USER MOD reduce.3.24.130724 H: found=0, std=0, add=1488, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1486 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 35 CYS SG : rot -11:sc= 0.233 USER MOD Set 1.2: B 39 GLN : amide:sc= -1.15 K(o=-1.4,f=-7.4!) USER MOD Set 1.3: B 43 HIS : no HD1:sc= -0.506 K(o=-1.4,f=-4.9!) USER MOD Set 2.1: B 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 50 ASN : amide:sc= -0.015 K(o=-0.015,f=-2!) USER MOD Set 3.1: A 91 GLN : amide:sc= -0.971 K(o=-2.7,f=-5.4) USER MOD Set 3.2: B 81 HIS : no HD1:sc= -1.69 K(o=-2.7,f=-4.1) USER MOD Set 4.1: A 81 HIS : no HE2:sc= -1.04 K(o=-2.1,f=-4.8) USER MOD Set 4.2: B 91 GLN : amide:sc= -1.09 K(o=-2.1,f=-5) USER MOD Set 5.1: A 35 CYS SG : rot -11:sc= 0.285 USER MOD Set 5.2: A 39 GLN : amide:sc= -0.92 K(o=-0.86,f=-5.1!) USER MOD Set 5.3: A 43 HIS : no HD1:sc= -0.226 K(o=-0.86,f=-4.9!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00481 USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.253 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.0613 K(o=-0.061,f=-1.6) USER MOD Single : A 52 SER OG : rot 92:sc= 1.31 USER MOD Single : A 53 ASN : amide:sc= 0.92 K(o=0.92,f=0) USER MOD Single : A 54 HIS : no HD1:sc= -1.66 X(o=-1.7,f=-2.1) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 21:sc= 1.25 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.67) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -66:sc= 1.17 USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.543 USER MOD Single : A 100 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.28) USER MOD Single : B 24 CYS SG : rot 92:sc= 0.00824 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.234 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 88:sc= 1.26 USER MOD Single : B 53 ASN : amide:sc= 0.836 K(o=0.84,f=0) USER MOD Single : B 54 HIS : no HE2:sc= -0.528 K(o=-0.53,f=-4.3!) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 180:sc= -0.122 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.52) USER MOD Single : B 75 TYR OH : rot 180:sc= 0.0264 USER MOD Single : B 80 SER OG : rot -68:sc= 1.13 USER MOD Single : B 98 THR OG1 : rot -160:sc= -0.995 USER MOD Single : B 100 GLN : amide:sc= -0.419 X(o=-0.42,f=-0.39) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 10 10.237 -0.065 -11.346 1.00 0.00 N ATOM 2 CA ALA A 10 9.371 -1.156 -10.891 1.00 0.00 C ATOM 3 C ALA A 10 8.372 -0.631 -9.849 1.00 0.00 C ATOM 4 O ALA A 10 8.555 -0.781 -8.639 1.00 0.00 O ATOM 5 CB ALA A 10 10.202 -2.361 -10.436 1.00 0.00 C ATOM 0 HA ALA A 10 8.769 -1.530 -11.719 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.536 -3.157 -10.103 1.00 0.00 H new ATOM 0 HB2 ALA A 10 10.809 -2.719 -11.268 1.00 0.00 H new ATOM 0 HB3 ALA A 10 10.853 -2.064 -9.613 1.00 0.00 H new ATOM 11 N LEU A 11 7.310 0.020 -10.331 1.00 0.00 N ATOM 12 CA LEU A 11 6.366 0.763 -9.489 1.00 0.00 C ATOM 13 C LEU A 11 5.667 -0.098 -8.428 1.00 0.00 C ATOM 14 O LEU A 11 5.410 0.409 -7.339 1.00 0.00 O ATOM 15 CB LEU A 11 5.344 1.502 -10.372 1.00 0.00 C ATOM 16 CG LEU A 11 5.740 2.915 -10.857 1.00 0.00 C ATOM 17 CD1 LEU A 11 5.859 3.893 -9.680 1.00 0.00 C ATOM 18 CD2 LEU A 11 7.018 2.932 -11.701 1.00 0.00 C ATOM 0 H LEU A 11 7.079 0.047 -11.324 1.00 0.00 H new ATOM 0 HA LEU A 11 6.953 1.488 -8.926 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.142 0.886 -11.248 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.409 1.582 -9.817 1.00 0.00 H new ATOM 0 HG LEU A 11 4.931 3.243 -11.510 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.139 4.878 -10.053 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.901 3.959 -9.163 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.621 3.537 -8.987 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.238 3.955 -12.008 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.849 2.544 -11.111 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.878 2.310 -12.585 1.00 0.00 H new ATOM 30 N ALA A 12 5.436 -1.395 -8.657 1.00 0.00 N ATOM 31 CA ALA A 12 4.925 -2.310 -7.621 1.00 0.00 C ATOM 32 C ALA A 12 5.778 -2.293 -6.327 1.00 0.00 C ATOM 33 O ALA A 12 5.264 -2.395 -5.208 1.00 0.00 O ATOM 34 CB ALA A 12 4.846 -3.714 -8.235 1.00 0.00 C ATOM 0 H ALA A 12 5.596 -1.842 -9.560 1.00 0.00 H new ATOM 0 HA ALA A 12 3.935 -1.979 -7.307 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.470 -4.416 -7.491 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.173 -3.699 -9.092 1.00 0.00 H new ATOM 0 HB3 ALA A 12 5.839 -4.026 -8.559 1.00 0.00 H new ATOM 40 N ARG A 13 7.092 -2.066 -6.449 1.00 0.00 N ATOM 41 CA ARG A 13 8.017 -1.970 -5.315 1.00 0.00 C ATOM 42 C ARG A 13 7.759 -0.729 -4.427 1.00 0.00 C ATOM 43 O ARG A 13 8.177 -0.722 -3.265 1.00 0.00 O ATOM 44 CB ARG A 13 9.464 -1.962 -5.823 1.00 0.00 C ATOM 45 CG ARG A 13 9.844 -3.030 -6.864 1.00 0.00 C ATOM 46 CD ARG A 13 9.933 -4.478 -6.371 1.00 0.00 C ATOM 47 NE ARG A 13 10.069 -5.388 -7.527 1.00 0.00 N ATOM 48 CZ ARG A 13 11.108 -5.425 -8.355 1.00 0.00 C ATOM 49 NH1 ARG A 13 12.272 -4.874 -8.096 1.00 0.00 N ATOM 50 NH2 ARG A 13 11.000 -5.996 -9.531 1.00 0.00 N ATOM 0 H ARG A 13 7.548 -1.942 -7.353 1.00 0.00 H new ATOM 0 HA ARG A 13 7.845 -2.845 -4.689 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.666 -0.981 -6.254 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.125 -2.075 -4.964 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.114 -2.991 -7.672 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.808 -2.758 -7.293 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.786 -4.593 -5.702 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.042 -4.733 -5.798 1.00 0.00 H new ATOM 0 HE ARG A 13 9.305 -6.040 -7.704 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.418 -4.381 -7.215 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.030 -4.939 -8.776 1.00 0.00 H new ATOM 0 HH21 ARG A 13 10.115 -6.415 -9.815 1.00 0.00 H new ATOM 0 HH22 ARG A 13 11.801 -6.021 -10.161 1.00 0.00 H new ATOM 64 N LEU A 14 7.044 0.291 -4.920 1.00 0.00 N ATOM 65 CA LEU A 14 6.598 1.452 -4.138 1.00 0.00 C ATOM 66 C LEU A 14 5.504 1.050 -3.142 1.00 0.00 C ATOM 67 O LEU A 14 5.573 1.435 -1.977 1.00 0.00 O ATOM 68 CB LEU A 14 6.142 2.547 -5.126 1.00 0.00 C ATOM 69 CG LEU A 14 5.917 3.969 -4.572 1.00 0.00 C ATOM 70 CD1 LEU A 14 4.592 4.130 -3.805 1.00 0.00 C ATOM 71 CD2 LEU A 14 7.078 4.443 -3.698 1.00 0.00 C ATOM 0 H LEU A 14 6.753 0.333 -5.897 1.00 0.00 H new ATOM 0 HA LEU A 14 7.414 1.849 -3.534 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.885 2.611 -5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.211 2.216 -5.586 1.00 0.00 H new ATOM 0 HG LEU A 14 5.861 4.601 -5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.502 5.155 -3.445 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.758 3.904 -4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.577 3.445 -2.957 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.871 5.449 -3.333 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.196 3.767 -2.851 1.00 0.00 H new ATOM 0 HD23 LEU A 14 7.996 4.452 -4.286 1.00 0.00 H new ATOM 83 N GLY A 15 4.580 0.164 -3.543 1.00 0.00 N ATOM 84 CA GLY A 15 3.606 -0.434 -2.627 1.00 0.00 C ATOM 85 C GLY A 15 4.301 -1.272 -1.556 1.00 0.00 C ATOM 86 O GLY A 15 3.970 -1.148 -0.383 1.00 0.00 O ATOM 0 H GLY A 15 4.490 -0.155 -4.508 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.018 0.352 -2.153 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.911 -1.059 -3.188 1.00 0.00 H new ATOM 90 N ARG A 16 5.337 -2.040 -1.925 1.00 0.00 N ATOM 91 CA ARG A 16 6.206 -2.750 -0.973 1.00 0.00 C ATOM 92 C ARG A 16 6.824 -1.752 0.001 1.00 0.00 C ATOM 93 O ARG A 16 6.789 -1.966 1.203 1.00 0.00 O ATOM 94 CB ARG A 16 7.276 -3.572 -1.722 1.00 0.00 C ATOM 95 CG ARG A 16 8.431 -4.170 -0.884 1.00 0.00 C ATOM 96 CD ARG A 16 9.515 -3.208 -0.344 1.00 0.00 C ATOM 97 NE ARG A 16 10.081 -2.297 -1.362 1.00 0.00 N ATOM 98 CZ ARG A 16 11.136 -2.550 -2.126 1.00 0.00 C ATOM 99 NH1 ARG A 16 11.726 -3.719 -2.160 1.00 0.00 N ATOM 100 NH2 ARG A 16 11.659 -1.632 -2.904 1.00 0.00 N ATOM 0 H ARG A 16 5.598 -2.187 -2.900 1.00 0.00 H new ATOM 0 HA ARG A 16 5.611 -3.457 -0.395 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.773 -4.392 -2.235 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.713 -2.935 -2.491 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.991 -4.688 -0.032 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.929 -4.924 -1.493 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.087 -2.612 0.462 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.323 -3.797 0.090 1.00 0.00 H new ATOM 0 HE ARG A 16 9.620 -1.396 -1.488 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.377 -4.484 -1.582 1.00 0.00 H new ATOM 0 HH12 ARG A 16 12.535 -3.865 -2.764 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.254 -0.696 -2.932 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.470 -1.854 -3.481 1.00 0.00 H new ATOM 114 N ALA A 17 7.343 -0.627 -0.494 1.00 0.00 N ATOM 115 CA ALA A 17 7.960 0.390 0.348 1.00 0.00 C ATOM 116 C ALA A 17 6.982 1.046 1.337 1.00 0.00 C ATOM 117 O ALA A 17 7.472 1.595 2.324 1.00 0.00 O ATOM 118 CB ALA A 17 8.646 1.422 -0.552 1.00 0.00 C ATOM 0 H ALA A 17 7.346 -0.399 -1.488 1.00 0.00 H new ATOM 0 HA ALA A 17 8.701 -0.098 0.981 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.113 2.190 0.065 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.408 0.929 -1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.906 1.883 -1.207 1.00 0.00 H new ATOM 124 N LEU A 18 5.655 0.973 1.116 1.00 0.00 N ATOM 125 CA LEU A 18 4.643 1.414 2.108 1.00 0.00 C ATOM 126 C LEU A 18 4.037 0.271 2.952 1.00 0.00 C ATOM 127 O LEU A 18 3.482 0.539 4.019 1.00 0.00 O ATOM 128 CB LEU A 18 3.561 2.294 1.435 1.00 0.00 C ATOM 129 CG LEU A 18 3.928 3.792 1.514 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.102 4.154 0.595 1.00 0.00 C ATOM 131 CD2 LEU A 18 2.758 4.731 1.187 1.00 0.00 C ATOM 0 H LEU A 18 5.252 0.610 0.252 1.00 0.00 H new ATOM 0 HA LEU A 18 5.177 2.026 2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.447 2.000 0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.599 2.127 1.920 1.00 0.00 H new ATOM 0 HG LEU A 18 4.211 3.940 2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.321 5.218 0.687 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.981 3.576 0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.839 3.926 -0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.090 5.766 1.263 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.407 4.536 0.174 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.945 4.558 1.892 1.00 0.00 H new ATOM 143 N ALA A 19 4.202 -0.979 2.511 1.00 0.00 N ATOM 144 CA ALA A 19 3.904 -2.210 3.244 1.00 0.00 C ATOM 145 C ALA A 19 4.962 -2.593 4.297 1.00 0.00 C ATOM 146 O ALA A 19 4.609 -3.166 5.324 1.00 0.00 O ATOM 147 CB ALA A 19 3.811 -3.320 2.194 1.00 0.00 C ATOM 0 H ALA A 19 4.569 -1.169 1.578 1.00 0.00 H new ATOM 0 HA ALA A 19 2.981 -2.063 3.804 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.589 -4.268 2.685 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.018 -3.084 1.485 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.760 -3.400 1.664 1.00 0.00 H new ATOM 153 N ASP A 20 6.244 -2.310 4.037 1.00 0.00 N ATOM 154 CA ASP A 20 7.363 -2.593 4.929 1.00 0.00 C ATOM 155 C ASP A 20 7.093 -2.059 6.348 1.00 0.00 C ATOM 156 O ASP A 20 6.716 -0.895 6.494 1.00 0.00 O ATOM 157 CB ASP A 20 8.642 -1.907 4.430 1.00 0.00 C ATOM 158 CG ASP A 20 9.458 -2.593 3.341 1.00 0.00 C ATOM 159 OD1 ASP A 20 8.992 -3.537 2.670 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.588 -2.076 3.149 1.00 0.00 O ATOM 0 H ASP A 20 6.536 -1.862 3.168 1.00 0.00 H new ATOM 0 HA ASP A 20 7.483 -3.676 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.366 -0.918 4.064 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.295 -1.758 5.290 1.00 0.00 H new ATOM 165 N PRO A 21 7.402 -2.844 7.390 1.00 0.00 N ATOM 166 CA PRO A 21 7.012 -2.603 8.780 1.00 0.00 C ATOM 167 C PRO A 21 7.544 -1.273 9.337 1.00 0.00 C ATOM 168 O PRO A 21 6.814 -0.280 9.426 1.00 0.00 O ATOM 169 CB PRO A 21 7.569 -3.819 9.528 1.00 0.00 C ATOM 170 CG PRO A 21 8.771 -4.256 8.684 1.00 0.00 C ATOM 171 CD PRO A 21 8.235 -4.030 7.287 1.00 0.00 C ATOM 0 HA PRO A 21 5.932 -2.500 8.890 1.00 0.00 H new ATOM 0 HB2 PRO A 21 7.868 -3.560 10.544 1.00 0.00 H new ATOM 0 HB3 PRO A 21 6.827 -4.613 9.607 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.659 -3.657 8.888 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.042 -5.297 8.859 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.045 -3.882 6.573 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.658 -4.888 6.942 1.00 0.00 H new ATOM 179 N THR A 22 8.837 -1.244 9.690 1.00 0.00 N ATOM 180 CA THR A 22 9.548 -0.049 10.138 1.00 0.00 C ATOM 181 C THR A 22 9.398 1.068 9.122 1.00 0.00 C ATOM 182 O THR A 22 9.261 2.207 9.548 1.00 0.00 O ATOM 183 CB THR A 22 11.032 -0.358 10.325 1.00 0.00 C ATOM 184 OG1 THR A 22 11.197 -1.499 11.124 1.00 0.00 O ATOM 185 CG2 THR A 22 11.805 0.797 10.956 1.00 0.00 C ATOM 0 H THR A 22 9.428 -2.075 9.670 1.00 0.00 H new ATOM 0 HA THR A 22 9.118 0.267 11.088 1.00 0.00 H new ATOM 0 HB THR A 22 11.435 -0.527 9.327 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.153 -1.686 11.234 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.853 0.518 11.063 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.728 1.678 10.319 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.387 1.021 11.937 1.00 0.00 H new ATOM 193 N ARG A 23 9.387 0.783 7.811 1.00 0.00 N ATOM 194 CA ARG A 23 9.335 1.831 6.785 1.00 0.00 C ATOM 195 C ARG A 23 8.012 2.598 6.769 1.00 0.00 C ATOM 196 O ARG A 23 8.034 3.828 6.724 1.00 0.00 O ATOM 197 CB ARG A 23 9.651 1.277 5.390 1.00 0.00 C ATOM 198 CG ARG A 23 10.758 2.116 4.751 1.00 0.00 C ATOM 199 CD ARG A 23 10.732 2.083 3.213 1.00 0.00 C ATOM 200 NE ARG A 23 10.978 0.748 2.630 1.00 0.00 N ATOM 201 CZ ARG A 23 11.531 0.503 1.449 1.00 0.00 C ATOM 202 NH1 ARG A 23 11.773 1.445 0.564 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.863 -0.723 1.132 1.00 0.00 N ATOM 0 H ARG A 23 9.413 -0.166 7.438 1.00 0.00 H new ATOM 0 HA ARG A 23 10.111 2.545 7.060 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.964 0.235 5.462 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.757 1.298 4.767 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.663 3.148 5.088 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.726 1.755 5.099 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.762 2.444 2.870 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.483 2.776 2.833 1.00 0.00 H new ATOM 0 HE ARG A 23 10.697 -0.059 3.186 1.00 0.00 H new ATOM 0 HH11 ARG A 23 11.534 2.414 0.773 1.00 0.00 H new ATOM 0 HH12 ARG A 23 12.200 1.206 -0.331 1.00 0.00 H new ATOM 0 HH21 ARG A 23 11.696 -1.483 1.791 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.288 -0.918 0.226 1.00 0.00 H new ATOM 217 N CYS A 24 6.883 1.894 6.890 1.00 0.00 N ATOM 218 CA CYS A 24 5.561 2.477 7.126 1.00 0.00 C ATOM 219 C CYS A 24 5.591 3.380 8.372 1.00 0.00 C ATOM 220 O CYS A 24 5.179 4.539 8.318 1.00 0.00 O ATOM 221 CB CYS A 24 4.561 1.313 7.258 1.00 0.00 C ATOM 222 SG CYS A 24 2.863 1.930 7.116 1.00 0.00 S ATOM 0 H CYS A 24 6.864 0.876 6.825 1.00 0.00 H new ATOM 0 HA CYS A 24 5.253 3.116 6.299 1.00 0.00 H new ATOM 0 HB2 CYS A 24 4.752 0.570 6.484 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.696 0.815 8.218 1.00 0.00 H new ATOM 0 HG CYS A 24 2.030 0.938 7.227 1.00 0.00 H new ATOM 228 N ARG A 25 6.222 2.910 9.458 1.00 0.00 N ATOM 229 CA ARG A 25 6.427 3.688 10.687 1.00 0.00 C ATOM 230 C ARG A 25 7.337 4.919 10.462 1.00 0.00 C ATOM 231 O ARG A 25 6.952 6.004 10.892 1.00 0.00 O ATOM 232 CB ARG A 25 6.899 2.718 11.793 1.00 0.00 C ATOM 233 CG ARG A 25 6.756 3.166 13.258 1.00 0.00 C ATOM 234 CD ARG A 25 5.395 3.771 13.637 1.00 0.00 C ATOM 235 NE ARG A 25 5.450 5.244 13.672 1.00 0.00 N ATOM 236 CZ ARG A 25 5.872 5.984 14.697 1.00 0.00 C ATOM 237 NH1 ARG A 25 6.215 5.457 15.855 1.00 0.00 N ATOM 238 NH2 ARG A 25 5.976 7.292 14.582 1.00 0.00 N ATOM 0 H ARG A 25 6.609 1.967 9.507 1.00 0.00 H new ATOM 0 HA ARG A 25 5.491 4.137 11.018 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.349 1.784 11.675 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.951 2.494 11.614 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.944 2.307 13.902 1.00 0.00 H new ATOM 0 HG3 ARG A 25 7.532 3.900 13.472 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.640 3.451 12.918 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.087 3.394 14.612 1.00 0.00 H new ATOM 0 HE ARG A 25 5.137 5.741 12.838 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.162 4.448 15.991 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.533 6.059 16.615 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.733 7.748 13.702 1.00 0.00 H new ATOM 0 HH22 ARG A 25 6.300 7.849 15.372 1.00 0.00 H new ATOM 252 N ILE A 26 8.454 4.802 9.727 1.00 0.00 N ATOM 253 CA ILE A 26 9.359 5.913 9.332 1.00 0.00 C ATOM 254 C ILE A 26 8.595 7.012 8.627 1.00 0.00 C ATOM 255 O ILE A 26 8.702 8.173 9.005 1.00 0.00 O ATOM 256 CB ILE A 26 10.542 5.445 8.438 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.365 4.348 9.144 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.417 6.640 8.021 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.886 4.476 9.233 1.00 0.00 C ATOM 0 H ILE A 26 8.771 3.899 9.374 1.00 0.00 H new ATOM 0 HA ILE A 26 9.782 6.298 10.260 1.00 0.00 H new ATOM 0 HB ILE A 26 10.134 5.007 7.527 1.00 0.00 H new ATOM 0 HG12 ILE A 26 10.986 4.262 10.162 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.147 3.405 8.643 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.238 6.289 7.396 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.814 7.354 7.460 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.819 7.124 8.911 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.293 3.614 9.762 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.307 4.517 8.228 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.143 5.388 9.772 1.00 0.00 H new ATOM 271 N LEU A 27 7.806 6.638 7.624 1.00 0.00 N ATOM 272 CA LEU A 27 7.071 7.593 6.796 1.00 0.00 C ATOM 273 C LEU A 27 6.235 8.566 7.625 1.00 0.00 C ATOM 274 O LEU A 27 6.238 9.755 7.318 1.00 0.00 O ATOM 275 CB LEU A 27 6.207 6.823 5.788 1.00 0.00 C ATOM 276 CG LEU A 27 6.955 6.471 4.498 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.122 5.492 3.672 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.211 7.721 3.641 1.00 0.00 C ATOM 0 H LEU A 27 7.657 5.664 7.361 1.00 0.00 H new ATOM 0 HA LEU A 27 7.793 8.208 6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.847 5.906 6.254 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.329 7.420 5.540 1.00 0.00 H new ATOM 0 HG LEU A 27 7.910 6.028 4.780 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.656 5.243 2.755 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.950 4.584 4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.165 5.950 3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.743 7.437 2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.259 8.181 3.375 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.812 8.433 4.206 1.00 0.00 H new ATOM 290 N VAL A 28 5.594 8.107 8.703 1.00 0.00 N ATOM 291 CA VAL A 28 4.725 8.968 9.532 1.00 0.00 C ATOM 292 C VAL A 28 5.509 10.073 10.257 1.00 0.00 C ATOM 293 O VAL A 28 4.925 11.075 10.656 1.00 0.00 O ATOM 294 CB VAL A 28 3.765 8.226 10.498 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.310 6.864 9.957 1.00 0.00 C ATOM 296 CG2 VAL A 28 4.328 8.019 11.913 1.00 0.00 C ATOM 0 H VAL A 28 5.656 7.142 9.028 1.00 0.00 H new ATOM 0 HA VAL A 28 4.068 9.437 8.800 1.00 0.00 H new ATOM 0 HB VAL A 28 2.911 8.900 10.566 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.640 6.392 10.676 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.786 7.005 9.011 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.180 6.226 9.799 1.00 0.00 H new ATOM 0 HG21 VAL A 28 3.594 7.493 12.523 1.00 0.00 H new ATOM 0 HG22 VAL A 28 5.243 7.429 11.858 1.00 0.00 H new ATOM 0 HG23 VAL A 28 4.547 8.987 12.363 1.00 0.00 H new ATOM 306 N ALA A 29 6.830 9.905 10.416 1.00 0.00 N ATOM 307 CA ALA A 29 7.720 10.917 10.982 1.00 0.00 C ATOM 308 C ALA A 29 8.217 11.958 9.967 1.00 0.00 C ATOM 309 O ALA A 29 8.896 12.935 10.302 1.00 0.00 O ATOM 310 CB ALA A 29 8.880 10.174 11.664 1.00 0.00 C ATOM 0 H ALA A 29 7.313 9.047 10.149 1.00 0.00 H new ATOM 0 HA ALA A 29 7.160 11.512 11.703 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.569 10.897 12.100 1.00 0.00 H new ATOM 0 HB2 ALA A 29 8.487 9.528 12.449 1.00 0.00 H new ATOM 0 HB3 ALA A 29 9.408 9.569 10.927 1.00 0.00 H new ATOM 316 N LEU A 30 7.901 11.732 8.697 1.00 0.00 N ATOM 317 CA LEU A 30 8.087 12.711 7.636 1.00 0.00 C ATOM 318 C LEU A 30 6.788 13.360 7.148 1.00 0.00 C ATOM 319 O LEU A 30 6.807 14.344 6.415 1.00 0.00 O ATOM 320 CB LEU A 30 8.829 12.025 6.513 1.00 0.00 C ATOM 321 CG LEU A 30 10.366 11.926 6.688 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.028 12.423 7.991 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.749 10.459 6.629 1.00 0.00 C ATOM 0 H LEU A 30 7.503 10.851 8.372 1.00 0.00 H new ATOM 0 HA LEU A 30 8.663 13.547 8.032 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.429 11.018 6.399 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.621 12.558 5.585 1.00 0.00 H new ATOM 0 HG LEU A 30 10.720 12.589 5.898 1.00 0.00 H new ATOM 0 HD11 LEU A 30 12.106 12.273 7.931 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.816 13.484 8.125 1.00 0.00 H new ATOM 0 HD13 LEU A 30 10.630 11.863 8.838 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.828 10.359 6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.243 9.918 7.429 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.452 10.044 5.666 1.00 0.00 H new ATOM 335 N LEU A 31 5.687 12.759 7.548 1.00 0.00 N ATOM 336 CA LEU A 31 4.330 13.284 7.511 1.00 0.00 C ATOM 337 C LEU A 31 4.217 14.439 8.526 1.00 0.00 C ATOM 338 O LEU A 31 3.768 15.529 8.193 1.00 0.00 O ATOM 339 CB LEU A 31 3.454 12.108 7.952 1.00 0.00 C ATOM 340 CG LEU A 31 2.067 11.982 7.317 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.463 10.788 8.056 