -11.810 -8.124 -2.330 1.00 0.00 H new ATOM 1677 N SER B 30 -11.128 -11.376 -4.614 1.00 0.00 N ATOM 1678 CA SER B 30 -11.749 -12.090 -5.781 1.00 0.00 C ATOM 1679 C SER B 30 -11.469 -11.341 -7.089 1.00 0.00 C ATOM 1680 O SER B 30 -11.833 -10.192 -7.238 1.00 0.00 O ATOM 1681 CB SER B 30 -13.258 -12.175 -5.563 1.00 0.00 C ATOM 1682 OG SER B 30 -13.619 -10.874 -5.122 1.00 0.00 O ATOM 0 H SER B 30 -11.675 -11.397 -3.753 1.00 0.00 H new ATOM 0 HA SER B 30 -11.318 -13.088 -5.854 1.00 0.00 H new ATOM 0 HB2 SER B 30 -13.779 -12.443 -6.482 1.00 0.00 H new ATOM 0 HB3 SER B 30 -13.511 -12.932 -4.821 1.00 0.00 H new ATOM 0 HG SER B 30 -13.285 -10.208 -5.759 1.00 0.00 H new ATOM 1688 N GLY B 31 -10.828 -12.021 -8.006 1.00 0.00 N ATOM 1689 CA GLY B 31 -10.498 -11.385 -9.317 1.00 0.00 C ATOM 1690 C GLY B 31 -11.136 -12.182 -10.467 1.00 0.00 C ATOM 1691 O GLY B 31 -11.957 -13.049 -10.246 1.00 0.00 O ATOM 0 H GLY B 31 -10.519 -12.988 -7.903 1.00 0.00 H new ATOM 0 HA2 GLY B 31 -10.860 -10.357 -9.332 1.00 0.00 H new ATOM 0 HA3 GLY B 31 -9.417 -11.345 -9.448 1.00 0.00 H new ATOM 1695 N PRO B 32 -10.736 -11.860 -11.680 1.00 0.00 N ATOM 1696 CA PRO B 32 -11.261 -12.536 -12.873 1.00 0.00 C ATOM 1697 C PRO B 32 -10.757 -13.979 -12.912 1.00 0.00 C ATOM 1698 O PRO B 32 -11.088 -14.742 -13.798 1.00 0.00 O ATOM 1699 CB PRO B 32 -10.706 -11.740 -14.060 1.00 0.00 C ATOM 1700 CG PRO B 32 -9.768 -10.635 -13.478 1.00 0.00 C ATOM 1701 CD PRO B 32 -9.743 -10.813 -11.948 1.00 0.00 C ATOM 0 HA PRO B 32 -12.350 -12.573 -12.886 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -10.156 -12.393 -14.738 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -11.516 -11.293 -14.636 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -8.764 -10.727 -13.892 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -10.133 -9.643 -13.743 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -8.753 -11.107 -11.599 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -9.998 -9.885 -11.437 1.00 0.00 H new ATOM 1709 N HIS B 33 -9.960 -14.307 -11.935 1.00 0.00 N ATOM 1710 CA HIS B 33 -9.391 -15.680 -11.849 1.00 0.00 C ATOM 1711 C HIS B 33 -9.836 -16.332 -10.538 1.00 0.00 C ATOM 1712 O HIS B 33 -9.767 -17.534 -10.380 1.00 0.00 O ATOM 1713 CB HIS B 33 -7.874 -15.565 -11.864 1.00 0.00 C ATOM 1714 CG HIS B 33 -7.415 -15.030 -10.508 1.00 0.00 C ATOM 1715 ND1 HIS B 33 -7.819 -13.923 -9.976 1.00 0.00 N ATOM 1716 CD2 HIS B 33 -6.536 -15.586 -9.577 1.00 0.00 C ATOM 1717 CE1 HIS B 33 -7.287 -13.747 -8.826 1.00 0.00 C ATOM 1718 NE2 HIS B 33 -6.499 -14.748 -8.555 1.00 0.00 N ATOM 0 H HIS B 33 -9.676 -13.677 -11.185 1.00 0.00 H new ATOM 0 HA HIS B 33 -9.735 -16.287 -12.687 1.00 0.00 H new ATOM 0 HB2 HIS B 33 -7.422 -16.537 -12.060 1.00 0.00 H new ATOM 0 HB3 HIS B 33 -7.553 -14.897 -12.663 1.00 0.00 H new ATOM 0 HD2 HIS B 33 -5.994 -16.515 -9.672 1.00 0.00 H new ATOM 0 HE1 HIS B 33 -7.464 -12.900 -8.180 1.00 0.00 H new ATOM 0 HE2 HIS B 33 -5.950 -14.865 -7.704 1.00 0.00 H new ATOM 1726 N CYS B 34 -10.284 -15.510 -9.625 1.00 0.00 N ATOM 1727 CA CYS B 34 -10.741 -16.042 -8.309 1.00 0.00 C ATOM 1728 C CYS B 34 -12.018 -15.318 -7.868 1.00 0.00 C ATOM 1729 O CYS B 34 -12.098 -14.106 -7.927 1.00 0.00 O ATOM 1730 CB CYS B 34 -9.641 -15.811 -7.272 1.00 0.00 C ATOM 1731 SG CYS B 34 -9.514 -16.992 -5.900 1.00 0.00 S ATOM 0 H CYS B 34 -10.353 -14.498 -9.734 1.00 0.00 H new ATOM 0 HA CYS B 34 -10.950 -17.108 -8.400 1.00 0.00 H new ATOM 0 HB2 CYS B 34 -8.684 -15.800 -7.795 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -9.784 -14.817 -6.847 1.00 0.00 H new ATOM 1736 N ALA B 35 -12.987 -16.079 -7.435 1.00 0.00 N ATOM 1737 CA ALA B 35 -14.268 -15.459 -6.989 1.00 0.00 C ATOM 1738 C ALA B 35 -14.309 -15.363 -5.460 1.00 0.00 C ATOM 1739 O ALA B 35 -15.369 -15.344 -4.867 1.00 0.00 O ATOM 1740 CB ALA B 35 -15.433 -16.319 -7.476 1.00 0.00 C ATOM 0 H ALA B 35 -12.948 -17.096 -7.371 1.00 0.00 H new ATOM 0 HA ALA B 35 -14.344 -14.455 -7.406 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -16.374 -15.873 -7.154 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -15.412 -16.377 -8.564 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -15.345 -17.322 -7.057 1.00 0.00 H new ATOM 1746 N ASN B 36 -13.153 -15.303 -4.855 1.00 0.00 N ATOM 1747 CA ASN B 36 -13.114 -15.212 -3.364 1.00 0.00 C ATOM 1748 C ASN B 36 -11.901 -14.396 -2.903 1.00 0.00 C ATOM 1749 O ASN B 36 -11.309 -13.671 -3.664 1.00 0.00 O ATOM 1750 CB ASN B 36 -13.027 -16.621 -2.782 1.00 0.00 C ATOM 1751 CG ASN B 36 -14.235 -17.438 -3.246 1.00 0.00 C ATOM 1752 OD1 ASN B 36 -14.168 -18.172 -4.212 1.00 0.00 O ATOM 1753 ND2 ASN B 36 -15.356 -17.342 -2.585 1.00 0.00 N ATOM 0 H ASN B 36 -12.245 -15.313 -5.319 1.00 0.00 H new ATOM 0 HA ASN B 36 -14.020 -14.715 -3.016 1.00 0.00 H new ATOM 0 HB2 ASN B 36 -12.103 -17.103 -3.103 1.00 0.00 H new ATOM 0 HB3 ASN B 36 -13.001 -16.576 -1.693 1.00 0.00 H new ATOM 0 HD21 ASN B 36 -16.170 -17.881 -2.880 1.00 0.00 H new ATOM 0 HD22 ASN B 36 -15.418 -16.728 -1.773 1.00 0.00 H new ATOM 1760 N THR B 37 -11.572 -14.538 -1.655 1.00 0.00 N ATOM 1761 CA THR B 37 -10.401 -13.791 -1.097 