USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 874 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 Single : A 0 SER OG : rot 180:sc= 0.076 USER MOD Single : A 3 GLN : amide:sc= -3.38! C(o=-3.4!,f=-3.4!) USER MOD Single : A 5 SER OG : rot -64:sc= 1.26 USER MOD Single : A 6 LYS NZ :NH3+ 163:sc= -0.0174 (180deg=-0.203) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 130:sc= 0.141 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -5.06! C(o=-5.1!,f=-8.5!) USER MOD Single : A 16 GLN : amide:sc= -1.68 X(o=-1.7,f=-2) USER MOD Single : A 19 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.58) USER MOD Single : A 22 SER OG : rot 180:sc= -0.734 USER MOD Single : A 31 THR OG1 : rot 81:sc= 1.22 USER MOD Single : A 38 ASN : amide:sc= -2.41 K(o=-2.4,f=-9.1!) USER MOD Single : A 39 SER OG : rot 180:sc= -0.78 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0101 USER MOD Single : A 47 HIS : no HE2:sc= -7.87! C(o=-7.9!,f=-7.9!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.0139) USER MOD Single : A 51 GLN : amide:sc= -0.739 K(o=-0.74,f=-3!) USER MOD Single : A 54 THR OG1 : rot -70:sc= 1.21 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -5.26 K(o=-5.3,f=-9.1!) USER MOD Single : A 74 GLN : amide:sc= -2.01 K(o=-2,f=-4.2!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 161:sc= -0.0594 (180deg=-0.36) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 87 ASN : amide:sc= -1.06 X(o=-1.1,f=-1.1) USER MOD Single : A 90 GLN : amide:sc= 0.0673 X(o=0.067,f=-0.11) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 HIS : no HD1:sc=-0.000738 X(o=-0.00074,f=-0.056) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 103 SER OG : rot 180:sc= 0.00982 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 5.285 -0.097 -2.264 1.00 0.00 N ATOM 2 CA GLY A -1 3.861 0.157 -2.391 1.00 0.00 C ATOM 3 C GLY A -1 3.090 -1.072 -2.830 1.00 0.00 C ATOM 4 O GLY A -1 2.967 -2.038 -2.078 1.00 0.00 O ATOM 0 H1 GLY A -1 5.767 0.773 -1.962 1.00 0.00 H new ATOM 0 H2 GLY A -1 5.443 -0.843 -1.557 1.00 0.00 H new ATOM 0 H3 GLY A -1 5.666 -0.403 -3.182 1.00 0.00 H new ATOM 0 HA2 GLY A -1 3.470 0.505 -1.435 1.00 0.00 H new ATOM 0 HA3 GLY A -1 3.701 0.959 -3.111 1.00 0.00 H new ATOM 8 N SER A 0 2.568 -1.035 -4.052 1.00 0.00 N ATOM 9 CA SER A 0 1.800 -2.152 -4.589 1.00 0.00 C ATOM 10 C SER A 0 2.721 -3.297 -5.000 1.00 0.00 C ATOM 11 O SER A 0 3.021 -3.474 -6.180 1.00 0.00 O ATOM 12 CB SER A 0 0.967 -1.697 -5.789 1.00 0.00 C ATOM 13 OG SER A 0 1.593 -0.619 -6.463 1.00 0.00 O ATOM 0 H SER A 0 2.663 -0.244 -4.689 1.00 0.00 H new ATOM 0 HA SER A 0 1.131 -2.510 -3.806 1.00 0.00 H new ATOM 0 HB2 SER A 0 0.830 -2.531 -6.478 1.00 0.00 H new ATOM 0 HB3 SER A 0 -0.025 -1.394 -5.454 1.00 0.00 H new ATOM 0 HG SER A 0 1.043 -0.347 -7.227 1.00 0.00 H new ATOM 19 N ALA A 1 3.165 -4.073 -4.016 1.00 0.00 N ATOM 20 CA ALA A 1 4.050 -5.202 -4.274 1.00 0.00 C ATOM 21 C ALA A 1 3.257 -6.494 -4.436 1.00 0.00 C ATOM 22 O ALA A 1 3.234 -7.088 -5.515 1.00 0.00 O ATOM 23 CB ALA A 1 5.068 -5.342 -3.151 1.00 0.00 C ATOM 0 H ALA A 1 2.926 -3.940 -3.033 1.00 0.00 H new ATOM 0 HA ALA A 1 4.579 -5.012 -5.208 1.00 0.00 H new ATOM 0 HB1 ALA A 1 5.722 -6.189 -3.357 1.00 0.00 H new ATOM 0 HB2 ALA A 1 5.663 -4.431 -3.084 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.548 -5.506 -2.207 1.00 0.00 H new ATOM 29 N ARG A 2 2.610 -6.926 -3.359 1.00 0.00 N ATOM 30 CA ARG A 2 1.818 -8.150 -3.382 1.00 0.00 C ATOM 31 C ARG A 2 0.837 -8.140 -4.551 1.00 0.00 C ATOM 32 O ARG A 2 0.782 -9.087 -5.334 1.00 0.00 O ATOM 33 CB ARG A 2 1.058 -8.316 -2.065 1.00 0.00 C ATOM 34 CG ARG A 2 1.565 -9.465 -1.210 1.00 0.00 C ATOM 35 CD ARG A 2 1.474 -10.791 -1.949 1.00 0.00 C ATOM 36 NE ARG A 2 1.217 -11.907 -1.041 1.00 0.00 N ATOM 37 CZ ARG A 2 0.029 -12.156 -0.502 1.00 0.00 C ATOM 38 NH1 ARG A 2 -1.006 -11.374 -0.777 1.00 0.00 N ATOM 39 NH2 ARG A 2 -0.126 -13.191 0.314 1.00 0.00 N ATOM 0 H ARG A 2 2.619 -6.446 -2.459 1.00 0.00 H new ATOM 0 HA ARG A 2 2.499 -8.992 -3.508 1.00 0.00 H new ATOM 0 HB2 ARG A 2 1.130 -7.390 -1.494 1.00 0.00 H new ATOM 0 HB3 ARG A 2 0.002 -8.475 -2.282 1.00 0.00 H new ATOM 0 HG2 ARG A 2 2.600 -9.277 -0.923 1.00 0.00 H new ATOM 0 HG3 ARG A 2 0.984 -9.519 -0.290 1.00 0.00 H new ATOM 0 HD2 ARG A 2 0.679 -10.738 -2.692 1.00 0.00 H new ATOM 0 HD3 ARG A 2 2.404 -10.970 -2.489 1.00 0.00 H new ATOM 0 HE ARG A 2 1.992 -12.528 -0.809 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -0.891 -10.578 -1.404 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -1.917 -11.568 -0.361 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.667 -13.795 0.527 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -1.039 -13.382 0.728 1.00 0.00 H new ATOM 53 N GLN A 3 0.065 -7.063 -4.659 1.00 0.00 N ATOM 54 CA GLN A 3 -0.915 -6.931 -5.731 1.00 0.00 C ATOM 55 C GLN A 3 -0.251 -7.080 -7.096 1.00 0.00 C ATOM 56 O GLN A 3 -0.875 -7.538 -8.055 1.00 0.00 O ATOM 57 CB GLN A 3 -1.624 -5.579 -5.639 1.00 0.00 C ATOM 58 CG GLN A 3 -0.677 -4.409 -5.423 1.00 0.00 C ATOM 59 CD GLN A 3 -1.039 -3.583 -4.205 1.00 0.00 C ATOM 60 OE1 GLN A 3 -0.578 -3.855 -3.096 1.00 0.00 O ATOM 61 NE2 GLN A 3 -1.869 -2.565 -4.405 1.00 0.00 N ATOM 0 H GLN A 3 0.099 -6.270 -4.018 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.651 -7.727 -5.617 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -2.191 -5.412 -6.555 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -2.343 -5.610 -4.820 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.340 -4.785 -5.313 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.687 -3.771 -6.306 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.227 -2.375 -5.341 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -2.148 -1.973 -3.623 1.00 0.00 H new ATOM 70 N LEU A 4 1.016 -6.689 -7.178 1.00 0.00 N ATOM 71 CA LEU A 4 1.764 -6.778 -8.427 1.00 0.00 C ATOM 72 C LEU A 4 2.522 -8.099 -8.515 1.00 0.00 C ATOM 73 O LEU A 4 3.088 -8.433 -9.556 1.00 0.00 O ATOM 74 CB LEU A 4 2.742 -5.607 -8.543 1.00 0.00 C ATOM 75 CG LEU A 4 2.218 -4.364 -9.263 1.00 0.00 C ATOM 76 CD1 LEU A 4 0.894 -3.918 -8.664 1.00 0.00 C ATOM 77 CD2 LEU A 4 3.241 -3.239 -9.198 1.00 0.00 C ATOM 0 H LEU A 4 1.547 -6.307 -6.395 1.00 0.00 H new ATOM 0 HA LEU A 4 1.053 -6.733 -9.252 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.052 -5.317 -7.539 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.634 -5.955 -9.064 1.00 0.00 H new ATOM 0 HG LEU A 4 2.052 -4.617 -10.310 1.00 0.00 H new ATOM 0 HD11 LEU A 4 0.537 -3.032 -9.189 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.161 -4.719 -8.764 1.00 0.00 H new ATOM 0 HD13 LEU A 4 1.033 -3.683 -7.609 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.851 -2.362 -9.715 1.00 0.00 H new ATOM 0 HD22 LEU A 4 3.439 -2.987 -8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.166 -3.561 -9.676 1.00 0.00 H new ATOM 89 N SER A 5 2.527 -8.846 -7.416 1.00 0.00 N ATOM 90 CA SER A 5 3.217 -10.130 -7.368 1.00 0.00 C ATOM 91 C SER A 5 2.584 -11.123 -8.339 1.00 0.00 C ATOM 92 O SER A 5 3.166 -12.163 -8.648 1.00 0.00 O ATOM 93 CB SER A 5 3.185 -10.697 -5.948 1.00 0.00 C ATOM 94 OG SER A 5 1.958 -11.357 -5.689 1.00 0.00 O ATOM 0 H SER A 5 2.061 -8.585 -6.547 1.00 0.00 H new ATOM 0 HA SER A 5 4.254 -9.969 -7.664 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.012 -11.394 -5.813 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.327 -9.891 -5.228 1.00 0.00 H new ATOM 0 HG SER A 5 1.224 -10.709 -5.724 1.00 0.00 H new ATOM 100 N LYS A 6 1.388 -10.794 -8.816 1.00 0.00 N ATOM 101 CA LYS A 6 0.675 -11.654 -9.752 1.00 0.00 C ATOM 102 C LYS A 6 1.594 -12.111 -10.880 1.00 0.00 C ATOM 103 O LYS A 6 1.478 -13.234 -11.373 1.00 0.00 O ATOM 104 CB LYS A 6 -0.535 -10.918 -10.332 1.00 0.00 C ATOM 105 CG LYS A 6 -1.666 -11.842 -10.750 1.00 0.00 C ATOM 106 CD LYS A 6 -2.388 -12.421 -9.545 1.00 0.00 C ATOM 107 CE LYS A 6 -3.378 -11.427 -8.958 1.00 0.00 C ATOM 108 NZ LYS A 6 -4.562 -11.237 -9.840 1.00 0.00 N ATOM 0 H LYS A 6 0.892 -9.937 -8.569 1.00 0.00 H new ATOM 0 HA LYS A 6 0.331 -12.534 -9.208 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.909 -10.211 -9.591 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -0.215 -10.335 -11.196 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.374 -11.293 -11.371 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.268 -12.652 -11.361 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.913 -13.330 -9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.660 -12.703 -8.784 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.707 -11.777 -7.979 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.882 -10.469 -8.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -5.331 -10.794 -9.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -4.304 -10.624 -10.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.879 -12.160 -10.200 1.00 0.00 H new ATOM 122 N LEU A 7 2.508 -11.235 -11.284 1.00 0.00 N ATOM 123 CA LEU A 7 3.448 -11.549 -12.354 1.00 0.00 C ATOM 124 C LEU A 7 4.751 -12.106 -11.787 1.00 0.00 C ATOM 125 O LEU A 7 5.464 -12.851 -12.459 1.00 0.00 O ATOM 126 CB LEU A 7 3.736 -10.300 -13.190 1.00 0.00 C ATOM 127 CG LEU A 7 4.708 -10.482 -14.356 1.00 0.00 C ATOM 128 CD1 LEU A 7 6.146 -10.420 -13.867 1.00 0.00 C ATOM 129 CD2 LEU A 7 4.442 -11.799 -15.071 1.00 0.00 C ATOM 0 H LEU A 7 2.618 -10.302 -10.887 1.00 0.00 H new ATOM 0 HA LEU A 7 2.995 -12.309 -12.991 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.792 -9.926 -13.585 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.133 -9.529 -12.530 1.00 0.00 H new ATOM 0 HG LEU A 7 4.552 -9.669 -15.065 1.00 0.00 H new ATOM 0 HD11 LEU A 7 6.823 -10.552 -14.711 1.00 0.00 H new ATOM 0 HD12 LEU A 7 6.330 -9.452 -13.401 1.00 0.00 H new ATOM 0 HD13 LEU A 7 6.317 -11.212 -13.138 1.00 0.00 H new ATOM 0 HD21 LEU A 7 5.143 -11.912 -15.898 1.00 0.00 H new ATOM 0 HD22 LEU A 7 4.570 -12.625 -14.371 1.00 0.00 H new ATOM 0 HD23 LEU A 7 3.422 -11.804 -15.456 1.00 0.00 H new ATOM 141 N LYS A 8 5.054 -11.741 -10.546 1.00 0.00 N ATOM 142 CA LYS A 8 6.268 -12.206 -9.887 1.00 0.00 C ATOM 143 C LYS A 8 6.419 -13.718 -10.029 1.00 0.00 C ATOM 144 O LYS A 8 7.380 -14.201 -10.628 1.00 0.00 O ATOM 145 CB LYS A 8 6.248 -11.822 -8.405 1.00 0.00 C ATOM 146 CG LYS A 8 7.549 -12.120 -7.682 1.00 0.00 C ATOM 147 CD LYS A 8 7.312 -12.928 -6.417 1.00 0.00 C ATOM 148 CE LYS A 8 7.027 -12.028 -5.225 1.00 0.00 C ATOM 149 NZ LYS A 8 6.660 -12.811 -4.013 1.00 0.00 N ATOM 0 H LYS A 8 4.475 -11.124 -9.976 1.00 0.00 H new ATOM 0 HA LYS A 8 7.120 -11.726 -10.369 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.029 -10.758 -8.317 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.437 -12.357 -7.911 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.217 -12.669 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.048 -11.185 -7.429 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.473 -13.607 -6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 8 8.187 -13.544 -6.208 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.906 -11.419 -5.012 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.217 -11.342 -5.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.474 -12.161 -3.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.807 -13.373 -4.