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.194 13.233 7.475 1.00 0.00 C ATOM 0 H LEU A 31 5.716 11.817 7.939 1.00 0.00 H new ATOM 0 HA LEU A 31 4.041 13.666 6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.001 11.187 7.750 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.325 12.172 9.032 1.00 0.00 H new ATOM 0 HG LEU A 31 2.130 11.856 6.236 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.457 10.600 7.682 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.083 9.907 7.891 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.418 11.005 9.123 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.228 13.065 6.999 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.045 13.441 8.534 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.688 14.083 7.004 1.00 0.00 H new ATOM 354 N ASP A 32 4.703 14.176 9.747 1.00 0.00 N ATOM 355 CA ASP A 32 4.826 15.077 10.891 1.00 0.00 C ATOM 356 C ASP A 32 6.215 14.860 11.518 1.00 0.00 C ATOM 357 O ASP A 32 6.448 13.910 12.261 1.00 0.00 O ATOM 358 CB ASP A 32 3.693 14.783 11.891 1.00 0.00 C ATOM 359 CG ASP A 32 3.816 15.604 13.183 1.00 0.00 C ATOM 360 OD1 ASP A 32 3.702 16.847 13.094 1.00 0.00 O ATOM 361 OD2 ASP A 32 4.011 14.975 14.250 1.00 0.00 O ATOM 0 H ASP A 32 5.049 13.244 9.975 1.00 0.00 H new ATOM 0 HA ASP A 32 4.736 16.121 10.589 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.733 14.996 11.420 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.698 13.721 12.138 1.00 0.00 H new ATOM 366 N GLY A 33 7.173 15.706 11.134 1.00 0.00 N ATOM 367 CA GLY A 33 8.542 15.718 11.663 1.00 0.00 C ATOM 368 C GLY A 33 9.485 16.419 10.715 1.00 0.00 C ATOM 369 O GLY A 33 9.637 17.637 10.781 1.00 0.00 O ATOM 0 H GLY A 33 7.015 16.423 10.426 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.557 16.218 12.631 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.881 14.695 11.827 1.00 0.00 H new ATOM 373 N VAL A 34 10.166 15.641 9.874 1.00 0.00 N ATOM 374 CA VAL A 34 11.112 16.158 8.856 1.00 0.00 C ATOM 375 C VAL A 34 12.163 17.125 9.417 1.00 0.00 C ATOM 376 O VAL A 34 12.584 18.049 8.733 1.00 0.00 O ATOM 377 CB VAL A 34 10.426 16.715 7.577 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.359 15.791 7.019 1.00 0.00 C ATOM 379 CG2 VAL A 34 9.751 18.103 7.675 1.00 0.00 C ATOM 0 H VAL A 34 10.084 14.624 9.871 1.00 0.00 H new ATOM 0 HA VAL A 34 11.659 15.271 8.538 1.00 0.00 H new ATOM 0 HB VAL A 34 11.298 16.802 6.929 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.920 16.239 6.127 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.807 14.832 6.760 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.582 15.638 7.768 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.315 18.364 6.711 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.967 18.074 8.432 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.495 18.851 7.951 1.00 0.00 H new ATOM 389 N CYS A 35 12.603 16.930 10.662 1.00 0.00 N ATOM 390 CA CYS A 35 13.625 17.780 11.278 1.00 0.00 C ATOM 391 C CYS A 35 15.028 17.376 10.827 1.00 0.00 C ATOM 392 O CYS A 35 15.709 18.121 10.138 1.00 0.00 O ATOM 393 CB CYS A 35 13.508 17.750 12.813 1.00 0.00 C ATOM 394 SG CYS A 35 11.797 17.589 13.404 1.00 0.00 S ATOM 0 H CYS A 35 12.264 16.183 11.269 1.00 0.00 H new ATOM 0 HA CYS A 35 13.454 18.804 10.945 1.00 0.00 H new ATOM 0 HB2 CYS A 35 14.097 16.918 13.199 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.941 18.663 13.221 1.00 0.00 H new ATOM 0 HG CYS A 35 10.977 17.759 12.410 1.00 0.00 H new ATOM 400 N TYR A 36 15.447 16.169 11.211 1.00 0.00 N ATOM 401 CA TYR A 36 16.819 15.685 11.003 1.00 0.00 C ATOM 402 C TYR A 36 16.849 14.154 10.856 1.00 0.00 C ATOM 403 O TYR A 36 15.989 13.504 11.452 1.00 0.00 O ATOM 404 CB TYR A 36 17.743 16.083 12.186 1.00 0.00 C ATOM 405 CG TYR A 36 17.339 17.244 13.087 1.00 0.00 C ATOM 406 CD1 TYR A 36 17.404 18.572 12.625 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.935 16.991 14.415 1.00 0.00 C ATOM 408 CE1 TYR A 36 17.038 19.642 13.466 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.569 18.053 15.264 1.00 0.00 C ATOM 410 CZ TYR A 36 16.619 19.385 14.790 1.00 0.00 C ATOM 411 OH TYR A 36 16.269 20.416 15.605 1.00 0.00 O ATOM 0 H TYR A 36 14.843 15.493 11.678 1.00 0.00 H new ATOM 0 HA TYR A 36 17.181 16.150 10.086 1.00 0.00 H new ATOM 0 HB2 TYR A 36 17.864 15.203 12.818 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.724 16.315 11.772 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.737 18.773 11.617 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.906 15.976 14.783 1.00 0.00 H new ATOM 0 HE1 TYR A 36 17.078 20.657 13.099 1.00 0.00 H new ATOM 0 HE2 TYR A 36 16.250 17.851 16.276 1.00 0.00 H new ATOM 0 HH TYR A 36 16.005 20.065 16.481 1.00 0.00 H new ATOM 421 N PRO A 37 17.877 13.544 10.227 1.00 0.00 N ATOM 422 CA PRO A 37 18.071 12.088 10.243 1.00 0.00 C ATOM 423 C PRO A 37 18.231 11.489 11.652 1.00 0.00 C ATOM 424 O PRO A 37 18.038 10.290 11.817 1.00 0.00 O ATOM 425 CB PRO A 37 19.311 11.818 9.387 1.00 0.00 C ATOM 426 CG PRO A 37 20.060 13.151 9.371 1.00 0.00 C ATOM 427 CD PRO A 37 18.947 14.190 9.479 1.00 0.00 C ATOM 0 HA PRO A 37 17.178 11.602 9.849 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.923 11.023 9.814 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.038 11.504 8.380 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.761 13.227 10.202 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.637 13.276 8.455 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.297 15.087 9.991 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.603 14.500 8.492 1.00 0.00 H new ATOM 435 N GLY A 38 18.550 12.296 12.676 1.00 0.00 N ATOM 436 CA GLY A 38 18.529 11.857 14.077 1.00 0.00 C ATOM 437 C GLY A 38 17.171 11.986 14.784 1.00 0.00 C ATOM 438 O GLY A 38 17.029 11.454 15.879 1.00 0.00 O ATOM 0 H GLY A 38 18.829 13.270 12.555 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.845 10.815 14.119 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.266 12.436 14.633 1.00 0.00 H new ATOM 442 N GLN A 39 16.186 12.690 14.213 1.00 0.00 N ATOM 443 CA GLN A 39 14.940 13.037 14.917 1.00 0.00 C ATOM 444 C GLN A 39 13.984 11.851 15.008 1.00 0.00 C ATOM 445 O GLN A 39 13.312 11.672 16.020 1.00 0.00 O ATOM 446 CB GLN A 39 14.265 14.258 14.261 1.00 0.00 C ATOM 447 CG GLN A 39 13.311 13.974 13.076 1.00 0.00 C ATOM 448 CD GLN A 39 11.875 13.569 13.426 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.283 12.747 12.757 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.258 14.113 14.450 1.00 0.00 N ATOM 0 H GLN A 39 16.227 13.035 13.254 1.00 0.00 H new ATOM 0 HA GLN A 39 15.204 13.305 15.940 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.704 14.790 15.029 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.047 14.933 13.913 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.270 14.867 12.452 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.749 13.181 12.470 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.737 14.806 15.025 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.299 13.843 14.670 1.00 0.00 H new ATOM 459 N LEU A 40 13.939 11.029 13.957 1.00 0.00 N ATOM 460 CA LEU A 40 12.997 9.926 13.850 1.00 0.00 C ATOM 461 C LEU A 40 13.293 8.848 14.903 1.00 0.00 C ATOM 462 O LEU A 40 12.418 8.070 15.236 1.00 0.00 O ATOM 463 CB LEU A 40 12.944 9.322 12.430 1.00 0.00 C ATOM 464 CG LEU A 40 13.199 10.251 11.228 1.00 0.00 C ATOM 465 CD1 LEU A 40 14.695 10.495 10.947 1.00 0.00 C ATOM 466 CD2 LEU A 40 12.622 9.617 9.957 1.00 0.00 C ATOM 0 H LEU A 40 14.562 11.115 13.154 1.00 0.00 H new ATOM 0 HA LEU A 40 12.007 10.337 14.047 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.674 8.514 12.386 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.961 8.871 12.298 1.00 0.00 H new ATOM 0 HG LEU A 40 12.726 11.199 11.483 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.801 11.158 10.088 1.00 0.00 H new ATOM 0 HD12 LEU A 40 15.159 10.955 11.819 1.00 0.00 H new ATOM 0 HD13 LEU A 40 15.185 9.545 10.735 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.803 10.275 9.107 1.00 0.00 H new ATOM 0 HD22 LEU A 40 13.103 8.655 9.780 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.549 9.469 10.079 1.00 0.00 H new ATOM 478 N ALA A 41 14.499 8.819 15.468 1.00 0.00 N ATOM 479 CA ALA A 41 14.899 7.798 16.447 1.00 0.00 C ATOM 480 C ALA A 41 14.020 7.811 17.715 1.00 0.00 C ATOM 481 O ALA A 41 13.666 6.757 18.240 1.00 0.00 O ATOM 482 CB ALA A 41 16.387 7.988 16.764 1.00 0.00 C ATOM 0 H ALA A 41 15.229 9.501 15.263 1.00 0.00 H new ATOM 0 HA ALA A 41 14.745 6.810 16.014 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.703 7.239 17.490 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.971 7.877 15.850 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.547 8.984 17.178 1.00 0.00 H new ATOM 488 N ALA A 42 13.605 9.003 18.165 1.00 0.00 N ATOM 489 CA ALA A 42 12.610 9.146 19.227 1.00 0.00 C ATOM 490 C ALA A 42 11.200 8.836 18.703 1.00 0.00 C ATOM 491 O ALA A 42 10.471 8.045 19.292 1.00 0.00 O ATOM 492 CB ALA A 42 12.712 10.569 19.792 1.00 0.00 C ATOM 0 H ALA A 42 13.951 9.891 17.802 1.00 0.00 H new ATOM 0 HA ALA A 42 12.805 8.430 20.025 1.00 0.00 H new ATOM 0 HB1 ALA A 42 11.978 10.698 20.587 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.713 10.731 20.193 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.518 11.290 18.998 1.00 0.00 H new ATOM 498 N HIS A 43 10.832 9.412 17.557 1.00 0.00 N ATOM 499 CA HIS A 43 9.503 9.284 16.944 1.00 0.00 C ATOM 500 C HIS A 43 9.086 7.825 16.651 1.00 0.00 C ATOM 501 O HIS A 43 7.914 7.457 16.758 1.00 0.00 O ATOM 502 CB HIS A 43 9.545 10.095 15.640 1.00 0.00 C ATOM 503 CG HIS A 43 8.220 10.637 15.189 1.00 0.00 C ATOM 504 ND1 HIS A 43 6.953 10.241 15.623 1.00 0.00 N ATOM 505 CD2 HIS A 43 8.096 11.662 14.308 1.00 0.00 C ATOM 506 CE1 HIS A 43 6.095 11.082 15.014 1.00 0.00 C ATOM 507 NE2 HIS A 43 6.752 11.947 14.223 1.00 0.00 N ATOM 0 H HIS A 43 11.466 9.997 17.013 1.00 0.00 H new ATOM 0 HA HIS A 43 8.756 9.655 17.645 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.236 10.928 15.769 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.951 9.464 14.850 1.00 0.00 H new ATOM 0 HD2 HIS A 43 8.896 12.157 13.777 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.023 11.064 15.144 1.00 0.00 H new ATOM 0 HE2 HIS A 43 6.329 12.685 13.659 1.00 0.00 H new ATOM 515 N LEU A 44 10.065 7.001 16.266 1.00 0.00 N ATOM 516 CA LEU A 44 9.951 5.587 15.900 1.00 0.00 C ATOM 517 C LEU A 44 10.237 4.655 17.082 1.00 0.00 C ATOM 518 O LEU A 44 9.919 3.474 16.981 1.00 0.00 O ATOM 519 CB LEU A 44 10.891 5.293 14.711 1.00 0.00 C ATOM 520 CG LEU A 44 10.619 6.216 13.507 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.599 6.051 12.374 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.192 6.153 12.970 1.00 0.00 C ATOM 0 H LEU A 44 11.028 7.329 16.197 1.00 0.00 H new ATOM 0 HA LEU A 44 8.921 5.391 15.604 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.926 5.413 15.031 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.770 4.254 14.404 1.00 0.00 H new ATOM 0 HG LEU A 44 10.763 7.209 13.934 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.339 6.735 11.566 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.606 6.273 12.728 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.562 5.025 12.007 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.091 6.834 12.125 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.970 5.136 12.646 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.494 6.444 13.755 1.00 0.00 H new ATOM 534 N GLY A 45 10.840 5.161 18.168 1.00 0.00 N ATOM 535 CA GLY A 45 11.346 4.354 19.284 1.00 0.00 C ATOM 536 C GLY A 45 12.521 3.457 18.888 1.00 0.00 C ATOM 537 O GLY A 45 12.883 2.558 19.646 1.00 0.00 O ATOM 0 H GLY A 45 10.992 6.162 18.296 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.657 5.016 20.092 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.538 3.734 19.673 1.00 0.00 H new ATOM 541 N LEU A 46 13.090 3.658 17.693 1.00 0.00 N ATOM 542 CA LEU A 46 14.060 2.750 17.084 1.00 0.00 C ATOM 543 C LEU A 46 15.416 3.430 16.889 1.00 0.00 C ATOM 544 O LEU A 46 15.511 4.641 16.704 1.00 0.00 O ATOM 545 CB LEU A 46 13.466 2.212 15.768 1.00 0.00 C ATOM 546 CG LEU A 46 12.344 1.172 16.000 1.00 0.00 C ATOM 547 CD1 LEU A 46 11.524 0.952 14.723 1.00 0.00 C ATOM 548 CD2 LEU A 46 12.907 -0.178 16.476 1.00 0.00 C ATOM 0 H LEU A 46 12.883 4.472 17.115 1.00 0.00 H new ATOM 0 HA LEU A 46 14.251 1.907 17.748 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.070 3.044 15.186 1.00 0.00 H new ATOM 0 HB3 LEU A 46 14.260 1.758 15.175 1.00 0.00 H new ATOM 0 HG LEU A 46 11.699 1.576 16.780 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.743 0.217 14.915 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.069 1.894 14.416 1.00 0.00 H new ATOM 0 HD13 LEU A 46 12.177 0.589 13.929 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.088 -0.881 16.628 1.00 0.00 H new ATOM 0 HD22 LEU A 46 13.590 -0.573 15.724 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.443 -0.038 17.415 1.00 0.00 H new ATOM 560 N THR A 47 16.493 2.638 16.945 1.00 0.00 N ATOM 561 CA THR A 47 17.869 3.157 16.938 1.00 0.00 C ATOM 562 C THR A 47 18.138 3.909 15.643 1.00 0.00 C ATOM 563 O THR A 47 17.660 3.508 14.581 1.00 0.00 O ATOM 564 CB THR A 47 18.924 2.065 17.185 1.00 0.00 C ATOM 565 OG1 THR A 47 19.122 1.280 16.034 1.00 0.00 O ATOM 566 CG2 THR A 47 18.543 1.100 18.307 1.00 0.00 C ATOM 0 H THR A 47 16.437 1.621 16.996 1.00 0.00 H new ATOM 0 HA THR A 47 17.958 3.850 17.774 1.00 0.00 H new ATOM 0 HB THR A 47 19.826 2.610 17.462 1.00 0.00 H new ATOM 0 HG1 THR A 47 19.798 0.595 16.218 1.00 0.00 H new ATOM 0 HG21 THR A 47 19.330 0.355 18.429 1.00 0.00 H new ATOM 0 HG22 THR A 47 18.420 1.654 19.238 1.00 0.00 H new ATOM 0 HG23 THR A 47 17.607 0.601 18.056 1.00 0.00 H new ATOM 574 N ARG A 48 18.973 4.952 15.691 1.00 0.00 N ATOM 575 CA ARG A 48 19.337 5.708 14.483 1.00 0.00 C ATOM 576 C ARG A 48 20.007 4.835 13.405 1.00 0.00 C ATOM 577 O ARG A 48 19.973 5.181 12.229 1.00 0.00 O ATOM 578 CB ARG A 48 20.153 6.961 14.830 1.00 0.00 C ATOM 579 CG ARG A 48 21.532 6.683 15.451 1.00 0.00 C ATOM 580 CD ARG A 48 22.268 7.991 15.783 1.00 0.00 C ATOM 581 NE ARG A 48 22.609 8.765 14.570 1.00 0.00 N ATOM 582 CZ ARG A 48 23.715 8.657 13.838 1.00 0.00 C ATOM 583 NH1 ARG A 48 24.654 7.777 14.122 1.00 0.00 N ATOM 584 NH2 ARG A 48 23.897 9.452 12.801 1.00 0.00 N ATOM 0 H ARG A 48 19.409 5.293 16.548 1.00 0.00 H new ATOM 0 HA ARG A 48 18.405 6.051 14.033 1.00 0.00 H new ATOM 0 HB2 ARG A 48 20.291 7.550 13.923 1.00 0.00 H new ATOM 0 HB3 ARG A 48 19.575 7.573 15.523 1.00 0.00 H new ATOM 0 HG2 ARG A 48 21.412 6.090 16.358 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.132 6.091 14.760 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.644 8.600 16.437 1.00 0.00 H new ATOM 0 HD3 ARG A 48 23.180 7.763 16.334 1.00 0.00 H new ATOM 0 HE ARG A 48 21.924 9.455 14.262 1.00 0.00 H new ATOM 0 HH11 ARG A 48 24.544 7.154 14.922 1.00 0.00 H new ATOM 0 HH12 ARG A 48 25.491 7.719 13.541 1.00 0.00 H new ATOM 0 HH21 ARG A 48 23.191 10.148 12.562 1.00 0.00 H new ATOM 0 HH22 ARG A 48 24.744 9.371 12.239 1.00 0.00 H new ATOM 598 N SER A 49 20.558 3.677 13.767 1.00 0.00 N ATOM 599 CA SER A 49 21.034 2.658 12.820 1.00 0.00 C ATOM 600 C SER A 49 19.872 1.899 12.154 1.00 0.00 C ATOM 601 O SER A 49 19.854 1.767 10.934 1.00 0.00 O ATOM 602 CB SER A 49 21.955 1.662 13.543 1.00 0.00 C ATOM 603 OG SER A 49 22.930 2.335 14.325 1.00 0.00 O ATOM 0 H SER A 49 20.690 3.412 14.743 1.00 0.00 H new ATOM 0 HA SER A 49 21.586 3.174 12.035 1.00 0.00 H new ATOM 0 HB2 SER A 49 21.359 1.011 14.182 1.00 0.00 H new ATOM 0 HB3 SER A 49 22.450 1.024 12.811 1.00 0.00 H new ATOM 0 HG SER A 49 23.500 1.677 14.774 1.00 0.00 H new ATOM 609 N ASN A 50 18.873 1.449 12.926 1.00 0.00 N ATOM 610 CA ASN A 50 17.660 0.792 12.415 1.00 0.00 C ATOM 611 C ASN A 50 16.799 1.754 11.560 1.00 0.00 C ATOM 612 O ASN A 50 16.367 1.421 10.453 1.00 0.00 O ATOM 613 CB ASN A 50 16.878 0.251 13.624 1.00 0.00 C ATOM 614 CG ASN A 50 15.537 -0.344 13.223 1.00 0.00 C ATOM 615 OD1 ASN A 50 14.555 0.367 13.114 1.00 0.00 O ATOM 616 ND2 ASN A 50 15.464 -1.641 12.996 1.00 0.00 N ATOM 0 H ASN A 50 18.885 1.533 13.942 1.00 0.00 H new ATOM 0 HA ASN A 50 17.934 -0.027 11.750 1.00 0.00 H new ATOM 0 HB2 ASN A 50 17.474 -0.509 14.129 1.00 0.00 H new ATOM 0 HB3 ASN A 50 16.716 1.057 14.340 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.575 -2.062 12.725 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.296 -2.223 13.092 1.00 0.00 H new ATOM 623 N VAL A 51 16.631 2.979 12.055 1.00 0.00 N ATOM 624 CA VAL A 51 15.980 4.081 11.348 1.00 0.00 C ATOM 625 C VAL A 51 16.732 4.442 10.062 1.00 0.00 C ATOM 626 O VAL A 51 16.086 4.626 9.036 1.00 0.00 O ATOM 627 CB VAL A 51 15.817 5.295 12.292 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.525 6.629 11.591 1.00 0.00 C ATOM 629 CG2 VAL A 51 14.732 4.995 13.345 1.00 0.00 C ATOM 0 H VAL A 51 16.954 3.240 12.987 1.00 0.00 H new ATOM 0 HA VAL A 51 14.984 3.761 11.042 1.00 0.00 H new ATOM 0 HB VAL A 51 16.789 5.431 12.765 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.428 7.418 12.337 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.343 6.870 10.912 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.597 6.547 11.026 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.621 5.853 14.008 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.784 4.798 12.845 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.023 4.121 13.928 1.00 0.00 H new ATOM 639 N SER A 52 18.073 4.468 10.056 1.00 0.00 N ATOM 640 CA SER A 52 18.821 4.650 8.796 1.00 0.00 C ATOM 641 C SER A 52 18.611 3.495 7.811 1.00 0.00 C ATOM 642 O SER A 52 18.430 3.746 6.621 1.00 0.00 O ATOM 643 CB SER A 52 20.328 4.793 9.014 1.00 0.00 C ATOM 644 OG SER A 52 20.643 5.942 9.780 1.00 0.00 O ATOM 0 H SER A 52 18.655 4.368 10.888 1.00 0.00 H new ATOM 0 HA SER A 52 18.418 5.573 8.380 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.708 3.905 9.519 1.00 0.00 H new ATOM 0 HB3 SER A 52 20.831 4.851 8.049 1.00 0.00 H new ATOM 0 HG SER A 52 20.678 5.703 10.730 1.00 0.00 H new ATOM 650 N ASN A 53 18.597 2.245 8.290 1.00 0.00 N ATOM 651 CA ASN A 53 18.366 1.063 7.457 1.00 0.00 C ATOM 652 C ASN A 53 17.055 1.175 6.677 1.00 0.00 C ATOM 653 O ASN A 53 17.054 1.030 5.454 1.00 0.00 O ATOM 654 CB ASN A 53 18.416 -0.207 8.318 1.00 0.00 C ATOM 655 CG ASN A 53 19.812 -0.813 8.315 1.00 0.00 C ATOM 656 OD1 ASN A 53 20.145 -1.650 7.493 1.00 0.00 O ATOM 657 ND2 ASN A 53 20.678 -0.391 9.215 1.00 0.00 N ATOM 0 H ASN A 53 18.747 2.026 9.275 1.00 0.00 H new ATOM 0 HA ASN A 53 19.163 1.000 6.716 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.121 0.030 9.340 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.699 -0.935 7.940 1.00 0.00 H new ATOM 0 HD21 ASN A 53 21.627 -0.765 9.224 1.00 0.00 H new ATOM 0 HD22 ASN A 53 20.399 0.309 9.902 1.00 0.00 H new ATOM 664 N HIS A 54 15.951 1.526 7.342 1.00 0.00 N ATOM 665 CA HIS A 54 14.691 1.721 6.623 1.00 0.00 C ATOM 666 C HIS A 54 14.552 3.088 5.918 1.00 0.00 C ATOM 667 O HIS A 54 13.835 3.153 4.914 1.00 0.00 O ATOM 668 CB HIS A 54 13.503 1.280 7.488 1.00 0.00 C ATOM 669 CG HIS A 54 13.113 -0.145 7.160 1.00 0.00 C ATOM 670 ND1 HIS A 54 12.541 -0.576 5.981 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.321 -1.262 7.924 1.00 0.00 C ATOM 672 CE1 HIS A 54 12.362 -1.904 6.057 1.00 0.00 C ATOM 673 NE2 HIS A 54 12.809 -2.359 7.233 1.00 0.00 N ATOM 0 H HIS A 54 15.903 1.677 8.350 1.00 0.00 H new ATOM 0 HA HIS A 54 14.696 1.053 5.762 1.00 0.00 H new ATOM 0 HB2 HIS A 54 13.764 1.359 8.543 1.00 0.00 H new ATOM 0 HB3 HIS A 54 12.655 1.944 7.319 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.798 -1.289 8.892 1.00 0.00 H new ATOM 0 HE1 HIS A 54 11.922 -2.515 5.283 1.00 0.00 H new ATOM 0 HE2 HIS A 54 12.781 -3.324 7.561 1.00 0.00 H new ATOM 681 N LEU A 55 15.269 4.150 6.328 1.00 0.00 N ATOM 682 CA LEU A 55 15.374 5.360 5.498 1.00 0.00 C ATOM 683 C LEU A 55 16.119 5.058 4.198 1.00 0.00 C ATOM 684 O LEU A 55 15.850 5.711 3.201 1.00 0.00 O ATOM 685 CB LEU A 55 16.113 6.509 6.214 1.00 0.00 C ATOM 686 CG LEU A 55 15.271 7.311 7.221 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.200 8.225 8.029 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.230 8.174 6.494 1.00 0.00 C ATOM 0 H LEU A 55 15.775 4.194 7.212 1.00 0.00 H new ATOM 0 HA LEU A 55 14.350 5.675 5.295 1.00 0.00 H new ATOM 0 HB2 LEU A 55 16.975 6.094 6.737 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.498 7.196 5.460 1.00 0.00 H new ATOM 0 HG LEU A 55 14.751 6.614 7.879 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.613 8.798 8.746 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.933 7.619 8.562 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.716 8.908 7.354 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.646 8.733 7.225 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.737 8.870 5.826 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.567 7.532 5.914 1.00 0.00 H new ATOM 700 N SER A 56 17.056 4.111 4.182 1.00 0.00 N ATOM 701 CA SER A 56 17.920 3.827 3.027 1.00 0.00 C ATOM 702 C SER A 56 17.130 3.641 1.722 1.00 0.00 C ATOM 703 O SER A 56 17.255 4.461 0.814 1.00 0.00 O ATOM 704 CB SER A 56 18.839 2.634 3.328 1.00 0.00 C ATOM 705 OG SER A 56 20.020 2.741 2.555 1.00 0.00 O ATOM 0 H SER A 56 17.243 3.507 4.983 1.00 0.00 H new ATOM 0 HA SER A 56 18.546 4.704 2.862 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.087 2.611 4.389 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.326 1.700 3.100 1.00 0.00 H new ATOM 0 HG SER A 56 20.607 1.981 2.748 1.00 0.00 H new ATOM 711 N CYS A 57 16.222 2.664 1.659 1.00 0.00 N ATOM 712 CA CYS A 57 15.336 2.482 0.509 1.00 0.00 C ATOM 713 C CYS A 57 14.150 3.486 0.516 1.00 0.00 C ATOM 714 O CYS A 57 13.469 3.598 -0.494 1.00 0.00 O ATOM 715 CB CYS A 57 14.942 0.996 0.478 1.00 0.00 C ATOM 716 SG CYS A 57 14.227 0.310 -1.075 1.00 0.00 S ATOM 0 H CYS A 57 16.081 1.979 2.402 1.00 0.00 H new ATOM 0 HA CYS A 57 15.839 2.720 -0.428 1.00 0.00 H new ATOM 0 HB2 CYS A 57 15.830 0.412 0.721 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.221 0.827 1.278 1.00 0.00 H new ATOM 721 N LEU A 58 13.869 4.250 1.584 1.00 0.00 N