1.00 0.00 C ATOM 1762 C THR B 37 -9.303 -14.771 -0.672 1.00 0.00 C ATOM 1763 O THR B 37 -9.584 -15.870 -0.234 1.00 0.00 O ATOM 1764 CB THR B 37 -10.866 -12.978 0.109 1.00 0.00 C ATOM 1765 OG1 THR B 37 -11.017 -11.651 -0.387 1.00 0.00 O ATOM 1766 CG2 THR B 37 -9.789 -12.882 1.191 1.00 0.00 C ATOM 0 H THR B 37 -12.060 -15.138 -0.990 1.00 0.00 H new ATOM 0 HA THR B 37 -9.995 -13.126 -1.859 1.00 0.00 H new ATOM 0 HB THR B 37 -11.759 -13.435 0.535 1.00 0.00 H new ATOM 0 HG1 THR B 37 -11.889 -11.297 -0.114 1.00 0.00 H new ATOM 0 HG21 THR B 37 -10.166 -12.295 2.028 1.00 0.00 H new ATOM 0 HG22 THR B 37 -9.531 -13.883 1.537 1.00 0.00 H new ATOM 0 HG23 THR B 37 -8.902 -12.400 0.780 1.00 0.00 H new ATOM 1774 N GLU B 38 -8.074 -14.350 -0.815 1.00 0.00 N ATOM 1775 CA GLU B 38 -6.939 -15.240 -0.426 1.00 0.00 C ATOM 1776 C GLU B 38 -5.846 -14.423 0.271 1.00 0.00 C ATOM 1777 O GLU B 38 -5.244 -13.552 -0.324 1.00 0.00 O ATOM 1778 CB GLU B 38 -6.364 -15.895 -1.681 1.00 0.00 C ATOM 1779 CG GLU B 38 -7.514 -16.338 -2.587 1.00 0.00 C ATOM 1780 CD GLU B 38 -6.971 -17.262 -3.679 1.00 0.00 C ATOM 1781 OE1 GLU B 38 -6.326 -16.729 -4.567 1.00 0.00 O ATOM 1782 OE2 GLU B 38 -7.232 -18.448 -3.564 1.00 0.00 O ATOM 0 H GLU B 38 -7.807 -13.436 -1.181 1.00 0.00 H new ATOM 0 HA GLU B 38 -7.300 -16.006 0.260 1.00 0.00 H new ATOM 0 HB2 GLU B 38 -5.718 -15.193 -2.209 1.00 0.00 H new ATOM 0 HB3 GLU B 38 -5.748 -16.752 -1.409 1.00 0.00 H new ATOM 0 HG2 GLU B 38 -8.274 -16.855 -2.002 1.00 0.00 H new ATOM 0 HG3 GLU B 38 -7.994 -15.468 -3.036 1.00 0.00 H new ATOM 1789 N ILE B 39 -5.613 -14.724 1.520 1.00 0.00 N ATOM 1790 CA ILE B 39 -4.565 -13.972 2.270 1.00 0.00 C ATOM 1791 C ILE B 39 -3.199 -14.641 2.091 1.00 0.00 C ATOM 1792 O ILE B 39 -2.872 -15.585 2.782 1.00 0.00 O ATOM 1793 CB ILE B 39 -4.927 -13.950 3.754 1.00 0.00 C ATOM 1794 CG1 ILE B 39 -6.184 -13.094 3.952 1.00 0.00 C ATOM 1795 CG2 ILE B 39 -3.767 -13.343 4.546 1.00 0.00 C ATOM 1796 CD1 ILE B 39 -6.934 -13.574 5.198 1.00 0.00 C ATOM 0 H ILE B 39 -6.097 -15.450 2.049 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.513 -12.954 1.883 1.00 0.00 H new ATOM 0 HB ILE B 39 -5.116 -14.965 4.104 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -5.910 -12.045 4.061 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -6.828 -13.166 3.076 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -4.020 -13.325 5.606 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -2.871 -13.945 4.397 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -3.583 -12.326 4.200 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.828 -12.967 5.341 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -7.221 -14.618 5.071 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.288 -13.479 6.071 1.00 0.00 H new ATOM 1808 N ILE B 40 -2.432 -14.138 1.164 1.00 0.00 N ATOM 1809 CA ILE B 40 -1.083 -14.729 0.932 1.00 0.00 C ATOM 1810 C ILE B 40 -0.046 -14.023 1.811 1.00 0.00 C ATOM 1811 O ILE B 40 -0.208 -12.871 2.158 1.00 0.00 O ATOM 1812 CB ILE B 40 -0.705 -14.558 -0.539 1.00 0.00 C ATOM 1813 CG1 ILE B 40 -1.519 -15.540 -1.385 1.00 0.00 C ATOM 1814 CG2 ILE B 40 0.785 -14.853 -0.716 1.00 0.00 C ATOM 1815 CD1 ILE B 40 -1.810 -14.905 -2.745 1.00 0.00 C ATOM 0 H ILE B 40 -2.677 -13.352 0.562 1.00 0.00 H new ATOM 0 HA ILE B 40 -1.104 -15.789 1.187 1.00 0.00 H new ATOM 0 HB ILE B 40 -0.916 -13.537 -0.856 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -0.968 -16.471 -1.515 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.452 -15.789 -0.879 1.00 0.00 H new ATOM 0 HG21 ILE B 40 1.058 -14.732 -1.764 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.368 -14.162 -0.107 1.00 0.00 H new ATOM 0 HG23 ILE B 40 0.993 -15.876 -0.403 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.390 -15.599 -3.354 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -2.377 -13.985 -2.603 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -0.871 -14.678 -3.249 1.00 0.00 H new ATOM 1827 N VAL B 41 0.995 -14.732 2.154 1.00 0.00 N ATOM 1828 CA VAL B 41 2.050 -14.117 3.009 1.00 0.00 C ATOM 1829 C VAL B 41 3.432 -14.618 2.584 1.00 0.00 C ATOM 1830 O VAL B 41 3.554 -15.677 2.000 1.00 0.00 O ATOM 1831 CB VAL B 41 1.795 -14.495 4.469 1.00 0.00 C ATOM 1832 CG1 VAL B 41 1.915 -16.014 4.628 1.00 0.00 C ATOM 1833 CG2 VAL B 41 2.839 -13.813 5.356 1.00 0.00 C ATOM 0 H VAL B 41 1.160 -15.701 1.882 1.00 0.00 H new ATOM 0 HA VAL B 41 2.018 -13.033 2.896 1.00 0.00 H new ATOM 0 HB VAL B 41 0.795 -14.173 4.761 1.00 0.00 H new ATOM 0 HG11 VAL B 41 1.734 -16.286 5.668 1.00 0.00 H new ATOM 0 HG12 VAL B 41 1.180 -16.506 3.991 1.00 0.00 H new ATOM 0 HG13 VAL B 41 2.917 -16.332 4.339 1.00 0.00 H new ATOM 0 HG21 VAL B 41 2.661 -14.080 6.398 1.00 0.00 H new ATOM 0 HG22 VAL B 41 3.836 -14.141 5.063 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.764 -12.732 5.240 1.00 0.00 H new ATOM 1843 N LYS B 42 4.441 -13.840 2.889 1.00 0.00 N ATOM 1844 CA LYS B 42 5.832 -14.246 2.521 1.00 0.00 C ATOM 1845 C LYS B 42 6.709 -14.302 3.772 1.00 0.00 C ATOM 1846 O LYS B 42 6.828 -13.327 4.504 1.00 0.00 O ATOM 1847 CB LYS B 42 6.413 -13.232 