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.443 -13.447 -3.760 1.00 0.00 H new ATOM 163 N ARG A 9 5.464 -14.458 -9.475 1.00 0.00 N ATOM 164 CA ARG A 9 5.492 -15.914 -9.540 1.00 0.00 C ATOM 165 C ARG A 9 5.796 -16.389 -10.958 1.00 0.00 C ATOM 166 O ARG A 9 6.720 -17.173 -11.177 1.00 0.00 O ATOM 167 CB ARG A 9 4.155 -16.492 -9.073 1.00 0.00 C ATOM 168 CG ARG A 9 3.768 -16.072 -7.665 1.00 0.00 C ATOM 169 CD ARG A 9 4.476 -16.917 -6.617 1.00 0.00 C ATOM 170 NE ARG A 9 3.956 -18.281 -6.571 1.00 0.00 N ATOM 171 CZ ARG A 9 4.575 -19.283 -5.957 1.00 0.00 C ATOM 172 NH1 ARG A 9 5.730 -19.075 -5.341 1.00 0.00 N ATOM 173 NH2 ARG A 9 4.038 -20.497 -5.959 1.00 0.00 N ATOM 0 H ARG A 9 4.662 -14.073 -8.976 1.00 0.00 H new ATOM 0 HA ARG A 9 6.284 -16.267 -8.879 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.372 -16.179 -9.764 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.204 -17.580 -9.118 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.017 -15.021 -7.516 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.689 -16.164 -7.540 1.00 0.00 H new ATOM 0 HD2 ARG A 9 5.544 -16.943 -6.834 1.00 0.00 H new ATOM 0 HD3 ARG A 9 4.361 -16.452 -5.638 1.00 0.00 H new ATOM 0 HE ARG A 9 3.069 -18.475 -7.036 1.00 0.00 H new ATOM 0 HH11 ARG A 9 6.146 -18.144 -5.338 1.00 0.00 H new ATOM 0 HH12 ARG A 9 6.203 -19.846 -4.870 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.149 -20.661 -6.432 1.00 0.00 H new ATOM 0 HH22 ARG A 9 4.514 -21.266 -5.487 1.00 0.00 H new ATOM 187 N PHE A 10 5.013 -15.909 -11.918 1.00 0.00 N ATOM 188 CA PHE A 10 5.197 -16.285 -13.315 1.00 0.00 C ATOM 189 C PHE A 10 6.611 -15.955 -13.785 1.00 0.00 C ATOM 190 O PHE A 10 7.199 -16.687 -14.582 1.00 0.00 O ATOM 191 CB PHE A 10 4.174 -15.568 -14.198 1.00 0.00 C ATOM 192 CG PHE A 10 4.397 -15.780 -15.668 1.00 0.00 C ATOM 193 CD1 PHE A 10 4.967 -16.954 -16.134 1.00 0.00 C ATOM 194 CD2 PHE A 10 4.037 -14.805 -16.584 1.00 0.00 C ATOM 195 CE1 PHE A 10 5.174 -17.151 -17.486 1.00 0.00 C ATOM 196 CE2 PHE A 10 4.242 -14.997 -17.938 1.00 0.00 C ATOM 197 CZ PHE A 10 4.810 -16.172 -18.389 1.00 0.00 C ATOM 0 H PHE A 10 4.245 -15.259 -11.754 1.00 0.00 H new ATOM 0 HA PHE A 10 5.047 -17.361 -13.398 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.174 -15.915 -13.937 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.207 -14.500 -13.984 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.253 -17.724 -15.432 1.00 0.00 H new ATOM 0 HD2 PHE A 10 3.591 -13.885 -16.237 1.00 0.00 H new ATOM 0 HE1 PHE A 10 5.620 -18.070 -17.836 1.00 0.00 H new ATOM 0 HE2 PHE A 10 3.958 -14.229 -18.642 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.969 -16.325 -19.446 1.00 0.00 H new ATOM 207 N LEU A 11 7.150 -14.848 -13.287 1.00 0.00 N ATOM 208 CA LEU A 11 8.495 -14.419 -13.655 1.00 0.00 C ATOM 209 C LEU A 11 9.543 -15.377 -13.099 1.00 0.00 C ATOM 210 O LEU A 11 10.283 -16.011 -13.852 1.00 0.00 O ATOM 211 CB LEU A 11 8.758 -13.002 -13.142 1.00 0.00 C ATOM 212 CG LEU A 11 9.458 -12.055 -14.117 1.00 0.00 C ATOM 213 CD1 LEU A 11 10.865 -12.545 -14.420 1.00 0.00 C ATOM 214 CD2 LEU A 11 8.651 -11.918 -15.400 1.00 0.00 C ATOM 0 H LEU A 11 6.676 -14.231 -12.627 1.00 0.00 H new ATOM 0 HA LEU A 11 8.567 -14.424 -14.743 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.805 -12.558 -12.856 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.362 -13.071 -12.237 1.00 0.00 H new ATOM 0 HG LEU A 11 9.530 -11.073 -13.650 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.348 -11.858 -15.116 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.441 -12.590 -13.496 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.816 -13.538 -14.866 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.164 -11.240 -16.082 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.546 -12.896 -15.870 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.663 -11.520 -15.168 1.00 0.00 H new ATOM 226 N THR A 12 9.601 -15.479 -11.774 1.00 0.00 N ATOM 227 CA THR A 12 10.558 -16.360 -11.116 1.00 0.00 C ATOM 228 C THR A 12 10.560 -17.744 -11.755 1.00 0.00 C ATOM 229 O THR A 12 11.617 -18.299 -12.057 1.00 0.00 O ATOM 230 CB THR A 12 10.250 -16.500 -9.614 1.00 0.00 C ATOM 231 OG1 THR A 12 11.065 -17.530 -9.041 1.00 0.00 O ATOM 232 CG2 THR A 12 8.781 -16.825 -9.390 1.00 0.00 C ATOM 0 H THR A 12 8.996 -14.962 -11.136 1.00 0.00 H new ATOM 0 HA THR A 12 11.542 -15.906 -11.237 1.00 0.00 H new ATOM 0 HB THR A 12 10.473 -15.549 -9.130 1.00 0.00 H new ATOM 0 HG1 THR A 12 11.507 -17.188 -8.236 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.588 -16.919 -8.321 1.00 0.00 H new ATOM 0 HG22 THR A 12 8.165 -16.025 -9.801 1.00 0.00 H new ATOM 0 HG23 THR A 12 8.536 -17.764 -9.887 1.00 0.00 H new ATOM 240 N THR A 13 9.369 -18.298 -11.959 1.00 0.00 N ATOM 241 CA THR A 13 9.233 -19.618 -12.561 1.00 0.00 C ATOM 242 C THR A 13 9.585 -19.585 -14.044 1.00 0.00 C ATOM 243 O THR A 13 10.144 -20.542 -14.582 1.00 0.00 O ATOM 244 CB THR A 13 7.803 -20.167 -12.397 1.00 0.00 C ATOM 245 OG1 THR A 13 7.726 -21.498 -12.920 1.00 0.00 O ATOM 246 CG2 THR A 13 6.797 -19.277 -13.110 1.00 0.00 C ATOM 0 H THR A 13 8.484 -17.852 -11.716 1.00 0.00 H new ATOM 0 HA THR A 13 9.928 -20.276 -12.039 1.00 0.00 H new ATOM 0 HB THR A 13 7.562 -20.181 -11.334 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.814 -21.840 -12.811 1.00 0.00 H new ATOM 0 HG21 THR A 13 5.794 -19.685 -12.980 1.00 0.00 H new ATOM 0 HG22 THR A 13 6.838 -18.272 -12.689 1.00 0.00 H new ATOM 0 HG23 THR A 13 7.037 -19.235 -14.172 1.00 0.00 H new ATOM 254 N LEU A 14 9.255 -18.478 -14.700 1.00 0.00 N ATOM 255 CA LEU A 14 9.538 -18.320 -16.123 1.00 0.00 C ATOM 256 C LEU A 14 11.036 -18.417 -16.395 1.00 0.00 C ATOM 257 O LEU A 14 11.459 -19.023 -17.379 1.00 0.00 O ATOM 258 CB LEU A 14 9.003 -16.976 -16.622 1.00 0.00 C ATOM 259 CG LEU A 14 9.551 -16.494 -17.966 1.00 0.00 C ATOM 260 CD1 LEU A 14 8.412 -16.140 -18.910 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.473 -15.300 -17.769 1.00 0.00 C ATOM 0 H LEU A 14 8.792 -17.677 -14.270 1.00 0.00 H new ATOM 0 HA LEU A 14 9.038 -19.126 -16.660 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.918 -17.045 -16.698 1.00 0.00 H new ATOM 0 HB3 LEU A 14 9.222 -16.218 -15.870 1.00 0.00 H new ATOM 0 HG LEU A 14 10.128 -17.303 -18.413 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.821 -15.799 -19.861 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.791 -17.020 -19.076 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.808 -15.347 -18.470 1.00 0.00 H new ATOM 0 HD21 LEU A 14 10.853 -14.971 -18.736 1.00 0.00 H new ATOM 0 HD22 LEU A 14 9.919 -14.486 -17.301 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.308 -15.586 -17.129 1.00 0.00 H new ATOM 273 N GLN A 15 11.832 -17.818 -15.515 1.00 0.00 N ATOM 274 CA GLN A 15 13.282 -17.839 -15.660 1.00 0.00 C ATOM 275 C GLN A 15 13.875 -19.093 -15.026 1.00 0.00 C ATOM 276 O GLN A 15 14.912 -19.590 -15.464 1.00 0.00 O ATOM 277 CB GLN A 15 13.898 -16.592 -15.023 1.00 0.00 C ATOM 278 CG GLN A 15 13.501 -16.392 -13.569 1.00 0.00 C ATOM 279 CD GLN A 15 14.502 -15.551 -12.801 1.00 0.00 C ATOM 280 OE1 GLN A 15 15.652 -15.949 -12.616 1.00 0.00 O ATOM 281 NE2 GLN A 15 14.068 -14.380 -12.350 1.00 0.00 N ATOM 0 H GLN A 15 11.497 -17.313 -14.695 1.00 0.00 H new ATOM 0 HA GLN A 15 13.515 -17.847 -16.725 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.984 -16.660 -15.088 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.598 -15.715 -15.597 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.522 -15.914 -13.526 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.403 -17.364 -13.086 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.106 -14.090 -12.527 1.00 0.00 H new ATOM 0 HE22 GLN A 15 14.696 -13.770 -11.827 1.00 0.00 H new ATOM 290 N GLN A 16 13.209 -19.600 -13.993 1.00 0.00 N ATOM 291 CA GLN A 16 13.671 -20.796 -13.299 1.00 0.00 C ATOM 292 C GLN A 16 13.504 -22.033 -14.176 1.00 0.00 C ATOM 293 O GLN A 16 14.386 -22.890 -14.231 1.00 0.00 O ATOM 294 CB GLN A 16 12.904 -20.978 -11.988 1.00 0.00 C ATOM 295 CG GLN A 16 12.723 -22.433 -11.587 1.00 0.00 C ATOM 296 CD GLN A 16 14.041 -23.172 -11.461 1.00 0.00 C ATOM 297 OE1 GLN A 16 14.198 -24.278 -11.980 1.00 0.00 O ATOM 298 NE2 GLN A 16 14.997 -22.564 -10.768 1.00 0.00 N ATOM 0 H GLN A 16 12.348 -19.201 -13.619 1.00 0.00 H new ATOM 0 HA GLN A 16 14.731 -20.671 -13.077 1.00 0.00 H new ATOM 0 HB2 GLN A 16 13.432 -20.453 -11.192 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.924 -20.511 -12.082 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.192 -22.481 -10.636 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.099 -22.935 -12.326 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.823 -21.648 -10.355 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.905 -23.013 -10.649 1.00 0.00 H new ATOM 307 N PHE A 17 12.368 -22.119 -14.859 1.00 0.00 N ATOM 308 CA PHE A 17 12.085 -23.252 -15.732 1.00 0.00 C ATOM 309 C PHE A 17 12.458 -22.932 -17.177 1.00 0.00 C ATOM 310 O PHE A 17 12.471 -23.812 -18.036 1.00 0.00 O ATOM 311 CB PHE A 17 10.605 -23.631 -15.648 1.00 0.00 C ATOM 312 CG PHE A 17 10.369 -25.112 -15.573 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.943 -25.868 -14.564 1.00 0.00 C ATOM 314 CD2 PHE A 17 9.573 -25.749 -16.512 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.728 -27.232 -14.492 1.00 0.00 C ATOM 316 CE2 PHE A 17 9.353 -27.111 -16.444 1.00 0.00 C ATOM 317 CZ PHE A 17 9.932 -27.854 -15.434 1.00 0.00 C ATOM 0 H PHE A 17 11.628 -21.418 -14.825 1.00 0.00 H new ATOM 0 HA PHE A 17 12.689 -24.096 -15.397 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.166 -23.156 -14.771 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.086 -23.232 -16.520 1.00 0.00 H new ATOM 0 HD1 PHE A 17 11.566 -25.386 -13.825 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.120 -25.174 -17.306 1.00 0.00 H new ATOM 0 HE1 PHE A 17 11.182 -27.810 -13.701 1.00 0.00 H new ATOM 0 HE2 PHE A 17 8.728 -27.595 -17.180 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.763 -28.919 -15.381 1.00 0.00 H new ATOM 327 N GLY A 18 12.762 -21.663 -17.436 1.00 0.00 N ATOM 328 CA GLY A 18 13.130 -21.248 -18.777 1.00 0.00 C ATOM 329 C GLY A 18 14.300 -22.039 -19.328 1.00 0.00 C ATOM 330 O GLY A 18 14.463 -22.154 -20.542 1.00 0.00 O ATOM 0 H GLY A 18 12.760 -20.916 -16.741 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.272 -21.366 -19.439 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.383 -20.188 -18.769 1.00 0.00 H new ATOM 334 N ASN A 19 15.117 -22.585 -18.433 1.00 0.00 N ATOM 335 CA ASN A 19 16.280 -23.368 -18.837 1.00 0.00 C ATOM 336 C ASN A 19 15.873 -24.787 -19.222 1.00 0.00 C ATOM 337 O ASN A 19 16.632 -25.506 -19.872 1.00 0.00 O ATOM 338 CB ASN A 19 17.310 -23.409 -17.707 1.00 0.00 C ATOM 339 CG ASN A 19 18.319 -24.527 -17.885 1.00 0.00 C ATOM 340 OD1 ASN A 19 18.094 -25.657 -17.451 1.00 0.00 O ATOM 341 ND2 ASN A 19 19.440 -24.215 -18.526 1.00 0.00 N ATOM 0 H ASN A 19 14.996 -22.500 -17.424 1.00 0.00 H new ATOM 0 HA ASN A 19 16.726 -22.888 -19.708 1.00 0.00 H new ATOM 0 HB2 ASN A 19 17.834 -22.454 -17.662 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.796 -23.536 -16.754 1.00 0.00 H new ATOM 0 HD21 ASN A 19 20.157 -24.925 -18.676 1.00 0.00 H new ATOM 0 HD22 ASN A 19 19.584 -23.265 -18.869 1.00 0.00 H new ATOM 348 N ASP A 20 14.672 -25.183 -18.816 1.00 0.00 N ATOM 349 CA ASP A 20 14.163 -26.515 -19.119 1.00 0.00 C ATOM 350 C ASP A 20 13.563 -26.562 -20.521 1.00 0.00 C ATOM 351 O ASP A 20 13.881 -27.449 -21.313 1.00 0.00 O ATOM 352 CB ASP A 20 13.113 -26.930 -18.087 1.00 0.00 C ATOM 353 CG ASP A 20 12.422 -28.229 -18.455 1.00 0.00 C ATOM 354 OD1 ASP A 20 13.026 -29.302 -18.246 1.00 0.00 O ATOM 355 OD2 ASP A 20 11.277 -28.173 -18.951 1.00 0.00 O ATOM 0 H ASP A 20 14.032 -24.600 -18.276 1.00 0.00 H new ATOM 0 HA ASP A 20 14.998 -27.214 -19.077 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.589 -27.038 -17.112 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.368 -26.140 -17.992 1.00 0.00 H new ATOM 360 N ILE A 21 12.693 -25.602 -20.819 1.00 0.00 N ATOM 361 CA ILE A 21 12.049 -25.534 -22.125 1.00 0.00 C ATOM 362 C ILE A 21 13.075 -25.624 -23.249 1.00 0.00 C ATOM 363 O ILE A 21 12.853 -26.300 -24.254 1.00 0.00 O ATOM 364 CB ILE A 21 11.240 -24.234 -22.286 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.736 -24.097 -23.725 1.00 0.00 C ATOM 366 CG2 ILE A 21 12.087 -23.031 -21.899 1.00 0.00 C ATOM 367 CD1 ILE A 21 9.908 -22.853 -23.958 1.00 0.00 C ATOM 0 H ILE A 21 12.418 -24.861 -20.174 1.00 0.00 H new ATOM 0 HA ILE A 21 11.370 -26.385 -22.187 1.00 0.00 H new ATOM 0 HB ILE A 21 10.378 -24.275 -21.621 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.591 -24.087 -24.402 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.139 -24.974 -23.978 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.501 -22.120 -22.018 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.402 -23.127 -20.860 1.00 0.00 H new ATOM 0 HG23 ILE A 21 12.966 -22.983 -22.541 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.585 -22.821 -24.998 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.034 -22.870 -23.307 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.508 -21.970 -23.737 1.00 0.00 H new ATOM 379 N SER A 22 14.201 -24.940 -23.072 1.00 0.00 N ATOM 380 CA SER A 22 15.262 -24.941 -24.073 1.00 0.00 C ATOM 381 C SER A 22 16.426 -24.059 -23.631 1.00 0.00 C ATOM 382 O SER A 22 16.284 -23.180 -22.781 1.00 0.00 O ATOM 383 CB SER A 22 14.722 -24.455 -25.419 1.00 0.00 C ATOM 384 OG SER A 22 13.661 -23.532 -25.241 1.00 0.00 O ATOM 0 H SER A 22 14.402 -24.378 -22.245 1.00 0.00 H new ATOM 0 HA SER A 22 15.624 -25.963 -24.182 1.00 0.00 H new ATOM 0 HB2 SER A 22 15.525 -23.986 -25.988 1.00 0.00 H new ATOM 0 HB3 SER A 22 14.373 -25.307 -26.003 1.00 0.00 H new ATOM 0 HG SER A 22 13.335 -23.236 -26.116 1.00 0.00 H new ATOM 390 N PRO A 23 17.606 -24.299 -24.222 1.00 0.00 N ATOM 391 CA PRO A 23 18.818 -23.538 -23.906 1.00 0.00 C ATOM 392 C PRO A 23 18.748 -22.100 -24.410 1.00 0.00 C ATOM 393 O PRO A 23 19.017 -21.159 -23.665 1.00 0.00 O ATOM 394 CB PRO A 23 19.921 -24.307 -24.638 1.00 0.00 C ATOM 395 CG PRO A 23 19.221 -24.999 -25.757 1.00 0.00 C ATOM 396 CD PRO A 23 17.847 -25.332 -25.243 1.00 0.00 C ATOM 0 HA PRO A 23 18.978 -23.455 -22.831 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.693 -23.634 -25.010 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.412 -25.021 -23.976 1.00 0.00 H new ATOM 0 HG2 PRO A 23 19.164 -24.358 -26.637 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.756 -25.901 -26.054 1.00 0.00 H new ATOM 0 HD2 PRO A 23 17.101 -25.294 -26.037 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.809 -26.335 -24.817 1.00 0.00 H new ATOM 404 N GLU A 24 18.383 -21.940 -25.678 1.00 0.00 N ATOM 405 CA GLU A 24 18.278 -20.616 -26.280 1.00 0.00 C ATOM 406 C GLU A 24 17.384 -19.706 -25.442 1.00 