ATOM 722 CA LEU A 58 12.915 5.381 1.510 1.00 0.00 C ATOM 723 C LEU A 58 13.500 6.502 0.636 1.00 0.00 C ATOM 724 O LEU A 58 12.784 7.165 -0.116 1.00 0.00 O ATOM 725 CB LEU A 58 12.578 5.903 2.929 1.00 0.00 C ATOM 726 CG LEU A 58 11.141 6.441 3.100 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.079 5.345 2.994 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.008 7.118 4.468 1.00 0.00 C ATOM 0 H LEU A 58 14.283 4.111 2.506 1.00 0.00 H new ATOM 0 HA LEU A 58 11.988 5.033 1.054 1.00 0.00 H new ATOM 0 HB2 LEU A 58 12.735 5.096 3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.280 6.697 3.185 1.00 0.00 H new ATOM 0 HG LEU A 58 10.971 7.150 2.289 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.089 5.784 3.122 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.142 4.871 2.014 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.248 4.598 3.770 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.994 7.498 4.589 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.220 6.394 5.255 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.715 7.945 4.535 1.00 0.00 H new ATOM 740 N ARG A 59 14.819 6.688 0.731 1.00 0.00 N ATOM 741 CA ARG A 59 15.630 7.585 -0.092 1.00 0.00 C ATOM 742 C ARG A 59 15.975 6.938 -1.441 1.00 0.00 C ATOM 743 O ARG A 59 16.401 7.635 -2.355 1.00 0.00 O ATOM 744 CB ARG A 59 16.905 7.953 0.684 1.00 0.00 C ATOM 745 CG ARG A 59 16.661 8.551 2.090 1.00 0.00 C ATOM 746 CD ARG A 59 17.878 8.330 2.995 1.00 0.00 C ATOM 747 NE ARG A 59 19.127 8.918 2.466 1.00 0.00 N ATOM 748 CZ ARG A 59 20.319 8.340 2.347 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.539 7.087 2.697 1.00 0.00 N ATOM 750 NH2 ARG A 59 21.332 9.040 1.874 1.00 0.00 N ATOM 0 H ARG A 59 15.379 6.189 1.422 1.00 0.00 H new ATOM 0 HA ARG A 59 15.061 8.490 -0.307 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.521 7.060 0.787 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.478 8.669 0.095 1.00 0.00 H new ATOM 0 HG2 ARG A 59 16.454 9.618 2.005 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.781 8.090 2.538 1.00 0.00 H new ATOM 0 HD2 ARG A 59 17.672 8.758 3.976 1.00 0.00 H new ATOM 0 HD3 ARG A 59 18.023 7.259 3.138 1.00 0.00 H new ATOM 0 HE ARG A 59 19.067 9.887 2.154 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.779 6.522 3.076 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.469 6.683 2.589 1.00 0.00 H new ATOM 0 HH21 ARG A 59 21.197 10.014 1.604 1.00 0.00 H new ATOM 0 HH22 ARG A 59 22.251 8.607 1.778 1.00 0.00 H new ATOM 764 N GLY A 60 15.749 5.625 -1.588 1.00 0.00 N ATOM 765 CA GLY A 60 15.958 4.870 -2.823 1.00 0.00 C ATOM 766 C GLY A 60 14.709 4.894 -3.696 1.00 0.00 C ATOM 767 O GLY A 60 14.749 5.471 -4.770 1.00 0.00 O ATOM 0 H GLY A 60 15.405 5.044 -0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.799 5.292 -3.373 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.219 3.839 -2.583 1.00 0.00 H new ATOM 771 N CYS A 61 13.593 4.364 -3.175 1.00 0.00 N ATOM 772 CA CYS A 61 12.231 4.406 -3.711 1.00 0.00 C ATOM 773 C CYS A 61 11.645 5.840 -3.915 1.00 0.00 C ATOM 774 O CYS A 61 10.439 5.983 -4.102 1.00 0.00 O ATOM 775 CB CYS A 61 11.375 3.527 -2.762 1.00 0.00 C ATOM 776 SG CYS A 61 11.737 1.741 -2.836 1.00 0.00 S ATOM 0 H CYS A 61 13.626 3.852 -2.293 1.00 0.00 H new ATOM 0 HA CYS A 61 12.227 4.018 -4.730 1.00 0.00 H new ATOM 0 HB2 CYS A 61 11.524 3.871 -1.739 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.322 3.680 -3.000 1.00 0.00 H new ATOM 781 N GLY A 62 12.454 6.899 -3.755 1.00 0.00 N ATOM 782 CA GLY A 62 12.088 8.310 -3.954 1.00 0.00 C ATOM 783 C GLY A 62 11.153 8.909 -2.901 1.00 0.00 C ATOM 784 O GLY A 62 10.890 10.100 -2.935 1.00 0.00 O ATOM 0 H GLY A 62 13.427 6.789 -3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.002 8.903 -3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.615 8.409 -4.931 1.00 0.00 H new ATOM 788 N LEU A 63 10.681 8.118 -1.935 1.00 0.00 N ATOM 789 CA LEU A 63 9.697 8.487 -0.910 1.00 0.00 C ATOM 790 C LEU A 63 10.122 9.653 -0.009 1.00 0.00 C ATOM 791 O LEU A 63 9.264 10.397 0.464 1.00 0.00 O ATOM 792 CB LEU A 63 9.380 7.247 -0.085 1.00 0.00 C ATOM 793 CG LEU A 63 8.520 6.252 -0.877 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.459 4.978 -0.065 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.093 6.763 -1.114 1.00 0.00 C ATOM 0 H LEU A 63 10.990 7.151 -1.840 1.00 0.00 H new ATOM 0 HA LEU A 63 8.810 8.853 -1.427 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.308 6.765 0.221 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.857 7.538 0.826 1.00 0.00 H new ATOM 0 HG LEU A 63 8.968 6.101 -1.859 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.855 4.239 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.467 4.588 0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.011 5.187 0.906 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.529 6.020 -1.678 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.605 6.937 -0.155 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.129 7.695 -1.677 1.00 0.00 H new ATOM 807 N VAL A 64 11.428 9.812 0.206 1.00 0.00 N ATOM 808 CA VAL A 64 12.037 10.940 0.931 1.00 0.00 C ATOM 809 C VAL A 64 13.136 11.607 0.123 1.00 0.00 C ATOM 810 O VAL A 64 14.003 10.936 -0.437 1.00 0.00 O ATOM 811 CB VAL A 64 12.652 10.558 2.295 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.635 10.695 3.422 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.301 9.202 2.307 1.00 0.00 C ATOM 0 H VAL A 64 12.118 9.140 -0.129 1.00 0.00 H new ATOM 0 HA VAL A 64 11.200 11.618 1.098 1.00 0.00 H new ATOM 0 HB VAL A 64 13.456 11.274 2.467 1.00 0.00 H new ATOM 0 HG11 VAL A 64 12.101 10.418 4.368 1.00 0.00 H new ATOM 0 HG12 VAL A 64 11.289 11.727 3.476 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.787 10.038 3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.710 9.003 3.298 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.560 8.442 2.061 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.104 9.177 1.571 1.00 0.00 H new ATOM 823 N VAL A 65 13.122 12.937 0.160 1.00 0.00 N ATOM 824 CA VAL A 65 14.131 13.824 -0.431 1.00 0.00 C ATOM 825 C VAL A 65 14.793 14.649 0.679 1.00 0.00 C ATOM 826 O VAL A 65 14.136 15.094 1.624 1.00 0.00 O ATOM 827 CB VAL A 65 13.480 14.722 -1.510 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.476 15.722 -2.126 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.887 13.851 -2.634 1.00 0.00 C ATOM 0 H VAL A 65 12.374 13.453 0.623 1.00 0.00 H new ATOM 0 HA VAL A 65 14.906 13.235 -0.923 1.00 0.00 H new ATOM 0 HB VAL A 65 12.695 15.293 -1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.967 16.327 -2.877 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.871 16.371 -1.344 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.296 15.177 -2.594 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.431 14.492 -3.389 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.679 13.259 -3.092 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.131 13.186 -2.218 1.00 0.00 H new ATOM 839 N ALA A 66 16.114 14.833 0.575 1.00 0.00 N ATOM 840 CA ALA A 66 16.916 15.641 1.498 1.00 0.00 C ATOM 841 C ALA A 66 17.009 17.118 1.094 1.00 0.00 C ATOM 842 O ALA A 66 16.975 17.473 -0.089 1.00 0.00 O ATOM 843 CB ALA A 66 18.307 15.010 1.624 1.00 0.00 C ATOM 0 H ALA A 66 16.668 14.413 -0.172 1.00 0.00 H new ATOM 0 HA ALA A 66 16.414 15.641 2.465 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.914 15.602 2.309 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.212 13.994 2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.785 14.984 0.645 1.00 0.00 H new ATOM 849 N THR A 67 17.137 17.994 2.097 1.00 0.00 N ATOM 850 CA THR A 67 17.177 19.464 1.977 1.00 0.00 C ATOM 851 C THR A 67 17.553 20.039 3.338 1.00 0.00 C ATOM 852 O THR A 67 17.342 19.381 4.346 1.00 0.00 O ATOM 853 CB THR A 67 15.822 19.970 1.444 1.00 0.00 C ATOM 854 OG1 THR A 67 15.850 19.845 0.039 1.00 0.00 O ATOM 855 CG2 THR A 67 15.441 21.416 1.734 1.00 0.00 C ATOM 0 H THR A 67 17.220 17.686 3.066 1.00 0.00 H new ATOM 0 HA THR A 67 17.929 19.796 1.261 1.00 0.00 H new ATOM 0 HB THR A 67 15.083 19.364 1.968 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.538 19.196 -0.218 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.465 21.629 1.299 1.00 0.00 H new ATOM 0 HG22 THR A 67 15.400 21.572 2.812 1.00 0.00 H new ATOM 0 HG23 THR A 67 16.186 22.083 1.299 1.00 0.00 H new ATOM 863 N TYR A 68 18.081 21.257 3.397 1.00 0.00 N ATOM 864 CA TYR A 68 18.307 21.956 4.669 1.00 0.00 C ATOM 865 C TYR A 68 16.994 22.458 5.310 1.00 0.00 C ATOM 866 O TYR A 68 16.045 22.819 4.603 1.00 0.00 O ATOM 867 CB TYR A 68 19.276 23.123 4.438 1.00 0.00 C ATOM 868 CG TYR A 68 20.746 22.743 4.394 1.00 0.00 C ATOM 869 CD1 TYR A 68 21.487 22.705 5.589 1.00 0.00 C ATOM 870 CD2 TYR A 68 21.382 22.451 3.170 1.00 0.00 C ATOM 871 CE1 TYR A 68 22.853 22.368 5.572 1.00 0.00 C ATOM 872 CE2 TYR A 68 22.754 22.125 3.142 1.00 0.00 C ATOM 873 CZ TYR A 68 23.494 22.085 4.347 1.00 0.00 C ATOM 874 OH TYR A 68 24.819 21.773 4.335 1.00 0.00 O ATOM 0 H TYR A 68 18.364 21.789 2.574 1.00 0.00 H new ATOM 0 HA TYR A 68 18.741 21.244 5.371 1.00 0.00 H new ATOM 0 HB2 TYR A 68 19.015 23.611 3.499 1.00 0.00 H new ATOM 0 HB3 TYR A 68 19.130 23.858 5.230 1.00 0.00 H new ATOM 0 HD1 TYR A 68 21.004 22.936 6.527 1.00 0.00 H new ATOM 0 HD2 TYR A 68 20.816 22.477 2.250 1.00 0.00 H new ATOM 0 HE1 TYR A 68 23.411 22.326 6.496 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.239 21.906 2.202 1.00 0.00 H new ATOM 0 HH TYR A 68 25.107 21.604 3.414 1.00 0.00 H new ATOM 884 N GLU A 69 16.898 22.418 6.641 1.00 0.00 N ATOM 885 CA GLU A 69 15.864 23.136 7.402 1.00 0.00 C ATOM 886 C GLU A 69 16.366 24.579 7.628 1.00 0.00 C ATOM 887 O GLU A 69 16.690 25.221 6.630 1.00 0.00 O ATOM 888 CB GLU A 69 15.342 22.316 8.603 1.00 0.00 C ATOM 889 CG GLU A 69 16.339 21.779 9.641 1.00 0.00 C ATOM 890 CD GLU A 69 16.735 22.837 10.668 1.00 0.00 C ATOM 891 OE1 GLU A 69 15.821 23.496 11.197 1.00 0.00 O ATOM 892 OE2 GLU A 69 17.946 23.106 10.815 1.00 0.00 O ATOM 0 H GLU A 69 17.538 21.884 7.228 1.00 0.00 H new ATOM 0 HA GLU A 69 14.930 23.250 6.852 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.620 22.937 9.134 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.795 21.462 8.203 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.899 20.924 10.155 1.00 0.00 H new ATOM 0 HG3 GLU A 69 17.232 21.419 9.131 1.00 0.00 H new ATOM 899 N GLY A 70 16.461 25.112 8.853 1.00 0.00 N ATOM 900 CA GLY A 70 17.104 26.406 9.124 1.00 0.00 C ATOM 901 C GLY A 70 18.640 26.361 9.123 1.00 0.00 C ATOM 902 O GLY A 70 19.271 27.364 8.796 1.00 0.00 O ATOM 0 H GLY A 70 16.093 24.656 9.688 1.00 0.00 H new ATOM 0 HA2 GLY A 70 16.773 27.127 8.376 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.763 26.772 10.093 1.00 0.00 H new ATOM 906 N ARG A 71 19.261 25.222 9.468 1.00 0.00 N ATOM 907 CA ARG A 71 20.731 25.050 9.491 1.00 0.00 C ATOM 908 C ARG A 71 21.212 23.588 9.427 1.00 0.00 C ATOM 909 O ARG A 71 22.313 23.351 8.919 1.00 0.00 O ATOM 910 CB ARG A 71 21.322 25.779 10.725 1.00 0.00 C ATOM 911 CG ARG A 71 22.213 26.990 10.368 1.00 0.00 C ATOM 912 CD ARG A 71 23.710 26.683 10.199 1.00 0.00 C ATOM 913 NE ARG A 71 23.955 25.594 9.241 1.00 0.00 N ATOM 914 CZ ARG A 71 25.093 25.221 8.678 1.00 0.00 C ATOM 915 NH1 ARG A 71 26.219 25.888 8.833 1.00 0.00 N ATOM 916 NH2 ARG A 71 25.084 24.131 7.945 1.00 0.00 N ATOM 0 H ARG A 71 18.754 24.381 9.743 1.00 0.00 H new ATOM 0 HA ARG A 71 21.104 25.501 8.572 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.504 26.117 11.362 1.00 0.00 H new ATOM 0 HB3 ARG A 71 21.908 25.069 11.309 1.00 0.00 H new ATOM 0 HG2 ARG A 71 21.843 27.430 9.442 1.00 0.00 H new ATOM 0 HG3 ARG A 71 22.100 27.744 11.147 1.00 0.00 H new ATOM 0 HD2 ARG A 71 24.227 27.582 9.863 1.00 0.00 H new ATOM 0 HD3 ARG A 71 24.134 26.414 11.166 1.00 0.00 H new ATOM 0 HE ARG A 71 23.134 25.051 8.974 1.00 0.00 H new ATOM 0 HH11 ARG A 71 26.238 26.731 9.407 1.00 0.00 H new ATOM 0 HH12 ARG A 71 27.072 25.561 8.379 1.00 0.00 H new ATOM 0 HH21 ARG A 71 24.219 23.604 7.826 1.00 0.00 H new ATOM 0 HH22 ARG A 71 25.942 23.812 7.495 1.00 0.00 H new ATOM 930 N GLN A 72 20.444 22.626 9.923 1.00 0.00 N ATOM 931 CA GLN A 72 20.654 21.189 9.746 1.00 0.00 C ATOM 932 C GLN A 72 20.102 20.715 8.397 1.00 0.00 C ATOM 933 O GLN A 72 19.353 21.435 7.739 1.00 0.00 O ATOM 934 CB GLN A 72 19.942 20.421 10.880 1.00 0.00 C ATOM 935 CG GLN A 72 20.608 20.626 12.245 1.00 0.00 C ATOM 936 CD GLN A 72 22.060 20.156 12.236 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.436 19.224 11.540 1.00 0.00 O ATOM 938 NE2 GLN A 72 22.938 20.820 12.954 1.00 0.00 N ATOM 0 H GLN A 72 19.619 22.833 10.486 1.00 0.00 H new ATOM 0 HA GLN A 72 21.726 20.994 9.773 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.903 20.745 10.935 1.00 0.00 H new ATOM 0 HB3 GLN A 72 19.932 19.357 10.642 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.568 21.681 12.516 1.00 0.00 H new ATOM 0 HG3 GLN A 72 20.053 20.080 13.008 1.00 0.00 H new ATOM 0 HE21 GLN A 72 22.635 21.599 13.538 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.923 20.556 12.927 1.00 0.00 H new ATOM 947 N VAL A 73 20.430 19.479 8.011 1.00 0.00 N ATOM 948 CA VAL A 73 19.800 18.795 6.867 1.00 0.00 C ATOM 949 C VAL A 73 18.710 17.840 7.358 1.00 0.00 C ATOM 950 O VAL A 73 18.827 17.250 8.437 1.00 0.00 O ATOM 951 CB VAL A 73 20.801 18.080 5.935 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.839 19.060 5.370 1.00 0.00 C ATOM 953 CG2 VAL A 73 21.518 16.894 6.609 1.00 0.00 C ATOM 0 H VAL A 73 21.141 18.919 8.481 1.00 0.00 H new ATOM 0 HA VAL A 73 19.347 19.573 6.252 1.00 0.00 H new ATOM 0 HB VAL A 73 20.203 17.677 5.118 1.00 0.00 H new ATOM 0 HG11 VAL A 73 22.528 18.524 4.718 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.332 19.839 4.800 1.00 0.00 H new ATOM 0 HG13 VAL A 73 22.395 19.514 6.190 1.00 0.00 H new ATOM 0 HG21 VAL A 73 22.207 16.435 5.900 1.00 0.00 H new ATOM 0 HG22 VAL A 73 22.073 17.250 7.477 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.781 16.157 6.927 1.00 0.00 H new ATOM 963 N ARG A 74 17.656 17.691 6.555 1.00 0.00 N ATOM 964 CA ARG A 74 16.432 16.973 6.891 1.00 0.00 C ATOM 965 C ARG A 74 16.053 15.973 5.808 1.00 0.00 C ATOM 966 O ARG A 74 16.558 16.029 4.691 1.00 0.00 O ATOM 967 CB ARG A 74 15.293 17.969 7.131 1.00 0.00 C ATOM 968 CG ARG A 74 14.500 18.471 5.911 1.00 0.00 C ATOM 969 CD ARG A 74 13.518 19.580 6.324 1.00 0.00 C ATOM 970 NE ARG A 74 13.724 20.840 5.587 1.00 0.00 N ATOM 971 CZ ARG A 74 12.812 21.783 5.364 1.00 0.00 C ATOM 972 NH1 ARG A 74 11.539 21.629 5.679 1.00 0.00 N ATOM 973 NH2 ARG A 74 13.195 22.917 4.817 1.00 0.00 N ATOM 0 H ARG A 74 17.634 18.085 5.614 1.00 0.00 H new ATOM 0 HA ARG A 74 16.610 16.408 7.806 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.587 17.508 7.821 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.712 18.839 7.637 1.00 0.00 H new ATOM 0 HG2 ARG A 74 15.187 18.849 5.154 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.953 17.643 5.460 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.498 19.233 6.160 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.622 19.770 7.392 1.00 0.00 H new ATOM 0 HE ARG A 74 14.658 21.005 5.211 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.222 20.761 6.111 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.873 22.378 5.491 1.00 0.00 H new ATOM 0 HH21 ARG A 74 14.175 23.060 4.572 1.00 0.00 H new ATOM 0 HH22 ARG A 74 12.512 23.653 4.638 1.00 0.00 H new ATOM 987 N TYR A 75 15.095 15.112 6.124 1.00 0.00 N ATOM 988 CA TYR A 75 14.446 14.197 5.184 1.00 0.00 C ATOM 989 C TYR A 75 12.939 14.469 5.175 1.00 0.00 C ATOM 990 O TYR A 75 12.348 14.545 6.243 1.00 0.00 O ATOM 991 CB TYR A 75 14.777 12.771 5.639 1.00 0.00 C ATOM 992 CG TYR A 75 16.171 12.365 5.193 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.396 12.044 3.840 1.00 0.00 C ATOM 994 CD2 TYR A 75 17.258 12.416 6.087 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.698 11.779 3.376 1.00 0.00 C ATOM 996 CE2 TYR A 75 18.566 12.156 5.627 1.00 0.00 C ATOM 997 CZ TYR A 75 18.791 11.837 4.268 1.00 0.00 C ATOM 998 OH TYR A 75 20.060 11.606 3.824 1.00 0.00 O ATOM 0 H TYR A 75 14.733 15.026 7.074 1.00 0.00 H new ATOM 0 HA TYR A 75 14.801 14.336 4.163 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.706 12.707 6.725 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.044 12.076 5.230 1.00 0.00 H new ATOM 0 HD1 TYR A 75 15.563 12.001 3.154 1.00 0.00 H new ATOM 0 HD2 TYR A 75 17.090 12.655 7.127 1.00 0.00 H new ATOM 0 HE1 TYR A 75 17.861 11.531 2.338 1.00 0.00 H new ATOM 0 HE2 TYR A 75 19.398 12.201 6.315 1.00 0.00 H new ATOM 0 HH TYR A 75 20.688 11.688 4.572 1.00 0.00 H new ATOM 1008 N ALA A 76 12.329 14.656 4.000 1.00 0.00 N ATOM 1009 CA ALA A 76 10.925 15.053 3.825 1.00 0.00 C ATOM 1010 C ALA A 76 10.292 14.354 2.613 1.00 0.00 C ATOM 1011 O ALA A 76 11.014 13.982 1.685 1.00 0.00 O ATOM 1012 CB ALA A 76 10.867 16.579 3.661 1.00 0.00 C ATOM 0 H ALA A 76 12.815 14.531 3.112 1.00 0.00 H new ATOM 0 HA ALA A 76 10.354 14.750 4.703 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.831 16.892 3.530 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.280 17.056 4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.448 16.873 2.787 1.00 0.00 H new ATOM 1018 N LEU A 77 8.966 14.167 2.627 1.00 0.00 N ATOM 1019 CA LEU A 77 8.252 13.476 1.556 1.00 0.00 C ATOM 1020 C LEU A 77 8.330 14.225 0.221 1.00 0.00 C ATOM 1021 O LEU A 77 8.375 15.453 0.181 1.00 0.00 O ATOM 1022 CB LEU A 77 6.800 13.215 1.984 1.00 0.00 C ATOM 1023 CG LEU A 77 6.690 12.458 3.313 1.00 0.00 C ATOM 1024 CD1 LEU A 77 5.215 12.345 3.645 1.00 0.00 C ATOM 1025 CD2 LEU A 77 7.342 11.071 3.292 1.00 0.00 C ATOM 0 H LEU A 77 8.362 14.492 3.382 1.00 0.00 H new ATOM 0 HA LEU A 77 8.743 12.518 1.386 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.277 14.167 2.071 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.295 12.644 1.205 1.00 0.00 H new ATOM 0 HG LEU A 77 7.237 13.016 4.073 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.094 11.811 4.587 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.785 13.342 3.736 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.704 11.801 2.851 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.223 10.598 4.267 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.864 10.456 2.530 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.403 11.171 3.065 1.00 0.00 H new ATOM 1037 N ALA A 78 8.345 13.452 -0.862 1.00 0.00 N ATOM 1038 CA ALA A 78 8.572 13.983 -2.210 1.00 0.00 C ATOM 1039 C ALA A 78 7.369 14.746 -2.795 1.00 0.00 C ATOM 1040 O ALA A 78 7.574 15.674 -3.572 1.00 0.00 O ATOM 1041 CB ALA A 78 9.027 12.832 -3.111 1.00 0.00 C ATOM 0 H ALA A 78 8.201 12.443 -0.834 1.00 0.00 H new ATOM 0 HA ALA A 78 9.354 14.740 -2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.201 13.207 -4.120 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.950 12.405 -2.718 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.254 12.064 -3.138 1.00 0.00 H new ATOM 1047 N ASP A 79 6.136 14.405 -2.400 1.00 0.00 N ATOM 1048 CA ASP A 79 4.907 15.054 -2.873 1.00 0.00 C ATOM 1049 C ASP A 79 3.686 14.749 -1.983 1.00 0.00 C ATOM 1050 O ASP A 79 3.611 13.751 -1.257 1.00 0.00 O ATOM 1051 CB ASP A 79 4.631 14.698 -4.357 1.00 0.00 C ATOM 1052 CG ASP A 79 3.287 15.226 -4.886 1.00 0.00 C ATOM 1053 OD1 ASP A 79 2.985 16.430 -4.692 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.457 14.393 -5.304 1.00 0.00 O ATOM 0 H ASP A 79 5.961 13.656 -1.730 1.00 0.00 H new ATOM 0 HA ASP A 79 5.071 16.129 -2.802 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.436 15.100 -4.972 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.654 13.614 -4.471 1.00 0.00 H new ATOM 1059 N SER A 80 2.698 15.632 -2.118 1.00 0.00 N ATOM 1060 CA SER A 80 1.324 15.543 -1.635 1.00 0.00 C ATOM 1061 C SER A 80 0.677 14.167 -1.855 1.00 0.00 C ATOM 1062 O SER A 80 -0.030 13.697 -0.966 1.00 0.00 O ATOM 1063 CB SER A 80 0.506 16.631 -2.354 1.00 0.00 C ATOM 1064 OG SER A 80 0.435 16.428 -3.760 1.00 0.00 O ATOM 0 H SER A 80 2.856 16.509 -2.615 1.00 0.00 H new ATOM 0 HA SER A 80 1.336 15.690 -0.555 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.503 16.651 -1.943 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.951 17.606 -2.154 1.00 0.00 H new ATOM 0 HG SER A 80 1.327 16.535 -4.151 1.00 0.00 H new ATOM 1070 N HIS A 81 0.972 13.485 -2.975 1.00 0.00 N ATOM 1071 CA HIS A 81 0.559 12.108 -3.259 1.00 0.00 C ATOM 1072 C HIS A 81 0.892 11.149 -2.119 1.00 0.00 C ATOM 1073 O HIS A 81 0.009 10.429 -1.652 1.00 0.00 O ATOM 1074 CB HIS A 81 1.245 11.636 -4.561 1.00 0.00 C ATOM 1075 CG HIS A 81 0.477 11.926 -5.824 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.773 12.506 -5.918 1.00 0.00 N ATOM 1077 CD2 HIS A 81 0.725 11.304 -7.013 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -1.316 12.140 -7.093 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -0.387 11.477 -7.812 1.00 0.00 N ATOM 0 H HIS A 81 1.523 13.894 -3.730 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.525 12.101 -3.372 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.224 12.110 -4.631 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.416 10.561 -4.496 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -1.208 13.107 -5.218 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.627 10.773 -7.280 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -2.329 12.343 -7.409 1.00 0.00 H new ATOM 1088 N LEU A 82 2.152 11.133 -1.674 1.00 0.00 N ATOM 1089 CA LEU A 82 2.588 10.235 -0.604 1.00 0.00 C ATOM 1090 C LEU A 82 1.994 10.715 0.713 1.00 0.00 C ATOM 1091 O LEU A 82 1.276 9.955 1.348 1.00 0.00 O ATOM 1092 CB LEU A 82 4.124 10.132 -0.510 1.00 0.00 C ATOM 1093 CG LEU A 82 4.898 10.156 -1.849 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.393 10.280 -1.539 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.584 8.908 -2.688 1.00 0.00 C ATOM 0 H LEU A 82 2.889 11.735 -2.041 1.00 0.00 H new ATOM 0 HA LEU A 82 2.230 9.231 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.484 10.955 0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.373 9.208 0.012 1.00 0.00 H new ATOM 0 HG LEU A 82 4.587 11.012 -2.447 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.958 