1.540 1.00 0.00 C ATOM 1848 CG LYS B 42 6.741 -13.937 0.223 1.00 0.00 C ATOM 1849 CD LYS B 42 7.245 -12.905 -0.787 1.00 0.00 C ATOM 1850 CE LYS B 42 8.196 -13.588 -1.772 1.00 0.00 C ATOM 1851 NZ LYS B 42 9.590 -13.573 -1.245 1.00 0.00 N ATOM 0 H LYS B 42 4.362 -12.946 3.374 1.00 0.00 H new ATOM 0 HA LYS B 42 5.806 -15.233 2.059 1.00 0.00 H new ATOM 0 HB2 LYS B 42 5.700 -12.426 1.367 1.00 0.00 H new ATOM 0 HB3 LYS B 42 7.312 -12.778 1.957 1.00 0.00 H new ATOM 0 HG2 LYS B 42 7.498 -14.704 0.386 1.00 0.00 H new ATOM 0 HG3 LYS B 42 5.855 -14.440 -0.164 1.00 0.00 H new ATOM 0 HD2 LYS B 42 6.405 -12.462 -1.322 1.00 0.00 H new ATOM 0 HD3 LYS B 42 7.758 -12.094 -0.271 1.00 0.00 H new ATOM 0 HE2 LYS B 42 7.876 -14.616 -1.942 1.00 0.00 H new ATOM 0 HE3 LYS B 42 8.159 -13.079 -2.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 10.223 -14.040 -1.925 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 9.898 -12.589 -1.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 9.623 -14.079 -0.337 1.00 0.00 H new ATOM 1865 N LEU B 43 7.305 -15.444 3.992 1.00 0.00 N ATOM 1866 CA LEU B 43 8.179 -15.598 5.186 1.00 0.00 C ATOM 1867 C LEU B 43 9.588 -15.082 4.878 1.00 0.00 C ATOM 1868 O LEU B 43 10.087 -15.251 3.782 1.00 0.00 O ATOM 1869 CB LEU B 43 8.243 -17.076 5.572 1.00 0.00 C ATOM 1870 CG LEU B 43 6.959 -17.458 6.312 1.00 0.00 C ATOM 1871 CD1 LEU B 43 5.756 -17.183 5.407 1.00 0.00 C ATOM 1872 CD2 LEU B 43 7.000 -18.948 6.655 1.00 0.00 C ATOM 0 H LEU B 43 7.224 -16.270 3.400 1.00 0.00 H new ATOM 0 HA LEU B 43 7.767 -15.019 6.013 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.361 -17.692 4.681 1.00 0.00 H new ATOM 0 HB3 LEU B 43 9.111 -17.262 6.205 1.00 0.00 H new ATOM 0 HG LEU B 43 6.873 -16.872 7.227 1.00 0.00 H new ATOM 0 HD11 LEU B 43 4.838 -17.453 5.929 1.00 0.00 H new ATOM 0 HD12 LEU B 43 5.729 -16.124 5.150 1.00 0.00 H new ATOM 0 HD13 LEU B 43 5.843 -17.775 4.496 1.00 0.00 H new ATOM 0 HD21 LEU B 43 6.087 -19.225 7.182 1.00 0.00 H new ATOM 0 HD22 LEU B 43 7.080 -19.531 5.737 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.862 -19.152 7.290 1.00 0.00 H new ATOM 1884 N SER B 44 10.196 -14.468 5.859 1.00 0.00 N ATOM 1885 CA SER B 44 11.572 -13.915 5.654 1.00 0.00 C ATOM 1886 C SER B 44 12.503 -14.968 5.042 1.00 0.00 C ATOM 1887 O SER B 44 13.425 -14.637 4.323 1.00 0.00 O ATOM 1888 CB SER B 44 12.134 -13.471 7.004 1.00 0.00 C ATOM 1889 OG SER B 44 12.824 -14.615 7.486 1.00 0.00 O ATOM 0 H SER B 44 9.804 -14.325 6.790 1.00 0.00 H new ATOM 0 HA SER B 44 11.510 -13.070 4.968 1.00 0.00 H new ATOM 0 HB2 SER B 44 12.804 -12.618 6.896 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.340 -13.168 7.686 1.00 0.00 H new ATOM 0 HG SER B 44 13.222 -14.414 8.359 1.00 0.00 H new ATOM 1895 N ASP B 45 12.245 -16.210 5.336 1.00 0.00 N ATOM 1896 CA ASP B 45 13.120 -17.284 4.779 1.00 0.00 C ATOM 1897 C ASP B 45 13.097 -17.240 3.248 1.00 0.00 C ATOM 1898 O ASP B 45 13.822 -17.962 2.591 1.00 0.00 O ATOM 1899 CB ASP B 45 12.612 -18.643 5.260 1.00 0.00 C ATOM 1900 CG ASP B 45 11.102 -18.724 5.039 1.00 0.00 C ATOM 1901 OD1 ASP B 45 10.631 -17.943 4.229 1.00 0.00 O ATOM 1902 OD2 ASP B 45 10.503 -19.564 5.691 1.00 0.00 O ATOM 0 H ASP B 45 11.478 -16.528 5.929 1.00 0.00 H new ATOM 0 HA ASP B 45 14.143 -17.129 5.121 1.00 0.00 H new ATOM 0 HB2 ASP B 45 13.114 -19.444 4.718 1.00 0.00 H new ATOM 0 HB3 ASP B 45 12.844 -18.778 6.316 1.00 0.00 H new ATOM 1907 N GLY B 46 12.264 -16.391 2.714 1.00 0.00 N ATOM 1908 CA GLY B 46 12.178 -16.281 1.231 1.00 0.00 C ATOM 1909 C GLY B 46 11.139 -17.261 0.687 1.00 0.00 C ATOM 1910 O GLY B 46 11.212 -17.672 -0.455 1.00 0.00 O ATOM 0 H GLY B 46 11.643 -15.773 3.236 1.00 0.00 H new ATOM 0 HA2 GLY B 46 11.910 -15.263 0.950 1.00 0.00 H new ATOM 0 HA3 GLY B 46 13.152 -16.489 0.787 1.00 0.00 H new ATOM 1914 N ARG B 47 10.190 -17.612 1.520 1.00 0.00 N ATOM 1915 CA ARG B 47 9.132 -18.578 1.078 1.00 0.00 C ATOM 1916 C ARG B 47 7.782 -17.867 0.946 1.00 0.00 C ATOM 1917 O ARG B 47 7.596 -16.781 1.456 1.00 0.00 O ATOM 1918 CB ARG B 47 9.005 -19.706 2.113 1.00 0.00 C ATOM 1919 CG ARG B 47 10.391 -20.307 2.429 1.00 0.00 C ATOM 1920 CD ARG B 47 10.828 -21.238 1.292 1.00 0.00 C ATOM 1921 NE ARG B 47 9.787 -22.285 1.091 1.00 0.00 N ATOM 1922 CZ ARG B 47 9.877 -23.091 0.068 1.00 0.00 C ATOM 1923 NH1 ARG B 47 10.941 -23.040 -0.686 1.00 0.00 N ATOM 1924 NH2 ARG B 47 8.898 -23.922 -0.166 1.00 0.00 N ATOM 0 H ARG B 47 10.101 -17.276 2.479 1.00 0.00 H new ATOM 0 HA ARG B 47 9.416 -18.989 0.109 1.00 0.00 H new ATOM 0 HB2 ARG B 47 8.552 -19.320 3.026 1.00 0.00 H new ATOM 0 HB3 ARG B 47 8.343 -20.484 1.733 1.00 0.00 H new ATOM 0 HG2 ARG B 47 11.122 -19.509 2.558 1.00 0.00 H new ATOM 0 HG3 ARG B 47 10.352 -20.859 3.368 1.00 0.00 H new ATOM 0 HD2 ARG B 47 10.971 -20.668 0.374 1.00 0.00 H new ATOM 0 HD3 ARG B 47 11.785 -21.701 1.532 1.00 0.00 H new ATOM 0 HE ARG B 47 9.011 -22.371 1.747 1.00 0.00 H new ATOM 0 HH11 ARG B 47 11.686 -22.377 -0.472 1.00 0.00 H new ATOM 0 HH12 ARG B 47 11.027 -23.663 -1.489 1.00 0.00 H new ATOM 0 HH21 ARG B 47 8.082 -23.934 0.445 1.00 0.00 H new ATOM 0 HH22 ARG B 47 8.949 -24.560 -0.960 1.00 0.00 H new ATOM 1938 N GLU B 48 6.868 -18.505 0.260 1.00 0.00 N ATOM 1939 CA GLU B 48 5.516 -17.895 0.080 1.00 0.00 C ATOM 1940 C GLU B 48 4.435 -18.969 0.225 1.00 0.00 C ATOM 1941 O GLU B 48 4.472 -19.982 -0.445 1.00 0.00 O ATOM 1942 CB GLU B 48 5.430 -17.266 -1.310 1.00 0.00 C ATOM 1943 CG GLU B 48 5.597 -18.359 -2.367 1.00 0.00 C ATOM 1944 CD GLU B 48 6.105 -17.731 -3.667 1.00 0.00 C ATOM 1945 OE1 GLU B 48 5.348 -16.955 -4.226 1.00 0.00 O ATOM 1946 OE2 GLU B 48 7.222 -18.064 -4.027 1.00 0.00 O ATOM 0 H GLU B 48 6.998 -19.416 -0.181 1.00 0.00 H new ATOM 0 HA GLU B 48 5.360 -17.130 0.841 1.00 0.00 H new ATOM 0 HB2 GLU B 48 4.471 -16.764 -1.437 1.00 0.00 H new ATOM 0 HB3 GLU B 48 6.204 -16.508 -1.428 1.00 0.00 H new ATOM 0 HG2 GLU B 48 6.299 -19.116 -2.017 1.00 0.00 H new ATOM 0 HG3 GLU B 48 4.646 -18.862 -2.540 1.00 0.00 H new ATOM 1953 N LEU B 49 3.495 -18.721 1.103 1.00 0.00 N ATOM 1954 CA LEU B 49 2.398 -19.720 1.317 1.00 0.00 C ATOM 1955 C LEU B 49 1.034 -19.019 1.355 1.00 0.00 C ATOM 1956 O LEU B 49 0.950 -17.835 1.617 1.00 0.00 O ATOM 1957 CB LEU B 49 2.637 -20.441 2.642 1.00 0.00 C ATOM 1958 CG LEU B 49 4.020 -21.098 2.613 1.00 0.00 C ATOM 1959 CD1 LEU B 49 5.010 -20.222 3.383 1.00 0.00 C ATOM 1960 CD2 LEU B 49 3.939 -22.472 3.279 1.00 0.00 C ATOM 0 H LEU B 49 3.438 -17.879 1.677 1.00 0.00 H new ATOM 0 HA LEU B 49 2.399 -20.435 0.494 1.00 0.00 H new ATOM 0 HB2 LEU B 49 2.573 -19.736 3.471 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.866 -21.194 2.804 1.00 0.00 H new ATOM 0 HG LEU B 49 4.353 -21.209 1.581 1.00 0.00 H new ATOM 0 HD11 LEU B 49 5.996 -20.686 3.365 1.00 0.00 H new ATOM 0 HD12 LEU B 49 5.063 -19.238 2.918 1.00 0.00 H new ATOM 0 HD13 LEU B 49 4.677 -20.118 4.416 1.00 0.00 H new ATOM 0 HD21 LEU B 49 4.921 -22.944 3.261 1.00 0.00 H new ATOM 0 HD22 LEU B 49 3.611 -22.357 4.312 1.00 0.00 H new ATOM 0 HD23 LEU B 49 3.227 -23.096 2.740 1.00 0.00 H new ATOM 1972 N CYS B 50 -0.004 -19.775 1.092 1.00 0.00 N ATOM 1973 CA CYS B 50 -1.380 -19.181 1.101 1.00 0.00 C ATOM 1974 C CYS B 50 -2.152 -19.641 2.345 1.00 0.00 C ATOM 1975 O CYS B 50 -2.095 -20.797 2.720 1.00 0.00 O ATOM 1976 CB CYS B 50 -2.122 -19.637 -0.153 1.00 0.00 C ATOM 1977 SG CYS B 50 -1.263 -19.461 -1.735 1.00 0.00 S ATOM 0 H CYS B 50 0.039 -20.770 0.873 1.00 0.00 H new ATOM 0 HA CYS B 50 -1.302 -18.094 1.119 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -2.384 -20.687 -0.027 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -3.057 -19.080 -0.213 1.00 0.00 H new ATOM 1982 N LEU B 51 -2.860 -18.719 2.955 1.00 0.00 N ATOM 1983 CA LEU B 51 -3.647 -19.072 4.182 1.00 0.00 C ATOM 1984 C LEU B 51 -5.150 -18.977 3.900 1.00 0.00 C ATOM 1985 O LEU B 51 -5.567 -18.350 2.945 1.00 0.00 O ATOM 1986 CB LEU B 51 -3.293 -18.099 5.307 1.00 0.00 C ATOM 1987 CG LEU B 51 -1.775 -17.918 5.374 1.00 0.00 C ATOM 1988 CD1 LEU B 51 -1.439 -16.969 6.529 1.00 0.00 C ATOM 1989 CD2 LEU B 51 -1.112 -19.276 5.627 1.00 0.00 C ATOM 0 H LEU B 51 -2.927 -17.745 2.660 1.00 0.00 H new ATOM 0 HA LEU B 51 -3.401 -20.093 4.473 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.776 -17.137 5.135 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.666 -18.477 6.259 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.410 -17.504 4.434 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -0.359 -16.833 6.586 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.918 -16.005 6.359 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.801 -17.393 7.466 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -0.030 -19.150 5.675 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -1.472 -19.686 6.571 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -1.362 -19.960 4.815 1.00 0.00 H new ATOM 2001 N ASP B 52 -5.927 -19.604 4.748 1.00 0.00 N ATOM 2002 CA ASP B 52 -7.411 -19.569 4.571 1.00 0.00 C ATOM 2003 C ASP B 52 -8.060 -18.764 5.740 1.00 0.00 C ATOM 2004 O ASP B 52 -7.939 -19.161 6.881 1.00 0.00 O ATOM 2005 CB ASP B 52 -7.935 -21.003 4.615 1.00 0.00 C ATOM 2006 CG ASP B 52 -9.304 -21.063 3.933 1.00 0.00 C ATOM 2007 OD1 ASP B 52 -10.112 -20.212 4.267 1.00 0.00 O ATOM 2008 OD2 ASP B 52 -9.464 -21.956 3.118 1.00 0.00 O ATOM 0 H ASP B 52 -5.599 -20.137 5.553 1.00 0.00 H new ATOM 0 HA ASP B 52 -7.659 -19.096 3.621 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -7.237 -21.673 4.114 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -8.015 -21.341 5.648 1.00 0.00 H new ATOM 2013 N PRO B 53 -8.740 -17.644 5.450 1.00 0.00 N ATOM 2014 CA PRO B 53 -9.368 -16.853 6.521 1.00 0.00 C ATOM 2015 C PRO B 53 -10.427 -17.685 7.253 1.00 0.00 C ATOM 2016 O PRO B 53 -11.063 -17.216 8.176 1.00 0.00 O ATOM 2017 CB PRO B 53 -10.022 -15.657 5.819 1.00 0.00 C ATOM 2018 CG PRO B 53 -9.760 -15.812 4.292 1.00 0.00 C ATOM 2019 CD PRO B 53 -8.936 -17.096 4.091 1.00 0.00 C ATOM 0 HA PRO B 53 -8.639 -16.537 7.267 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -11.092 -15.630 6.024 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -9.603 -14.720 6.187 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -10.701 -15.871 3.746 