0.00 C ATOM 407 O GLU A 24 17.871 -18.843 -24.710 1.00 0.00 O ATOM 408 CB GLU A 24 17.726 -20.720 -27.703 1.00 0.00 C ATOM 409 CG GLU A 24 16.756 -21.874 -27.896 1.00 0.00 C ATOM 410 CD GLU A 24 17.380 -23.044 -28.632 1.00 0.00 C ATOM 411 OE1 GLU A 24 17.994 -22.815 -29.695 1.00 0.00 O ATOM 412 OE2 GLU A 24 17.255 -24.187 -28.146 1.00 0.00 O ATOM 0 H GLU A 24 18.155 -22.710 -26.308 1.00 0.00 H new ATOM 0 HA GLU A 24 19.277 -20.182 -26.316 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.223 -19.787 -27.958 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.557 -20.835 -28.399 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.399 -22.211 -26.923 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.886 -21.523 -28.451 1.00 0.00 H new ATOM 419 N ILE A 25 16.076 -19.906 -25.554 1.00 0.00 N ATOM 420 CA ILE A 25 15.114 -19.105 -24.806 1.00 0.00 C ATOM 421 C ILE A 25 15.464 -19.070 -23.322 1.00 0.00 C ATOM 422 O ILE A 25 15.223 -18.075 -22.641 1.00 0.00 O ATOM 423 CB ILE A 25 13.681 -19.645 -24.972 1.00 0.00 C ATOM 424 CG1 ILE A 25 12.722 -18.507 -25.326 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.231 -20.350 -23.702 1.00 0.00 C ATOM 426 CD1 ILE A 25 12.760 -17.357 -24.344 1.00 0.00 C ATOM 0 H ILE A 25 15.657 -20.616 -26.155 1.00 0.00 H new ATOM 0 HA ILE A 25 15.161 -18.095 -25.212 1.00 0.00 H new ATOM 0 HB ILE A 25 13.672 -20.368 -25.788 1.00 0.00 H new ATOM 0 HG12 ILE A 25 12.966 -18.133 -26.320 1.00 0.00 H new ATOM 0 HG13 ILE A 25 11.706 -18.900 -25.374 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.217 -20.726 -23.835 1.00 0.00 H new ATOM 0 HG22 ILE A 25 13.902 -21.183 -23.491 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.251 -19.647 -22.869 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.055 -16.587 -24.658 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.487 -17.716 -23.352 1.00 0.00 H new ATOM 0 HD13 ILE A 25 13.766 -16.938 -24.314 1.00 0.00 H new ATOM 438 N GLY A 26 16.035 -20.165 -22.828 1.00 0.00 N ATOM 439 CA GLY A 26 16.410 -20.238 -21.428 1.00 0.00 C ATOM 440 C GLY A 26 17.465 -19.215 -21.057 1.00 0.00 C ATOM 441 O GLY A 26 17.209 -18.312 -20.262 1.00 0.00 O ATOM 0 H GLY A 26 16.244 -21.002 -23.372 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.526 -20.084 -20.810 1.00 0.00 H new ATOM 0 HA3 GLY A 26 16.784 -21.238 -21.207 1.00 0.00 H new ATOM 445 N GLU A 27 18.655 -19.359 -21.632 1.00 0.00 N ATOM 446 CA GLU A 27 19.753 -18.441 -21.353 1.00 0.00 C ATOM 447 C GLU A 27 19.302 -16.991 -21.507 1.00 0.00 C ATOM 448 O GLU A 27 19.702 -16.121 -20.733 1.00 0.00 O ATOM 449 CB GLU A 27 20.931 -18.722 -22.288 1.00 0.00 C ATOM 450 CG GLU A 27 20.809 -18.043 -23.642 1.00 0.00 C ATOM 451 CD GLU A 27 21.729 -18.649 -24.684 1.00 0.00 C ATOM 452 OE1 GLU A 27 21.668 -19.880 -24.886 1.00 0.00 O ATOM 453 OE2 GLU A 27 22.511 -17.892 -25.297 1.00 0.00 O ATOM 0 H GLU A 27 18.883 -20.102 -22.293 1.00 0.00 H new ATOM 0 HA GLU A 27 20.071 -18.597 -20.322 1.00 0.00 H new ATOM 0 HB2 GLU A 27 21.852 -18.392 -21.807 1.00 0.00 H new ATOM 0 HB3 GLU A 27 21.017 -19.798 -22.437 1.00 0.00 H new ATOM 0 HG2 GLU A 27 19.778 -18.114 -23.988 1.00 0.00 H new ATOM 0 HG3 GLU A 27 21.037 -16.983 -23.534 1.00 0.00 H new ATOM 460 N ARG A 28 18.469 -16.740 -22.511 1.00 0.00 N ATOM 461 CA ARG A 28 17.965 -15.396 -22.767 1.00 0.00 C ATOM 462 C ARG A 28 17.061 -14.928 -21.630 1.00 0.00 C ATOM 463 O ARG A 28 17.336 -13.919 -20.980 1.00 0.00 O ATOM 464 CB ARG A 28 17.197 -15.360 -24.090 1.00 0.00 C ATOM 465 CG ARG A 28 17.363 -14.058 -24.855 1.00 0.00 C ATOM 466 CD ARG A 28 18.504 -14.142 -25.857 1.00 0.00 C ATOM 467 NE ARG A 28 19.399 -12.991 -25.765 1.00 0.00 N ATOM 468 CZ ARG A 28 20.404 -12.773 -26.606 1.00 0.00 C ATOM 469 NH1 ARG A 28 20.641 -13.622 -27.596 1.00 0.00 N ATOM 470 NH2 ARG A 28 21.175 -11.704 -26.457 1.00 0.00 N ATOM 0 H ARG A 28 18.129 -17.449 -23.160 1.00 0.00 H new ATOM 0 HA ARG A 28 18.819 -14.721 -22.831 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.532 -16.186 -24.718 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.138 -15.522 -23.890 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.436 -13.821 -25.377 1.00 0.00 H new ATOM 0 HG3 ARG A 28 17.552 -13.245 -24.154 1.00 0.00 H new ATOM 0 HD2 ARG A 28 19.071 -15.057 -25.685 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.097 -14.205 -26.866 1.00 0.00 H new ATOM 0 HE ARG A 28 19.244 -12.318 -25.014 1.00 0.00 H new ATOM 0 HH11 ARG A 28 20.051 -14.446 -27.714 1.00 0.00 H new ATOM 0 HH12 ARG A 28 21.413 -13.452 -28.240 1.00 0.00 H new ATOM 0 HH21 ARG A 28 20.996 -11.048 -25.696 1.00 0.00 H new ATOM 0 HH22 ARG A 28 21.946 -11.537 -27.103 1.00 0.00 H new ATOM 484 N VAL A 29 15.982 -15.668 -21.395 1.00 0.00 N ATOM 485 CA VAL A 29 15.039 -15.329 -20.336 1.00 0.00 C ATOM 486 C VAL A 29 15.767 -14.928 -19.058 1.00 0.00 C ATOM 487 O VAL A 29 15.566 -13.833 -18.534 1.00 0.00 O ATOM 488 CB VAL A 29 14.094 -16.506 -20.028 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.335 -16.257 -18.734 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.133 -16.734 -21.185 1.00 0.00 C ATOM 0 H VAL A 29 15.739 -16.506 -21.924 1.00 0.00 H new ATOM 0 HA VAL A 29 14.451 -14.485 -20.695 1.00 0.00 H new ATOM 0 HB VAL A 29 14.694 -17.407 -19.901 1.00 0.00 H new ATOM 0 HG11 VAL A 29 12.673 -17.099 -18.533 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.043 -16.148 -17.912 1.00 0.00 H new ATOM 0 HG13 VAL A 29 12.745 -15.345 -18.828 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.473 -17.569 -20.950 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.538 -15.835 -21.346 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.699 -16.961 -22.088 1.00 0.00 H new ATOM 500 N ARG A 30 16.615 -15.823 -18.562 1.00 0.00 N ATOM 501 CA ARG A 30 17.374 -15.564 -17.344 1.00 0.00 C ATOM 502 C ARG A 30 18.283 -14.351 -17.519 1.00 0.00 C ATOM 503 O ARG A 30 18.355 -13.484 -16.647 1.00 0.00 O ATOM 504 CB ARG A 30 18.207 -16.789 -16.966 1.00 0.00 C ATOM 505 CG ARG A 30 19.178 -17.225 -18.052 1.00 0.00 C ATOM 506 CD ARG A 30 19.654 -18.652 -17.833 1.00 0.00 C ATOM 507 NE ARG A 30 19.963 -18.917 -16.431 1.00 0.00 N ATOM 508 CZ ARG A 30 20.134 -20.137 -15.934 1.00 0.00 C ATOM 509 NH1 ARG A 30 20.027 -21.199 -16.722 1.00 0.00 N ATOM 510 NH2 ARG A 30 20.413 -20.298 -14.647 1.00 0.00 N ATOM 0 H ARG A 30 16.794 -16.734 -18.985 1.00 0.00 H new ATOM 0 HA ARG A 30 16.666 -15.354 -16.542 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.767 -16.571 -16.057 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.536 -17.617 -16.736 1.00 0.00 H new ATOM 0 HG2 ARG A 30 18.695 -17.147 -19.026 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.036 -16.552 -18.066 1.00 0.00 H new ATOM 0 HD2 ARG A 30 18.885 -19.346 -18.172 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.540 -18.836 -18.440 1.00 0.00 H new ATOM 0 HE ARG A 30 20.052 -18.122 -15.798 1.00 0.00 H new ATOM 0 HH11 ARG A 30 19.813 -21.080 -17.712 1.00 0.00 H new ATOM 0 HH12 ARG A 30 20.159 -22.135 -16.338 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.496 -19.484 -14.038 1.00 0.00 H new ATOM 0 HH22 ARG A 30 20.544 -21.235 -14.267 1.00 0.00 H new ATOM 524 N THR A 31 18.978 -14.296 -18.651 1.00 0.00 N ATOM 525 CA THR A 31 19.884 -13.192 -18.940 1.00 0.00 C ATOM 526 C THR A 31 19.173 -11.850 -18.813 1.00 0.00 C ATOM 527 O THR A 31 19.570 -10.998 -18.017 1.00 0.00 O ATOM 528 CB THR A 31 20.483 -13.311 -20.354 1.00 0.00 C ATOM 529 OG1 THR A 31 21.467 -14.351 -20.383 1.00 0.00 O ATOM 530 CG2 THR A 31 21.114 -11.997 -20.787 1.00 0.00 C ATOM 0 H THR A 31 18.930 -15.004 -19.383 1.00 0.00 H new ATOM 0 HA THR A 31 20.689 -13.245 -18.207 1.00 0.00 H new ATOM 0 HB THR A 31 19.677 -13.554 -21.047 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.022 -15.220 -20.467 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.530 -12.106 -21.789 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.356 -11.214 -20.792 1.00 0.00 H new ATOM 0 HG23 THR A 31 21.909 -11.728 -20.091 1.00 0.00 H new ATOM 538 N LEU A 32 18.120 -11.667 -19.601 1.00 0.00 N ATOM 539 CA LEU A 32 17.351 -10.427 -19.577 1.00 0.00 C ATOM 540 C LEU A 32 16.779 -10.168 -18.187 1.00 0.00 C ATOM 541 O LEU A 32 17.036 -9.128 -17.582 1.00 0.00 O ATOM 542 CB LEU A 32 16.219 -10.485 -20.604 1.00 0.00 C ATOM 543 CG LEU A 32 16.568 -11.118 -21.952 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.440 -10.904 -22.949 1.00 0.00 C ATOM 545 CD2 LEU A 32 17.872 -10.546 -22.488 1.00 0.00 C ATOM 0 H LEU A 32 17.778 -12.362 -20.265 1.00 0.00 H new ATOM 0 HA LEU A 32 18.023 -9.607 -19.832 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.388 -11.040 -20.169 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.865 -9.470 -20.783 1.00 0.00 H new ATOM 0 HG LEU A 32 16.698 -12.190 -21.806 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.705 -11.361 -23.902 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.527 -11.362 -22.569 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.278 -9.836 -23.091 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.105 -11.008 -23.448 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.770 -9.469 -22.619 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.677 -10.751 -21.782 1.00 0.00 H new ATOM 557 N VAL A 33 16.003 -11.124 -17.685 1.00 0.00 N ATOM 558 CA VAL A 33 15.397 -11.001 -16.364 1.00 0.00 C ATOM 559 C VAL A 33 16.438 -10.633 -15.314 1.00 0.00 C ATOM 560 O VAL A 33 16.484 -9.497 -14.840 1.00 0.00 O ATOM 561 CB VAL A 33 14.699 -12.308 -15.944 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.224 -12.220 -14.501 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.539 -12.617 -16.878 1.00 0.00 C ATOM 0 H VAL A 33 15.779 -11.991 -18.173 1.00 0.00 H new ATOM 0 HA VAL A 33 14.655 -10.206 -16.429 1.00 0.00 H new ATOM 0 HB VAL A 33 15.419 -13.123 -16.015 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.733 -13.152 -14.222 1.00 0.00 H new ATOM 0 HG12 VAL A 33 15.079 -12.050 -13.846 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.519 -11.395 -14.400 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.058 -13.544 -16.566 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.816 -11.802 -16.842 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.911 -12.727 -17.897 1.00 0.00 H new ATOM 573 N LEU A 34 17.275 -11.600 -14.953 1.00 0.00 N ATOM 574 CA LEU A 34 18.318 -11.379 -13.958 1.00 0.00 C ATOM 575 C LEU A 34 19.138 -10.138 -14.296 1.00 0.00 C ATOM 576 O LEU A 34 19.631 -9.445 -13.407 1.00 0.00 O ATOM 577 CB LEU A 34 19.234 -12.601 -13.869 1.00 0.00 C ATOM 578 CG LEU A 34 18.536 -13.952 -13.712 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.540 -15.088 -13.831 1.00 0.00 C ATOM 580 CD2 LEU A 34 17.804 -14.022 -12.380 1.00 0.00 C ATOM 0 H LEU A 34 17.251 -12.545 -15.335 1.00 0.00 H new ATOM 0 HA LEU A 34 17.837 -11.223 -12.992 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.850 -12.635 -14.768 1.00 0.00 H new ATOM 0 HB3 LEU A 34 19.910 -12.463 -13.025 1.00 0.00 H new ATOM 0 HG LEU A 34 17.803 -14.057 -14.512 1.00 0.00 H new ATOM 0 HD11 LEU A 34 19.025 -16.042 -13.717 1.00 0.00 H new ATOM 0 HD12 LEU A 34 20.019 -15.049 -14.809 1.00 0.00 H new ATOM 0 HD13 LEU A 34 20.296 -14.988 -13.052 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.313 -14.990 -12.285 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.517 -13.896 -11.566 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.056 -13.230 -12.334 1.00 0.00 H new ATOM 592 N GLY A 35 19.280 -9.862 -15.589 1.00 0.00 N ATOM 593 CA GLY A 35 20.039 -8.704 -16.022 1.00 0.00 C ATOM 594 C GLY A 35 19.472 -7.405 -15.485 1.00 0.00 C ATOM 595 O GLY A 35 20.103 -6.734 -14.668 1.00 0.00 O ATOM 0 H GLY A 35 18.883 -10.420 -16.344 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.073 -8.808 -15.694 1.00 0.00 H new ATOM 0 HA3 GLY A 35 20.052 -8.668 -17.111 1.00 0.00 H new ATOM 599 N LEU A 36 18.278 -7.047 -15.946 1.00 0.00 N ATOM 600 CA LEU A 36 17.625 -5.818 -15.509 1.00 0.00 C ATOM 601 C LEU A 36 17.509 -5.775 -13.988 1.00 0.00 C ATOM 602 O LEU A 36 17.409 -4.702 -13.393 1.00 0.00 O ATOM 603 CB LEU A 36 16.238 -5.701 -16.141 1.00 0.00 C ATOM 604 CG LEU A 36 15.302 -6.892 -15.932 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.748 -6.894 -14.516 1.00 0.00 C ATOM 606 CD2 LEU A 36 14.170 -6.866 -16.949 1.00 0.00 C ATOM 0 H LEU A 36 17.742 -7.591 -16.623 1.00 0.00 H new ATOM 0 HA LEU A 36 18.236 -4.976 -15.833 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.753 -4.810 -15.743 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.361 -5.545 -17.213 1.00 0.00 H new ATOM 0 HG LEU A 36 15.874 -7.808 -16.078 1.00 0.00 H new ATOM 0 HD11 LEU A 36 14.084 -7.749 -14.386 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.570 -6.962 -13.804 1.00 0.00 H new ATOM 0 HD13 LEU A 36 14.192 -5.973 -14.342 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.514 -7.721 -16.785 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.600 -5.944 -16.835 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.584 -6.914 -17.956 1.00 0.00 H new ATOM 618 N VAL A 37 17.525 -6.949 -13.365 1.00 0.00 N ATOM 619 CA VAL A 37 17.425 -7.046 -11.914 1.00 0.00 C ATOM 620 C VAL A 37 18.681 -6.507 -11.239 1.00 0.00 C ATOM 621 O VAL A 37 18.612 -5.601 -10.409 1.00 0.00 O ATOM 622 CB VAL A 37 17.198 -8.501 -11.463 1.00 0.00 C ATOM 623 CG1 VAL A 37 17.417 -8.636 -9.964 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.802 -8.967 -11.850 1.00 0.00 C ATOM 0 H VAL A 37 17.606 -7.846 -13.843 1.00 0.00 H new ATOM 0 HA VAL A 37 16.568 -6.443 -11.615 1.00 0.00 H new ATOM 0 HB VAL A 37 17.923 -9.138 -11.971 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.252 -9.671 -9.664 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.438 -8.345 -9.718 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.718 -7.989 -9.434 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.659 -9.997 -11.524 1.00 0.00 H new ATOM 0 HG22 VAL A 37 15.060 -8.328 -11.372 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.686 -8.910 -12.932 1.00 0.00 H new ATOM 634 N ASN A 38 19.829 -7.069 -11.602 1.00 0.00 N ATOM 635 CA ASN A 38 21.103 -6.645 -11.032 1.00 0.00 C ATOM 636 C ASN A 38 21.986 -5.999 -12.094 1.00 0.00 C ATOM 637 O ASN A 38 22.545 -4.923 -11.881 1.00 0.00 O ATOM 638 CB ASN A 38 21.828 -7.837 -10.405 1.00 0.00 C ATOM 639 CG ASN A 38 20.869 -8.911 -9.928 1.00 0.00 C ATOM 640 OD1 ASN A 38 20.481 -8.938 -8.760 1.00 0.00 O ATOM 641 ND2 ASN A 38 20.483 -9.804 -10.832 1.00 0.00 N ATOM 0 H ASN A 38 19.904 -7.820 -12.289 1.00 0.00 H new ATOM 0 HA ASN A 38 20.898 -5.906 -10.258 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.515 -8.265 -11.134 1.00 0.00 H new ATOM 0 HB3 ASN A 38 22.430 -7.492 -9.564 1.00 0.00 H new ATOM 0 HD21 ASN A 38 19.840 -10.551 -10.569 1.00 0.00 H new ATOM 0 HD22 ASN A 38 20.830 -9.743 -11.789 1.00 0.00 H new ATOM 648 N SER A 39 22.107 -6.663 -13.239 1.00 0.00 N ATOM 649 CA SER A 39 22.925 -6.155 -14.335 1.00 0.00 C ATOM 650 C SER A 39 22.303 -4.902 -14.942 1.00 0.00 C ATOM 651 O SER A 39 21.144 -4.580 -14.680 1.00 0.00 O ATOM 652 CB SER A 39 23.095 -7.228 -15.412 1.00 0.00 C ATOM 653 OG SER A 39 22.275 -6.957 -16.536 1.00 0.00 O ATOM 0 H SER A 39 21.649 -7.554 -13.432 1.00 0.00 H new ATOM 0 HA SER A 39 23.905 -5.895 -13.934 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.139 -7.274 -15.722 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.841 -8.205 -15.000 1.00 0.00 H new ATOM 0 HG SER A 39 22.403 -7.656 -17.210 1.00 0.00 H new ATOM 659 N THR A 40 23.082 -4.198 -15.758 1.00 0.00 N ATOM 660 CA THR A 40 22.609 -2.980 -16.403 1.00 0.00 C ATOM 661 C THR A 40 21.758 -3.300 -17.627 1.00 0.00 C ATOM 662 O THR A 40 22.269 -3.391 -18.744 1.00 0.00 O ATOM 663 CB THR A 40 23.783 -2.078 -16.830 1.00 0.00 C ATOM 664 OG1 THR A 40 24.472 -1.591 -15.673 1.00 0.00 O ATOM 665 CG2 THR A 40 23.289 -0.905 -17.663 1.00 0.00 C ATOM 0 H THR A 40 24.043 -4.451 -15.987 1.00 0.00 H new ATOM 0 HA THR A 40 22.001 -2.450 -15.670 1.00 0.00 H new ATOM 0 HB THR A 40 24.467 -2.672 -17.437 1.00 0.00 H new ATOM 0 HG1 THR A 40 25.218 -1.020 -15.953 1.00 0.00 H new ATOM 0 HG21 THR A 40 24.135 -0.282 -17.953 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.790 -1.278 -18.557 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.587 -0.312 -17.077 1.00 0.00 H new ATOM 673 N LEU A 41 20.459 -3.469 -17.410 1.00 0.00 N ATOM 674 CA LEU A 41 19.536 -3.778 -18.497 1.00 0.00 C ATOM 675 C LEU A 41 18.240 -2.988 -18.352 1.00 0.00 C ATOM 676 O LEU A 41 17.550 -3.085 -17.337 1.00 0.00 O ATOM 677 CB LEU A 41 19.232 -5.277 -18.523 1.00 0.00 C ATOM 678 CG LEU A 41 19.984 -6.096 -19.573 1.00 0.00 C ATOM 679 CD1 LEU A 41 19.565 -7.557 -19.511 1.00 0.00 C ATOM 680 CD2 LEU A 41 19.745 -5.529 -20.964 1.00 0.00 C ATOM 0 H LEU A 41 20.021 -3.397 -16.492 1.00 0.00 H new ATOM 0 HA LEU A 41 20.011 -3.493 -19.436 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.457 -5.690 -17.540 1.00 0.00 H new ATOM 0 HB3 LEU A 41 18.162 -5.408 -18.687 1.00 0.00 H new ATOM 0 HG LEU A 41 21.051 -6.036 -19.357 1.00 0.00 H new ATOM 0 HD11 LEU A 41 20.110 -8.124 -20.265 1.00 0.00 H new ATOM 0 HD12 LEU A 41 19.789 -7.958 -18.523 1.00 0.00 H new ATOM 0 HD13 LEU A 41 18.495 -7.637 -19.701 1.00 0.00 H new ATOM 0 HD21 LEU A 41 20.288 -6.125 -21.698 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.679 -5.558 -21.190 1.00 0.00 H new ATOM 0 HD23 LEU A 41 20.096 -4.498 -21.002 1.00 0.00 H new ATOM 692 N THR A 42 17.912 -2.206 -19.376 1.00 0.00 N ATOM 693 CA THR A 42 16.698 -1.399 -19.364 1.00 0.00 C ATOM 694 C THR A 42 15.489 -2.218 -19.802 1.00 0.00 C ATOM 695 O THR A 42 15.619 -3.172 -20.570 1.00 0.00 O ATOM 696 CB THR A 42 16.831 -0.170 -20.283 1.00 0.00 C ATOM 697 OG1 THR A 42 15.588 0.539 -20.336 1.00 0.00 O ATOM 698 CG2 THR A 42 17.244 -0.586 -21.687 1.00 0.00 C ATOM 0 H THR A 42 18.471 -2.114 -20.225 1.00 0.00 H new ATOM 0 HA THR A 42 16.553 -1.062 -18.338 1.00 0.00 H new ATOM 0 HB THR A 42 17.603 0.481 -19.873 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.681 1.320 -20.921 1.00 0.00 H new ATOM 0 HG21 THR A 42 17.331 0.299 -22.318 1.00 0.00 H new ATOM 0 HG22 THR A 42 18.205 -1.099 -21.647 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.492 -1.256 -22.104 1.00 0.00 H new ATOM 706 N ILE A 43 14.315 -1.840 -19.309 1.00 0.00 N ATOM 707 CA ILE A 43 13.082 -2.540 -19.651 1.00 0.00 C ATOM 708 C ILE A 43 12.972 -2.754 -21.157 1.00 0.00 C ATOM 709 O ILE A 43 12.619 -3.841 -21.615 1.00 0.00 O ATOM 710 CB ILE A 43 11.843 -1.768 -19.162 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.918 -1.546 -17.650 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.572 -2.520 -19.530 1.00 0.00 C ATOM 713 CD1 ILE A 43 11.426 -2.725 -16.840 1.00 0.00 C ATOM 0 H ILE A 43 14.191 -1.053 -18.672 1.00 0.00 H new ATOM 0 HA ILE A 43 13.118 -3.507 -19.150 1.00 0.00 H new ATOM 0 HB ILE A 43 11.822 -0.795 -19.653 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.950 -1.331 -17.373 1.00 0.00 H new ATOM 0 HG13 ILE A 43 11.329 -0.666 -17.391 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.704 -1.962 -19.178 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.516 -2.632 -20.613 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.584 -3.505 -19.063 1.00 0.00 H new ATOM 0 HD11 ILE A 43 11.509 -2.496 -15.777 1.00 0.00 H new ATOM 0 HD12 ILE A 43 10.384 -2.927 -17.088 1.00 0.00 H new ATOM 0 HD13 ILE A 43 12.031 -3.602 -17.070 1.00 0.00 H new ATOM 725 N GLU A 44 13.278 -1.711 -21.922 1.00 0.00 N ATOM 726 CA GLU A 44 13.214 -1.786 -23.377 1.00 0.00 C ATOM 727 C GLU A 44 14.119 -2.896 -23.904 1.00 0.00 C ATOM 728 O GLU A 44 13.649 -3.856 -24.515 1.00 0.00 O ATOM 729 CB GLU A 44 13.618 -0.447 -23.997 1.00 0.00 C ATOM 730 CG GLU A 44 13.247 -0.320 -25.465 1.00 0.00 C ATOM 731 CD GLU A 44 14.091 0.708 -26.194 1.00 0.00 C ATOM 732 OE1 GLU A 44 15.221 0.978 -25.736 1.00 0.00 O ATOM 733 OE2 GLU A 44 13.622 1.241 -27.221 1.00 0.00 O ATOM 0 H GLU A 44 13.573 -0.805 -21.559 1.00 0.00 H new ATOM 0 HA GLU A 44 12.186 -2.013 -23.659 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.143 0.360 -23.440 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.695 -0.317 -23.890 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.363 -1.289 -25.950 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.195 -0.046 -25.548 1.00 0.00 H new ATOM 740 N GLU A 45 15.419 -2.757 -23.664 1.00 0.00 N ATOM 741 CA GLU A 45 16.389 -3.747 -24.116 1.00 0.00 C ATOM 742 C GLU A 45 15.971 -5.152 -23.692 1.00 0.00 C ATOM 743 O GLU A 45 15.984 -6.085 -24.495 1.00 0.00 O ATOM 744 CB GLU A 45 17.777 -3.426 -23.559 1.00 0.00 C ATOM 745 CG GLU A 45 18.836 -4.449 -23.933 1.00 0.00 C ATOM 746 CD GLU A 45 19.486 -4.152 -25.271 1.00 0.00 C ATOM 747 OE1 GLU A 45 19.010 -3.236 -25.973 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.473 -4.837 -25.615 1.00 0.00 O ATOM 0 H GLU A 45 15.824 -1.969 -23.159 1.00 0.00 H new ATOM 0 HA GLU A 45 16.425 -3.711 -25.205 1.00 0.00 H new ATOM 0 HB2 GLU A 45 18.087 -2.446 -23.922 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.716 -3.359 -22.473 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.602 -4.473 -23.158 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.383 -5.440 -23.965 1.00 0.00 H new ATOM 755 N PHE A 46 15.601 -5.295 -22.423 1.00 0.00 N ATOM 756 CA PHE A 46 15.180 -6.585 -21.890 1.00 0.00 C ATOM 757 C PHE A 46 14.071 -7.191 -22.745 1.00 0.00 C ATOM 758 O PHE A 46 13.982 -8.410 -22.893 1.00 0.00 O ATOM 759 CB PHE A 46 14.701 -6.432 -20.445 1.00 0.00 C ATOM 760 CG PHE A 46 13.523 -7.301 -20.109 1.00 0.00 C ATOM 761 CD1 PHE A 46 12.232 -6.871 -20.369 1.00 0.00 C ATOM 762 CD2 PHE A 46 13.707 -8.549 -19.535 1.00 0.00 C ATOM 763 CE1 PHE A 46 11.146 -7.669 -20.060 1.00 0.00 C ATOM 764 CE2 PHE A 46 12.625 -9.351 -19.224 1.00 0.00 C ATOM 765 CZ PHE A 46 11.343 -8.911 -19.488 1.00 0.00 C ATOM 0 H PHE A 46 15.584 -4.533 -21.745 1.00 0.00 H new ATOM 0 HA PHE A 46 16.038 -7.257 -21.911 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.523 -6.672 -19.771 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.436 -5.390 -20.267 1.00 0.00 H new ATOM 0 HD1 PHE A 46 12.072 -5.902 -20.818 1.00 0.00 H new ATOM 0 HD2 PHE A 46 14.708 -8.899 -19.328 1.00 0.00 H new ATOM 0 HE1 PHE A 46 10.144 -7.322 -20.266 1.00 0.00 H new ATOM 0 HE2 PHE A 46 12.782 -10.321 -18.775 1.00 0.00 H new ATOM 0 HZ PHE A 46 10.496 -9.537 -19.248 1.00 0.00 H new ATOM 775 N HIS A 47 13.226 -6.331 -23.304 1.00 0.00 N ATOM 776 CA HIS A 47 12.122 -6.780 -24.144 1.00 0.00 C ATOM 777 C HIS A 47 12.593 -7.027 -25.574 1.00 0.00 C ATOM 778 O HIS A 47 11.957 -7.762 -26.329 1.00 0.00 O ATOM 779 CB HIS A 47 10.994 -5.747 -24.137 1.00 0.00 C ATOM 780 CG HIS A 47 9.992 -5.947 -25.232 1.00 0.00 C ATOM 781 ND1 HIS A 47 9.095 -6.994 -25.249 1.00 0.00 N ATOM 782 CD2 HIS A 47 9.747 -5.225 -26.350 1.00 0.00 C ATOM 783 CE1 HIS A 47 8.343 -6.909 -26.332 1.00 0.00 C ATOM 784 NE2 HIS A 47 8.718 -5.843 -27.017 1.00 0.00 N ATOM 0 H HIS A 47 13.285 -5.319 -23.190 1.00 0.00 H new ATOM 0 HA HIS A 47 11.747 -7.719 -23.736 1.00 0.00 H new ATOM 0 HB2 HIS A 47 10.482 -5.787 -23.176 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.425 -4.750 -24.228 1.00 0.00 H new ATOM 0 HD1 HIS A 47 9.023 -7.721 -24.537 1.00 0.00 H new ATOM 0 HD2 HIS A 47 10.265 -4.329 -26.660 1.00 0.00 H new ATOM 0 HE1 HIS A 47 7.556 -7.594 -26.610 1.00 0.00 H new ATOM 792 N SER A 48 13.710 -6.406 -25.940 1.00 0.00 N ATOM 793 CA SER A 48 14.263 -6.555 -27.281 1.00 0.00 C ATOM 794 C SER A 48 14.817 -7.961 -27.487 1.00 0.00 C ATOM 795 O SER A 48 14.808 -8.488 -28.600 1.00 0.00 O ATOM 796 CB SER A 48 15.365 -5.520 -27.518 1.00 0.00 C ATOM 797 OG SER A 48 15.939 -5.673 -28.805 1.00 0.00 O ATOM 0 H SER A 48 14.250 -5.795 -25.327 1.00 0.00 H new ATOM 0 HA SER A 48 13.460 -6.391 -27.999 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.953 -4.516 -27.417 1.00 0.00 H new ATOM 0 HB3 SER A 48 16.138 -5.626 -26.757 1.00 0.00 H new ATOM 0 HG SER A 48 16.639 -4.999 -28.933 1.00 0.00 H new ATOM 803 N LYS A 49 15.300 -8.565 -26.406 1.00 0.00 N ATOM 804 CA LYS A 49 15.858 -9.910 -26.465 1.00 0.00 C ATOM 805 C LYS A 49 14.810 -10.951 -26.082 1.00 0.00 C ATOM 806 O LYS A 49 14.955 -12.135 -26.390 1.00 0.00 O ATOM 807 CB LYS A 49 17.069 -10.024 -25.536 1.00 0.00 C ATOM 808 CG LYS A 49 18.401 -9.924 -26.258 1.00 0.00 C ATOM 809 CD LYS A 49 18.843 -8.478 -26.414 1.00 0.00 C ATOM 810 CE LYS A 49 19.460 -7.942 -25.131 1.00 0.00 C ATOM 811 NZ LYS A 49 20.933 -8.155 -25.093 1.00 0.00 N ATOM 0 H LYS A 49 15.316 -8.143 -25.478 1.00 0.00 H new ATOM 0 HA LYS A 49 16.176 -10.100 -27.490 1.00 0.00 H new ATOM 0 HB2 LYS A 49 17.014 -9.238 -24.783 1.00 0.00 H new ATOM 0 HB3 LYS A 49 17.022 -10.976 -25.007 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.158 -10.479 -25.705 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.319 -10.389 -27.241 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.567 -8.403 -27.226 1.00 0.00 H new ATOM 0 HD3 LYS A 49 17.987 -7.863 -26.692 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.245 -6.877 -25.042 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.000 -8.433 -24.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.259 -8.150 -24.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.163 -9.071 -25.