10.299 -2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.575 11.202 -0.986 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.712 9.428 -0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.141 8.949 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.872 8.015 -2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.516 8.873 -2.902 1.00 0.00 H new ATOM 1107 N ALA A 83 2.200 11.992 1.061 1.00 0.00 N ATOM 1108 CA ALA A 83 1.738 12.599 2.309 1.00 0.00 C ATOM 1109 C ALA A 83 0.231 12.405 2.550 1.00 0.00 C ATOM 1110 O ALA A 83 -0.174 12.183 3.687 1.00 0.00 O ATOM 1111 CB ALA A 83 2.111 14.088 2.256 1.00 0.00 C ATOM 0 H ALA A 83 2.706 12.646 0.464 1.00 0.00 H new ATOM 0 HA ALA A 83 2.223 12.105 3.151 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.782 14.578 3.172 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.192 14.189 2.158 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.624 14.555 1.400 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.593 12.446 1.496 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.047 12.320 1.598 1.00 0.00 C ATOM 1119 C ARG A 84 -2.481 10.871 1.868 1.00 0.00 C ATOM 1120 O ARG A 84 -3.039 10.631 2.936 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.691 12.944 0.344 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.221 12.879 0.274 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.925 13.318 1.567 1.00 0.00 C ATOM 1124 NE ARG A 84 -6.334 12.924 1.563 1.00 0.00 N ATOM 1125 CZ ARG A 84 -7.375 13.580 2.053 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.313 14.851 2.402 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -8.503 12.936 2.219 1.00 0.00 N ATOM 0 H ARG A 84 -0.263 12.569 0.539 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.407 12.874 2.465 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.388 13.989 0.286 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.285 12.445 -0.536 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.564 13.509 -0.546 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.521 11.858 0.038 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.423 12.873 2.426 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.848 14.400 1.677 1.00 0.00 H new ATOM 0 HE ARG A 84 -6.542 12.026 1.125 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -6.439 15.366 2.298 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.139 15.318 2.775 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -8.567 11.948 1.972 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -9.317 13.422 2.595 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.119 9.904 1.013 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.483 8.490 1.219 1.00 0.00 C ATOM 1143 C ALA A 85 -1.835 7.881 2.483 1.00 0.00 C ATOM 1144 O ALA A 85 -2.388 6.975 3.110 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.124 7.701 -0.048 1.00 0.00 C ATOM 0 H ALA A 85 -1.573 10.074 0.169 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.557 8.429 1.395 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.388 6.652 0.089 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.675 8.106 -0.897 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.054 7.784 -0.237 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.678 8.417 2.882 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.035 8.140 4.163 1.00 0.00 C ATOM 1153 C LEU A 86 -0.833 8.746 5.339 1.00 0.00 C ATOM 1154 O LEU A 86 -0.976 8.096 6.372 1.00 0.00 O ATOM 1155 CB LEU A 86 1.389 8.724 4.056 1.00 0.00 C ATOM 1156 CG LEU A 86 2.265 8.565 5.299 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.613 7.125 5.669 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.535 9.397 5.095 1.00 0.00 C ATOM 0 H LEU A 86 -0.151 9.073 2.305 1.00 0.00 H new ATOM 0 HA LEU A 86 0.003 7.070 4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.894 8.250 3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.310 9.786 3.823 1.00 0.00 H new ATOM 0 HG LEU A 86 1.681 8.922 6.148 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.236 7.120 6.563 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.697 6.567 5.862 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.155 6.659 4.846 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.178 9.300 5.970 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.066 9.040 4.213 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.266 10.444 4.957 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.349 9.971 5.176 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.003 10.792 6.204 1.00 0.00 C ATOM 1172 C GLY A 87 -3.444 10.408 6.519 1.00 0.00 C ATOM 1173 O GLY A 87 -3.829 10.437 7.684 1.00 0.00 O ATOM 0 H GLY A 87 -1.320 10.443 4.272 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.418 10.731 7.122 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.983 11.833 5.882 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.238 10.029 5.517 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.586 9.472 5.738 1.00 0.00 C ATOM 1179 C GLU A 88 -5.570 7.969 6.058 1.00 0.00 C ATOM 1180 O GLU A 88 -6.549 7.440 6.590 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.484 9.791 4.537 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.217 8.971 3.262 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.507 9.837 2.041 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -7.604 10.435 1.976 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.568 10.114 1.267 1.00 0.00 O ATOM 0 H GLU A 88 -3.974 10.096 4.534 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.000 9.952 6.625 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.522 9.639 4.833 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.373 10.848 4.296 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.182 8.631 3.244 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.846 8.081 3.249 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.435 7.320 5.757 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.104 5.913 5.959 1.00 0.00 C ATOM 1194 C LEU A 89 -4.934 4.985 5.058 1.00 0.00 C ATOM 1195 O LEU A 89 -6.155 5.082 4.962 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.213 5.558 7.460 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.755 4.141 7.849 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -2.269 3.892 7.549 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -4.021 3.918 9.343 1.00 0.00 C ATOM 0 H LEU A 89 -3.657 7.820 5.326 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.070 5.752 5.655 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.624 6.278 8.028 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.251 5.681 7.769 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.326 3.436 7.244 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -2.003 2.877 7.844 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.087 4.019 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.661 4.603 8.108 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.698 2.916 9.624 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.467 4.654 9.925 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.087 4.026 9.543 1.00 0.00 H new ATOM 1211 N VAL A 90 -4.286 3.941 4.542 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.886 2.825 3.773 1.00 0.00 C ATOM 1213 C VAL A 90 -5.888 1.962 4.567 1.00 0.00 C ATOM 1214 O VAL A 90 -6.095 0.783 4.275 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.815 1.889 3.186 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.900 2.601 2.180 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.998 1.278 4.337 1.00 0.00 C ATOM 0 H VAL A 90 -3.277 3.835 4.648 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.436 3.330 2.979 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.320 1.099 2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -2.163 1.896 1.796 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.498 2.986 1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.389 3.427 2.674 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.236 0.613 3.930 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.518 2.075 4.905 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.660 0.713 4.993 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.465 2.501 5.639 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.698 2.062 6.250 1.00 0.00 C ATOM 1229 C GLN A 91 -7.510 0.855 7.174 1.00 0.00 C ATOM 1230 O GLN A 91 -8.223 0.773 8.163 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.761 1.890 5.148 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.371 3.220 4.658 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.192 3.933 5.727 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.375 3.685 5.898 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.590 4.770 6.541 1.00 0.00 N ATOM 0 H GLN A 91 -6.055 3.299 6.124 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.065 2.826 6.936 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.312 1.373 4.300 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -9.560 1.251 5.524 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.569 3.879 4.325 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.004 3.025 3.792 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.602 4.987 6.410 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.111 5.203 7.304 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.499 0.013 6.949 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.054 -1.207 7.669 1.00 0.00 C ATOM 1246 C VAL A 92 -5.769 -1.096 9.183 1.00 0.00 C ATOM 1247 O VAL A 92 -4.998 -1.857 9.754 1.00 0.00 O ATOM 1248 CB VAL A 92 -4.845 -1.781 6.892 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -3.543 -1.008 7.180 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -4.654 -3.285 7.084 1.00 0.00 C ATOM 0 H VAL A 92 -5.885 0.185 6.153 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.912 -1.880 7.678 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.089 -1.637 5.839 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.724 -1.449 6.611 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.667 0.035 6.888 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.316 -1.062 8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.789 -3.618 6.511 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.494 -3.499 8.141 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.543 -3.812 6.738 1.00 0.00 H new ATOM 1260 N VAL A 93 -6.363 -0.113 9.853 1.00 0.00 N ATOM 1261 CA VAL A 93 -6.419 0.004 11.317 1.00 0.00 C ATOM 1262 C VAL A 93 -5.031 0.302 11.941 1.00 0.00 C ATOM 1263 O VAL A 93 -4.878 0.227 13.156 1.00 0.00 O ATOM 1264 CB VAL A 93 -7.145 -1.233 11.948 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -7.817 -0.847 13.277 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -8.292 -1.789 11.058 1.00 0.00 C ATOM 0 H VAL A 93 -6.838 0.655 9.379 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.025 0.876 11.563 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.364 -1.983 12.070 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.316 -1.719 13.699 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.062 -0.487 13.976 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -8.550 -0.061 13.099 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -8.754 -2.644 11.552 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.041 -1.012 10.902 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.887 -2.101 10.095 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.040 0.651 11.093 1.00 0.00 N ATOM 1277 CA LEU A 94 -2.603 0.849 11.363 1.00 0.00 C ATOM 1278 C LEU A 94 -1.879 -0.507 11.293 1.00 0.00 C ATOM 1279 O LEU A 94 -1.945 -1.316 12.212 1.00 0.00 O ATOM 1280 CB LEU A 94 -2.352 1.626 12.678 1.00 0.00 C ATOM 1281 CG LEU A 94 -1.015 2.398 12.731 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -0.967 3.238 14.015 1.00 0.00 C ATOM 1283 CD2 LEU A 94 0.226 1.494 12.675 1.00 0.00 C ATOM 0 H LEU A 94 -4.248 0.817 10.108 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.178 1.489 10.589 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.169 2.332 12.828 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.382 0.923 13.510 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.984 3.027 11.841 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.025 3.785 14.057 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.797 3.944 14.019 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.045 2.582 14.882 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.126 2.108 12.717 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.215 0.808 13.522 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.219 0.923 11.746 1.00 0.00 H new ATOM 1295 N ALA A 95 -1.209 -0.771 10.171 1.00 0.00 N ATOM 1296 CA ALA A 95 -0.551 -2.043 9.884 1.00 0.00 C ATOM 1297 C ALA A 95 0.580 -2.403 10.875 1.00 0.00 C ATOM 1298 O ALA A 95 1.667 -1.839 10.803 1.00 0.00 O ATOM 1299 CB ALA A 95 -0.043 -1.995 8.434 1.00 0.00 C ATOM 0 H ALA A 95 -1.107 -0.089 9.419 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.281 -2.842 10.010 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.454 -2.934 8.191 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.885 -1.845 7.758 1.00 0.00 H new ATOM 0 HB3 ALA A 95 0.663 -1.172 8.323 1.00 0.00 H new ATOM 1305 N VAL A 96 0.333 -3.396 11.736 1.00 0.00 N ATOM 1306 CA VAL A 96 1.341 -4.034 12.612 1.00 0.00 C ATOM 1307 C VAL A 96 2.406 -4.832 11.852 1.00 0.00 C ATOM 1308 O VAL A 96 2.139 -5.438 10.812 1.00 0.00 O ATOM 1309 CB VAL A 96 0.750 -5.022 13.663 1.00 0.00 C ATOM 1310 CG1 VAL A 96 1.027 -4.509 15.084 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -0.743 -5.330 13.495 1.00 0.00 C ATOM 0 H VAL A 96 -0.599 -3.795 11.851 1.00 0.00 H new ATOM 0 HA VAL A 96 1.779 -3.167 13.107 1.00 0.00 H new ATOM 0 HB VAL A 96 1.261 -5.969 13.488 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.610 -5.207 15.810 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.103 -4.425 15.237 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.565 -3.530 15.214 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.061 -6.025 14.272 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.317 -4.407 13.578 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.914 -5.777 12.516 1.00 0.00 H new ATOM 1321 N ASP A 97 3.589 -4.877 12.465 1.00 0.00 N ATOM 1322 CA ASP A 97 4.694 -5.779 12.152 1.00 0.00 C ATOM 1323 C ASP A 97 4.502 -7.088 12.947 1.00 0.00 C ATOM 1324 O ASP A 97 3.959 -7.079 14.059 1.00 0.00 O ATOM 1325 CB ASP A 97 6.021 -5.093 12.520 1.00 0.00 C ATOM 1326 CG ASP A 97 7.272 -5.813 11.995 1.00 0.00 C ATOM 1327 OD1 ASP A 97 7.118 -6.844 11.299 1.00 0.00 O ATOM 1328 OD2 ASP A 97 8.370 -5.259 12.231 1.00 0.00 O ATOM 0 H ASP A 97 3.813 -4.249 13.237 1.00 0.00 H new ATOM 0 HA ASP A 97 4.714 -6.016 11.088 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.011 -4.075 12.129 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.088 -5.017 13.605 1.00 0.00 H new ATOM 1333 N THR A 98 4.907 -8.221 12.367 1.00 0.00 N ATOM 1334 CA THR A 98 4.776 -9.584 12.915 1.00 0.00 C ATOM 1335 C THR A 98 5.519 -10.557 12.015 1.00 0.00 C ATOM 1336 O THR A 98 5.420 -10.530 10.788 1.00 0.00 O ATOM 1337 CB THR A 98 3.327 -10.072 13.150 1.00 0.00 C ATOM 1338 OG1 THR A 98 2.371 -9.048 13.053 1.00 0.00 O ATOM 1339 CG2 THR A 98 3.169 -10.637 14.561 1.00 0.00 C ATOM 0 H THR A 98 5.360 -8.218 11.453 1.00 0.00 H new ATOM 0 HA THR A 98 5.216 -9.545 13.911 1.00 0.00 H new ATOM 0 HB THR A 98 3.158 -10.818 12.374 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.477 -9.419 13.209 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.143 -10.974 14.705 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.849 -11.478 14.695 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.402 -9.862 15.291 1.00 0.00 H new ATOM 1347 N ASP A 99 6.238 -11.437 12.694 1.00 0.00 N ATOM 1348 CA ASP A 99 6.920 -12.649 12.230 1.00 0.00 C ATOM 1349 C ASP A 99 5.926 -13.737 11.777 1.00 0.00 C ATOM 1350 O ASP A 99 6.197 -14.502 10.848 1.00 0.00 O ATOM 1351 CB ASP A 99 7.809 -13.157 13.394 1.00 0.00 C ATOM 1352 CG ASP A 99 7.187 -13.140 14.812 1.00 0.00 C ATOM 1353 OD1 ASP A 99 5.947 -12.973 14.939 1.00 0.00 O ATOM 1354 OD2 ASP A 99 7.961 -13.268 15.781 1.00 0.00 O ATOM 0 H ASP A 99 6.377 -11.310 13.697 1.00 0.00 H new ATOM 0 HA ASP A 99 7.527 -12.415 11.355 1.00 0.00 H new ATOM 0 HB2 ASP A 99 8.111 -14.180 13.169 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.717 -12.554 13.415 1.00 0.00 H new ATOM 1359 N GLN A 100 4.759 -13.740 12.420 1.00 0.00 N ATOM 1360 CA GLN A 100 3.564 -14.533 12.134 1.00 0.00 C ATOM 1361 C GLN A 100 2.981 -14.279 10.720 1.00 0.00 C ATOM 1362 O GLN A 100 3.420 -13.358 10.037 1.00 0.00 O ATOM 1363 CB GLN A 100 2.570 -14.274 13.296 1.00 0.00 C ATOM 1364 CG GLN A 100 2.469 -15.430 14.315 1.00 0.00 C ATOM 1365 CD GLN A 100 3.809 -16.089 14.657 1.00 0.00 C ATOM 1366 OE1 GLN A 100 4.044 -17.242 14.309 1.00 0.00 O ATOM 1367 NE2 GLN A 100 4.738 -15.394 15.269 1.00 0.00 N ATOM 0 H GLN A 100 4.613 -13.133 13.227 1.00 0.00 H new ATOM 0 HA GLN A 100 3.807 -15.595 12.094 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.871 -13.368 13.821 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.581 -14.086 12.878 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.019 -15.051 15.233 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.795 -16.189 13.919 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.549 -14.435 15.561 1.00 0.00 H new ATOM 0 HE22 GLN A 100 5.650 -15.812 15.453 1.00 0.00 H new ATOM 1376 N PRO A 101 2.030 -15.097 10.219 1.00 0.00 N ATOM 1377 CA PRO A 101 1.552 -15.013 8.836 1.00 0.00 C ATOM 1378 C PRO A 101 0.758 -13.740 8.560 1.00 0.00 C ATOM 1379 O PRO A 101 0.201 -13.156 9.490 1.00 0.00 O ATOM 1380 CB PRO A 101 0.691 -16.263 8.641 1.00 0.00 C ATOM 1381 CG PRO A 101 0.137 -16.542 10.030 1.00 0.00 C ATOM 1382 CD PRO A 101 1.320 -16.164 10.919 1.00 0.00 C ATOM 0 HA PRO A 101 2.386 -14.969 8.136 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -0.107 -16.090 7.919 1.00 0.00 H new ATOM 0 HB3 PRO A 101 1.281 -17.101 8.270 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.746 -15.941 10.247 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -0.150 -17.586 10.154 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.979 -15.828 11.898 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.972 -17.022 11.085 1.00 0.00 H new ATOM 1390 N CYS A 102 0.659 -13.353 7.272 1.00 0.00 N ATOM 1391 CA CYS A 102 -0.304 -12.344 6.816 1.00 0.00 C ATOM 1392 C CYS A 102 -1.667 -12.718 7.433 1.00 0.00 C ATOM 1393 O CYS A 102 -2.255 -12.015 8.254 1.00 0.00 O ATOM 1394 CB CYS A 102 -0.280 -12.341 5.259 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.841 -13.815 4.302 1.00 0.00 S ATOM 0 H CYS A 102 1.243 -13.732 6.527 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.072 -11.327 7.133 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -0.886 -11.497 4.931 1.00 0.00 H new ATOM 0 HB3 CYS A 102 0.746 -12.134 4.955 1.00 0.00 H new ATOM 1400 N VAL A 103 -2.008 -13.947 7.074 1.00 0.00 N ATOM 1401 CA VAL A 103 -3.048 -14.848 7.557 1.00 0.00 C ATOM 1402 C VAL A 103 -2.911 -16.181 6.808 1.00 0.00 C ATOM 1403 O VAL A 103 -2.682 -17.215 7.429 1.00 0.00 O ATOM 1404 CB VAL A 103 -4.458 -14.222 7.500 1.00 0.00 C ATOM 1405 CG1 VAL A 103 -4.698 -13.285 6.306 1.00 0.00 C ATOM 1406 CG2 VAL A 103 -5.521 -15.325 7.500 1.00 0.00 C ATOM 0 H VAL A 103 -1.483 -14.402 6.327 1.00 0.00 H new ATOM 0 HA VAL A 103 -2.910 -15.041 8.621 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.534 -13.600 8.392 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.714 -12.893 6.350 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -3.988 -12.458 6.344 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -4.562 -13.838 5.377 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.513 -14.875 7.460 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.379 -15.967 6.631 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.429 -15.919 8.409 1.00 0.00 H new ATOM 1416 N ALA A 104 -2.951 -16.148 5.473 1.00 0.00 N ATOM 1417 CA ALA A 104 -2.733 -17.310 4.603 1.00 0.00 C ATOM 1418 C ALA A 104 -1.240 -17.531 4.272 1.00 0.00 C ATOM 1419 O ALA A 104 -0.849 -17.560 3.109 1.00 0.00 O ATOM 1420 CB ALA A 104 -3.615 -17.153 3.361 1.00 0.00 C ATOM 0 H ALA A 104 -3.141 -15.291 4.953 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.026 -18.220 5.127 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -3.468 -18.007 2.700 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.661 -17.103 3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.344 -16.237 2.836 1.00 0.00 H new ATOM 1426 N GLU A 105 -0.417 -17.676 5.308 1.00 0.00 N ATOM 1427 CA GLU A 105 1.005 -18.041 5.263 1.00 0.00 C ATOM 1428 C GLU A 105 1.269 -19.000 6.451 1.00 0.00 C ATOM 1429 O GLU A 105 0.334 -19.316 7.192 1.00 0.00 O ATOM 1430 CB GLU A 105 1.870 -16.758 5.324 1.00 0.00 C ATOM 1431 CG GLU A 105 1.963 -15.987 3.994 1.00 0.00 C ATOM 1432 CD GLU A 105 2.597 -14.594 4.136 1.00 0.00 C ATOM 1433 OE1 GLU A 105 3.190 -14.299 5.198 1.00 0.00 O ATOM 1434 OE2 GLU A 105 2.484 -13.779 3.191 1.00 0.00 O ATOM 0 H GLU A 105 -0.742 -17.534 6.264 1.00 0.00 H new ATOM 0 HA GLU A 105 1.270 -18.549 4.336 1.00 0.00 H new ATOM 0 HB2 GLU A 105 1.461 -16.095 6.086 1.00 0.00 H new ATOM 0 HB3 GLU A 105 2.876 -17.028 5.644 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.547 -16.573 3.284 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.963 -15.881 3.574 1.00 0.00 H new ATOM 1441 N ARG A 106 2.509 -19.462 6.698 1.00 0.00 N ATOM 1442 CA ARG A 106 2.800 -20.309 7.877 1.00 0.00 C ATOM 1443 C ARG A 106 4.116 -20.011 8.605 1.00 0.00 C ATOM 1444 O ARG A 106 5.209 -20.231 8.084 1.00 0.00 O ATOM 1445 CB ARG A 106 2.580 -21.809 7.572 1.00 0.00 C ATOM 1446 CG ARG A 106 3.432 -22.512 6.486 1.00 0.00 C ATOM 1447 CD ARG A 106 4.808 -23.086 6.885 1.00 0.00 C ATOM 1448 NE ARG A 106 4.757 -23.903 8.119 1.00 0.00 N ATOM 1449 CZ ARG A 106 5.298 -23.592 9.294 1.00 0.00 C ATOM 1450 NH1 ARG A 106 6.092 -22.559 9.452 1.00 0.00 N ATOM 1451 NH2 ARG A 106 5.022 -24.290 10.375 1.00 0.00 N ATOM 0 H ARG A 106 3.318 -19.268 6.108 1.00 0.00 H new ATOM 0 HA ARG A 106 2.057 -20.018 8.619 1.00 0.00 