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -9.221 -14.947 3.906 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -9.461 -17.806 3.452 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -7.981 -16.881 3.611 1.00 0.00 H new ATOM 2027 N LYS B 54 -10.590 -18.905 6.821 1.00 0.00 N ATOM 2028 CA LYS B 54 -11.598 -19.782 7.467 1.00 0.00 C ATOM 2029 C LYS B 54 -11.073 -20.312 8.808 1.00 0.00 C ATOM 2030 O LYS B 54 -11.828 -20.829 9.608 1.00 0.00 O ATOM 2031 CB LYS B 54 -11.901 -20.958 6.535 1.00 0.00 C ATOM 2032 CG LYS B 54 -13.037 -21.804 7.125 1.00 0.00 C ATOM 2033 CD LYS B 54 -12.482 -23.168 7.544 1.00 0.00 C ATOM 2034 CE LYS B 54 -12.088 -23.958 6.293 1.00 0.00 C ATOM 2035 NZ LYS B 54 -12.960 -25.156 6.137 1.00 0.00 N ATOM 0 H LYS B 54 -10.070 -19.328 6.052 1.00 0.00 H new ATOM 0 HA LYS B 54 -12.505 -19.207 7.654 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -12.183 -20.590 5.549 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -11.009 -21.570 6.404 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -13.476 -21.297 7.984 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -13.832 -21.931 6.390 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -11.617 -23.038 8.194 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -13.230 -23.718 8.115 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -12.173 -23.322 5.412 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.045 -24.267 6.364 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -12.680 -25.681 5.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -12.859 -25.770 6.970 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -13.951 -24.855 6.048 1.00 0.00 H new ATOM 2049 N GLU B 55 -9.789 -20.168 9.029 1.00 0.00 N ATOM 2050 CA GLU B 55 -9.208 -20.670 10.313 1.00 0.00 C ATOM 2051 C GLU B 55 -9.028 -19.515 11.303 1.00 0.00 C ATOM 2052 O GLU B 55 -8.608 -18.436 10.937 1.00 0.00 O ATOM 2053 CB GLU B 55 -7.855 -21.321 10.038 1.00 0.00 C ATOM 2054 CG GLU B 55 -8.017 -22.395 8.957 1.00 0.00 C ATOM 2055 CD GLU B 55 -8.853 -23.550 9.512 1.00 0.00 C ATOM 2056 OE1 GLU B 55 -8.706 -23.805 10.696 1.00 0.00 O ATOM 2057 OE2 GLU B 55 -9.592 -24.112 8.720 1.00 0.00 O ATOM 0 H GLU B 55 -9.127 -19.732 8.387 1.00 0.00 H new ATOM 0 HA GLU B 55 -9.888 -21.403 10.746 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.136 -20.568 9.714 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.461 -21.766 10.952 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -8.501 -21.971 8.077 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.039 -22.758 8.640 1.00 0.00 H new ATOM 2064 N ASN B 56 -9.342 -19.773 12.541 1.00 0.00 N ATOM 2065 CA ASN B 56 -9.211 -18.701 13.570 1.00 0.00 C ATOM 2066 C ASN B 56 -7.739 -18.331 13.791 1.00 0.00 C ATOM 2067 O ASN B 56 -7.409 -17.169 13.921 1.00 0.00 O ATOM 2068 CB ASN B 56 -9.813 -19.195 14.883 1.00 0.00 C ATOM 2069 CG ASN B 56 -11.097 -18.415 15.174 1.00 0.00 C ATOM 2070 OD1 ASN B 56 -11.132 -17.552 16.028 1.00 0.00 O ATOM 2071 ND2 ASN B 56 -12.172 -18.688 14.487 1.00 0.00 N ATOM 0 H ASN B 56 -9.681 -20.671 12.885 1.00 0.00 H new ATOM 0 HA ASN B 56 -9.740 -17.814 13.222 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -10.028 -20.262 14.820 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -9.100 -19.061 15.697 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -13.036 -18.178 14.668 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -12.148 -19.412 13.769 1.00 0.00 H new ATOM 2078 N TRP B 57 -6.881 -19.317 13.830 1.00 0.00 N ATOM 2079 CA TRP B 57 -5.440 -19.000 14.056 1.00 0.00 C ATOM 2080 C TRP B 57 -4.901 -18.119 12.928 1.00 0.00 C ATOM 2081 O TRP B 57 -3.899 -17.460 13.087 1.00 0.00 O ATOM 2082 CB TRP B 57 -4.617 -20.295 14.153 1.00 0.00 C ATOM 2083 CG TRP B 57 -4.742 -21.118 12.863 1.00 0.00 C ATOM 2084 CD1 TRP B 57 -5.596 -22.124 12.700 1.00 0.00 C ATOM 2085 CD2 TRP B 57 -3.983 -20.969 11.788 1.00 0.00 C ATOM 2086 NE1 TRP B 57 -5.316 -22.585 11.471 1.00 0.00 N ATOM 2087 CE2 TRP B 57 -4.309 -21.911 10.826 1.00 0.00 C ATOM 2088 CE3 TRP B 57 -2.980 -20.051 11.529 1.00 0.00 C ATOM 2089 CZ2 TRP B 57 -3.638 -21.936 9.620 1.00 0.00 C ATOM 2090 CZ3 TRP B 57 -2.312 -20.076 10.319 1.00 0.00 C ATOM 2091 CH2 TRP B 57 -2.641 -21.019 9.367 1.00 0.00 C ATOM 0 H TRP B 57 -7.108 -20.305 13.718 1.00 0.00 H new ATOM 0 HA TRP B 57 -5.352 -18.455 14.996 1.00 0.00 H new ATOM 0 HB2 TRP B 57 -3.570 -20.053 14.335 1.00 0.00 H new ATOM 0 HB3 TRP B 57 -4.960 -20.887 15.002 1.00 0.00 H new ATOM 0 HD1 TRP B 57 -6.340 -22.485 13.394 1.00 0.00 H new ATOM 0 HE1 TRP B 57 -5.811 -23.372 11.051 1.00 0.00 H new ATOM 0 HE3 TRP B 57 -2.719 -19.314 12.274 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 -3.894 -22.674 8.875 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 -1.532 -19.357 10.119 1.00 0.00 H new ATOM 0 HH2 TRP B 57 -2.117 -21.038 8.423 1.00 0.00 H new ATOM 2102 N VAL B 58 -5.575 -18.115 11.814 1.00 0.00 N ATOM 2103 CA VAL B 58 -5.091 -17.265 10.687 1.00 0.00 C ATOM 2104 C VAL B 58 -5.472 -15.813 10.941 1.00 0.00 C ATOM 2105 O VAL B 58 -4.730 -14.905 10.624 1.00 0.00 O ATOM 2106 CB VAL B 58 -5.732 -17.742 9.382 1.00 0.00 C ATOM 2107 CG1 VAL B 58 -5.726 -16.602 8.364 1.00 0.00 C ATOM 2108 CG2 VAL B 58 -4.932 -18.914 8.826 1.00 0.00 C ATOM 0 H VAL B 58 -6.424 -18.651 11.634 1.00 0.00 H new ATOM 0 HA VAL B 58 -4.006 -17.344 10.611 1.00 0.00 H new ATOM 0 HB VAL B 58 -6.758 -18.055 9.575 1.00 0.00 H new ATOM 0 HG11 VAL B 58 -6.183 -16.942 7.434 1.00 0.00 H new ATOM 0 HG12 VAL B 58 -6.292 -15.758 8.759 1.00 0.00 H new ATOM 0 HG13 VAL B 58 -4.699 -16.292 8.171 1.00 0.00 H new ATOM 0 HG21 VAL B 58 -5.386 -19.256 7.896 1.00 0.00 H new ATOM 0 HG22 VAL B 58 -3.907 -18.596 8.634 1.00 0.00 H new ATOM 0 HG23 VAL B 58 -4.930 -19.729 9.550 1.00 0.00 H new ATOM 2118 N GLN B 59 -6.623 -15.625 11.511 1.00 0.00 N ATOM 2119 CA GLN B 59 -7.077 -14.242 11.799 1.00 0.00 C ATOM 2120 C GLN B 59 -6.251 -13.649 12.943 1.00 0.00 C ATOM 2121 O GLN B 59 -6.121 -12.452 13.058 1.00 0.00 O ATOM 2122 CB GLN B 59 -8.550 -14.284 12.205 1.00 0.00 C ATOM 2123 CG GLN B 59 -9.166 -12.899 12.011 1.00 0.00 C ATOM 2124 CD GLN B 59 -10.537 -12.858 12.690 1.00 0.00 C ATOM 2125 OE1 GLN B 59 -10.688 -13.246 13.832 1.00 0.00 O ATOM 2126 NE2 GLN B 59 -11.561 -12.397 12.025 1.00 0.00 N ATOM 0 H GLN B 59 -7.267 -16.365 11.789 1.00 0.00 H new ATOM 0 HA GLN B 59 -6.949 -13.622 10.912 1.00 0.00 H new ATOM 0 HB2 GLN B 59 -9.084 -15.020 11.604 1.00 0.00 H new ATOM 0 HB3 GLN B 59 -8.644 -14.594 13.246 1.00 0.00 H new ATOM 0 HG2 GLN B 59 -8.514 -12.135 12.435 1.00 0.00 H new ATOM 0 HG3 GLN B 59 -9.266 -12.678 10.948 1.00 0.00 H new ATOM 0 HE21 GLN B 59 -11.441 -12.070 11.066 1.00 0.00 H new ATOM 0 HE22 GLN B 59 -12.481 -12.364 12.464 1.00 0.00 H new ATOM 2135 N ARG B 60 -5.695 -14.506 13.757 1.00 0.00 N ATOM 2136 CA ARG B 60 -4.896 -14.004 14.912 1.00 0.00 C ATOM 2137 C ARG B 60 -3.428 -13.760 14.525 1.00 0.00 C ATOM 2138 O ARG B 60 -2.909 -12.684 14.741 1.00 0.00 O ATOM 2139 CB ARG B 60 -4.956 -15.030 16.042 1.00 0.00 C ATOM 2140 CG ARG B 60 -5.889 -14.515 17.139 1.00 0.00 C ATOM 2141 CD ARG B 60 -6.078 -15.608 18.193 1.00 0.00 C ATOM 2142 NE ARG B 60 -6.045 -14.987 19.547 1.00 0.00 N ATOM 2143 CZ ARG B 60 -4.979 -15.117 20.287 1.00 0.00 C ATOM 2144 NH1 ARG B 60 -4.839 -16.196 21.007 1.00 0.00 N ATOM 2145 NH2 ARG B 60 -4.087 -14.164 20.282 1.00 0.00 N ATOM 0 H ARG B 60 -5.758 -15.521 13.674 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.321 -13.053 15.233 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -5.315 -15.987 15.662 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -3.959 -15.202 16.447 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -5.471 -13.619 17.598 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -6.852 -14.234 16.712 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -7.027 -16.121 18.037 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -5.292 -16.358 18.103 1.00 0.00 H new ATOM 0 HE ARG B 60 -6.850 -14.464 19.892 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -5.557 -16.920 20.985 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -4.012 -16.315 21.592 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -4.230 -13.335 19.706 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -3.247 -14.249 20.855 1.00 0.00 H new ATOM 2159 N VAL B 61 -2.783 -14.753 13.962 1.00 0.00 N ATOM 2160 CA VAL B 61 -1.355 -14.557 13.596 1.00 0.00 C ATOM 2161 C VAL B 61 -1.238 -13.418 12.578 1.00 0.00 C ATOM 2162 O VAL B 61 -0.298 -12.647 12.607 1.00 0.00 O ATOM 2163 CB VAL B 61 -0.802 -15.861 13.016 1.00 0.00 C ATOM 2164 CG1 VAL B 61 -1.003 -16.989 14.039 1.00 0.00 C ATOM 2165 CG2 VAL B 61 -1.551 -16.189 11.720 1.00 0.00 C ATOM 0 H VAL B 61 -3.176 -15.669 13.746 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.776 -14.291 14.480 1.00 0.00 H new ATOM 0 HB VAL B 61 0.261 -15.756 12.800 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.612 -17.922 13.633 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -0.474 -16.743 14.960 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.066 -17.103 14.251 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -1.163 -17.117 11.300 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -2.614 -16.304 11.933 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -1.410 -15.380 11.003 1.00 0.00 H new ATOM 2175 N VAL B 62 -2.200 -13.325 11.704 1.00 0.00 N ATOM 2176 CA VAL B 62 -2.158 -12.224 10.703 1.00 0.00 C ATOM 2177 C VAL B 62 -2.499 -10.900 11.393 1.00 0.00 C ATOM 2178 O VAL B 62 -1.895 -9.882 11.121 1.00 0.00 O ATOM 2179 CB VAL B 62 -3.172 -12.504 9.596 1.00 0.00 C ATOM 2180 CG1 VAL B 62 -3.259 -11.284 8.676 1.00 0.00 C ATOM 2181 CG2 VAL B 62 -2.709 -13.718 8.785 1.00 0.00 C ATOM 0 H VAL B 62 -3.001 -13.953 11.639 1.00 0.00 H new ATOM 0 HA VAL B 62 -1.160 -12.160 10.269 1.00 0.00 H new ATOM 0 HB VAL B 62 -4.150 -12.706 10.032 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -3.981 -11.477 7.883 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -3.577 -10.415 9.253 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -2.281 -11.089 8.236 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -3.429 -13.923 7.993 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -1.734 -13.511 8.344 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -2.634 -14.586 9.440 1.00 0.00 H new ATOM 2191 N GLU B 63 -3.465 -10.943 12.277 1.00 0.00 N ATOM 2192 CA GLU B 63 -3.843 -9.697 13.004 1.00 0.00 C ATOM 2193 C GLU B 63 -2.621 -9.141 13.732 1.00 0.00 C ATOM 2194 O GLU B 63 -2.408 -7.945 13.773 1.00 0.00 O ATOM 2195 CB GLU B 63 -4.936 -10.014 14.024 1.00 0.00 C ATOM 2196 CG GLU B 63 -5.096 -8.826 14.975 1.00 0.00 C ATOM 2197 CD GLU B 63 -6.560 -8.718 15.408 1.00 0.00 C ATOM 2198 OE1 GLU B 63 -7.017 -9.674 16.013 1.00 0.00 O ATOM 2199 OE2 GLU B 63 -7.138 -7.687 15.109 1.00 0.00 O ATOM 0 H GLU B 63 -4.000 -11.776 12.523 1.00 0.00 H new ATOM 0 HA GLU B 63 -4.211 -8.959 12.291 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -5.878 -10.217 13.514 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -4.677 -10.912 14.585 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -4.455 -8.955 15.847 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -4.782 -7.906 14.482 1.00 0.00 H new ATOM 2206 N LYS B 64 -1.842 -10.025 14.292 1.00 0.00 N ATOM 2207 CA LYS B 64 -0.628 -9.568 15.021 1.00 0.00 C ATOM 2208 C LYS B 64 0.321 -8.852 14.057 1.00 0.00 C ATOM 2209 O LYS B 64 0.822 -7.786 14.356 1.00 0.00 O ATOM 2210 CB LYS B 64 0.074 -10.778 15.630 1.00 0.00 C ATOM 2211 CG LYS B 64 -0.126 -10.765 17.147 1.00 0.00 C ATOM 2212 CD LYS B 64 0.339 -12.103 17.725 1.00 0.00 C ATOM 2213 CE LYS B 64 0.541 -11.954 19.234 1.00 0.00 C ATOM 2214 NZ LYS B 64 1.695 -11.055 19.520 1.00 0.00 N ATOM 0 H LYS B 64 -1.992 -11.034 14.277 1.00 0.00 H new ATOM 0 HA LYS B 64 -0.918 -8.875 15.811 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -0.328 -11.698 15.206 1.00 0.00 H new ATOM 0 HB3 LYS B 64 1.137 -10.755 15.391 1.00 0.00 H new ATOM 0 HG2 LYS B 64 0.438 -9.946 17.594 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -1.176 -10.597 17.386 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -0.399 -12.878 17.519 1.00 0.00 H new ATOM 0 HD3 LYS B 64 1.269 -12.415 17.250 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -0.363 -11.551 19.690 1.00 0.00 H new ATOM 0 HE3 LYS B 64 0.715 -12.932 19.682 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 2.118 -11.314 20.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 2.407 -11.154 18.768 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 1.366 -10.069 19.558 1.00 0.00 H new ATOM 2228 N PHE B 65 0.549 -9.451 12.916 1.00 0.00 N ATOM 2229 CA PHE B 65 1.461 -8.800 11.931 1.00 0.00 C ATOM 2230 C PHE B 65 1.022 -7.355 11.683 1.00 0.00 C ATOM 2231 O PHE B 65 1.842 -6.470 11.550 1.00 0.00 O ATOM 2232 CB PHE B 65 1.427 -9.561 10.620 1.00 0.00 C ATOM 2233 CG PHE B 65 2.370 -8.876 9.623 1.00 0.00 C ATOM 2234 CD1 PHE B 65 3.743 -9.006 9.749 1.00 0.00 C ATOM 2235 CD2 PHE B 65 1.861 -8.116 8.585 1.00 0.00 C ATOM 2236 CE1 PHE B 65 4.591 -8.385 8.850 1.00 0.00 C ATOM 2237 CE2 PHE B 65 2.710 -7.497 7.689 1.00 0.00 C ATOM 2238 CZ PHE B 65 4.073 -7.630 7.822 1.00 0.00 C ATOM 0 H PHE B 65 0.152 -10.345 12.628 1.00 0.00 H new ATOM 0 HA PHE B 65 2.474 -8.807 12.334 1.00 0.00 H new ATOM 0 HB2 PHE B 65 1.732 -10.596 10.777 1.00 0.00 H new ATOM 0 HB3 PHE B 65 0.412 -9.584 10.224 1.00 0.00 H new ATOM 0 HD1 PHE B 65 4.154 -9.596 10.555 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.792 -8.006 8.475 1.00 0.00 H new ATOM 0 HE1 PHE B 65 5.661 -8.492 8.955 1.00 0.00 H new ATOM 0 HE2 PHE B 65 2.303 -6.907 6.881 1.00 0.00 H new ATOM 0 HZ PHE B 65 4.735 -7.143 7.121 1.00 0.00 H new ATOM 2248 N LEU B 66 -0.266 -7.148 11.624 1.00 0.00 N ATOM 2249 CA LEU B 66 -0.773 -5.765 11.386 1.00 0.00 C ATOM 2250 C LEU B 66 -0.464 -4.878 12.595 1.00 0.00 C ATOM 2251 O LEU B 66 0.050 -3.786 12.453 1.00 0.00 O ATOM 2252 CB LEU B 66 -2.284 -5.817 11.164 1.00 0.00 C ATOM 2253 CG LEU B 66 -2.565 -6.066 9.680 1.00 0.00 C ATOM 2254 CD1 LEU B 66 -3.916 -6.768 9.534 1.00 0.00 C ATOM 2255 CD2 LEU B 66 -2.612 -4.725 8.944 1.00 0.00 C ATOM 0 H LEU B 66 -0.982 -7.867 11.729 1.00 0.00 H new ATOM 0 HA LEU B 66 -0.284 -5.347 10.506 1.00 0.00 H new ATOM 0 HB2 LEU B 66 -2.726 -6.609 11.768 1.00 0.00 H new ATOM 0 HB3 LEU B 66 -2.743 -4.881 11.481 1.00 0.00 H new ATOM 0 HG LEU B 66 -1.778 -6.691 9.257 1.00 0.00 H new ATOM 0 HD11 LEU B 66 -4.121 -6.947 8.479 1.00 0.00 H new ATOM 0 HD12 LEU B 66 -3.891 -7.719 10.066 1.00 0.00 H new ATOM 0 HD13 LEU B 66 -4.700 -6.138 9.954 1.00 0.00 H new ATOM 0 HD21 LEU B 66 -2.812 -4.897 7.886 1.00 0.00 H new ATOM 0 HD22 LEU B 66 -3.403 -4.106 9.367 1.00 0.00 H new ATOM 0 HD23 LEU B 66 -1.655 -4.216 9.054 1.00 0.00 H new ATOM 2267 N LYS B 67 -0.785 -5.368 13.761 1.00 0.00 N ATOM 2268 CA LYS B 67 -0.514 -4.568 14.991 1.00 0.00 C ATOM 2269 C LYS B 67 0.994 -4.352 15.156 1.00 0.00 C ATOM 2270 O LYS B 67 1.423 -3.406 15.785 1.00 0.00 O ATOM 2271 CB LYS B 67 -1.057 -5.319 16.205 1.00 0.00 C ATOM 2272 CG LYS B 67 -2.416 -4.732 16.591 1.00 0.00 C ATOM 2273 CD LYS B 67 -3.025 -5.574 17.714 1.00 0.00 C ATOM 2274 CE LYS B 67 -3.826 -4.663 18.646 1.00 0.00 C ATOM 2275 NZ LYS B 67 -2.911 -3.865 19.509 1.00 0.00 N ATOM 0 H LYS B 67 -1.219 -6.278 13.916 