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.408 -7.393 -25.618 1.00 0.00 H new ATOM 825 N LEU A 50 13.755 -10.502 -25.411 1.00 0.00 N ATOM 826 CA LEU A 50 12.682 -11.395 -24.987 1.00 0.00 C ATOM 827 C LEU A 50 11.644 -11.562 -26.093 1.00 0.00 C ATOM 828 O LEU A 50 11.056 -12.632 -26.248 1.00 0.00 O ATOM 829 CB LEU A 50 12.013 -10.855 -23.722 1.00 0.00 C ATOM 830 CG LEU A 50 11.420 -11.902 -22.778 1.00 0.00 C ATOM 831 CD1 LEU A 50 11.726 -11.550 -21.331 1.00 0.00 C ATOM 832 CD2 LEU A 50 9.918 -12.023 -22.993 1.00 0.00 C ATOM 0 H LEU A 50 13.620 -9.526 -25.149 1.00 0.00 H new ATOM 0 HA LEU A 50 13.118 -12.371 -24.772 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.747 -10.270 -23.168 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.218 -10.171 -24.019 1.00 0.00 H new ATOM 0 HG LEU A 50 11.878 -12.866 -23.001 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.296 -12.306 -20.674 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.806 -11.514 -21.186 1.00 0.00 H new ATOM 0 HD13 LEU A 50 11.296 -10.577 -21.094 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.512 -12.772 -22.313 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.444 -11.061 -22.798 1.00 0.00 H new ATOM 0 HD23 LEU A 50 9.721 -12.322 -24.022 1.00 0.00 H new ATOM 844 N GLN A 51 11.428 -10.498 -26.859 1.00 0.00 N ATOM 845 CA GLN A 51 10.462 -10.528 -27.952 1.00 0.00 C ATOM 846 C GLN A 51 10.968 -11.392 -29.102 1.00 0.00 C ATOM 847 O GLN A 51 10.187 -12.058 -29.780 1.00 0.00 O ATOM 848 CB GLN A 51 10.180 -9.110 -28.450 1.00 0.00 C ATOM 849 CG GLN A 51 11.343 -8.486 -29.203 1.00 0.00 C ATOM 850 CD GLN A 51 11.260 -8.715 -30.700 1.00 0.00 C ATOM 851 OE1 GLN A 51 10.278 -9.263 -31.201 1.00 0.00 O ATOM 852 NE2 GLN A 51 12.292 -8.294 -31.422 1.00 0.00 N ATOM 0 H GLN A 51 11.908 -9.605 -26.744 1.00 0.00 H new ATOM 0 HA GLN A 51 9.537 -10.964 -27.574 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.306 -9.130 -29.101 1.00 0.00 H new ATOM 0 HB3 GLN A 51 9.929 -8.478 -27.598 1.00 0.00 H new ATOM 0 HG2 GLN A 51 11.367 -7.415 -29.004 1.00 0.00 H new ATOM 0 HG3 GLN A 51 12.278 -8.901 -28.827 1.00 0.00 H new ATOM 0 HE21 GLN A 51 13.085 -7.845 -30.964 1.00 0.00 H new ATOM 0 HE22 GLN A 51 12.291 -8.420 -32.434 1.00 0.00 H new ATOM 861 N GLU A 52 12.280 -11.375 -29.316 1.00 0.00 N ATOM 862 CA GLU A 52 12.890 -12.157 -30.385 1.00 0.00 C ATOM 863 C GLU A 52 13.261 -13.553 -29.895 1.00 0.00 C ATOM 864 O GLU A 52 13.732 -14.389 -30.666 1.00 0.00 O ATOM 865 CB GLU A 52 14.133 -11.445 -30.922 1.00 0.00 C ATOM 866 CG GLU A 52 15.315 -11.481 -29.968 1.00 0.00 C ATOM 867 CD GLU A 52 16.350 -10.418 -30.281 1.00 0.00 C ATOM 868 OE1 GLU A 52 16.022 -9.471 -31.025 1.00 0.00 O ATOM 869 OE2 GLU A 52 17.488 -10.534 -29.780 1.00 0.00 O ATOM 0 H GLU A 52 12.941 -10.828 -28.763 1.00 0.00 H new ATOM 0 HA GLU A 52 12.161 -12.256 -31.189 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.425 -11.904 -31.866 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.882 -10.406 -31.137 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.957 -11.345 -28.947 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.784 -12.464 -30.013 1.00 0.00 H new ATOM 876 N ALA A 53 13.047 -13.798 -28.606 1.00 0.00 N ATOM 877 CA ALA A 53 13.357 -15.092 -28.013 1.00 0.00 C ATOM 878 C ALA A 53 12.086 -15.890 -27.739 1.00 0.00 C ATOM 879 O ALA A 53 12.001 -17.074 -28.064 1.00 0.00 O ATOM 880 CB ALA A 53 14.153 -14.907 -26.729 1.00 0.00 C ATOM 0 H ALA A 53 12.660 -13.117 -27.953 1.00 0.00 H new ATOM 0 HA ALA A 53 13.961 -15.654 -28.725 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.378 -15.882 -26.297 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.084 -14.385 -26.950 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.568 -14.322 -26.020 1.00 0.00 H new ATOM 886 N THR A 54 11.099 -15.233 -27.137 1.00 0.00 N ATOM 887 CA THR A 54 9.833 -15.881 -26.818 1.00 0.00 C ATOM 888 C THR A 54 9.051 -16.214 -28.083 1.00 0.00 C ATOM 889 O THR A 54 9.085 -15.467 -29.060 1.00 0.00 O ATOM 890 CB THR A 54 8.962 -14.994 -25.908 1.00 0.00 C ATOM 891 OG1 THR A 54 8.739 -13.724 -26.531 1.00 0.00 O ATOM 892 CG2 THR A 54 9.625 -14.791 -24.554 1.00 0.00 C ATOM 0 H THR A 54 11.152 -14.253 -26.861 1.00 0.00 H new ATOM 0 HA THR A 54 10.075 -16.804 -26.291 1.00 0.00 H new ATOM 0 HB THR A 54 8.007 -15.496 -25.755 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.574 -13.210 -26.535 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.991 -14.162 -23.929 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.767 -15.757 -24.070 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.593 -14.309 -24.691 1.00 0.00 H new ATOM 900 N ASN A 55 8.347 -17.341 -28.058 1.00 0.00 N ATOM 901 CA ASN A 55 7.556 -17.773 -29.205 1.00 0.00 C ATOM 902 C ASN A 55 6.541 -16.704 -29.599 1.00 0.00 C ATOM 903 O ASN A 55 6.178 -15.849 -28.791 1.00 0.00 O ATOM 904 CB ASN A 55 6.835 -19.085 -28.887 1.00 0.00 C ATOM 905 CG ASN A 55 7.761 -20.284 -28.952 1.00 0.00 C ATOM 906 OD1 ASN A 55 8.121 -20.746 -30.035 1.00 0.00 O ATOM 907 ND2 ASN A 55 8.150 -20.794 -27.790 1.00 0.00 N ATOM 0 H ASN A 55 8.308 -17.971 -27.257 1.00 0.00 H new ATOM 0 HA ASN A 55 8.233 -17.932 -30.044 1.00 0.00 H new ATOM 0 HB2 ASN A 55 6.395 -19.023 -27.892 1.00 0.00 H new ATOM 0 HB3 ASN A 55 6.014 -19.225 -29.590 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.773 -21.602 -27.770 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.826 -20.378 -26.917 1.00 0.00 H new ATOM 914 N PHE A 56 6.086 -16.760 -30.847 1.00 0.00 N ATOM 915 CA PHE A 56 5.114 -15.797 -31.350 1.00 0.00 C ATOM 916 C PHE A 56 5.694 -14.386 -31.348 1.00 0.00 C ATOM 917 O PHE A 56 6.686 -14.096 -30.679 1.00 0.00 O ATOM 918 CB PHE A 56 3.840 -15.837 -30.503 1.00 0.00 C ATOM 919 CG PHE A 56 2.703 -16.563 -31.163 1.00 0.00 C ATOM 920 CD1 PHE A 56 2.894 -17.819 -31.716 1.00 0.00 C ATOM 921 CD2 PHE A 56 1.444 -15.990 -31.231 1.00 0.00 C ATOM 922 CE1 PHE A 56 1.850 -18.489 -32.326 1.00 0.00 C ATOM 923 CE2 PHE A 56 0.396 -16.656 -31.839 1.00 0.00 C ATOM 924 CZ PHE A 56 0.599 -17.907 -32.386 1.00 0.00 C ATOM 0 H PHE A 56 6.375 -17.462 -31.528 1.00 0.00 H new ATOM 0 HA PHE A 56 4.869 -16.069 -32.377 1.00 0.00 H new ATOM 0 HB2 PHE A 56 4.062 -16.317 -29.550 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.529 -14.816 -30.281 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.870 -18.280 -31.670 1.00 0.00 H new ATOM 0 HD2 PHE A 56 1.279 -15.012 -30.804 1.00 0.00 H new ATOM 0 HE1 PHE A 56 2.012 -19.467 -32.755 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -0.581 -16.198 -31.886 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.219 -18.430 -32.860 1.00 0.00 H new ATOM 934 N PRO A 57 5.062 -13.486 -32.116 1.00 0.00 N ATOM 935 CA PRO A 57 5.498 -12.090 -32.222 1.00 0.00 C ATOM 936 C PRO A 57 5.255 -11.308 -30.935 1.00 0.00 C ATOM 937 O PRO A 57 4.946 -11.888 -29.893 1.00 0.00 O ATOM 938 CB PRO A 57 4.635 -11.534 -33.357 1.00 0.00 C ATOM 939 CG PRO A 57 3.417 -12.392 -33.362 1.00 0.00 C ATOM 940 CD PRO A 57 3.874 -13.761 -32.941 1.00 0.00 C ATOM 0 HA PRO A 57 6.570 -12.010 -32.405 1.00 0.00 H new ATOM 0 HB2 PRO A 57 4.382 -10.488 -33.186 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.158 -11.583 -34.312 1.00 0.00 H new ATOM 0 HG2 PRO A 57 2.663 -12.004 -32.677 1.00 0.00 H new ATOM 0 HG3 PRO A 57 2.963 -12.419 -34.353 1.00 0.00 H new ATOM 0 HD2 PRO A 57 3.104 -14.285 -32.375 1.00 0.00 H new ATOM 0 HD3 PRO A 57 4.118 -14.385 -33.801 1.00 0.00 H new ATOM 948 N LEU A 58 5.395 -9.990 -31.014 1.00 0.00 N ATOM 949 CA LEU A 58 5.190 -9.128 -29.855 1.00 0.00 C ATOM 950 C LEU A 58 3.881 -9.467 -29.149 1.00 0.00 C ATOM 951 O LEU A 58 2.831 -9.568 -29.783 1.00 0.00 O ATOM 952 CB LEU A 58 5.187 -7.659 -30.282 1.00 0.00 C ATOM 953 CG LEU A 58 6.149 -6.739 -29.529 1.00 0.00 C ATOM 954 CD1 LEU A 58 5.692 -6.549 -28.092 1.00 0.00 C ATOM 955 CD2 LEU A 58 7.564 -7.299 -29.571 1.00 0.00 C ATOM 0 H LEU A 58 5.650 -9.494 -31.868 1.00 0.00 H new ATOM 0 HA LEU A 58 6.011 -9.296 -29.158 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.426 -7.610 -31.344 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.176 -7.269 -30.164 1.00 0.00 H new ATOM 0 HG LEU A 58 6.149 -5.766 -30.020 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.389 -5.892 -27.572 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.697 -6.104 -28.082 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.662 -7.516 -27.589 1.00 0.00 H new ATOM 0 HD21 LEU A 58 8.235 -6.632 -29.030 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.579 -8.284 -29.106 1.00 0.00 H new ATOM 0 HD23 LEU A 58 7.892 -7.382 -30.607 1.00 0.00 H new ATOM 967 N ARG A 59 3.952 -9.638 -27.833 1.00 0.00 N ATOM 968 CA ARG A 59 2.772 -9.964 -27.041 1.00 0.00 C ATOM 969 C ARG A 59 2.237 -8.726 -26.327 1.00 0.00 C ATOM 970 O ARG A 59 2.961 -7.762 -26.079 1.00 0.00 O ATOM 971 CB ARG A 59 3.104 -11.052 -26.018 1.00 0.00 C ATOM 972 CG ARG A 59 4.386 -10.791 -25.245 1.00 0.00 C ATOM 973 CD ARG A 59 4.175 -10.951 -23.747 1.00 0.00 C ATOM 974 NE ARG A 59 5.358 -11.493 -23.083 1.00 0.00 N ATOM 975 CZ ARG A 59 5.466 -11.623 -21.766 1.00 0.00 C ATOM 976 NH1 ARG A 59 4.468 -11.251 -20.975 1.00 0.00 N ATOM 977 NH2 ARG A 59 6.574 -12.125 -21.236 1.00 0.00 N ATOM 0 H ARG A 59 4.813 -9.556 -27.293 1.00 0.00 H new ATOM 0 HA ARG A 59 2.001 -10.333 -27.718 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.277 -11.141 -25.314 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.189 -12.009 -26.533 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.161 -11.480 -25.580 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.742 -9.783 -25.458 1.00 0.00 H new ATOM 0 HD2 ARG A 59 3.925 -9.984 -23.311 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.325 -11.610 -23.569 1.00 0.00 H new ATOM 0 HE ARG A 59 6.144 -11.788 -23.663 1.00 0.00 H new ATOM 0 HH11 ARG A 59 3.615 -10.864 -21.378 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.554 -11.352 -19.964 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.344 -12.412 -21.840 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.656 -12.224 -20.224 1.00 0.00 H new ATOM 991 N PRO A 60 0.939 -8.752 -25.990 1.00 0.00 N ATOM 992 CA PRO A 60 0.279 -7.639 -25.301 1.00 0.00 C ATOM 993 C PRO A 60 0.751 -7.489 -23.859 1.00 0.00 C ATOM 994 O PRO A 60 1.161 -8.461 -23.224 1.00 0.00 O ATOM 995 CB PRO A 60 -1.202 -8.027 -25.341 1.00 0.00 C ATOM 996 CG PRO A 60 -1.202 -9.512 -25.450 1.00 0.00 C ATOM 997 CD PRO A 60 0.017 -9.868 -26.256 1.00 0.00 C ATOM 0 HA PRO A 60 0.496 -6.681 -25.772 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.722 -7.696 -24.442 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -1.709 -7.568 -26.190 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -1.167 -9.976 -24.464 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -2.110 -9.868 -25.938 1.00 0.00 H new ATOM 0 HD2 PRO A 60 0.441 -10.822 -25.944 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -0.214 -9.954 -27.318 1.00 0.00 H new ATOM 1005 N PHE A 61 0.691 -6.264 -23.346 1.00 0.00 N ATOM 1006 CA PHE A 61 1.113 -5.986 -21.978 1.00 0.00 C ATOM 1007 C PHE A 61 2.421 -6.704 -21.656 1.00 0.00 C ATOM 1008 O PHE A 61 2.546 -7.354 -20.618 1.00 0.00 O ATOM 1009 CB PHE A 61 0.027 -6.414 -20.990 1.00 0.00 C ATOM 1010 CG PHE A 61 -1.361 -6.041 -21.426 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -1.717 -4.711 -21.590 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -2.310 -7.019 -21.674 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -2.993 -4.366 -21.990 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -3.588 -6.680 -22.075 1.00 0.00 C ATOM 1015 CZ PHE A 61 -3.930 -5.351 -22.235 1.00 0.00 C ATOM 0 H PHE A 61 0.354 -5.448 -23.857 1.00 0.00 H new ATOM 0 HA PHE A 61 1.276 -4.912 -21.886 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.078 -7.494 -20.852 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.229 -5.959 -20.020 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.988 -3.936 -21.403 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.048 -8.060 -21.552 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.258 -3.326 -22.111 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.319 -7.453 -22.263 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.927 -5.083 -22.551 1.00 0.00 H new ATOM 1025 N VAL A 62 3.392 -6.583 -22.555 1.00 0.00 N ATOM 1026 CA VAL A 62 4.691 -7.220 -22.368 1.00 0.00 C ATOM 1027 C VAL A 62 5.695 -6.250 -21.755 1.00 0.00 C ATOM 1028 O VAL A 62 6.473 -6.621 -20.876 1.00 0.00 O ATOM 1029 CB VAL A 62 5.253 -7.750 -23.700 1.00 0.00 C ATOM 1030 CG1 VAL A 62 5.670 -6.597 -24.601 1.00 0.00 C ATOM 1031 CG2 VAL A 62 6.423 -8.690 -23.448 1.00 0.00 C ATOM 0 H VAL A 62 3.304 -6.050 -23.420 1.00 0.00 H new ATOM 0 HA VAL A 62 4.538 -8.058 -21.688 1.00 0.00 H new ATOM 0 HB VAL A 62 4.468 -8.311 -24.208 1.00 0.00 H new ATOM 0 HG11 VAL A 62 6.065 -6.991 -25.537 1.00 0.00 H new ATOM 0 HG12 VAL A 62 4.806 -5.966 -24.808 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.439 -6.006 -24.103 1.00 0.00 H new ATOM 0 HG21 VAL A 62 6.808 -9.055 -24.400 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.212 -8.155 -22.919 1.00 0.00 H new ATOM 0 HG23 VAL A 62 6.088 -9.534 -22.844 1.00 0.00 H new ATOM 1041 N ILE A 63 5.671 -5.007 -22.224 1.00 0.00 N ATOM 1042 CA ILE A 63 6.578 -3.984 -21.721 1.00 0.00 C ATOM 1043 C ILE A 63 6.133 -3.480 -20.352 1.00 0.00 C ATOM 1044 O ILE A 63 6.901 -3.459 -19.390 1.00 0.00 O ATOM 1045 CB ILE A 63 6.674 -2.790 -22.689 1.00 0.00 C ATOM 1046 CG1 ILE A 63 7.652 -3.102 -23.823 1.00 0.00 C ATOM 1047 CG2 ILE A 63 7.102 -1.536 -21.943 1.00 0.00 C ATOM 1048 CD1 ILE A 63 9.067 -3.349 -23.350 1.00 0.00 C ATOM 0 H ILE A 63 5.033 -4.685 -22.952 1.00 0.00 H new ATOM 0 HA ILE A 63 7.560 -4.449 -21.633 1.00 0.00 H new ATOM 0 HB ILE A 63 5.690 -2.613 -23.122 1.00 0.00 H new ATOM 0 HG12 ILE A 63 7.300 -3.980 -24.364 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.653 -2.272 -24.529 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.165 -0.701 -22.641 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.371 -1.306 -21.168 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.077 -1.700 -21.485 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.705 -3.564 -24.207 1.00 0.00 H new ATOM 0 HD12 ILE A 63 9.438 -2.463 -22.834 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.079 -4.198 -22.667 1.00 0.00 H new ATOM 1060 N PRO A 64 4.861 -3.064 -20.260 1.00 0.00 N ATOM 1061 CA PRO A 64 4.283 -2.554 -19.013 1.00 0.00 C ATOM 1062 C PRO A 64 4.104 -3.649 -17.967 1.00 0.00 C ATOM 1063 O PRO A 64 3.756 -3.374 -16.819 1.00 0.00 O ATOM 1064 CB PRO A 64 2.923 -2.005 -19.451 1.00 0.00 C ATOM 1065 CG PRO A 64 2.582 -2.775 -20.680 1.00 0.00 C ATOM 1066 CD PRO A 64 3.889 -3.060 -21.366 1.00 0.00 C ATOM 0 HA PRO A 64 4.925 -1.811 -18.540 1.00 0.00 H new ATOM 0 HB2 PRO A 64 2.171 -2.145 -18.675 1.00 0.00 H new ATOM 0 HB3 PRO A 64 2.975 -0.936 -19.655 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.063 -3.700 -20.429 1.00 0.00 H new ATOM 0 HG3 PRO A 64 1.918 -2.202 -21.328 1.00 0.00 H new ATOM 0 HD2 PRO A 64 3.869 -4.017 -21.887 1.00 0.00 H new ATOM 0 HD3 PRO A 64 4.128 -2.298 -22.108 1.00 0.00 H new ATOM 1074 N PHE A 65 4.344 -4.892 -18.371 1.00 0.00 N ATOM 1075 CA PHE A 65 4.209 -6.029 -17.468 1.00 0.00 C ATOM 1076 C PHE A 65 5.255 -5.970 -16.359 1.00 0.00 C ATOM 1077 O PHE A 65 4.939 -5.669 -15.207 1.00 0.00 O ATOM 1078 CB PHE A 65 4.345 -7.342 -18.243 1.00 0.00 C ATOM 1079 CG PHE A 65 3.265 -8.338 -17.930 1.00 0.00 C ATOM 1080 CD1 PHE A 65 1.935 -7.952 -17.904 1.00 0.00 C ATOM 1081 CD2 PHE A 65 3.581 -9.660 -17.660 1.00 0.00 C ATOM 1082 CE1 PHE A 65 0.939 -8.866 -17.617 1.00 0.00 C ATOM 1083 CE2 PHE A 65 2.589 -10.578 -17.372 1.00 0.00 C ATOM 1084 CZ PHE A 65 1.266 -10.180 -17.349 1.00 0.00 C ATOM 0 H PHE A 65 4.633 -5.138 -19.318 1.00 0.00 H new ATOM 0 HA PHE A 65 3.219 -5.984 -17.013 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.331 -7.127 -19.311 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.315 -7.787 -18.020 1.00 0.00 H new ATOM 0 HD1 PHE A 65 1.673 -6.925 -18.110 1.00 0.00 H new ATOM 0 HD2 PHE A 65 4.614 -9.976 -17.675 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -0.094 -8.552 -17.602 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.848 -11.606 -17.165 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.489 -10.895 -17.122 1.00 0.00 H new ATOM 1094 N LEU A 66 6.502 -6.260 -16.713 1.00 0.00 N ATOM 1095 CA LEU A 66 7.596 -6.241 -15.748 1.00 0.00 C ATOM 1096 C LEU A 66 7.940 -4.811 -15.344 1.00 0.00 C ATOM 1097 O LEU A 66 8.660 -4.586 -14.371 1.00 0.00 O ATOM 1098 CB LEU A 66 8.831 -6.929 -16.334 1.00 0.00 C ATOM 1099 CG LEU A 66 8.938 -8.435 -16.093 1.00 0.00 C ATOM 1100 CD1 LEU A 66 8.660 -9.202 -17.377 1.00 0.00 C ATOM 1101 CD2 LEU A 66 10.311 -8.791 -15.544 1.00 0.00 C ATOM 0 H LEU A 66 6.781 -6.511 -17.661 1.00 0.00 H new ATOM 0 HA LEU A 66 7.274 -6.783 -14.859 1.00 0.00 H new ATOM 0 HB2 LEU A 66 8.845 -6.751 -17.409 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.719 -6.451 -15.920 1.00 0.00 H new ATOM 0 HG LEU A 66 8.189 -8.719 -15.354 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.741 -10.272 -17.186 1.00 0.00 H new ATOM 0 HD12 LEU A 66 7.654 -8.971 -17.728 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.385 -8.913 -18.138 1.00 0.00 H new ATOM 0 HD21 LEU A 66 10.369 -9.867 -15.379 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.077 -8.492 -16.259 1.00 0.00 H new ATOM 0 HD23 LEU A 66 10.472 -8.270 -14.600 1.00 0.00 H new ATOM 1113 N LYS A 67 7.418 -3.847 -16.095 1.00 0.00 N ATOM 1114 CA LYS A 67 7.667 -2.438 -15.814 1.00 0.00 C ATOM 1115 C LYS A 67 7.374 -2.115 -14.352 1.00 0.00 C ATOM 1116 O LYS A 67 8.015 -1.250 -13.758 1.00 0.00 O ATOM 1117 CB LYS A 67 6.808 -1.557 -16.724 1.00 0.00 C ATOM 1118 CG LYS A 67 7.567 -0.988 -17.911 1.00 0.00 C ATOM 1119 CD LYS A 67 8.682 -0.057 -17.466 1.00 0.00 C ATOM 1120 CE LYS A 67 8.242 1.399 -17.506 1.00 0.00 C ATOM 1121 NZ LYS A 67 9.404 2.327 -17.580 1.00 0.00 N ATOM 0 H LYS A 67 6.819 -4.016 -16.903 1.00 0.00 H new ATOM 0 HA LYS A 67 8.720 -2.234 -16.009 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.963 -2.141 -17.089 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.397 -0.735 -16.138 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.986 -1.803 -18.501 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.878 -0.447 -18.560 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.992 -0.317 -16.454 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.550 -0.194 -18.110 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.594 1.559 -18.368 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.653 1.625 -16.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.063 3.309 -17.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.010 2.192 -16.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.952 2.129 -18.441 1.00 0.00 H new ATOM 1135 N ALA A 68 6.402 -2.818 -13.779 1.00 0.00 N ATOM 1136 CA ALA A 68 6.027 -2.608 -12.386 1.00 0.00 C ATOM 1137 C ALA A 68 6.485 -3.771 -11.513 1.00 0.00 C ATOM 1138 O ALA A 68 6.605 -3.636 -10.296 1.00 0.00 O ATOM 1139 CB ALA A 68 4.522 -2.417 -12.268 1.00 0.00 C ATOM 0 H ALA A 68 5.860 -3.537 -14.258 1.00 0.00 H new ATOM 0 HA ALA A 68 6.525 -1.705 -12.033 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.256 -2.261 -11.223 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.218 -1.549 -12.853 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.012 -3.304 -12.644 1.00 0.00 H new ATOM 1145 N ASN A 69 6.737 -4.914 -12.143 1.00 0.00 N ATOM 1146 CA ASN A 69 7.180 -6.102 -11.422 1.00 0.00 C ATOM 1147 C ASN A 69 8.691 -6.079 -11.212 1.00 0.00 C ATOM 1148 O ASN A 69 9.241 -6.907 -10.485 1.00 0.00 O ATOM 1149 CB ASN A 69 6.780 -7.366 -12.186 1.00 0.00 C ATOM 1150 CG ASN A 69 5.322 -7.351 -12.604 1.00 0.00 C ATOM 1151 OD1 ASN A 69 4.984 -7.716 -13.730 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.451 -6.928 -11.696 1.00 0.00 N ATOM 0 H ASN A 69 6.642 -5.043 -13.150 1.00 0.00 H new ATOM 0 HA ASN A 69 6.695 -6.106 -10.446 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.408 -7.466 -13.071 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.967 -8.239 -11.561 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.456 -6.896 -11.919 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.776 -6.635 -10.775 1.00 0.00 H new ATOM 1159 N LEU A 70 9.357 -5.124 -11.853 1.00 0.00 N ATOM 1160 CA LEU A 70 10.806 -4.992 -11.736 1.00 0.00 C ATOM 1161 C LEU A 70 11.240 -5.036 -10.275 1.00 0.00 C ATOM 1162 O LEU A 70 12.070 -5.852 -9.873 1.00 0.00 O ATOM 1163 CB LEU A 70 11.271 -3.684 -12.379 1.00 0.00 C ATOM 1164 CG LEU A 70 12.491 -3.785 -13.296 1.00 0.00 C ATOM 1165 CD1 LEU A 70 13.711 -4.242 -12.513 1.00 0.00 C ATOM 1166 CD2 LEU A 70 12.211 -4.732 -14.454 1.00 0.00 C ATOM 0 H LEU A 70 8.918 -4.431 -12.458 1.00 0.00 H new ATOM 0 HA LEU A 70 11.267 -5.831 -12.258 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.442 -3.270 -12.954 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.496 -2.972 -11.585 1.00 0.00 H new ATOM 0 HG LEU A 70 12.698 -2.796 -13.704 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.569 -4.308 -13.182 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.924 -3.525 -11.720 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.516 -5.221 -12.075 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.090 -4.792 -15.096 1.00 0.00 H new ATOM 0 HD22 LEU A 70 11.978 -5.723 -14.065 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.364 -4.360 -15.031 1.00 0.00 H new ATOM 1178 N PRO A 71 10.666 -4.139 -9.459 1.00 0.00 N ATOM 1179 CA PRO A 71 10.977 -4.057 -8.029 1.00 0.00 C ATOM 1180 C PRO A 71 10.442 -5.254 -7.250 1.00 0.00 C ATOM 1181 O PRO A 71 10.788 -5.454 -6.085 1.00 0.00 O ATOM 1182 CB PRO A 71 10.272 -2.773 -7.586 1.00 0.00 C ATOM 1183 CG PRO A 71 9.162 -2.593 -8.563 1.00 0.00 C ATOM 1184 CD PRO A 71 9.669 -3.137 -9.870 1.00 0.00 C ATOM 0 HA PRO A 71 12.051 -4.055 -7.845 1.00 0.00 H new ATOM 0 HB2 PRO A 71 9.893 -2.861 -6.568 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.953 -1.922 -7.600 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.267 -3.125 -8.240 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.891 -1.541 -8.657 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.867 -3.585 -10.457 1.00 0.00 H new ATOM 0 HD3 PRO A 71 10.115 -2.355 -10.485 1.00 0.00 H new ATOM 1192 N LEU A 72 9.598 -6.047 -7.900 1.00 0.00 N ATOM 1193 CA LEU A 72 9.016 -7.226 -7.268 1.00 0.00 C ATOM 1194 C LEU A 72 9.840 -8.472 -7.576 1.00 0.00 C ATOM 1195 O LEU A 72 9.830 -9.440 -6.814 1.00 0.00 O ATOM 1196 CB LEU A 72 7.575 -7.424 -7.741 1.00 0.00 C ATOM 1197 CG LEU A 72 6.500 -6.678 -6.950 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.637 -6.964 -5.463 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.583 -5.182 -7.217 1.00 0.00 C ATOM 0 H LEU A 72 9.301 -5.895 -8.864 1.00 0.00 H new ATOM 0 HA LEU A 72 9.019 -7.068 -6.189 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.511 -7.114 -8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.347 -8.489 -7.710 1.00 0.00 H new ATOM 0 HG LEU A 72 5.523 -7.032 -7.279 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.864 -6.425 -4.916 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.527 -8.034 -5.287 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.619 -6.639 -5.119 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.811 -4.667 -6.646 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.563 -4.813 -6.916 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.435 -4.993 -8.280 1.00 0.00 H new ATOM 1211 N LEU A 73 10.553 -8.441 -8.696 1.00 0.00 N ATOM 1212 CA LEU A 73 11.386 -9.568 -9.104 1.00 0.00 C ATOM 1213 C LEU A 73 12.745 -9.519 -8.413 1.00 0.00 C ATOM 1214 O LEU A 73 13.341 -10.555 -8.123 1.00 0.00 O ATOM 1215 CB LEU A 73 11.572 -9.566 -10.622 1.00 0.00 C ATOM 1216 CG LEU A 73 10.854 -10.678 -11.388 1.00 0.00 C ATOM 1217 CD1 LEU A 73 11.409 -12.039 -10.996 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.355 -10.618 -11.135 1.00 0.00 C ATOM 0 H LEU A 73 10.572 -7.649 -9.338 1.00 0.00 H new ATOM 0 HA LEU A 73 10.882 -10.488 -8.807 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.229 -8.606 -11.009 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.638 -9.634 -10.837 1.00 0.00 H new ATOM 0 HG LEU A 73 11.028 -10.530 -12.454 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.887 -12.818 -11.551 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.473 -12.079 -11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.266 -12.196 -9.927 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.860 -11.417 -11.688 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.161 -10.740 -10.069 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.968 -9.654 -11.466 1.00 0.00 H new ATOM 1230 N GLN A 74 13.227 -8.308 -8.152 1.00 0.00 N ATOM 1231 CA GLN A 74 14.515 -8.125 -7.494 1.00 0.00 C ATOM 1232 C GLN A 74 14.443 -8.543 -6.029 1.00 0.00 C ATOM 1233 O GLN A 74 15.455 -8.565 -5.329 1.00 0.00 O ATOM 1234 CB GLN A 74 14.962 -6.665 -7.598 1.00 0.00 C ATOM 1235 CG GLN A 74 13.945 -5.677 -7.050 1.00 0.00 C ATOM 1236 CD GLN A 74 14.067 -5.485 -5.551 1.00 0.00 C ATOM 1237 OE1 GLN A 74 14.959 -6.044 -4.912 1.00 0.00 O ATOM 1238 NE2 GLN A 74 13.169 -4.691 -4.980 1.00 0.00 N ATOM 0 H GLN A 74 12.745 -7.440 -8.386 1.00 0.00 H new ATOM 0 HA GLN A 74 15.245 -8.759 -7.998 1.00 0.00 H new ATOM 0 HB2 GLN A 74 15.902 -6.542 -7.060 1.00 0.00 H new ATOM 0 HB3 GLN A 74 15.160 -6.428 -8.643 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.074 -4.716 -7.547 1.00 0.00 H new ATOM 0 HG3 GLN A 74 12.940 -6.027 -7.287 1.00 0.00 H new ATOM 0 HE21 GLN A 74 12.446 -4.248 -5.547 1.00 0.00 H new ATOM 0 HE22 GLN A 74 13.202 -4.524 -3.974 1.00 0.00 H new ATOM 1247 N ARG A 75 13.239 -8.875 -5.573 1.00 0.00 N ATOM 1248 CA ARG A 75 13.035 -9.291 -4.191 1.00 0.00 C ATOM 1249 C ARG A 75 13.238 -10.796 -4.041 1.00 0.00 C ATOM 1250 O ARG A 75 14.090 -11.243 -3.273 1.00 0.00 O ATOM 1251 CB ARG A 75 11.630 -8.907 -3.722 1.00 0.00 C ATOM 1252 CG ARG A 75 11.093 -7.647 -4.381 1.00 0.00 C ATOM 1253 CD ARG A 75 10.249 -6.830 -3.414 1.00 0.00 C ATOM 1254 NE ARG A 75 11.001 -6.445 -2.223 1.00 0.00 N ATOM 1255 CZ ARG A 75 10.451 -5.860 -1.164 1.00 0.00 C ATOM 1256 NH1 ARG A 75 9.152 -5.595 -1.149 1.00 0.00 N ATOM 1257 NH2 ARG A 75 11.201 -5.540 -0.118 1.00 0.00 N ATOM 0 H ARG A 75 12.391 -8.864 -6.140 1.00 0.00 H new ATOM 0 HA ARG A 75 13.771 -8.778 -3.571 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.949 -9.733 -3.927 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.643 -8.765 -2.641 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.924 -7.041 -4.742 1.00 0.00 H new ATOM 0 HG3 ARG A 75 10.494 -7.917 -5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.885 -5.935 -3.918 1.00 0.00 H new ATOM 0 HD3 ARG A 75 9.374 -7.408 -3.119 1.00 0.00 H new ATOM 0 HE ARG A 75 12.003 -6.635 -2.203 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.572 -5.840 -1.952 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.732 -5.146 -0.335 1.00 0.00 H new ATOM 0 HH21 ARG A 75 12.201 -5.743 -0.126 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.778 -5.091 0.694 1.00 0.00 H new ATOM 1271 N GLU A 76 12.450 -11.571 -4.778 1.00 0.00 N ATOM 1272 CA GLU A 76 12.543 -13.026 -4.726 1.00 0.00 C ATOM 1273 C GLU A 76 13.963 -13.491 -5.034 1.00 0.00 C ATOM 1274 O GLU A 76 14.377 -14.576 -4.622 1.00 0.00 O ATOM 1275 CB GLU A 76 11.561 -13.658 -5.714 1.00 0.00 C ATOM 1276 CG GLU A 76 12.117 -13.792 -7.122 1.00 0.00 C ATOM 1277 CD GLU A 76 12.878 -15.087 -7.328 1.00 0.00 C ATOM 1278 OE1 GLU A 76 12.543 -16.086 -6.659 1.00 0.00 O ATOM 1279 OE2 GLU A 76 13.810 -15.100 -8.160 1.00 0.00 O ATOM 0 H GLU A 76 11.740 -11.216 -5.418 1.00 0.00 H new ATOM 0 HA GLU A 76 12.286 -13.345 -3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.276 -14.645 -5.349 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.653 -13.056 -5.747 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.298 -13.739 -7.839 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.777 -12.950 -7.329 1.00 0.00 H new ATOM 1286 N LEU A 77 14.706 -12.664 -5.762 1.00 0.00 N ATOM 1287 CA LEU A 77 16.080 -12.990 -6.127 1.00 0.00 C ATOM 1288 C LEU A 77 16.904 -13.335 -4.891 1.00 0.00 C ATOM 1289 O LEU A 77 17.836 -14.138 -4.957 1.00 0.00 O ATOM 1290 CB LEU A 77 16.722 -11.818 -6.871 1.00 0.00 C ATOM 1291 CG LEU A 77 17.674 -12.187 -8.010 1.00 0.00 C ATOM 1292 CD1 LEU A 77 16.935 -12.206 -9.339 1.00 0.00 C ATOM 1293 CD2 LEU A 77 18.844 -11.215 -8.062 1.00 0.00 C ATOM 0 H LEU A 77 14.380 -11.763 -6.111 1.00 0.00 H new ATOM 0 HA LEU A 77 16.059 -13.861 -6.782 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.927 -11.192 -7.277 1.00 0.00 H new ATOM 0 HB3 LEU A 77 17.269 -11.211 -6.149 1.00 0.00 H new ATOM 0 HG LEU A 77 18.065 -13.187 -7.822 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.629 -12.470 -10.137 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.131 -12.941 -9.298 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.515 -11.220 -9.536 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.511 -11.492 -8.878 1.00 0.00 H new ATOM 0 HD22 LEU A 77 18.470 -10.204 -8.226 1.00 0.00 H new ATOM 0 HD23 LEU A 77 19.389 -11.251 -7.119 1.00 0.00 H new ATOM 1305 N LEU A 78 16.555 -12.724 -3.764 1.00 0.00 N ATOM 1306 CA LEU A 78 17.261 -12.968 -2.511 1.00 0.00 C ATOM 1307 C LEU A 78 17.185 -14.441 -2.121 1.00 0.00 C ATOM 1308 O LEU A 78 17.987 -14.925 -1.321 1.00 0.00 O ATOM 1309 CB LEU A 78 16.675 -12.102 -1.395 1.00 0.00 C ATOM 1310 CG LEU A 78 17.506 -10.887 -0.981 1.00 0.00 C ATOM 1311 CD1 LEU A 78 16.604 -9.699 -0.686 1.00 0.00 C ATOM 1312 CD2 LEU A 78 18.368 -11.218 0.229 1.00 0.00 C ATOM 0 H LEU A 78 15.787 -12.056 -3.692 1.00 0.00 H new ATOM 0 HA LEU A 78 18.308 -12.703 -2.655 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.692 -11.754 -1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 78 16.524 -12.730 -0.517 1.00 0.00 H new ATOM 0 HG LEU A 78 18.163 -10.621 -1.809 1.00 0.00 H new ATOM 0 HD11 LEU A 78 17.213 -8.844 -0.393 1.00 0.00 H new ATOM 0 HD12 LEU A 78 16.030 -9.447 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 78 15.921 -9.953 0.125 1.00 0.00 H new ATOM 0 HD21 LEU A 78 18.953 -10.342 0.510 1.00 0.00 H new ATOM 0 HD22 LEU A 78 17.729 -11.510 1.062 1.00 0.00 H new ATOM 0 HD23 LEU A 78 19.041 -12.039 -0.017 1.00 0.00 H new ATOM 1324 N HIS A 79 16.216 -15.150 -2.692 1.00 0.00 N ATOM 1325 CA HIS A 79 16.037 -16.569 -2.406 1.00 0.00 C ATOM 1326 C HIS A 79 17.105 -17.404 -3.106 1.00 0.00 C ATOM 1327 O HIS A 79 17.667 -18.328 -2.520 1.00 0.00 O ATOM 1328 CB HIS A 79 14.646 -17.027 -2.845 1.00 0.00 C ATOM 1329 CG HIS A 79 14.418 -18.498 -2.673 1.00 0.00 C ATOM 1330 ND1 HIS A 79 14.234 -19.360 -3.734 1.00 0.00 N ATOM 1331 CD2 HIS A 79 14.347 -19.258 -1.556 1.00 0.00 C ATOM 1332 CE1 HIS A 79 14.057 -20.586 -3.275 1.00 0.00 C ATOM 1333 NE2 HIS A 79 14.122 -20.551 -1.957 1.00 0.00 N ATOM 0 H HIS A 79 15.543 -14.765 -3.355 1.00 0.00 H new ATOM 0 HA HIS A 79 16.136 -16.713 -1.330 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.895 -16.482 -2.273 1.00 0.00 H new ATOM 0 HB3 HIS A 79 14.500 -16.765 -3.893 1.00 0.00 H new ATOM 0 HD2 HIS A 79 14.449 -18.912 -0.538 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.888 -21.467 -3.876 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.021 -21.355 -1.337 1.00 0.00 H new ATOM 1341 N ALA A 80 17.380 -17.071 -4.363 1.00 0.00 N ATOM 1342 CA ALA A 80 18.381 -17.788 -5.142 1.00 0.00 C ATOM 1343 C ALA A 80 19.695 -17.901 -4.377 1.00 0.00 C ATOM 1344 O ALA A 80 20.375 -18.925 -4.440 1.00 0.00 O ATOM 1345 CB ALA A 80 18.604 -17.098 -6.479 1.00 0.00 C ATOM 0 H ALA A 80 16.923 -16.309 -4.863 1.00 0.00 H new ATOM 0 HA ALA A 80 18.009 -18.796 -5.324 1.00 0.00 H new ATOM 0 HB1 ALA A 80 19.354 -17.645 -7.050 1.00 0.00 H new ATOM 0 HB2 ALA A 80 17.668 -17.076 -7.037 1.00 0.00 H new ATOM 0 HB3 ALA A 80 18.950 -16.078 -6.309 1.00 0.00 H new ATOM 1351 N ALA A 81 20.047 -16.842 -3.655 1.00 0.00 N ATOM 1352 CA ALA A 81 21.279 -16.823 -2.877 1.00 0.00 C ATOM 1353 C ALA A 81 21.208 -17.805 -1.713 1.00 0.00 C ATOM 1354 O ALA A 81 22.163 -18.536 -1.446 1.00 0.00 O ATOM 1355 CB ALA A 81 21.560 -15.417 -2.367 1.00 0.00 C ATOM 0 H ALA A 81 19.496 -15.986 -3.593 1.00 0.00 H new ATOM 0 HA ALA A 81 22.096 -17.131 -3.529 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.483 -15.418 -1.788 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.663 -14.737 -3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.735 -15.088 -1.735 1.00 0.00 H new ATOM 1361 N ARG A 82 20.073 -17.816 -1.022 1.00 0.00 N ATOM 1362 CA ARG A 82 19.879 -18.708 0.115 1.00 0.00 C ATOM 1363 C ARG A 82 20.202 -20.150 -0.264 1.00 0.00 C ATOM 1364 O ARG A 82 20.713 -20.918 0.553 1.00 0.00 O ATOM 1365 CB ARG A 82 18.439 -18.613 0.624 1.00 0.00 C ATOM 1366 CG ARG A 82 18.062 -17.230 1.129 1.00 0.00 C ATOM 1367 CD ARG A 82 16.627 -17.194 1.634 1.00 0.00 C ATOM 1368 NE ARG A 82 16.562 -17.105 3.090 1.00 0.00 N ATOM 1369 CZ ARG A 82 15.425 -16.993 3.769 1.00 0.00 C ATOM 1370 NH1 ARG A 82 14.266 -16.958 3.126 1.00 0.00 N ATOM 1371 NH2 ARG A 82 15.447 -16.918 5.093 1.00 0.00 N ATOM 0 H ARG A 82 19.274 -17.217 -1.230 1.00 0.00 H new ATOM 0 HA ARG A 82 20.559 -18.398 0.908 1.00 0.00 H new ATOM 0 HB2 ARG A 82 17.759 -18.895 -0.180 1.00 0.00 H new ATOM 0 HB3 ARG A 82 18.298 -19.335 1.428 1.00 0.00 H new ATOM 0 HG2 ARG A 82 18.739 -16.937 1.932 1.00 0.00 H new ATOM 0 HG3 ARG A 82 18.185 -16.502 0.327 1.00 0.00 H new ATOM 0 HD2 ARG A 82 16.109 -16.341 1.195 1.00 0.00 H new ATOM 0 HD3 ARG A 82 16.103 -18.090 1.302 1.00 0.00 H new ATOM 0 HE ARG A 82 17.437 -17.130 3.614 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.246 -17.017 2.108 1.00 0.00 H new ATOM 0 HH12 ARG A 82 13.395 -16.872 3.649 1.00 0.00 H new ATOM 0 HH21 ARG A 82 16.337 -16.946 5.591 1.00 0.00 H new ATOM 0 HH22 ARG A 82 14.574 -16.832 5.614 1.00 0.00 H new ATOM 1385 N LEU A 83 19.901 -20.512 -1.506 1.00 0.00 N ATOM 1386 CA LEU A 83 20.159 -21.862 -1.994 1.00 0.00 C ATOM 1387 C LEU A 83 21.473 -21.920 -2.766 1.00 0.00 C ATOM 1388 O LEU A 83 22.029 -22.996 -2.984 1.00 0.00 O ATOM 1389 CB LEU A 83 19.008 -22.332 -2.885 1.00 0.00 C ATOM 1390 CG LEU A 83 18.895 -23.842 -3.095 1.00 0.00 C ATOM 1391 CD1 LEU A 83 18.234 -24.500 -1.894 1.00 0.00 C ATOM 1392 CD2 LEU A 83 18.118 -24.148 -4.367 1.00 0.00 C ATOM 0 H LEU A 83 19.478 -19.889 -2.194 1.00 0.00 H new ATOM 0 HA LEU A 83 20.236 -22.525 -1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 83 18.073 -21.974 -2.455 1.00 0.00 H new ATOM 0 HB3 LEU A 83 19.113 -21.857 -3.860 1.00 0.00 H new ATOM 0 HG LEU A 83 19.900 -24.250 -3.200 1.00 0.00 H new ATOM 0 HD11 LEU A 83 18.162 -25.575 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 83 18.831 -24.311 -1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 83 17.235 -24.087 -1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 83 18.048 -25.228 -4.500 1.00 0.00 H new ATOM 0 HD22 LEU A 83 17.116 -23.726 -4.292 1.00 0.00 H new ATOM 0 HD23 LEU A 83 18.633 -23.710 -5.222 1.00 0.00 H new ATOM 1404 N ALA A 84 21.964 -20.756 -3.177 1.00 0.00 N ATOM 1405 CA ALA A 84 23.214 -20.674 -3.921 1.00 0.00 C ATOM 1406 C ALA A 84 24.406 -20.539 -2.980 1.00 0.00 C ATOM 1407 O ALA A 84 25.557 -20.525 -3.416 1.00 0.00 O ATOM 1408 CB ALA A 84 23.173 -19.505 -4.895 1.00 0.00 C ATOM 0 H ALA A 84 21.515 -19.856 -3.007 1.00 0.00 H new ATOM 0 HA ALA A 84 23.333 -21.599 -4.485 1.00 0.00 H new ATOM 0 HB1 ALA A 84 24.113 -19.456 -5.444 1.00 0.00 H new ATOM 0 HB2 ALA A 84 22.350 -19.644 -5.596 1.00 0.00 H new ATOM 0 HB3 ALA A 84 23.026 -18.577 -4.343 1.00 0.00 H new ATOM 1414 N LYS A 85 24.123 -20.440 -1.685 1.00 0.00 N ATOM 1415 CA LYS A 85 25.171 -20.307 -0.681 1.00 0.00 C ATOM 1416 C LYS A 85 25.993 -19.043 -0.915 1.00 0.00 C ATOM 1417 O LYS A 85 27.110 -18.918 -0.416 1.00 0.00 O ATOM 1418 CB LYS A 85 26.086 -21.534 -0.702 1.00 0.00 C ATOM 1419 CG LYS A 85 25.367 -22.835 -0.389 1.00 0.00 C ATOM 1420 CD LYS A 85 25.042 -23.611 -1.655 1.00 0.00 C ATOM 1421 CE LYS A 85 26.273 -24.312 -2.209 1.00 0.00 C ATOM 1422 NZ LYS A 85 26.747 -25.397 -1.305 1.00 0.00 N ATOM 0 H LYS A 85 23.176 -20.449 -1.307 1.00 0.00 H new ATOM 0 HA LYS A 85 24.694 -20.233 0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 85 26.551 -21.613 -1.685 1.00 0.00 H new ATOM 0 HB3 LYS A 85 26.890 -21.390 0.020 1.00 0.00 H new ATOM 0 HG2 LYS A 85 25.988 -23.447 0.265 1.00 0.00 H new ATOM 0 HG3 LYS A 85 24.447 -22.622 0.154 1.00 0.00 H new ATOM 0 HD2 LYS A 85 24.267 -24.347 -1.443 1.00 0.00 H new ATOM 0 HD3 LYS A 85 24.639 -22.932 -2.406 1.00 0.00 H new ATOM 0 HE2 LYS A 85 26.043 -24.730 -3.189 1.00 0.00 H new ATOM 0 HE3 LYS A 85 27.072 -23.584 -2.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 27.360 -26.048 -1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 27.283 -24.982 -0.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 25.929 -25.919 -0.931 1.00 0.00 H new ATOM 1436 N GLN A 86 25.430 -18.110 -1.676 1.00 0.00 N ATOM 1437 CA GLN A 86 26.111 -16.856 -1.975 1.00 0.00 C ATOM 1438 C GLN A 86 25.230 -15.661 -1.626 1.00 0.00 C ATOM 1439 O GLN A 86 24.126 -15.823 -1.109 1.00 0.00 O ATOM 1440 CB GLN A 86 26.501 -16.803 -3.454 1.00 0.00 C ATOM 1441 CG GLN A 86 27.025 -18.124 -3.993 1.00 0.00 C ATOM 1442 CD GLN A 86 28.272 -17.956 -4.838 1.00 0.00 C ATOM 1443 OE1 GLN A 86 29.315 -17.523 -4.347 1.00 0.00 O ATOM 1444 NE2 GLN A 86 28.171 -18.298 -6.117 1.00 0.00 N ATOM 0 H GLN A 86 24.505 -18.199 -2.096 1.00 0.00 H new ATOM 0 HA GLN A 86 27.014 -16.808 -1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 86 25.633 -16.500 -4.039 1.00 0.00 H new ATOM 0 HB3 GLN A 86 27.263 -16.036 -3.593 1.00 0.00 H new ATOM 0 HG2 GLN A 86 27.243 -18.791 -3.159 1.00 0.00 H new ATOM 0 HG3 GLN A 86 26.248 -18.602 -4.590 1.00 0.00 H new ATOM 0 HE21 GLN A 86 27.287 -18.653 -6.482 1.00 0.00 H new ATOM 0 HE22 GLN A 86 28.978 -18.206 -6.735 1.00 0.00 H new ATOM 1453 N ASN A 87 25.728 -14.462 -1.911 1.00 0.00 N ATOM 1454 CA ASN A 87 24.986 -13.240 -1.626 1.00 0.00 C ATOM 1455 C ASN A 87 23.859 -13.039 -2.636 1.00 0.00 C ATOM 1456 O ASN A 87 23.915 -13.518 -3.769 1.00 0.00 O ATOM 1457 CB ASN A 87 25.925 -12.032 -1.646 1.00 0.00 C ATOM 1458 CG ASN A 87 26.079 -11.396 -0.278 1.00 0.00 C ATOM 1459 OD1 ASN A 87 26.372 -12.077 0.705 1.00 0.00 O ATOM 1460 ND2 ASN A 87 25.880 -10.085 -0.209 1.00 0.00 N ATOM 0 H ASN A 87 26.642 -14.311 -2.339 1.00 0.00 H new ATOM 0 HA ASN A 87 24.547 -13.335 -0.633 1.00 0.00 H new ATOM 0 HB2 ASN A 87 26.904 -12.342 -2.012 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.543 -11.290 -2.348 1.00 0.00 H new ATOM 0 HD21 ASN A 87 25.968 -9.602 0.685 1.00 0.00 H new ATOM 0 HD22 ASN A 87 25.639 -9.561 -1.050 1.00 0.00 H new ATOM 1467 N PRO A 88 22.812 -12.313 -2.217 1.00 0.00 N ATOM 1468 CA PRO A 88 21.653 -12.031 -3.069 1.00 0.00 C ATOM 1469 C PRO A 88 21.989 -11.072 -4.206 1.00 0.00 C ATOM 1470 O PRO A 88 21.482 -11.211 -5.318 1.00 0.00 O ATOM 1471 CB PRO A 88 20.652 -11.390 -2.105 1.00 0.00 C ATOM 1472 CG PRO A 88 21.491 -10.801 -1.024 1.00 0.00 C ATOM 1473 CD PRO A 88 22.678 -11.712 -0.880 1.00 0.00 C ATOM 0 HA PRO A 88 21.278 -12.930 -3.558 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.056 -10.626 -2.604 1.00 0.00 H new ATOM 0 HB3 PRO A 88 19.956 -12.129 -1.708 1.00 0.00 H new ATOM 0 HG2 PRO A 88 21.804 -9.789 -1.281 1.00 0.00 H new ATOM 0 HG3 PRO A 88 20.934 -10.735 -0.089 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.575 -11.161 -0.595 1.00 0.00 H new ATOM 0 HD3 PRO A 88 22.512 -12.469 -0.114 1.00 0.00 H new ATOM 1481 N ALA A 89 22.846 -10.098 -3.918 1.00 0.00 N ATOM 1482 CA ALA A 89 23.251 -9.117 -4.917 1.00 0.00 C ATOM 1483 C ALA A 89 24.526 -9.554 -5.631 1.00 0.00 C ATOM 1484 O ALA A 89 24.853 -9.046 -6.702 1.00 0.00 O ATOM 1485 CB ALA A 89 23.448 -7.755 -4.269 1.00 0.00 C ATOM 0 H ALA A 89 23.273 -9.967 -3.001 1.00 0.00 H new ATOM 