H new ATOM 0 HB2 ARG A 106 2.729 -22.354 8.504 1.00 0.00 H new ATOM 0 HB3 ARG A 106 1.533 -21.933 7.294 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.838 -23.329 6.077 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.592 -21.799 5.678 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.192 -23.696 6.067 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.511 -22.265 7.028 1.00 0.00 H new ATOM 0 HE ARG A 106 4.258 -24.791 8.063 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.315 -21.960 8.657 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.487 -22.355 10.370 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.384 -25.084 10.320 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.446 -24.037 11.267 1.00 0.00 H new TER 1465 ARG A 106 ATOM 1466 N ALA B 10 -0.078 -10.375 10.504 1.00 0.00 N ATOM 1467 CA ALA B 10 1.000 -9.523 9.999 1.00 0.00 C ATOM 1468 C ALA B 10 0.477 -8.519 8.962 1.00 0.00 C ATOM 1469 O ALA B 10 0.638 -8.705 7.754 1.00 0.00 O ATOM 1470 CB ALA B 10 2.145 -10.397 9.485 1.00 0.00 C ATOM 0 HA ALA B 10 1.400 -8.915 10.810 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.947 -9.762 9.109 1.00 0.00 H new ATOM 0 HB2 ALA B 10 2.523 -11.016 10.298 1.00 0.00 H new ATOM 0 HB3 ALA B 10 1.782 -11.037 8.681 1.00 0.00 H new ATOM 1476 N LEU B 11 -0.146 -7.432 9.430 1.00 0.00 N ATOM 1477 CA LEU B 11 -0.764 -6.426 8.560 1.00 0.00 C ATOM 1478 C LEU B 11 0.226 -5.668 7.658 1.00 0.00 C ATOM 1479 O LEU B 11 -0.206 -5.155 6.630 1.00 0.00 O ATOM 1480 CB LEU B 11 -1.667 -5.472 9.363 1.00 0.00 C ATOM 1481 CG LEU B 11 -3.100 -5.960 9.673 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -3.834 -6.376 8.397 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -3.172 -7.102 10.691 1.00 0.00 C ATOM 0 H LEU B 11 -0.236 -7.225 10.425 1.00 0.00 H new ATOM 0 HA LEU B 11 -1.392 -6.985 7.866 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.172 -5.252 10.309 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.740 -4.532 8.815 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.591 -5.099 10.127 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -4.839 -6.714 8.649 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -3.897 -5.524 7.719 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -3.290 -7.186 7.912 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.213 -7.383 10.850 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -2.618 -7.961 10.313 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.736 -6.776 11.635 1.00 0.00 H new ATOM 1495 N ALA B 12 1.534 -5.651 7.934 1.00 0.00 N ATOM 1496 CA ALA B 12 2.530 -5.182 6.958 1.00 0.00 C ATOM 1497 C ALA B 12 2.349 -5.932 5.612 1.00 0.00 C ATOM 1498 O ALA B 12 2.324 -5.361 4.518 1.00 0.00 O ATOM 1499 CB ALA B 12 3.913 -5.429 7.578 1.00 0.00 C ATOM 0 H ALA B 12 1.930 -5.956 8.823 1.00 0.00 H new ATOM 0 HA ALA B 12 2.412 -4.121 6.738 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.687 -5.095 6.887 1.00 0.00 H new ATOM 0 HB2 ALA B 12 3.997 -4.874 8.512 1.00 0.00 H new ATOM 0 HB3 ALA B 12 4.038 -6.494 7.776 1.00 0.00 H new ATOM 1505 N ARG B 13 2.058 -7.235 5.701 1.00 0.00 N ATOM 1506 CA ARG B 13 1.824 -8.121 4.558 1.00 0.00 C ATOM 1507 C ARG B 13 0.472 -7.867 3.843 1.00 0.00 C ATOM 1508 O ARG B 13 0.310 -8.309 2.699 1.00 0.00 O ATOM 1509 CB ARG B 13 2.008 -9.593 4.983 1.00 0.00 C ATOM 1510 CG ARG B 13 3.292 -9.825 5.810 1.00 0.00 C ATOM 1511 CD ARG B 13 3.548 -11.293 6.173 1.00 0.00 C ATOM 1512 NE ARG B 13 4.527 -11.382 7.275 1.00 0.00 N ATOM 1513 CZ ARG B 13 5.155 -12.474 7.695 1.00 0.00 C ATOM 1514 NH1 ARG B 13 5.066 -13.628 7.073 1.00 0.00 N ATOM 1515 NH2 ARG B 13 5.894 -12.413 8.777 1.00 0.00 N ATOM 0 H ARG B 13 1.977 -7.715 6.597 1.00 0.00 H new ATOM 0 HA ARG B 13 2.576 -7.886 3.804 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.144 -9.908 5.568 1.00 0.00 H new ATOM 0 HB3 ARG B 13 2.037 -10.222 4.093 1.00 0.00 H new ATOM 0 HG2 ARG B 13 4.146 -9.447 5.248 1.00 0.00 H new ATOM 0 HG3 ARG B 13 3.230 -9.241 6.728 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.614 -11.771 6.467 1.00 0.00 H new ATOM 0 HD3 ARG B 13 3.920 -11.831 5.301 1.00 0.00 H new ATOM 0 HE ARG B 13 4.743 -10.514 7.765 1.00 0.00 H new ATOM 0 HH11 ARG B 13 4.496 -13.711 6.231 1.00 0.00 H new ATOM 0 HH12 ARG B 13 5.566 -14.441 7.432 1.00 0.00 H new ATOM 0 HH21 ARG B 13 5.981 -11.533 9.286 1.00 0.00 H new ATOM 0 HH22 ARG B 13 6.381 -13.245 9.109 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.469 -7.107 4.429 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.683 -6.621 3.741 1.00 0.00 C ATOM 1531 C LEU B 14 -1.299 -5.566 2.695 1.00 0.00 C ATOM 1532 O LEU B 14 -1.731 -5.669 1.550 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.707 -6.123 4.789 1.00 0.00 C ATOM 1534 CG LEU B 14 -4.068 -5.550 4.320 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -3.956 -4.134 3.731 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.813 -6.432 3.315 1.00 0.00 C ATOM 0 H LEU B 14 -0.410 -6.809 5.403 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.170 -7.428 3.194 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.918 -6.956 5.460 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -2.216 -5.352 5.383 1.00 0.00 H new ATOM 0 HG LEU B 14 -4.649 -5.519 5.242 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -4.943 -3.790 3.421 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -3.555 -3.457 4.485 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -3.290 -4.150 2.868 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.754 -5.956 3.041 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.200 -6.565 2.423 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.016 -7.404 3.764 1.00 0.00 H new ATOM 1548 N GLY B 15 -0.374 -4.642 3.003 1.00 0.00 N ATOM 1549 CA GLY B 15 0.163 -3.702 2.008 1.00 0.00 C ATOM 1550 C GLY B 15 0.856 -4.427 0.854 1.00 0.00 C ATOM 1551 O GLY B 15 0.658 -4.076 -0.305 1.00 0.00 O ATOM 0 H GLY B 15 0.018 -4.527 3.938 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.647 -3.087 1.616 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.871 -3.028 2.490 1.00 0.00 H new ATOM 1555 N ARG B 16 1.582 -5.513 1.146 1.00 0.00 N ATOM 1556 CA ARG B 16 2.179 -6.395 0.133 1.00 0.00 C ATOM 1557 C ARG B 16 1.102 -6.960 -0.792 1.00 0.00 C ATOM 1558 O ARG B 16 1.332 -7.055 -1.989 1.00 0.00 O ATOM 1559 CB ARG B 16 3.013 -7.496 0.817 1.00 0.00 C ATOM 1560 CG ARG B 16 3.516 -8.662 -0.064 1.00 0.00 C ATOM 1561 CD ARG B 16 2.479 -9.712 -0.522 1.00 0.00 C ATOM 1562 NE ARG B 16 1.609 -10.200 0.569 1.00 0.00 N ATOM 1563 CZ ARG B 16 1.800 -11.306 1.278 1.00 0.00 C ATOM 1564 NH1 ARG B 16 2.885 -12.030 1.172 1.00 0.00 N ATOM 1565 NH2 ARG B 16 0.911 -11.725 2.145 1.00 0.00 N ATOM 0 H ARG B 16 1.774 -5.808 2.103 1.00 0.00 H new ATOM 0 HA ARG B 16 2.858 -5.818 -0.495 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.881 -7.023 1.277 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.415 -7.918 1.624 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.978 -8.235 -0.954 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.301 -9.182 0.484 1.00 0.00 H new ATOM 0 HD2 ARG B 16 1.857 -9.278 -1.305 1.00 0.00 H new ATOM 0 HD3 ARG B 16 3.003 -10.559 -0.964 1.00 0.00 H new ATOM 0 HE ARG B 16 0.790 -9.637 0.797 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.623 -11.751 0.526 1.00 0.00 H new ATOM 0 HH12 ARG B 16 2.992 -12.873 1.735 1.00 0.00 H new ATOM 0 HH21 ARG B 16 0.049 -11.198 2.287 1.00 0.00 H new ATOM 0 HH22 ARG B 16 1.081 -12.578 2.678 1.00 0.00 H new ATOM 1579 N ALA B 17 -0.074 -7.316 -0.277 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.188 -7.804 -1.089 1.00 0.00 C ATOM 1581 C ALA B 17 -1.881 -6.704 -1.919 1.00 0.00 C ATOM 1582 O ALA B 17 -2.635 -7.056 -2.823 1.00 0.00 O ATOM 1583 CB ALA B 17 -2.165 -8.540 -0.170 1.00 0.00 C ATOM 0 H ALA B 17 -0.282 -7.274 0.721 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.793 -8.490 -1.838 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -3.005 -8.913 -0.756 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.655 -9.377 0.307 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.532 -7.855 0.595 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.615 -5.413 -1.650 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.031 -4.287 -2.513 1.00 0.00 C ATOM 1591 C LEU B 18 -0.929 -3.883 -3.521 1.00 0.00 C ATOM 1592 O LEU B 18 -1.258 -3.373 -4.589 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.476 -3.108 -1.619 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.847 -3.343 -0.936 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.936 -2.583 0.393 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -5.027 -2.898 -1.823 1.00 0.00 C ATOM 0 H LEU B 18 -1.101 -5.117 -0.820 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.876 -4.602 -3.125 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.720 -2.936 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.529 -2.202 -2.223 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.917 -4.417 -0.764 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.908 -2.765 0.852 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.148 -2.928 1.063 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.815 -1.515 0.210 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.965 -3.083 -1.300 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.937 -1.834 -2.041 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -5.014 -3.462 -2.756 1.00 0.00 H new ATOM 1608 N ALA B 19 0.346 -4.148 -3.205 1.00 0.00 N ATOM 1609 CA ALA B 19 1.505 -4.060 -4.098 1.00 0.00 C ATOM 1610 C ALA B 19 1.667 -5.256 -5.063 1.00 0.00 C ATOM 1611 O ALA B 19 2.384 -5.145 -6.054 1.00 0.00 O ATOM 1612 CB ALA B 19 2.736 -3.964 -3.186 1.00 0.00 C ATOM 0 H ALA B 19 0.609 -4.446 -2.266 1.00 0.00 H new ATOM 0 HA ALA B 19 1.375 -3.194 -4.748 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.637 -3.896 -3.796 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.655 -3.077 -2.558 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.792 -4.851 -2.555 1.00 0.00 H new ATOM 1618 N ASP B 20 1.059 -6.404 -4.754 1.00 0.00 N ATOM 1619 CA ASP B 20 1.058 -7.637 -5.527 1.00 0.00 C ATOM 1620 C ASP B 20 0.512 -7.354 -6.940 1.00 0.00 C ATOM 1621 O ASP B 20 -0.561 -6.753 -7.065 1.00 0.00 O ATOM 1622 CB ASP B 20 0.264 -8.677 -4.722 1.00 0.00 C ATOM 1623 CG ASP B 20 0.166 -10.079 -5.327 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.572 -10.284 -6.318 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.660 -11.014 -4.661 1.00 0.00 O ATOM 0 H ASP B 20 0.517 -6.497 -3.895 1.00 0.00 H new ATOM 0 HA ASP B 20 2.057 -8.043 -5.686 1.00 0.00 H new ATOM 0 HB2 ASP B 20 0.717 -8.763 -3.734 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.747 -8.297 -4.577 1.00 0.00 H new ATOM 1630 N PRO B 21 1.240 -7.802 -7.980 1.00 0.00 N ATOM 1631 CA PRO B 21 1.101 -7.411 -9.385 1.00 0.00 C ATOM 1632 C PRO B 21 -0.335 -7.461 -9.905 1.00 0.00 C ATOM 1633 O PRO B 21 -1.038 -6.444 -9.947 1.00 0.00 O ATOM 1634 CB PRO B 21 2.056 -8.361 -10.130 1.00 0.00 C ATOM 1635 CG PRO B 21 2.082 -9.594 -9.231 1.00 0.00 C ATOM 1636 CD PRO B 21 2.181 -8.909 -7.886 1.00 0.00 C ATOM 0 HA PRO B 21 1.358 -6.363 -9.539 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.692 -8.598 -11.130 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.048 -7.926 -10.247 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.183 -10.203 -9.327 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.932 -10.245 -9.435 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.919 -9.587 -7.073 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.194 -8.556 -7.692 1.00 0.00 H new ATOM 1644 N THR B 22 -0.776 -8.656 -10.305 1.00 0.00 N ATOM 1645 CA THR B 22 -2.124 -8.900 -10.790 1.00 0.00 C ATOM 1646 C THR B 22 -3.156 -8.544 -9.728 1.00 0.00 C ATOM 1647 O THR B 22 -4.207 -8.055 -10.125 1.00 0.00 O ATOM 1648 CB THR B 22 -2.237 -10.348 -11.264 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.251 -10.589 -12.236 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.603 -10.678 -11.858 1.00 0.00 C ATOM 0 H THR B 22 -0.191 -9.492 -10.298 1.00 0.00 H new ATOM 0 HA THR B 22 -2.332 -8.254 -11.643 1.00 0.00 H new ATOM 0 HB THR B 22 -2.101 -10.984 -10.389 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.316 -11.517 -12.544 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.619 -11.721 -12.176 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.375 -10.516 -11.106 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.791 -10.034 -12.717 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.889 -8.701 -8.417 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.872 -8.376 -7.369 1.00 0.00 C ATOM 1660 C ARG B 23 -4.284 -6.910 -7.324 1.00 0.00 C ATOM 1661 O ARG B 23 -5.481 -6.648 -7.210 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.398 -8.777 -5.974 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.738 -10.243 -5.713 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.591 -10.600 -4.233 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.261 -11.110 -3.904 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.898 -11.572 -2.717 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -2.721 -11.561 -1.694 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.699 -12.067 -2.525 1.00 0.00 N ATOM 0 H ARG B 23 -2.000 -9.051 -8.060 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.743 -8.966 -7.654 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.322 -8.623 -5.887 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -3.872 -8.145 -5.223 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.759 -10.443 -6.037 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.084 -10.880 -6.308 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.796 -9.717 -3.628 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -4.338 -11.348 -3.968 1.00 0.00 H new ATOM 0 HE ARG B 23 -1.560 -11.110 -4.645 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -3.665 -11.191 -1.803 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -2.416 -11.923 -0.790 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -0.031 -12.100 -3.296 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -0.434 -12.419 -1.605 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.341 -5.975 -7.464 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.631 -4.543 -7.578 1.00 0.00 C ATOM 1684 C CYS B 24 -4.664 -4.291 -8.693 1.00 0.00 C ATOM 1685 O CYS B 24 -5.718 -3.694 -8.475 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.296 -3.822 -7.838 1.00 0.00 C ATOM 1687 SG CYS B 24 -2.457 -2.065 -7.424 1.00 0.00 S ATOM 0 H CYS B 24 -2.345 -6.193 -7.502 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.075 -4.155 -6.661 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.505 -4.275 -7.240 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.009 -3.934 -8.884 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.112 -1.878 -6.185 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.430 -4.900 -9.862 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.342 -4.873 -11.009 1.00 0.00 C ATOM 1695 C ARG B 25 -6.658 -5.642 -10.748 1.00 0.00 C ATOM 1696 O ARG B 25 -7.714 -5.102 -11.073 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.543 -5.353 -12.239 1.00 0.00 C ATOM 1698 CG ARG B 25 -5.115 -5.061 -13.639 1.00 0.00 C ATOM 1699 CD ARG B 25 -5.653 -3.637 -13.857 1.00 0.00 C ATOM 1700 NE ARG B 25 -7.124 -3.602 -13.744 1.00 0.00 N ATOM 1701 CZ ARG B 25 -7.992 -3.857 -14.723 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -7.608 -4.072 -15.966 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -9.284 -3.921 -14.475 1.00 0.00 N ATOM 0 H ARG B 25 -3.581 -5.437 -10.039 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.696 -3.860 -11.198 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.550 -4.907 -12.186 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -4.413 -6.432 -12.151 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.335 -5.252 -14.377 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -5.921 -5.768 -13.837 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -5.213 -2.962 -13.123 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -5.352 -3.278 -14.841 1.00 0.00 H new ATOM 0 HE ARG B 25 -7.512 -3.360 -12.832 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -6.617 -4.046 -16.205 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -8.302 -4.264 -16.688 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -9.629 -3.775 -13.526 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -9.939 -4.117 -15.232 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.629 -6.830 -10.122 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.802 -7.651 -9.726 1.00 0.00 C ATOM 1719 C ILE B 26 -8.764 -6.827 -8.909 1.00 0.00 C ATOM 1720 O ILE B 26 -9.944 -6.771 -9.225 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.405 -8.923 -8.920 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.557 -9.896 -9.765 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.630 -9.611 -8.293 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.096 -11.303 -10.047 1.00 0.00 C ATOM 0 H ILE B 26 -5.747 -7.272 -9.862 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.276 -7.980 -10.651 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.775 -8.595 -8.093 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.368 -9.418 -10.726 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.593 -10.007 -9.269 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.308 -10.493 -7.740 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.128 -8.919 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.323 -9.909 -9.080 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.376 -11.854 -10.653 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -7.254 -11.828 -9.105 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.042 -11.229 -10.584 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.247 -6.188 -7.868 1.00 0.00 N ATOM 1737 CA LEU B 27 -9.046 -5.483 -6.881 1.00 0.00 C ATOM 1738 C LEU B 27 -9.969 -4.447 -7.520 1.00 0.00 C ATOM 1739 O LEU B 27 -11.121 -4.357 -7.111 1.00 0.00 O ATOM 1740 CB LEU B 27 -8.085 -4.865 -5.861 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.607 -5.855 -4.786 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.466 -5.211 -4.000 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.752 -6.164 -3.810 1.00 0.00 C ATOM 0 H LEU B 27 -7.244 -6.146 -7.685 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.716 -6.180 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.218 -4.466 -6.387 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.577 -4.023 -5.374 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.277 -6.776 -5.266 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.117 -5.903 -3.233 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.645 -4.975 -4.677 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.821 -4.295 -3.528 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.405 -6.866 -3.052 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -9.078 -5.242 -3.328 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.587 -6.603 -4.356 1.00 0.00 H new ATOM 1755 N VAL B 28 -9.528 -3.749 -8.569 1.00 0.00 N ATOM 1756 CA VAL B 28 -10.363 -2.759 -9.277 1.00 0.00 C ATOM 1757 C VAL B 28 -11.591 -3.392 -9.960 1.00 0.00 C ATOM 1758 O VAL B 28 -12.575 -2.701 -10.197 1.00 0.00 O ATOM 1759 CB VAL B 28 -9.593 -1.809 -10.229 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -8.151 -1.554 -9.769 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -9.547 -2.281 -11.688 1.00 0.00 C ATOM 0 H VAL B 28 -8.589 -3.848 -8.955 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.730 -2.113 -8.480 1.00 0.00 H new ATOM 0 HB VAL B 28 -10.171 -0.886 -10.184 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.658 -0.882 -10.472 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -8.160 -1.099 -8.778 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.609 -2.499 -9.730 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.990 -1.560 -12.286 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -9.056 -3.253 -11.741 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -10.562 -2.366 -12.075 1.00 0.00 H new ATOM 1771 N ALA B 29 -11.554 -4.702 -10.247 1.00 0.00 N ATOM 1772 CA ALA B 29 -12.679 -5.480 -10.775 1.00 0.00 C ATOM 1773 C ALA B 29 -13.654 -5.996 -9.698 1.00 0.00 C ATOM 1774 O ALA B 29 -14.681 -6.626 -9.971 1.00 0.00 O ATOM 1775 CB ALA B 29 -12.098 -6.638 -11.605 1.00 0.00 C ATOM 0 H ALA B 29 -10.713 -5.264 -10.113 1.00 0.00 H new ATOM 0 HA ALA B 29 -13.288 -4.819 -11.392 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -12.912 -7.237 -12.013 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -11.499 -6.235 -12.422 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -11.471 -7.263 -10.969 1.00 0.00 H new ATOM 1781 N LEU B 30 -13.301 -5.766 -8.439 1.00 0.00 N ATOM 1782 CA LEU B 30 -14.156 -5.987 -7.281 1.00 0.00 C ATOM 1783 C LEU B 30 -14.679 -4.694 -6.651 1.00 0.00 C ATOM 1784 O LEU B 30 -15.637 -4.695 -5.886 1.00 0.00 O ATOM 1785 CB LEU B 30 -13.347 -6.801 -6.300 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.463 -8.336 -6.483 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.044 -8.910 -7.794 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -12.051 -8.887 -6.442 1.00 0.00 C ATOM 0 H LEU B 30 -12.379 -5.408 -8.189 1.00 0.00 H new ATOM 0 HA LEU B 30 -15.058 -6.515 -7.589 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.299 -6.516 -6.389 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.662 -6.544 -5.289 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.165 -8.620 -5.699 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.048 -9.999 -7.744 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -15.064 -8.549 -7.929 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -13.431 -8.588 -8.636 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -12.079 -9.969 -6.567 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -11.464 -8.444 -7.246 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -11.593 -8.644 -5.483 1.00 0.00 H new ATOM 1800 N LEU B 31 -13.992 -3.617 -6.961 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.405 -2.231 -6.793 1.00 0.00 C ATOM 1802 C LEU B 31 -15.626 -1.959 -7.696 1.00 0.00 C ATOM 1803 O LEU B 31 -16.634 -1.428 -7.243 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.214 -1.403 -7.287 1.00 0.00 C ATOM 1805 CG LEU B 31 -12.875 -0.132 -6.508 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -11.693 0.459 -7.269 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.036 0.865 -6.419 1.00 0.00 C ATOM 0 H LEU B 31 -13.059 -3.687 -7.368 1.00 0.00 H new ATOM 0 HA LEU B 31 -14.676 -1.994 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.333 -2.045 -7.286 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.404 -1.123 -8.323 1.00 0.00 H new ATOM 0 HG LEU B 31 -12.651 -0.359 -5.466 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -11.373 1.382 -6.785 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -10.869 -0.254 -7.272 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -11.991 0.673 -8.295 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -13.721 1.741 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.332 1.170 -7.423 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -14.882 0.394 -5.919 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.502 -2.380 -8.961 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.507 -2.361 -10.028 1.00 0.00 C ATOM 1821 C ASP B 32 -16.475 -3.719 -10.752 1.00 0.00 C ATOM 1822 O ASP B 32 -15.658 -3.966 -11.639 1.00 0.00 O ATOM 1823 CB ASP B 32 -16.223 -1.196 -10.995 1.00 0.00 C ATOM 1824 CG ASP B 32 -17.174 -1.182 -12.202 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -18.392 -0.988 -11.981 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -16.672 -1.356 -13.338 1.00 0.00 O ATOM 0 H ASP B 32 -14.622 -2.776 -9.291 1.00 0.00 H new ATOM 0 HA ASP B 32 -17.503 -2.206 -9.614 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -16.312 -0.252 -10.457 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -15.194 -1.265 -11.349 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.334 -4.638 -10.311 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.555 -5.943 -10.945 1.00 0.00 C ATOM 1833 C GLY B 33 -18.231 -6.923 -10.012 1.00 0.00 C ATOM 1834 O GLY B 33 -19.457 -7.003 -9.983 1.00 0.00 O ATOM 0 H GLY B 33 -17.911 -4.494 -9.482 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.167 -5.813 -11.838 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.599 -6.354 -11.271 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.431 -7.718 -9.298 1.00 0.00 N ATOM 1839 CA VAL B 34 -17.924 -8.716 -8.310 1.00 0.00 C ATOM 1840 C VAL B 34 -19.002 -9.653 -8.867 1.00 0.00 C ATOM 1841 O VAL B 34 -19.922 -10.035 -8.155 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.319 -8.098 -6.940 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.258 -7.145 -6.418 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.651 -7.317 -6.863 1.00 0.00 C ATOM 0 H VAL B 34 -16.415 -7.697 -9.380 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.059 -9.348 -8.109 1.00 0.00 H new ATOM 0 HB VAL B 34 -18.431 -9.001 -6.340 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -17.576 -6.737 -5.459 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.318 -7.682 -6.290 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.118 -6.332 -7.130 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -19.796 -6.944 -5.849 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.621 -6.478 -7.558 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.476 -7.978 -7.128 1.00 0.00 H new ATOM 1854 N CYS B 35 -18.908 -10.039 -10.141 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.887 -10.939 -10.756 1.00 0.00 C ATOM 1856 C CYS B 35 -19.595 -12.401 -10.426 1.00 0.00 C ATOM 1857 O CYS B 35 -20.351 -13.044 -9.712 1.00 0.00 O ATOM 1858 CB CYS B 35 -19.950 -10.717 -12.277 1.00 0.00 C ATOM 1859 SG CYS B 35 -19.708 -8.984 -12.770 1.00 0.00 S ATOM 0 H CYS B 35 -18.161 -9.741 -10.769 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.864 -10.702 -10.335 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.189 -11.332 -12.757 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.917 -11.059 -12.646 1.00 0.00 H new ATOM 0 HG CYS B 35 -19.764 -8.222 -11.718 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.478 -12.916 -10.939 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.113 -14.331 -10.811 1.00 0.00 C ATOM 1867 C TYR B 36 -16.586 -14.494 -10.745 1.00 0.00 C ATOM 1868 O TYR B 36 -15.894 -13.664 -11.339 1.00 0.00 O ATOM 1869 CB TYR B 36 -18.654 -15.162 -12.006 1.00 0.00 C ATOM 1870 CG TYR B 36 -19.829 -14.615 -12.806 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -21.125 -14.593 -12.257 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -19.627 -14.154 -14.125 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -22.210 -14.091 -13.003 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -20.704 -13.651 -14.876 1.00 0.00 C ATOM 1875 CZ TYR B 36 -22.003 -13.620 -14.319 1.00 0.00 C ATOM 1876 OH TYR B 36 -23.045 -13.139 -15.051 1.00 0.00 O ATOM 0 H TYR B 36 -17.796 -12.363 -11.458 1.00 0.00 H new ATOM 0 HA TYR B 36 -18.562 -14.698 -9.888 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -17.828 -15.321 -12.699 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -18.942 -16.141 -11.624 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -21.289 -14.964 -11.256 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -18.639 -14.188 -14.560 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -23.199 -14.066 -12.569 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.539 -13.288 -15.880 1.00 0.00 H new ATOM 0 HH TYR B 36 -22.723 -12.857 -15.933 1.00 0.00 H new ATOM 1886 N PRO B 37 -16.044 -15.595 -10.182 1.00 0.00 N ATOM 1887 CA PRO B 37 -14.612 -15.911 -10.246 1.00 0.00 C ATOM 1888 C PRO B 37 -14.052 -16.059 -11.671 1.00 0.00 C ATOM 1889 O PRO B 37 -12.837 -16.056 -11.831 1.00 0.00 O ATOM 1890 CB PRO B 37 -14.429 -17.213 -9.459 1.00 0.00 C ATOM 1891 CG PRO B 37 -15.823 -17.839 -9.426 1.00 0.00 C ATOM 1892 CD PRO B 37 -16.757 -16.634 -9.449 1.00 0.00 C ATOM 0 HA PRO B 37 -14.050 -15.077 -9.825 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -13.709 -17.872 -9.944 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -14.057 -17.020 -8.453 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -15.990 -18.492 -10.283 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -15.970 -18.443 -8.531 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -17.701 -16.879 -9.936 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -16.997 -16.305 -8.438 1.00 0.00 H new ATOM 1900 N GLY B 38 -14.897 -16.185 -12.703 1.00 0.00 N ATOM 1901 CA GLY B 38 -14.473 -16.122 -14.106 1.00 0.00 C ATOM 1902 C GLY B 38 -14.575 -14.739 -14.765 1.00 0.00 C ATOM 1903 O GLY B 38 -14.007 -14.564 -15.837 1.00 0.00 O ATOM 0 H GLY B 38 -15.899 -16.334 -12.586 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.439 -16.461 -14.171 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.075 -16.825 -14.682 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.283 -13.760 -14.178 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.585 -12.488 -14.857 1.00 0.00 C ATOM 1909 C GLN B 39 -14.340 -11.625 -15.040 1.00 0.00 C ATOM 1910 O GLN B 39 -14.204 -10.928 -16.042 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.688 -11.717 -14.102 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.222 -10.824 -12.927 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.666 -9.444 -13.300 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -14.669 -9.002 -12.766 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.268 -8.710 -14.208 1.00 0.00 N ATOM 0 H GLN B 39 -15.658 -13.825 -13.232 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.953 -12.730 -15.854 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.218 -11.090 -14.819 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.408 -12.440 -13.717 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -17.065 -10.682 -12.251 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.455 -11.363 -12.371 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -17.107 -9.059 -14.671 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -15.896 -7.791 -14.450 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.425 -11.697 -14.071 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.254 -10.843 -14.003 1.00 0.00 C ATOM 1926 C LEU B 40 -11.299 -11.147 -15.164 1.00 0.00 C ATOM 1927 O LEU B 40 -10.485 -10.317 -15.529 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.549 -10.965 -12.636 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.418 -11.193 -11.379 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -12.769 -12.673 -11.136 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.659 -10.715 -10.138 1.00 0.00 C ATOM 0 H LEU B 40 -13.485 -12.364 -13.302 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.580 -9.808 -14.101 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.838 -11.788 -12.702 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.970 -10.055 -12.479 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.340 -10.637 -11.551 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.380 -12.759 -10.238 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.323 -13.061 -11.991 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.852 -13.248 -11.007 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.273 -10.876 -9.252 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.729 -11.275 -10.042 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.434 -9.653 -10.236 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.421 -12.311 -15.800 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.520 -12.703 -16.887 1.00 0.00 C ATOM 1945 C ALA B 41 -10.579 -11.718 -18.078 1.00 0.00 C ATOM 1946 O ALA B 41 -9.549 -11.381 -18.660 1.00 0.00 O ATOM 1947 CB ALA B 41 -10.857 -14.141 -17.298 1.00 0.00 C ATOM 0 H ALA B 41 -12.138 -13.003 -15.581 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.489 -12.663 -16.537 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.197 -14.452 -18.107 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.722 -14.805 -16.444 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -11.892 -14.190 -17.636 1.00 0.00 H new ATOM 1953 N ALA B 42 -11.775 -11.197 -18.389 1.00 0.00 N ATOM 1954 CA ALA B 42 -11.950 -10.120 -19.364 1.00 0.00 C ATOM 1955 C ALA B 42 -11.530 -8.763 -18.780 1.00 0.00 C ATOM 1956 O ALA B 42 -10.776 -8.023 -19.402 1.00 0.00 O ATOM 1957 CB ALA B 42 -13.416 -10.115 -19.817 1.00 0.00 C ATOM 0 H ALA B 42 -12.648 -11.514 -17.968 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.305 -10.293 -20.226 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -13.569 -9.319 -20.545 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -13.659 -11.075 -20.273 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.062 -9.948 -18.955 1.00 0.00 H new ATOM 1963 N HIS B 43 -11.973 -8.446 -17.561 1.00 0.00 N ATOM 1964 CA HIS B 43 -11.711 -7.158 -16.901 1.00 0.00 C ATOM 1965 C HIS B 43 -10.209 -6.846 -16.724 1.00 0.00 C ATOM 1966 O HIS B 43 -9.781 -5.688 -16.741 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.409 -7.213 -15.534 1.00 0.00 C ATOM 1968 CG HIS B 43 -12.856 -5.883 -15.000 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -12.434 -4.616 -15.414 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -13.804 -5.749 -14.037 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -13.184 -3.749 -14.707 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -14.017 -4.400 -13.876 1.00 0.00 N ATOM 0 H HIS B 43 -12.532 -9.084 -16.994 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.096 -6.355 -17.530 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -13.277 -7.868 -15.611 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.730 -7.668 -14.813 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -14.296 -6.547 -13.501 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -13.124 -2.674 -14.796 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -14.688 -3.970 -13.239 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.416 -7.902 -16.532 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.972 -7.890 -16.281 1.00 0.00 C ATOM 1982 C LEU B 44 -7.152 -8.174 -17.541 1.00 0.00 C ATOM 1983 O LEU B 44 -5.969 -7.845 -17.551 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.657 -8.917 -15.176 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.476 -8.666 -13.895 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -8.256 -9.706 -12.836 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.316 -7.270 -13.296 1.00 0.00 C ATOM 0 H LEU B 44 -9.789 -8.851 -16.549 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.687 -6.889 -15.958 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.864 -9.921 -15.546 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.594 -8.878 -14.939 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.505 -8.742 -14.246 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.862 -9.469 -11.962 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.542 -10.684 -13.222 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.203 -9.721 -12.554 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.929 -7.187 -12.399 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.270 -7.102 -13.038 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.634 -6.523 -14.023 1.00 0.00 H new ATOM 1999 N GLY B 45 -7.757 -8.787 -18.567 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.072 -9.296 -19.760 1.00 0.00 C ATOM 2001 C GLY B 45 -6.246 -10.555 -19.483 1.00 0.00 C ATOM 2002 O GLY B 45 -5.401 -10.918 -20.300 1.00 0.00 O ATOM 0 H GLY B 45 -8.764 -8.946 -18.590 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -7.811 -9.515 -20.531 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.418 -8.519 -20.156 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.443 -11.200 -18.326 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.579 -12.278 -17.835 1.00 0.00 C ATOM 2008 C LEU B 46 -6.343 -13.597 -17.675 1.00 0.00 C ATOM 2009 O LEU B 46 -7.545 -13.614 -17.433 1.00 0.00 O ATOM 2010 CB LEU B 46 -4.915 -11.813 -16.525 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.846 -10.715 -16.739 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.452 -10.076 -15.402 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.584 -11.268 -17.423 1.00 0.00 C ATOM 0 H LEU B 46 -7.217 -10.984 -17.698 1.00 0.00 H new ATOM 0 HA LEU B 46 -4.801 -12.487 -18.569 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.683 -11.436 -15.850 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -4.453 -12.670 -16.035 1.00 0.00 H new ATOM 0 HG LEU B 46 -4.291 -9.963 -17.391 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.699 -9.307 -15.574 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.331 -9.627 -14.940 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.045 -10.840 -14.740 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.859 -10.464 -17.554 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -2.148 -12.052 -16.804 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.849 -11.680 -18.397 1.00 0.00 H new ATOM 2025 N THR B 47 -5.641 -14.730 -17.816 1.00 0.00 N ATOM 2026 CA THR B 47 -6.276 -16.061 -17.836 1.00 0.00 C ATOM 2027 C THR B 47 -6.957 -16.327 -16.501 1.00 0.00 C ATOM 2028 O THR B 47 -6.425 -15.963 -15.451 1.00 0.00 O ATOM 2029 CB THR B 47 -5.315 -17.198 -18.233 1.00 0.00 C ATOM 2030 OG1 THR B 47 -4.558 -17.657 -17.136 1.00 0.00 O ATOM 2031 CG2 THR B 47 -4.316 -16.803 -19.320 1.00 0.00 C ATOM 0 H THR B 47 -4.626 -14.754 -17.919 1.00 0.00 H new ATOM 0 HA THR B 47 -7.030 -16.048 -18.623 1.00 0.00 H new ATOM 0 HB THR B 47 -5.975 -17.979 -18.611 1.00 0.00 H new ATOM 0 HG1 THR B 47 -3.963 -18.378 -17.428 1.00 0.00 H new ATOM 0 HG21 THR B 47 -3.672 -17.652 -19.548 1.00 0.00 H new ATOM 0 HG22 THR B 47 -4.855 -16.504 -20.219 1.00 0.00 H new ATOM 0 HG23 THR B 47 -3.707 -15.970 -18.969 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.092 -17.038 -16.508 1.00 0.00 N ATOM 2040 CA ARG B 48 -8.775 -17.399 -15.254 1.00 0.00 C ATOM 2041 C ARG B 48 -7.919 -18.280 -14.325 1.00 0.00 C ATOM 2042 O ARG B 48 -8.183 -18.339 -13.128 1.00 0.00 O ATOM 2043 CB ARG B 48 -10.183 -17.962 -15.496 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.234 -19.311 -16.227 1.00 0.00 C ATOM 2045 CD ARG B 48 -11.689 -19.780 -16.393 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.306 -20.177 -15.108 1.00 0.00 N ATOM 2047 CZ ARG B 48 -12.334 -21.404 -14.593 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -11.708 -22.415 -15.161 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -13.004 -21.641 -13.485 1.00 0.00 N ATOM 0 H ARG B 48 -8.553 -17.372 -17.354 1.00 0.00 H new ATOM 0 HA ARG B 48 -8.913 -16.466 -14.708 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.683 -18.070 -14.534 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -10.754 -17.234 -16.072 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -9.762 -19.219 -17.205 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -9.667 -20.056 -15.668 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -12.276 -18.979 -16.842 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -11.719 -20.623 -17.083 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.753 -19.439 -14.564 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -11.181 -22.270 -16.022 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -11.750 -23.343 -14.739 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -13.503 -20.883 -13.019 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -13.024 -22.582 -13.092 1.00 0.00 H new ATOM 2063 N SER B 49 -6.860 -18.912 -14.833 1.00 0.00 N ATOM 2064 CA SER B 49 -5.844 -19.602 -14.026 1.00 0.00 C ATOM 2065 C SER B 49 -4.924 -18.607 -13.299 1.00 0.00 C ATOM 2066 O SER B 49 -4.735 -18.731 -12.091 1.00 0.00 O ATOM 2067 CB SER B 49 -4.998 -20.530 -14.913 1.00 0.00 C ATOM 2068 OG SER B 49 -5.811 -21.306 -15.779 1.00 0.00 O ATOM 0 H SER B 49 -6.678 -18.961 -15.835 1.00 0.00 H new ATOM 0 HA SER B 49 -6.370 -20.192 -13.275 1.00 0.00 H new ATOM 0 HB2 SER B 49 -4.301 -19.935 -15.503 1.00 0.00 H new ATOM 0 HB3 SER B 49 -4.401 -21.190 -14.284 1.00 0.00 H new ATOM 0 HG SER B 49 -5.243 -21.884 -16.330 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.398 -17.593 -14.002 1.00 0.00 N ATOM 2075 CA ASN B 50 -3.585 -16.523 -13.408 1.00 0.00 C ATOM 2076 C ASN B 50 -4.425 -15.653 -12.449 1.00 0.00 C ATOM 2077 O ASN B 50 -4.017 -15.420 -11.310 1.00 0.00 O ATOM 2078 CB ASN B 50 -2.946 -15.692 -14.530 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.346 -14.389 -14.008 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -2.983 -13.358 -14.094 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.154 -14.396 -13.443 1.00 0.00 N ATOM 0 H ASN B 50 -4.527 -17.492 -15.009 1.00 0.00 H new ATOM 0 HA ASN B 50 -2.789 -16.963 -12.808 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -2.168 -16.279 -15.018 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.697 -15.467 -15.287 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.760 -13.531 -13.074 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -0.627 -15.267 -13.375 1.00 0.00 H new ATOM 2088 N VAL B 51 -5.634 -15.266 -12.875 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.616 -14.591 -12.028 1.00 0.00 C ATOM 2090 C VAL B 51 -6.987 -15.423 -10.794 1.00 0.00 C ATOM 2091 O VAL B 51 -7.072 -14.846 -9.718 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.860 -14.183 -12.866 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -9.144 -13.948 -12.056 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.551 -12.955 -13.748 1.00 0.00 C ATOM 0 H VAL B 51 -5.958 -15.416 -13.830 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.160 -13.679 -11.642 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.068 -15.051 -13.492 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.953 -13.668 -12.730 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -9.413 -14.862 -11.526 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -8.978 -13.147 -11.336 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.437 -12.689 -14.325 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.264 -12.115 -13.115 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -6.733 -13.192 -14.428 1.00 0.00 H new ATOM 2104 N SER B 52 -7.150 -16.752 -10.880 1.00 0.00 N ATOM 2105 CA SER B 52 -7.390 -17.555 -9.663 1.00 0.00 C ATOM 2106 C SER B 52 -6.179 -17.591 -8.733 1.00 0.00 C ATOM 2107 O SER B 52 -6.343 -17.486 -7.519 1.00 0.00 O ATOM 2108 CB SER B 52 -7.739 -19.010 -9.959 1.00 0.00 C ATOM 2109 OG SER B 52 -8.935 -19.128 -10.708 1.00 0.00 O ATOM 0 H SER B 52 -7.122 -17.284 -11.750 1.00 0.00 H new ATOM 0 HA SER B 52 -8.233 -17.052 -9.189 1.00 0.00 H new ATOM 0 HB2 SER B 52 -6.920 -19.474 -10.508 1.00 0.00 H new ATOM 0 HB3 SER B 52 -7.843 -19.556 -9.021 1.00 0.00 H new ATOM 0 HG SER B 52 -8.729 -19.074 -11.665 1.00 0.00 H new ATOM 2115 N ASN B 53 -4.968 -17.722 -9.287 1.00 0.00 N ATOM 2116 CA ASN B 53 -3.724 -17.717 -8.518 1.00 0.00 C ATOM 2117 C ASN B 53 -3.575 -16.421 -7.712 1.00 0.00 C ATOM 2118 O ASN B 53 -3.355 -16.459 -6.502 1.00 0.00 O ATOM 2119 CB ASN B 53 -2.538 -17.912 -9.475 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.143 -19.379 -9.578 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.312 -19.879 -8.838 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -2.751 -20.122 -10.482 1.00 0.00 N ATOM 0 H ASN B 53 -4.826 -17.835 -10.291 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.745 -18.539 -7.802 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -2.800 -17.534 -10.463 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -1.687 -17.328 -9.126 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -2.526 -21.114 -10.562 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -3.446 -19.705 -11.101 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.795 -15.264 -8.340 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.759 -13.992 -7.618 1.00 0.00 C ATOM 2131 C HIS B 54 -5.018 -13.742 -6.754 1.00 0.00 C ATOM 2132 O HIS B 54 -4.894 -13.091 -5.716 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.357 -12.875 -8.592 1.00 0.00 C