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.003 -3.598 14.905 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.157 -6.380 15.977 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -0.361 -5.237 17.040 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.300 -3.698 16.917 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -3.080 -4.721 15.727 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -3.671 -6.346 17.297 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -2.238 -6.083 18.271 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -4.456 -3.995 18.058 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -4.491 -5.263 19.268 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.431 -3.521 20.341 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -2.118 -4.462 19.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -2.544 -3.055 18.970 1.00 0.00 H new ATOM 2289 N ARG B 68 1.765 -5.237 14.584 1.00 0.00 N ATOM 2290 CA ARG B 68 3.246 -5.100 14.696 1.00 0.00 C ATOM 2291 C ARG B 68 3.766 -4.115 13.643 1.00 0.00 C ATOM 2292 O ARG B 68 4.514 -3.208 13.953 1.00 0.00 O ATOM 2293 CB ARG B 68 3.891 -6.468 14.478 1.00 0.00 C ATOM 2294 CG ARG B 68 5.314 -6.446 15.040 1.00 0.00 C ATOM 2295 CD ARG B 68 5.288 -6.940 16.488 1.00 0.00 C ATOM 2296 NE ARG B 68 6.635 -6.738 17.092 1.00 0.00 N ATOM 2297 CZ ARG B 68 7.658 -7.386 16.607 1.00 0.00 C ATOM 2298 NH1 ARG B 68 7.484 -8.604 16.170 1.00 0.00 N ATOM 2299 NH2 ARG B 68 8.821 -6.795 16.574 1.00 0.00 N ATOM 0 H ARG B 68 1.438 -6.041 14.049 1.00 0.00 H new ATOM 0 HA ARG B 68 3.500 -4.723 15.687 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.304 -7.243 14.971 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.910 -6.710 13.415 1.00 0.00 H new ATOM 0 HG2 ARG B 68 5.966 -7.079 14.438 1.00 0.00 H new ATOM 0 HG3 ARG B 68 5.721 -5.436 14.995 1.00 0.00 H new ATOM 0 HD2 ARG B 68 4.534 -6.397 17.058 1.00 0.00 H new ATOM 0 HD3 ARG B 68 5.014 -7.995 16.521 1.00 0.00 H new ATOM 0 HE ARG B 68 6.756 -6.099 17.878 1.00 0.00 H new ATOM 0 HH11 ARG B 68 6.560 -9.033 16.211 1.00 0.00 H new ATOM 0 HH12 ARG B 68 8.272 -9.126 15.787 1.00 0.00 H new ATOM 0 HH21 ARG B 68 8.919 -5.842 16.924 1.00 0.00 H new ATOM 0 HH22 ARG B 68 9.632 -7.286 16.198 1.00 0.00 H new ATOM 2313 N ALA B 69 3.359 -4.316 12.419 1.00 0.00 N ATOM 2314 CA ALA B 69 3.818 -3.401 11.333 1.00 0.00 C ATOM 2315 C ALA B 69 3.225 -2.005 11.537 1.00 0.00 C ATOM 2316 O ALA B 69 3.735 -1.029 11.023 1.00 0.00 O ATOM 2317 CB ALA B 69 3.362 -3.957 9.984 1.00 0.00 C ATOM 0 H ALA B 69 2.734 -5.067 12.125 1.00 0.00 H new ATOM 0 HA ALA B 69 4.905 -3.330 11.357 1.00 0.00 H new ATOM 0 HB1 ALA B 69 3.694 -3.293 9.186 1.00 0.00 H new ATOM 0 HB2 ALA B 69 3.792 -4.947 9.835 1.00 0.00 H new ATOM 0 HB3 ALA B 69 2.274 -4.027 9.968 1.00 0.00 H new ATOM 2323 N GLU B 70 2.159 -1.941 12.285 1.00 0.00 N ATOM 2324 CA GLU B 70 1.518 -0.620 12.536 1.00 0.00 C ATOM 2325 C GLU B 70 2.137 0.040 13.773 1.00 0.00 C ATOM 2326 O GLU B 70 2.345 1.236 13.803 1.00 0.00 O ATOM 2327 CB GLU B 70 0.022 -0.826 12.761 1.00 0.00 C ATOM 2328 CG GLU B 70 -0.686 0.529 12.697 1.00 0.00 C ATOM 2329 CD GLU B 70 -1.824 0.554 13.719 1.00 0.00 C ATOM 2330 OE1 GLU B 70 -2.869 0.024 13.378 1.00 0.00 O ATOM 2331 OE2 GLU B 70 -1.584 1.100 14.783 1.00 0.00 O ATOM 0 H GLU B 70 1.707 -2.739 12.730 1.00 0.00 H new ATOM 0 HA GLU B 70 1.678 0.028 11.674 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -0.383 -1.498 12.004 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -0.151 -1.295 13.729 1.00 0.00 H new ATOM 0 HG2 GLU B 70 0.022 1.332 12.904 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -1.078 0.700 11.695 1.00 0.00 H new ATOM 2338 N ASN B 71 2.417 -0.758 14.767 1.00 0.00 N ATOM 2339 CA ASN B 71 3.023 -0.195 16.009 1.00 0.00 C ATOM 2340 C ASN B 71 4.445 0.300 15.726 1.00 0.00 C ATOM 2341 O ASN B 71 4.948 1.173 16.406 1.00 0.00 O ATOM 2342 CB ASN B 71 3.067 -1.284 17.080 1.00 0.00 C ATOM 2343 CG ASN B 71 3.791 -0.748 18.317 1.00 0.00 C ATOM 2344 OD1 ASN B 71 3.670 0.409 18.668 1.00 0.00 O ATOM 2345 ND2 ASN B 71 4.554 -1.554 19.004 1.00 0.00 N ATOM 0 H ASN B 71 2.255 -1.765 14.775 1.00 0.00 H new ATOM 0 HA ASN B 71 2.420 0.644 16.355 1.00 0.00 H new ATOM 0 HB2 ASN B 71 2.055 -1.593 17.342 1.00 0.00 H new ATOM 0 HB3 ASN B 71 3.581 -2.166 16.697 1.00 0.00 H new ATOM 0 HD21 ASN B 71 5.044 -1.211 19.830 1.00 0.00 H new ATOM 0 HD22 ASN B 71 4.660 -2.526 18.715 1.00 0.00 H new ATOM 2352 N SER B 72 5.062 -0.268 14.726 1.00 0.00 N ATOM 2353 CA SER B 72 6.451 0.157 14.384 1.00 0.00 C ATOM 2354 C SER B 72 6.512 1.679 14.220 1.00 0.00 C ATOM 2355 O SER B 72 5.512 2.217 13.773 1.00 0.00 O ATOM 2356 CB SER B 72 6.871 -0.514 13.078 1.00 0.00 C ATOM 2357 OG SER B 72 6.509 -1.875 13.254 1.00 0.00 O ATOM 2358 OXT SER B 72 7.556 2.218 14.551 1.00 0.00 O ATOM 0 H SER B 72 4.670 -1.001 14.135 1.00 0.00 H new ATOM 0 HA SER B 72 7.126 -0.138 15.187 1.00 0.00 H new ATOM 0 HB2 SER B 72 6.360 -0.074 12.222 1.00 0.00 H new ATOM 0 HB3 SER B 72 7.941 -0.406 12.901 1.00 0.00 H new ATOM 0 HG SER B 72 5.565 -1.995 13.021 1.00 0.00 H new TER 2364 SER B 72