0 HA ALA A 89 22.457 -9.043 -5.660 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.750 -7.032 -5.027 1.00 0.00 H new ATOM 0 HB2 ALA A 89 22.513 -7.431 -3.811 1.00 0.00 H new ATOM 0 HB3 ALA A 89 24.222 -7.824 -3.504 1.00 0.00 H new ATOM 1491 N GLN A 90 25.241 -10.499 -5.029 1.00 0.00 N ATOM 1492 CA GLN A 90 26.481 -11.003 -5.608 1.00 0.00 C ATOM 1493 C GLN A 90 26.239 -12.308 -6.361 1.00 0.00 C ATOM 1494 O GLN A 90 27.109 -12.786 -7.089 1.00 0.00 O ATOM 1495 CB GLN A 90 27.529 -11.218 -4.514 1.00 0.00 C ATOM 1496 CG GLN A 90 27.641 -10.055 -3.542 1.00 0.00 C ATOM 1497 CD GLN A 90 28.187 -8.800 -4.195 1.00 0.00 C ATOM 1498 OE1 GLN A 90 27.429 -7.956 -4.674 1.00 0.00 O ATOM 1499 NE2 GLN A 90 29.508 -8.670 -4.216 1.00 0.00 N ATOM 0 H GLN A 90 24.983 -10.931 -4.142 1.00 0.00 H new ATOM 0 HA GLN A 90 26.851 -10.260 -6.315 1.00 0.00 H new ATOM 0 HB2 GLN A 90 27.282 -12.123 -3.958 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.500 -11.386 -4.980 1.00 0.00 H new ATOM 0 HG2 GLN A 90 26.659 -9.843 -3.120 1.00 0.00 H new ATOM 0 HG3 GLN A 90 28.289 -10.340 -2.713 1.00 0.00 H new ATOM 0 HE21 GLN A 90 30.098 -9.394 -3.807 1.00 0.00 H new ATOM 0 HE22 GLN A 90 29.933 -7.846 -4.641 1.00 0.00 H new ATOM 1508 N TYR A 91 25.053 -12.878 -6.180 1.00 0.00 N ATOM 1509 CA TYR A 91 24.698 -14.129 -6.840 1.00 0.00 C ATOM 1510 C TYR A 91 24.991 -14.057 -8.336 1.00 0.00 C ATOM 1511 O TYR A 91 25.776 -14.845 -8.866 1.00 0.00 O ATOM 1512 CB TYR A 91 23.220 -14.448 -6.613 1.00 0.00 C ATOM 1513 CG TYR A 91 22.717 -15.610 -7.440 1.00 0.00 C ATOM 1514 CD1 TYR A 91 23.292 -16.870 -7.325 1.00 0.00 C ATOM 1515 CD2 TYR A 91 21.666 -15.448 -8.334 1.00 0.00 C ATOM 1516 CE1 TYR A 91 22.837 -17.934 -8.079 1.00 0.00 C ATOM 1517 CE2 TYR A 91 21.203 -16.508 -9.091 1.00 0.00 C ATOM 1518 CZ TYR A 91 21.792 -17.748 -8.960 1.00 0.00 C ATOM 1519 OH TYR A 91 21.335 -18.806 -9.712 1.00 0.00 O ATOM 0 H TYR A 91 24.321 -12.494 -5.582 1.00 0.00 H new ATOM 0 HA TYR A 91 25.305 -14.924 -6.407 1.00 0.00 H new ATOM 0 HB2 TYR A 91 23.063 -14.669 -5.557 1.00 0.00 H new ATOM 0 HB3 TYR A 91 22.626 -13.564 -6.845 1.00 0.00 H new ATOM 0 HD1 TYR A 91 24.109 -17.020 -6.634 1.00 0.00 H new ATOM 0 HD2 TYR A 91 21.203 -14.478 -8.439 1.00 0.00 H new ATOM 0 HE1 TYR A 91 23.297 -18.906 -7.979 1.00 0.00 H new ATOM 0 HE2 TYR A 91 20.385 -16.366 -9.781 1.00 0.00 H new ATOM 0 HH TYR A 91 20.595 -18.508 -10.281 1.00 0.00 H new ATOM 1529 N LEU A 92 24.354 -13.108 -9.012 1.00 0.00 N ATOM 1530 CA LEU A 92 24.545 -12.931 -10.447 1.00 0.00 C ATOM 1531 C LEU A 92 25.659 -11.928 -10.729 1.00 0.00 C ATOM 1532 O LEU A 92 26.432 -12.092 -11.673 1.00 0.00 O ATOM 1533 CB LEU A 92 23.244 -12.461 -11.101 1.00 0.00 C ATOM 1534 CG LEU A 92 23.150 -12.643 -12.616 1.00 0.00 C ATOM 1535 CD1 LEU A 92 22.497 -13.974 -12.955 1.00 0.00 C ATOM 1536 CD2 LEU A 92 22.378 -11.493 -13.245 1.00 0.00 C ATOM 0 H LEU A 92 23.700 -12.449 -8.589 1.00 0.00 H new ATOM 0 HA LEU A 92 24.831 -13.893 -10.871 1.00 0.00 H new ATOM 0 HB2 LEU A 92 22.415 -12.996 -10.639 1.00 0.00 H new ATOM 0 HB3 LEU A 92 23.108 -11.404 -10.873 1.00 0.00 H new ATOM 0 HG LEU A 92 24.160 -12.643 -13.025 1.00 0.00 H new ATOM 0 HD11 LEU A 92 22.439 -14.085 -14.038 1.00 0.00 H new ATOM 0 HD12 LEU A 92 23.091 -14.787 -12.538 1.00 0.00 H new ATOM 0 HD13 LEU A 92 21.493 -14.005 -12.533 1.00 0.00 H new ATOM 0 HD21 LEU A 92 22.321 -11.640 -14.324 1.00 0.00 H new ATOM 0 HD22 LEU A 92 21.371 -11.461 -12.830 1.00 0.00 H new ATOM 0 HD23 LEU A 92 22.888 -10.553 -13.033 1.00 0.00 H new ATOM 1548 N ALA A 93 25.738 -10.891 -9.902 1.00 0.00 N ATOM 1549 CA ALA A 93 26.760 -9.864 -10.060 1.00 0.00 C ATOM 1550 C ALA A 93 28.159 -10.461 -9.951 1.00 0.00 C ATOM 1551 O ALA A 93 28.975 -10.323 -10.862 1.00 0.00 O ATOM 1552 CB ALA A 93 26.570 -8.767 -9.023 1.00 0.00 C ATOM 0 H ALA A 93 25.106 -10.740 -9.116 1.00 0.00 H new ATOM 0 HA ALA A 93 26.655 -9.431 -11.055 1.00 0.00 H new ATOM 0 HB1 ALA A 93 27.340 -8.007 -9.153 1.00 0.00 H new ATOM 0 HB2 ALA A 93 25.587 -8.313 -9.149 1.00 0.00 H new ATOM 0 HB3 ALA A 93 26.647 -9.194 -8.023 1.00 0.00 H new ATOM 1558 N GLN A 94 28.429 -11.124 -8.831 1.00 0.00 N ATOM 1559 CA GLN A 94 29.731 -11.741 -8.604 1.00 0.00 C ATOM 1560 C GLN A 94 30.832 -10.687 -8.559 1.00 0.00 C ATOM 1561 O GLN A 94 31.997 -10.979 -8.834 1.00 0.00 O ATOM 1562 CB GLN A 94 30.032 -12.764 -9.700 1.00 0.00 C ATOM 1563 CG GLN A 94 28.885 -13.727 -9.965 1.00 0.00 C ATOM 1564 CD GLN A 94 29.302 -14.911 -10.815 1.00 0.00 C ATOM 1565 OE1 GLN A 94 29.711 -14.751 -11.965 1.00 0.00 O ATOM 1566 NE2 GLN A 94 29.200 -16.109 -10.252 1.00 0.00 N ATOM 0 H GLN A 94 27.764 -11.248 -8.067 1.00 0.00 H new ATOM 0 HA GLN A 94 29.701 -12.250 -7.641 1.00 0.00 H new ATOM 0 HB2 GLN A 94 30.272 -12.236 -10.623 1.00 0.00 H new ATOM 0 HB3 GLN A 94 30.917 -13.335 -9.420 1.00 0.00 H new ATOM 0 HG2 GLN A 94 28.491 -14.088 -9.015 1.00 0.00 H new ATOM 0 HG3 GLN A 94 28.076 -13.194 -10.464 1.00 0.00 H new ATOM 0 HE21 GLN A 94 28.856 -16.195 -9.296 1.00 0.00 H new ATOM 0 HE22 GLN A 94 29.466 -16.943 -10.776 1.00 0.00 H new ATOM 1575 N HIS A 95 30.457 -9.460 -8.213 1.00 0.00 N ATOM 1576 CA HIS A 95 31.413 -8.362 -8.132 1.00 0.00 C ATOM 1577 C HIS A 95 30.869 -7.229 -7.266 1.00 0.00 C ATOM 1578 O HIS A 95 29.724 -7.274 -6.819 1.00 0.00 O ATOM 1579 CB HIS A 95 31.740 -7.838 -9.531 1.00 0.00 C ATOM 1580 CG HIS A 95 33.037 -8.351 -10.075 1.00 0.00 C ATOM 1581 ND1 HIS A 95 34.260 -8.055 -9.510 1.00 0.00 N ATOM 1582 CD2 HIS A 95 33.299 -9.147 -11.138 1.00 0.00 C ATOM 1583 CE1 HIS A 95 35.217 -8.645 -10.204 1.00 0.00 C ATOM 1584 NE2 HIS A 95 34.661 -9.315 -11.196 1.00 0.00 N ATOM 0 H HIS A 95 29.497 -9.201 -7.984 1.00 0.00 H new ATOM 0 HA HIS A 95 32.325 -8.741 -7.671 1.00 0.00 H new ATOM 0 HB2 HIS A 95 30.935 -8.116 -10.211 1.00 0.00 H new ATOM 0 HB3 HIS A 95 31.772 -6.749 -9.504 1.00 0.00 H new ATOM 0 HD2 HIS A 95 32.572 -9.571 -11.815 1.00 0.00 H new ATOM 0 HE1 HIS A 95 36.275 -8.589 -9.995 1.00 0.00 H new ATOM 0 HE2 HIS A 95 35.161 -9.868 -11.892 1.00 0.00 H new ATOM 1592 N GLU A 96 31.699 -6.217 -7.035 1.00 0.00 N ATOM 1593 CA GLU A 96 31.300 -5.074 -6.221 1.00 0.00 C ATOM 1594 C GLU A 96 30.671 -3.984 -7.085 1.00 0.00 C ATOM 1595 O GLU A 96 29.622 -3.438 -6.745 1.00 0.00 O ATOM 1596 CB GLU A 96 32.506 -4.510 -5.467 1.00 0.00 C ATOM 1597 CG GLU A 96 32.205 -3.230 -4.707 1.00 0.00 C ATOM 1598 CD GLU A 96 33.368 -2.776 -3.846 1.00 0.00 C ATOM 1599 OE1 GLU A 96 34.129 -3.643 -3.371 1.00 0.00 O ATOM 1600 OE2 GLU A 96 33.515 -1.551 -3.648 1.00 0.00 O ATOM 0 H GLU A 96 32.650 -6.165 -7.399 1.00 0.00 H new ATOM 0 HA GLU A 96 30.558 -5.416 -5.500 1.00 0.00 H new ATOM 0 HB2 GLU A 96 32.869 -5.262 -4.766 1.00 0.00 H new ATOM 0 HB3 GLU A 96 33.311 -4.320 -6.177 1.00 0.00 H new ATOM 0 HG2 GLU A 96 31.953 -2.441 -5.416 1.00 0.00 H new ATOM 0 HG3 GLU A 96 31.329 -3.383 -4.077 1.00 0.00 H new ATOM 1607 N GLN A 97 31.321 -3.674 -8.202 1.00 0.00 N ATOM 1608 CA GLN A 97 30.827 -2.649 -9.113 1.00 0.00 C ATOM 1609 C GLN A 97 29.378 -2.921 -9.505 1.00 0.00 C ATOM 1610 O GLN A 97 28.608 -1.994 -9.760 1.00 0.00 O ATOM 1611 CB GLN A 97 31.703 -2.585 -10.366 1.00 0.00 C ATOM 1612 CG GLN A 97 32.776 -1.510 -10.303 1.00 0.00 C ATOM 1613 CD GLN A 97 33.818 -1.662 -11.394 1.00 0.00 C ATOM 1614 OE1 GLN A 97 33.577 -2.311 -12.412 1.00 0.00 O ATOM 1615 NE2 GLN A 97 34.984 -1.061 -11.187 1.00 0.00 N ATOM 0 H GLN A 97 32.190 -4.118 -8.498 1.00 0.00 H new ATOM 0 HA GLN A 97 30.871 -1.689 -8.598 1.00 0.00 H new ATOM 0 HB2 GLN A 97 32.179 -3.554 -10.516 1.00 0.00 H new ATOM 0 HB3 GLN A 97 31.069 -2.404 -11.234 1.00 0.00 H new ATOM 0 HG2 GLN A 97 32.308 -0.529 -10.387 1.00 0.00 H new ATOM 0 HG3 GLN A 97 33.266 -1.547 -9.330 1.00 0.00 H new ATOM 0 HE21 GLN A 97 35.140 -0.533 -10.328 1.00 0.00 H new ATOM 0 HE22 GLN A 97 35.723 -1.127 -11.887 1.00 0.00 H new ATOM 1624 N LEU A 98 29.013 -4.198 -9.550 1.00 0.00 N ATOM 1625 CA LEU A 98 27.656 -4.593 -9.911 1.00 0.00 C ATOM 1626 C LEU A 98 26.797 -4.791 -8.666 1.00 0.00 C ATOM 1627 O LEU A 98 26.428 -5.915 -8.326 1.00 0.00 O ATOM 1628 CB LEU A 98 27.681 -5.880 -10.737 1.00 0.00 C ATOM 1629 CG LEU A 98 27.878 -5.707 -12.244 1.00 0.00 C ATOM 1630 CD1 LEU A 98 26.703 -4.958 -12.853 1.00 0.00 C ATOM 1631 CD2 LEU A 98 29.183 -4.979 -12.531 1.00 0.00 C ATOM 0 H LEU A 98 29.638 -4.977 -9.341 1.00 0.00 H new ATOM 0 HA LEU A 98 27.218 -3.793 -10.509 1.00 0.00 H new ATOM 0 HB2 LEU A 98 28.480 -6.516 -10.357 1.00 0.00 H new ATOM 0 HB3 LEU A 98 26.744 -6.412 -10.572 1.00 0.00 H new ATOM 0 HG LEU A 98 27.929 -6.696 -12.700 1.00 0.00 H new ATOM 0 HD11 LEU A 98 26.861 -4.844 -13.926 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.784 -5.518 -12.679 1.00 0.00 H new ATOM 0 HD13 LEU A 98 26.621 -3.974 -12.392 1.00 0.00 H new ATOM 0 HD21 LEU A 98 29.307 -4.865 -13.608 1.00 0.00 H new ATOM 0 HD22 LEU A 98 29.162 -3.995 -12.062 1.00 0.00 H new ATOM 0 HD23 LEU A 98 30.017 -5.555 -12.129 1.00 0.00 H new ATOM 1643 N LEU A 99 26.481 -3.691 -7.991 1.00 0.00 N ATOM 1644 CA LEU A 99 25.663 -3.743 -6.784 1.00 0.00 C ATOM 1645 C LEU A 99 24.278 -3.157 -7.040 1.00 0.00 C ATOM 1646 O LEU A 99 23.981 -2.034 -6.630 1.00 0.00 O ATOM 1647 CB LEU A 99 26.348 -2.983 -5.647 1.00 0.00 C ATOM 1648 CG LEU A 99 25.984 -3.425 -4.229 1.00 0.00 C ATOM 1649 CD1 LEU A 99 24.509 -3.174 -3.954 1.00 0.00 C ATOM 1650 CD2 LEU A 99 26.323 -4.895 -4.025 1.00 0.00 C ATOM 0 H LEU A 99 26.779 -2.753 -8.259 1.00 0.00 H new ATOM 0 HA LEU A 99 25.548 -4.788 -6.497 1.00 0.00 H new ATOM 0 HB2 LEU A 99 27.427 -3.080 -5.770 1.00 0.00 H new ATOM 0 HB3 LEU A 99 26.109 -1.924 -5.749 1.00 0.00 H new ATOM 0 HG LEU A 99 26.570 -2.836 -3.524 1.00 0.00 H new ATOM 0 HD11 LEU A 99 24.268 -3.495 -2.940 1.00 0.00 H new ATOM 0 HD12 LEU A 99 24.295 -2.110 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU A 99 23.905 -3.737 -4.666 1.00 0.00 H new ATOM 0 HD21 LEU A 99 26.057 -5.192 -3.011 1.00 0.00 H new ATOM 0 HD22 LEU A 99 25.764 -5.500 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 99 27.391 -5.047 -4.180 1.00 0.00 H new ATOM 1662 N LEU A 100 23.432 -3.926 -7.717 1.00 0.00 N ATOM 1663 CA LEU A 100 22.077 -3.485 -8.026 1.00 0.00 C ATOM 1664 C LEU A 100 22.088 -2.111 -8.688 1.00 0.00 C ATOM 1665 O LEU A 100 21.613 -1.130 -8.115 1.00 0.00 O ATOM 1666 CB LEU A 100 21.231 -3.442 -6.752 1.00 0.00 C ATOM 1667 CG LEU A 100 20.576 -4.761 -6.337 1.00 0.00 C ATOM 1668 CD1 LEU A 100 19.602 -5.233 -7.405 1.00 0.00 C ATOM 1669 CD2 LEU A 100 21.635 -5.821 -6.071 1.00 0.00 C ATOM 0 H LEU A 100 23.661 -4.858 -8.062 1.00 0.00 H new ATOM 0 HA LEU A 100 21.639 -4.200 -8.723 1.00 0.00 H new ATOM 0 HB2 LEU A 100 21.862 -3.099 -5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 100 20.447 -2.696 -6.885 1.00 0.00 H new ATOM 0 HG LEU A 100 20.018 -4.594 -5.416 1.00 0.00 H new ATOM 0 HD11 LEU A 100 19.146 -6.172 -7.092 1.00 0.00 H new ATOM 0 HD12 LEU A 100 18.825 -4.482 -7.546 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.136 -5.384 -8.343 1.00 0.00 H new ATOM 0 HD21 LEU A 100 21.152 -6.753 -5.777 1.00 0.00 H new ATOM 0 HD22 LEU A 100 22.220 -5.986 -6.976 1.00 0.00 H new ATOM 0 HD23 LEU A 100 22.293 -5.485 -5.269 1.00 0.00 H new ATOM 1681 N ASP A 101 22.632 -2.048 -9.899 1.00 0.00 N ATOM 1682 CA ASP A 101 22.703 -0.795 -10.641 1.00 0.00 C ATOM 1683 C ASP A 101 21.363 -0.475 -11.296 1.00 0.00 C ATOM 1684 O ASP A 101 21.185 -0.675 -12.497 1.00 0.00 O ATOM 1685 CB ASP A 101 23.800 -0.868 -11.704 1.00 0.00 C ATOM 1686 CG ASP A 101 24.181 0.498 -12.239 1.00 0.00 C ATOM 1687 OD1 ASP A 101 25.091 1.129 -11.661 1.00 0.00 O ATOM 1688 OD2 ASP A 101 23.570 0.937 -13.235 1.00 0.00 O ATOM 0 H ASP A 101 23.030 -2.850 -10.387 1.00 0.00 H new ATOM 0 HA ASP A 101 22.943 0.002 -9.937 1.00 0.00 H new ATOM 0 HB2 ASP A 101 24.682 -1.347 -11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 101 23.462 -1.496 -12.528 1.00 0.00 H new ATOM 1693 N ALA A 102 20.424 0.022 -10.497 1.00 0.00 N ATOM 1694 CA ALA A 102 19.101 0.371 -11.000 1.00 0.00 C ATOM 1695 C ALA A 102 19.075 1.798 -11.536 1.00 0.00 C ATOM 1696 O ALA A 102 18.869 2.019 -12.729 1.00 0.00 O ATOM 1697 CB ALA A 102 18.058 0.198 -9.905 1.00 0.00 C ATOM 0 H ALA A 102 20.555 0.192 -9.500 1.00 0.00 H new ATOM 0 HA ALA A 102 18.864 -0.302 -11.824 1.00 0.00 H new ATOM 0 HB1 ALA A 102 17.075 0.462 -10.294 1.00 0.00 H new ATOM 0 HB2 ALA A 102 18.050 -0.840 -9.571 1.00 0.00 H new ATOM 0 HB3 ALA A 102 18.302 0.848 -9.064 1.00 0.00 H new ATOM 1703 N SER A 103 19.286 2.763 -10.647 1.00 0.00 N ATOM 1704 CA SER A 103 19.283 4.170 -11.031 1.00 0.00 C ATOM 1705 C SER A 103 20.499 4.502 -11.890 1.00 0.00 C ATOM 1706 O SER A 103 20.822 5.670 -12.102 1.00 0.00 O ATOM 1707 CB SER A 103 19.265 5.060 -9.787 1.00 0.00 C ATOM 1708 OG SER A 103 18.445 4.504 -8.774 1.00 0.00 O ATOM 0 H SER A 103 19.461 2.597 -9.656 1.00 0.00 H new ATOM 0 HA SER A 103 18.384 4.359 -11.617 1.00 0.00 H new ATOM 0 HB2 SER A 103 20.280 5.184 -9.410 1.00 0.00 H new ATOM 0 HB3 SER A 103 18.900 6.052 -10.051 1.00 0.00 H new ATOM 0 HG SER A 103 18.452 5.091 -7.989 1.00 0.00 H new TER 1714 SER A 103