ATOM 2134 CG HIS B 54 -1.865 -12.932 -8.866 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -0.854 -12.403 -8.092 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -1.253 -13.579 -9.908 1.00 0.00 C ATOM 2137 CE1 HIS B 54 0.323 -12.759 -8.638 1.00 0.00 C ATOM 2138 NE2 HIS B 54 0.128 -13.480 -9.748 1.00 0.00 N ATOM 0 H HIS B 54 -3.998 -15.182 -9.336 1.00 0.00 H new ATOM 0 HA HIS B 54 -2.984 -14.018 -6.852 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -3.910 -12.980 -9.525 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -3.621 -11.904 -8.172 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -0.977 -11.839 -7.251 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.758 -14.082 -10.719 1.00 0.00 H new ATOM 0 HE1 HIS B 54 1.291 -12.499 -8.236 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.198 -14.308 -7.066 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.331 -14.314 -6.121 1.00 0.00 C ATOM 2148 C LEU B 55 -7.019 -15.167 -4.888 1.00 0.00 C ATOM 2149 O LEU B 55 -7.559 -14.894 -3.825 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.636 -14.843 -6.758 1.00 0.00 C ATOM 2151 CG LEU B 55 -9.394 -13.852 -7.661 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.495 -14.606 -8.421 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.037 -12.733 -6.833 1.00 0.00 C ATOM 0 H LEU B 55 -6.392 -14.764 -7.958 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.479 -13.273 -5.833 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.397 -15.730 -7.345 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.305 -15.161 -5.958 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.684 -13.406 -8.357 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.036 -13.910 -9.063 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.045 -15.388 -9.032 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.187 -15.055 -7.708 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -10.566 -12.048 -7.496 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.741 -13.165 -6.122 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.262 -12.189 -6.292 1.00 0.00 H new ATOM 2165 N SER B 56 -6.191 -16.203 -4.998 1.00 0.00 N ATOM 2166 CA SER B 56 -5.955 -17.181 -3.926 1.00 0.00 C ATOM 2167 C SER B 56 -5.596 -16.533 -2.576 1.00 0.00 C ATOM 2168 O SER B 56 -6.349 -16.663 -1.611 1.00 0.00 O ATOM 2169 CB SER B 56 -4.901 -18.201 -4.371 1.00 0.00 C ATOM 2170 OG SER B 56 -5.084 -19.404 -3.651 1.00 0.00 O ATOM 0 H SER B 56 -5.655 -16.394 -5.844 1.00 0.00 H new ATOM 0 HA SER B 56 -6.896 -17.702 -3.749 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.987 -18.387 -5.441 1.00 0.00 H new ATOM 0 HB3 SER B 56 -3.900 -17.807 -4.196 1.00 0.00 H new ATOM 0 HG SER B 56 -4.413 -20.060 -3.934 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.526 -15.734 -2.534 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.164 -14.926 -1.366 1.00 0.00 C ATOM 2178 C CYS B 57 -4.998 -13.619 -1.260 1.00 0.00 C ATOM 2179 O CYS B 57 -4.936 -12.965 -0.227 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.637 -14.733 -1.413 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.760 -13.981 0.029 1.00 0.00 S ATOM 0 H CYS B 57 -3.881 -15.629 -3.317 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.419 -15.434 -0.436 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.191 -15.712 -1.590 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.414 -14.119 -2.285 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.799 -13.204 -2.255 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.790 -12.121 -2.050 1.00 0.00 C ATOM 2188 C LEU B 58 -7.879 -12.613 -1.079 1.00 0.00 C ATOM 2189 O LEU B 58 -8.357 -11.862 -0.231 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.408 -11.678 -3.401 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.768 -10.180 -3.495 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.528 -9.286 -3.544 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.585 -9.921 -4.763 1.00 0.00 C ATOM 0 H LEU B 58 -5.785 -13.592 -3.198 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.293 -11.252 -1.619 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.707 -11.918 -4.200 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.309 -12.265 -3.581 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.340 -9.937 -2.599 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.834 -8.242 -3.610 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.937 -9.434 -2.640 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.928 -9.544 -4.417 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.836 -8.862 -4.824 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -8.000 -10.206 -5.637 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.502 -10.510 -4.732 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.244 -13.894 -1.208 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.164 -14.642 -0.346 1.00 0.00 C ATOM 2207 C ARG B 59 -8.453 -15.164 0.917 1.00 0.00 C ATOM 2208 O ARG B 59 -9.106 -15.684 1.814 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.750 -15.816 -1.166 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.418 -15.421 -2.507 1.00 0.00 C ATOM 2211 CD ARG B 59 -10.505 -16.578 -3.520 1.00 0.00 C ATOM 2212 NE ARG B 59 -11.134 -17.814 -3.000 1.00 0.00 N ATOM 2213 CZ ARG B 59 -10.552 -18.994 -2.797 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -9.267 -19.185 -3.012 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -11.271 -20.022 -2.383 1.00 0.00 N ATOM 0 H ARG B 59 -7.881 -14.472 -1.966 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.963 -13.981 -0.011 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -8.950 -16.527 -1.373 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.486 -16.334 -0.552 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.423 -15.049 -2.306 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.857 -14.600 -2.954 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.068 -16.239 -4.390 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -9.499 -16.817 -3.865 1.00 0.00 H new ATOM 0 HE ARG B 59 -12.126 -17.754 -2.771 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -8.686 -18.416 -3.344 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -8.853 -20.102 -2.846 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -12.272 -19.911 -2.219 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.826 -20.926 -2.227 1.00 0.00 H new ATOM 2229 N GLY B 60 -7.122 -15.013 0.990 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.287 -15.316 2.150 1.00 0.00 C ATOM 2231 C GLY B 60 -6.123 -14.095 3.051 1.00 0.00 C ATOM 2232 O GLY B 60 -6.646 -14.092 4.154 1.00 0.00 O ATOM 0 H GLY B 60 -6.578 -14.660 0.203 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.733 -16.132 2.718 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -5.307 -15.658 1.816 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.478 -13.042 2.534 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.315 -11.708 3.111 1.00 0.00 C ATOM 2238 C CYS B 61 -6.644 -10.926 3.368 1.00 0.00 C ATOM 2239 O CYS B 61 -6.604 -9.703 3.488 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.339 -10.961 2.163 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.602 -11.504 2.235 1.00 0.00 S ATOM 0 H CYS B 61 -5.020 -13.110 1.625 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.915 -11.791 4.122 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.695 -11.077 1.139 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.378 -9.897 2.395 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.814 -11.584 3.325 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.145 -11.024 3.622 1.00 0.00 C ATOM 2248 C GLY B 62 -9.670 -9.989 2.626 1.00 0.00 C ATOM 2249 O GLY B 62 -10.805 -9.548 2.753 1.00 0.00 O ATOM 0 H GLY B 62 -7.861 -12.570 3.069 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.860 -11.845 3.675 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.113 -10.565 4.610 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.890 -9.631 1.604 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.193 -8.594 0.617 1.00 0.00 C ATOM 2255 C LEU B 63 -10.488 -8.849 -0.174 1.00 0.00 C ATOM 2256 O LEU B 63 -11.151 -7.902 -0.599 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.982 -8.435 -0.295 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.839 -7.661 0.383 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.634 -7.775 -0.520 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -7.160 -6.175 0.605 1.00 0.00 C ATOM 0 H LEU B 63 -7.988 -10.077 1.435 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.387 -7.662 1.147 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.624 -9.420 -0.594 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.281 -7.914 -1.205 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.669 -8.090 1.371 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.795 -7.238 -0.077 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.369 -8.825 -0.642 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.867 -7.344 -1.494 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -6.312 -5.688 1.087 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -7.355 -5.698 -0.355 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -8.040 -6.084 1.241 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.849 -10.123 -0.334 1.00 0.00 N ATOM 2273 CA VAL B 64 -12.120 -10.579 -0.924 1.00 0.00 C ATOM 2274 C VAL B 64 -12.835 -11.602 -0.055 1.00 0.00 C ATOM 2275 O VAL B 64 -12.239 -12.567 0.419 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.966 -11.208 -2.326 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -12.073 -10.148 -3.415 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.706 -12.020 -2.471 1.00 0.00 C ATOM 0 H VAL B 64 -10.248 -10.896 -0.049 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.705 -9.663 -1.000 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.793 -11.908 -2.446 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.961 -10.618 -4.392 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -13.047 -9.662 -3.355 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -11.288 -9.405 -3.278 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.655 -12.436 -3.477 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.840 -11.382 -2.298 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.710 -12.831 -1.743 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.147 -11.410 0.044 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.112 -12.319 0.669 1.00 0.00 C ATOM 2290 C VAL B 65 -16.092 -12.834 -0.390 1.00 0.00 C ATOM 2291 O VAL B 65 -16.567 -12.087 -1.247 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.837 -11.595 1.829 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -17.003 -12.410 2.419 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.814 -11.295 2.938 1.00 0.00 C ATOM 0 H VAL B 65 -14.593 -10.572 -0.329 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.596 -13.181 1.091 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.267 -10.679 1.424 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.468 -11.846 3.228 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.741 -12.605 1.641 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.626 -13.356 2.807 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.311 -10.784 3.763 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.382 -12.229 3.297 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.023 -10.659 2.541 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.381 -14.138 -0.339 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.328 -14.807 -1.238 1.00 0.00 C ATOM 2306 C ALA B 66 -18.781 -14.671 -0.765 1.00 0.00 C ATOM 2307 O ALA B 66 -19.082 -14.619 0.435 1.00 0.00 O ATOM 2308 CB ALA B 66 -16.925 -16.278 -1.382 1.00 0.00 C ATOM 0 H ALA B 66 -15.956 -14.770 0.340 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.283 -14.318 -2.211 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.624 -16.783 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -15.919 -16.341 -1.796 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -16.945 -16.758 -0.404 1.00 0.00 H new ATOM 2314 N THR B 67 -19.694 -14.572 -1.733 1.00 0.00 N ATOM 2315 CA THR B 67 -21.131 -14.322 -1.545 1.00 0.00 C ATOM 2316 C THR B 67 -21.843 -14.811 -2.804 1.00 0.00 C ATOM 2317 O THR B 67 -21.203 -14.941 -3.836 1.00 0.00 O ATOM 2318 CB THR B 67 -21.364 -12.829 -1.239 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.795 -12.546 0.015 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.819 -12.388 -1.134 1.00 0.00 C ATOM 0 H THR B 67 -19.443 -14.668 -2.717 1.00 0.00 H new ATOM 0 HA THR B 67 -21.538 -14.863 -0.691 1.00 0.00 H new ATOM 0 HB THR B 67 -20.922 -12.300 -2.083 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.930 -11.599 0.229 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.861 -11.321 -0.917 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.328 -12.586 -2.077 1.00 0.00 H new ATOM 0 HG23 THR B 67 -23.310 -12.941 -0.333 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.140 -15.088 -2.755 1.00 0.00 N ATOM 2329 CA TYR B 68 -23.927 -15.366 -3.971 1.00 0.00 C ATOM 2330 C TYR B 68 -24.403 -14.067 -4.654 1.00 0.00 C ATOM 2331 O TYR B 68 -24.652 -13.063 -3.976 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.117 -16.268 -3.611 1.00 0.00 C ATOM 2333 CG TYR B 68 -24.857 -17.759 -3.729 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -24.318 -18.480 -2.645 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -25.196 -18.436 -4.917 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -24.127 -19.872 -2.742 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -25.000 -19.826 -5.025 1.00 0.00 C ATOM 2338 CZ TYR B 68 -24.468 -20.549 -3.936 1.00 0.00 C ATOM 2339 OH TYR B 68 -24.274 -21.893 -4.041 1.00 0.00 O ATOM 0 H TYR B 68 -23.678 -15.128 -1.890 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.288 -15.881 -4.688 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.422 -16.049 -2.588 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -25.956 -16.010 -4.256 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -24.050 -17.963 -1.736 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -25.609 -17.886 -5.750 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -23.721 -20.422 -1.906 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -25.257 -20.339 -5.940 1.00 0.00 H new ATOM 0 HH TYR B 68 -24.563 -22.197 -4.927 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.452 -14.037 -5.988 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.161 -12.999 -6.753 1.00 0.00 C ATOM 2351 C GLU B 69 -26.628 -13.456 -6.942 1.00 0.00 C ATOM 2352 O GLU B 69 -27.181 -14.021 -6.000 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.351 -12.546 -7.991 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.055 -13.550 -9.119 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.217 -13.717 -10.094 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -25.808 -12.687 -10.464 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -25.596 -14.876 -10.371 1.00 0.00 O ATOM 0 H GLU B 69 -23.998 -14.736 -6.576 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.238 -12.054 -6.216 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -24.881 -11.704 -8.436 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.394 -12.167 -7.633 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.173 -13.220 -9.668 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -23.814 -14.519 -8.681 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.289 -13.239 -8.085 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.662 -13.711 -8.317 1.00 0.00 C ATOM 2366 C GLY B 70 -28.798 -15.234 -8.461 1.00 0.00 C ATOM 2367 O GLY B 70 -29.881 -15.767 -8.225 1.00 0.00 O ATOM 0 H GLY B 70 -26.889 -12.732 -8.875 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.291 -13.380 -7.491 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.047 -13.238 -9.220 1.00 0.00 H new ATOM 2371 N ARG B 71 -27.721 -15.943 -8.836 1.00 0.00 N ATOM 2372 CA ARG B 71 -27.693 -17.408 -9.011 1.00 0.00 C ATOM 2373 C ARG B 71 -26.289 -18.043 -8.937 1.00 0.00 C ATOM 2374 O ARG B 71 -26.188 -19.206 -8.534 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.401 -17.768 -10.342 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.748 -18.494 -10.140 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.654 -20.026 -10.102 1.00 0.00 C ATOM 2378 NE ARG B 71 -28.598 -20.501 -9.196 1.00 0.00 N ATOM 2379 CZ ARG B 71 -28.245 -21.749 -8.940 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.953 -22.776 -9.354 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -27.138 -21.951 -8.259 1.00 0.00 N ATOM 0 H ARG B 71 -26.821 -15.504 -9.031 1.00 0.00 H new ATOM 0 HA ARG B 71 -28.226 -17.836 -8.162 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -28.570 -16.856 -10.914 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -27.741 -18.400 -10.937 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -30.195 -18.148 -9.208 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -30.425 -18.205 -10.944 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -30.612 -20.438 -9.786 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -29.462 -20.400 -11.107 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.073 -19.778 -8.704 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -29.806 -22.624 -9.892 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -28.649 -23.725 -9.137 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -26.580 -21.157 -7.945 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -26.837 -22.902 -8.045 1.00 0.00 H new ATOM 2395 N GLN B 72 -25.232 -17.340 -9.325 1.00 0.00 N ATOM 2396 CA GLN B 72 -23.826 -17.738 -9.220 1.00 0.00 C ATOM 2397 C GLN B 72 -23.204 -17.309 -7.886 1.00 0.00 C ATOM 2398 O GLN B 72 -23.795 -16.537 -7.136 1.00 0.00 O ATOM 2399 CB GLN B 72 -23.034 -17.079 -10.369 1.00 0.00 C ATOM 2400 CG GLN B 72 -23.366 -17.665 -11.742 1.00 0.00 C ATOM 2401 CD GLN B 72 -23.044 -19.155 -11.808 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -22.130 -19.652 -11.169 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -23.815 -19.935 -12.530 1.00 0.00 N ATOM 0 H GLN B 72 -25.336 -16.418 -9.749 1.00 0.00 H new ATOM 0 HA GLN B 72 -23.781 -18.825 -9.280 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -23.241 -16.009 -10.378 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -21.967 -17.195 -10.180 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -24.423 -17.510 -11.959 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -22.802 -17.136 -12.510 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -24.583 -19.535 -13.069 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -23.646 -20.941 -12.551 1.00 0.00 H new ATOM 2412 N VAL B 73 -21.976 -17.770 -7.624 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.137 -17.259 -6.526 1.00 0.00 C ATOM 2414 C VAL B 73 -20.173 -16.195 -7.063 1.00 0.00 C ATOM 2415 O VAL B 73 -19.747 -16.256 -8.221 1.00 0.00 O ATOM 2416 CB VAL B 73 -20.380 -18.358 -5.750 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -21.347 -19.413 -5.192 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -19.282 -19.049 -6.581 1.00 0.00 C ATOM 0 H VAL B 73 -21.532 -18.510 -8.167 1.00 0.00 H new ATOM 0 HA VAL B 73 -21.813 -16.811 -5.797 1.00 0.00 H new ATOM 0 HB VAL B 73 -19.886 -17.844 -4.926 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -20.783 -20.173 -4.651 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.055 -18.935 -4.515 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -21.890 -19.880 -6.014 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -18.791 -19.810 -5.974 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -19.730 -19.517 -7.458 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -18.548 -18.309 -6.900 1.00 0.00 H new ATOM 2428 N ARG B 74 -19.809 -15.237 -6.207 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.044 -14.041 -6.542 1.00 0.00 C ATOM 2430 C ARG B 74 -17.987 -13.758 -5.485 1.00 0.00 C ATOM 2431 O ARG B 74 -18.082 -14.218 -4.348 1.00 0.00 O ATOM 2432 CB ARG B 74 -19.973 -12.834 -6.695 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.358 -12.065 -5.418 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.364 -10.949 -5.740 1.00 0.00 C ATOM 2435 NE ARG B 74 -22.577 -11.002 -4.903 1.00 0.00 N ATOM 2436 CZ ARG B 74 -23.370 -9.981 -4.598 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -23.061 -8.728 -4.875 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -24.522 -10.235 -4.014 1.00 0.00 N ATOM 0 H ARG B 74 -20.052 -15.279 -5.217 1.00 0.00 H new ATOM 0 HA ARG B 74 -18.541 -14.219 -7.492 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.500 -12.131 -7.381 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -20.892 -13.175 -7.172 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -20.790 -12.752 -4.690 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.465 -11.637 -4.962 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.879 -9.982 -5.606 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.651 -11.019 -6.789 1.00 0.00 H new ATOM 0 HE ARG B 74 -22.832 -11.913 -4.521 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -22.181 -8.511 -5.343 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -23.702 -7.977 -4.621 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -24.787 -11.198 -3.806 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -25.150 -9.469 -3.769 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.028 -12.917 -5.844 1.00 0.00 N ATOM 2453 CA TYR B 75 -15.983 -12.406 -4.963 1.00 0.00 C ATOM 2454 C TYR B 75 -16.088 -10.879 -4.890 1.00 0.00 C ATOM 2455 O TYR B 75 -16.157 -10.235 -5.929 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.646 -12.885 -5.539 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.389 -14.339 -5.176 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -13.977 -14.664 -3.868 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.670 -15.373 -6.091 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -13.839 -16.008 -3.475 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.542 -16.722 -5.701 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.120 -17.045 -4.391 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.986 -18.351 -4.018 1.00 0.00 O ATOM 0 H TYR B 75 -16.952 -12.556 -6.795 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.079 -12.772 -3.941 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.651 -12.772 -6.623 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -13.837 -12.262 -5.157 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -13.765 -13.875 -3.162 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.985 -15.131 -7.095 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -13.518 -16.247 -2.472 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -14.767 -17.510 -6.404 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.221 -18.932 -4.771 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.142 -10.313 -3.680 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.342 -8.883 -3.420 1.00 0.00 C ATOM 2475 C ALA B 76 -15.475 -8.412 -2.245 1.00 0.00 C ATOM 2476 O ALA B 76 -15.111 -9.230 -1.398 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.830 -8.648 -3.122 1.00 0.00 C ATOM 0 H ALA B 76 -16.044 -10.858 -2.823 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.043 -8.307 -4.296 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.999 -7.589 -2.926 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.426 -8.958 -3.980 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -18.122 -9.230 -2.248 1.00 0.00 H new ATOM 2483 N LEU B 77 -15.156 -7.114 -2.180 1.00 0.00 N ATOM 2484 CA LEU B 77 -14.331 -6.570 -1.107 1.00 0.00 C ATOM 2485 C LEU B 77 -15.014 -6.707 0.261 1.00 0.00 C ATOM 2486 O LEU B 77 -16.240 -6.673 0.367 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.957 -5.118 -1.438 1.00 0.00 C ATOM 2488 CG LEU B 77 -13.311 -4.941 -2.818 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -13.083 -3.453 -3.000 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -12.003 -5.714 -2.998 1.00 0.00 C ATOM 0 H LEU B 77 -15.461 -6.422 -2.864 1.00 0.00 H new ATOM 0 HA LEU B 77 -13.411 -7.150 -1.035 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.854 -4.501 -1.386 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.271 -4.747 -0.676 1.00 0.00 H new ATOM 0 HG LEU B 77 -13.979 -5.353 -3.575 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -12.623 -3.272 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -14.038 -2.930 -2.947 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.424 -3.087 -2.212 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.610 -5.536 -3.999 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -11.277 -5.377 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -12.189 -6.780 -2.865 1.00 0.00 H new ATOM 2502 N ALA B 78 -14.195 -6.875 1.300 1.00 0.00 N ATOM 2503 CA ALA B 78 -14.665 -7.170 2.660 1.00 0.00 C ATOM 2504 C ALA B 78 -15.321 -5.976 3.380 1.00 0.00 C ATOM 2505 O ALA B 78 -16.190 -6.180 4.223 1.00 0.00 O ATOM 2506 CB ALA B 78 -13.485 -7.724 3.463 1.00 0.00 C ATOM 0 H ALA B 78 -13.180 -6.810 1.224 1.00 0.00 H new ATOM 0 HA ALA B 78 -15.464 -7.907 2.581 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -13.810 -7.951 4.478 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -13.117 -8.633 2.988 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -12.687 -6.983 3.495 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.931 -4.743 3.041 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.423 -3.506 3.654 1.00 0.00 C ATOM 2514 C ASP B 79 -15.022 -2.267 2.836 1.00 0.00 C ATOM 2515 O ASP B 79 -14.057 -2.259 2.064 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.941 -3.381 5.125 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.270 -2.026 5.771 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.439 -1.582 5.689 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.322 -1.311 6.163 1.00 0.00 O ATOM 0 H ASP B 79 -14.242 -4.574 2.308 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.512 -3.557 3.658 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.397 -4.175 5.716 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.863 -3.537 5.159 1.00 0.00 H new ATOM 2524 N SER B 80 -15.767 -1.191 3.091 1.00 0.00 N ATOM 2525 CA SER B 80 -15.516 0.193 2.699 1.00 0.00 C ATOM 2526 C SER B 80 -14.045 0.616 2.854 1.00 0.00 C ATOM 2527 O SER B 80 -13.529 1.324 1.993 1.00 0.00 O ATOM 2528 CB SER B 80 -16.414 1.095 3.565 1.00 0.00 C ATOM 2529 OG SER B 80 -16.102 1.020 4.951 1.00 0.00 O ATOM 0 H SER B 80 -16.634 -1.274 3.622 1.00 0.00 H new ATOM 0 HA SER B 80 -15.745 0.292 1.638 1.00 0.00 H new ATOM 0 HB2 SER B 80 -16.314 2.128 3.231 1.00 0.00 H new ATOM 0 HB3 SER B 80 -17.456 0.812 3.416 1.00 0.00 H new ATOM 0 HG SER B 80 -16.333 0.130 5.291 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.348 0.122 3.890 1.00 0.00 N ATOM 2536 CA HIS B 81 -11.915 0.294 4.124 1.00 0.00 C ATOM 2537 C HIS B 81 -11.074 -0.007 2.887 1.00 0.00 C ATOM 2538 O HIS B 81 -10.282 0.839 2.471 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.491 -0.616 5.300 1.00 0.00 C ATOM 2540 CG HIS B 81 -11.648 0.027 6.656 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.269 1.235 6.918 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.866 -0.271 7.734 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.756 1.723 8.063 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -10.981 0.776 8.629 1.00 0.00 N ATOM 0 H HIS B 81 -13.795 -0.434 4.619 1.00 0.00 H new ATOM 0 HA HIS B 81 -11.736 1.341 4.368 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.083 -1.530 5.271 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.449 -0.907 5.165 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -10.268 -1.161 7.864 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -11.936 2.710 8.462 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -10.555 0.824 9.554 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.224 -1.192 2.297 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.412 -1.578 1.143 1.00 0.00 C ATOM 2555 C LEU B 82 -10.911 -0.846 -0.097 1.00 0.00 C ATOM 2556 O LEU B 82 -10.109 -0.211 -0.764 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.394 -3.100 0.934 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.346 -3.948 2.229 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.640 -5.401 1.850 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.993 -3.782 2.936 1.00 0.00 C ATOM 0 H LEU B 82 -11.896 -1.898 2.597 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.379 -1.286 1.334 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.282 -3.382 0.368 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.530 -3.355 0.321 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.099 -3.612 2.942 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -10.613 -6.023 2.745 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -11.628 -5.465 1.393 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.889 -5.751 1.142 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -8.980 -4.386 3.843 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -8.193 -4.108 2.272 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.844 -2.734 3.196 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.226 -0.829 -0.339 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.845 -0.132 -1.472 1.00 0.00 C ATOM 2574 C ALA B 83 -12.422 1.348 -1.574 1.00 0.00 C ATOM 2575 O ALA B 83 -12.226 1.854 -2.677 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.364 -0.272 -1.317 1.00 0.00 C ATOM 0 H ALA B 83 -12.902 -1.307 0.257 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.505 -0.585 -2.403 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.862 0.235 -2.143 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.635 -1.328 -1.323 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.676 0.177 -0.374 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.238 2.025 -0.433 1.00 0.00 N ATOM 2583 CA ARG B 84 -11.808 3.425 -0.348 1.00 0.00 C ATOM 2584 C ARG B 84 -10.298 3.581 -0.631 1.00 0.00 C ATOM 2585 O ARG B 84 -9.956 4.208 -1.634 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.264 3.976 1.021 1.00 0.00 C ATOM 2587 CG ARG B 84 -12.058 5.476 1.246 1.00 0.00 C ATOM 2588 CD ARG B 84 -12.812 6.376 0.257 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.150 7.676 0.143 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.610 8.805 -0.369 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -13.884 9.000 -0.648 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -11.743 9.757 -0.613 1.00 0.00 N ATOM 0 H ARG B 84 -12.389 1.601 0.482 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.278 4.025 -1.127 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.324 3.753 1.145 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.731 3.435 1.803 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.374 5.726 2.259 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -10.993 5.698 1.181 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -12.856 5.896 -0.721 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.840 6.513 0.591 1.00 0.00 H new ATOM 0 HE ARG B 84 -11.199 7.717 0.510 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -14.564 8.261 -0.469 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -14.189 9.890 -1.042 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -10.754 9.611 -0.408 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.057 10.644 -1.008 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.425 2.882 0.113 1.00 0.00 N ATOM 2607 CA ALA B 85 -7.961 2.883 -0.100 1.00 0.00 C ATOM 2608 C ALA B 85 -7.528 2.406 -1.507 1.00 0.00 C ATOM 2609 O ALA B 85 -6.492 2.821 -2.034 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.320 2.004 0.991 1.00 0.00 C ATOM 0 H ALA B 85 -9.717 2.291 0.891 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.616 3.915 -0.033 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.238 1.988 0.856 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.557 2.412 1.973 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.710 0.989 0.916 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.333 1.533 -2.118 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.224 1.073 -3.500 1.00 0.00 C ATOM 2618 C LEU B 86 -8.754 2.107 -4.509 1.00 0.00 C ATOM 2619 O LEU B 86 -8.180 2.247 -5.586 1.00 0.00 O ATOM 2620 CB LEU B 86 -9.065 -0.211 -3.556 1.00 0.00 C ATOM 2621 CG LEU B 86 -9.231 -0.867 -4.927 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.936 -1.381 -5.550 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -10.246 -1.996 -4.741 1.00 0.00 C ATOM 0 H LEU B 86 -9.122 1.106 -1.632 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.182 0.910 -3.774 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.616 -0.941 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.057 0.015 -3.165 1.00 0.00 H new ATOM 0 HG LEU B 86 -9.573 -0.115 -5.638 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.152 -1.830 -6.520 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -7.241 -0.552 -5.680 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -7.489 -2.129 -4.895 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -10.405 -2.503 -5.693 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -9.867 -2.709 -4.009 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -11.191 -1.582 -4.388 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.837 2.813 -4.160 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.620 3.687 -5.043 1.00 0.00 C ATOM 2637 C GLY B 87 -10.013 5.068 -5.240 1.00 0.00 C ATOM 2638 O GLY B 87 -9.985 5.550 -6.370 1.00 0.00 O ATOM 0 H GLY B 87 -10.208 2.789 -3.210 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.725 3.205 -6.015 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.623 3.797 -4.632 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.508 5.689 -4.170 1.00 0.00 N ATOM 2643 CA GLU B 88 -8.673 6.902 -4.259 1.00 0.00 C ATOM 2644 C GLU B 88 -7.212 6.554 -4.605 1.00 0.00 C ATOM 2645 O GLU B 88 -6.478 7.372 -5.177 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.776 7.688 -2.938 1.00 0.00 C ATOM 2647 CG GLU B 88 -8.061 7.042 -1.732 1.00 0.00 C ATOM 2648 CD GLU B 88 -8.819 7.239 -0.417 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -9.491 8.286 -0.255 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -8.858 6.277 0.381 1.00 0.00 O ATOM 0 H GLU B 88 -9.664 5.369 -3.214 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.041 7.531 -5.070 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -8.363 8.685 -3.094 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -9.830 7.815 -2.690 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -7.937 5.975 -1.918 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -7.062 7.467 -1.637 1.00 0.00 H new ATOM 2657 N LEU B 89 -6.836 5.307 -4.280 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.556 4.644 -4.483 1.00 0.00 C ATOM 2659 C LEU B 89 -4.462 5.253 -3.593 1.00 0.00 C ATOM 2660 O LEU B 89 -4.492 6.422 -3.219 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.215 4.639 -5.994 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.085 3.698 -6.455 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -4.371 2.224 -6.130 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -3.863 3.861 -7.965 1.00 0.00 C ATOM 0 H LEU B 89 -7.497 4.680 -3.821 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.621 3.603 -4.168 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.119 4.377 -6.544 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -4.949 5.655 -6.284 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.186 3.979 -5.906 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -3.542 1.607 -6.477 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -4.486 2.105 -5.053 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -5.289 1.913 -6.629 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.064 3.195 -8.289 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.781 3.612 -8.497 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.586 4.893 -8.183 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.381 4.501 -3.392 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.100 4.961 -2.803 1.00 0.00 C ATOM 2678 C VAL B 90 -1.426 6.113 -3.581 1.00 0.00 C ATOM 2679 O VAL B 90 -0.236 6.382 -3.416 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.069 3.823 -2.713 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.476 2.759 -1.684 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -0.856 3.182 -4.096 1.00 0.00 C ATOM 0 H VAL B 90 -3.361 3.512 -3.641 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.385 5.318 -1.814 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.129 4.259 -2.375 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -0.720 1.975 -1.653 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -1.562 3.219 -0.700 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.436 2.327 -1.968 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -0.124 2.379 -4.016 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -1.801 2.777 -4.459 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -0.492 3.936 -4.794 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.140 6.740 -4.518 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.777 7.977 -5.187 1.00 0.00 C ATOM 2694 C GLN B 91 -0.656 7.827 -6.222 1.00 0.00 C ATOM 2695 O GLN B 91 -0.586 8.662 -7.115 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.493 9.056 -4.130 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.768 9.746 -3.619 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.461 10.624 -4.656 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -3.164 11.799 -4.798 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.353 10.099 -5.469 1.00 0.00 N ATOM 0 H GLN B 91 -3.034 6.373 -4.843 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.627 8.293 -5.791 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.969 8.603 -3.288 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.826 9.806 -4.555 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.469 8.984 -3.278 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.515 10.357 -2.753 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.618 9.119 -5.371 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.779 10.672 -6.197 1.00 0.00 H new ATOM 2709 N VAL B 92 0.130 6.748 -6.197 1.00 0.00 N ATOM 2710 CA VAL B 92 1.231 6.393 -7.127 1.00 0.00 C ATOM 2711 C VAL B 92 0.860 6.235 -8.624 1.00 0.00 C ATOM 2712 O VAL B 92 1.552 5.585 -9.399 1.00 0.00 O ATOM 2713 CB VAL B 92 2.019 5.184 -6.563 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.372 3.832 -6.911 1.00 0.00 C ATOM 2715 CG2 VAL B 92 3.496 5.219 -6.973 1.00 0.00 C ATOM 0 H VAL B 92 0.013 6.038 -5.474 1.00 0.00 H new ATOM 0 HA VAL B 92 1.876 7.271 -7.161 1.00 0.00 H new ATOM 0 HB VAL B 92 1.976 5.280 -5.478 1.00 0.00 H new ATOM 0 HG11 VAL B 92 1.969 3.024 -6.489 1.00 0.00 H new ATOM 0 HG12 VAL B 92 0.365 3.793 -6.497 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.323 3.720 -7.994 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.010 4.353 -6.556 1.00 0.00 H new ATOM 0 HG22 VAL B 92 3.572 5.197 -8.060 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.957 6.131 -6.595 1.00 0.00 H new ATOM 2725 N VAL B 93 -0.264 6.816 -9.041 1.00 0.00 N ATOM 2726 CA VAL B 93 -0.638 7.038 -10.449 1.00 0.00 C ATOM 2727 C VAL B 93 -0.887 5.729 -11.240 1.00 0.00 C ATOM 2728 O VAL B 93 -0.775 5.719 -12.461 1.00 0.00 O ATOM 2729 CB VAL B 93 0.382 7.995 -11.152 1.00 0.00 C ATOM 2730 CG1 VAL B 93 -0.304 8.788 -12.282 1.00 0.00 C ATOM 2731 CG2 VAL B 93 0.980 9.071 -10.207 1.00 0.00 C ATOM 0 H VAL B 93 -0.969 7.160 -8.389 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.607 7.538 -10.444 1.00 0.00 H new ATOM 0 HB VAL B 93 1.170 7.334 -11.512 1.00 0.00 H new ATOM 0 HG11 VAL B 93 0.423 9.447 -12.757 1.00 0.00 H new ATOM 0 HG12 VAL B 93 -0.704 8.095 -13.022 1.00 0.00 H new ATOM 0 HG13 VAL B 93 -1.117 9.384 -11.867 1.00 0.00 H new ATOM 0 HG21 VAL B 93 1.678 9.697 -10.764 1.00 0.00 H new ATOM 0 HG22 VAL B 93 0.177 9.690 -9.806 1.00 0.00 H new ATOM 0 HG23 VAL B 93 1.506 8.583 -9.386 1.00 0.00 H new ATOM 2741 N LEU B 94 -1.219 4.633 -10.531 1.00 0.00 N ATOM 2742 CA LEU B 94 -1.425 3.262 -11.040 1.00 0.00 C ATOM 2743 C LEU B 94 -0.067 2.568 -11.265 1.00 0.00 C ATOM 2744 O LEU B 94 0.556 2.679 -12.318 1.00 0.00 O ATOM 2745 CB LEU B 94 -2.351 3.239 -12.284 1.00 0.00 C ATOM 2746 CG LEU B 94 -3.129 1.924 -12.505 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -4.061 2.085 -13.717 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -2.229 0.700 -12.728 1.00 0.00 C ATOM 0 H LEU B 94 -1.360 4.684 -9.522 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.955 2.682 -10.285 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -3.068 4.056 -12.198 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -1.747 3.437 -13.169 1.00 0.00 H new ATOM 0 HG LEU B 94 -3.690 1.739 -11.589 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -4.613 1.159 -13.877 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -4.763 2.898 -13.531 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -3.469 2.313 -14.603 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -2.848 -0.185 -12.876 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -1.609 0.860 -13.610 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -1.590 0.555 -11.857 1.00 0.00 H new ATOM 2760 N ALA B 95 0.400 1.847 -10.246 1.00 0.00 N ATOM 2761 CA ALA B 95 1.649 1.094 -10.295 1.00 0.00 C ATOM 2762 C ALA B 95 1.630 -0.043 -11.338 1.00 0.00 C ATOM 2763 O ALA B 95 0.732 -0.879 -11.316 1.00 0.00 O ATOM 2764 CB ALA B 95 1.932 0.527 -8.894 1.00 0.00 C ATOM 0 H ALA B 95 -0.086 1.770 -9.353 1.00 0.00 H new ATOM 0 HA ALA B 95 2.440 1.776 -10.606 1.00 0.00 H new ATOM 0 HB1 ALA B 95 2.863 -0.040 -8.912 1.00 0.00 H new ATOM 0 HB2 ALA B 95 2.020 1.347 -8.181 1.00 0.00 H new ATOM 0 HB3 ALA B 95 1.114 -0.129 -8.595 1.00 0.00 H new ATOM 2770 N VAL B 96 2.667 -0.095 -12.181 1.00 0.00 N ATOM 2771 CA VAL B 96 2.962 -1.225 -13.083 1.00 0.00 C ATOM 2772 C VAL B 96 3.765 -2.311 -12.364 1.00 0.00 C ATOM 2773 O VAL B 96 4.601 -2.015 -11.503 1.00 0.00 O ATOM 2774 CB VAL B 96 3.775 -0.841 -14.356 1.00 0.00 C ATOM 2775 CG1 VAL B 96 3.030 -1.307 -15.616 1.00 0.00 C ATOM 2776 CG2 VAL B 96 4.131 0.649 -14.479 1.00 0.00 C ATOM 0 H VAL B 96 3.344 0.664 -12.261 1.00 0.00 H new ATOM 0 HA VAL B 96 1.977 -1.577 -13.391 1.00 0.00 H new ATOM 0 HB VAL B 96 4.729 -1.358 -14.253 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.605 -1.034 -16.501 1.00 0.00 H new ATOM 0 HG12 VAL B 96 2.904 -2.389 -15.585 1.00 0.00 H new ATOM 0 HG13 VAL B 96 2.052 -0.829 -15.658 1.00 0.00 H new ATOM 0 HG21 VAL B 96 4.696 0.814 -15.397 1.00 0.00 H new ATOM 0 HG22 VAL B 96 3.216 1.241 -14.505 1.00 0.00 H new ATOM 0 HG23 VAL B 96 4.734 0.951 -13.623 1.00 0.00 H new ATOM 2786 N ASP B 97 3.541 -3.557 -12.784 1.00 0.00 N ATOM 2787 CA ASP B 97 4.389 -4.700 -12.449 1.00 0.00 C ATOM 2788 C ASP B 97 5.632 -4.701 -13.358 1.00 0.00 C ATOM 2789 O ASP B 97 5.617 -4.154 -14.467 1.00 0.00 O ATOM 2790 CB ASP B 97 3.591 -6.005 -12.579 1.00 0.00 C ATOM 2791 CG ASP B 97 4.406 -7.237 -12.166 1.00 0.00 C ATOM 2792 OD1 ASP B 97 5.262 -7.084 -11.261 1.00 0.00 O ATOM 2793 OD2 ASP B 97 4.153 -8.314 -12.747 1.00 0.00 O ATOM 0 H ASP B 97 2.749 -3.804 -13.378 1.00 0.00 H new ATOM 0 HA ASP B 97 4.724 -4.621 -11.415 1.00 0.00 H new ATOM 0 HB2 ASP B 97 2.695 -5.942 -11.961 1.00 0.00 H new ATOM 0 HB3 ASP B 97 3.259 -6.122 -13.610 1.00 0.00 H new ATOM 2798 N THR B 98 6.747 -5.249 -12.863 1.00 0.00 N ATOM 2799 CA THR B 98 8.085 -5.192 -13.481 1.00 0.00 C ATOM 2800 C THR B 98 9.044 -6.054 -12.678 1.00 0.00 C ATOM 2801 O THR B 98 9.015 -6.107 -11.449 1.00 0.00 O ATOM 2802 CB THR B 98 8.662 -3.768 -13.653 1.00 0.00 C ATOM 2803 OG1 THR B 98 7.712 -2.757 -13.421 1.00 0.00 O ATOM 2804 CG2 THR B 98 9.152 -3.544 -15.083 1.00 0.00 C ATOM 0 H THR B 98 6.746 -5.767 -11.984 1.00 0.00 H new ATOM 0 HA THR B 98 7.967 -5.574 -14.495 1.00 0.00 H new ATOM 0 HB THR B 98 9.468 -3.706 -12.922 1.00 0.00 H new ATOM 0 HG1 THR B 98 8.014 -1.923 -13.837 1.00 0.00 H new ATOM 0 HG21 THR B 98 9.553 -2.535 -15.176 1.00 0.00 H new ATOM 0 HG22 THR B 98 9.933 -4.268 -15.318 1.00 0.00 H new ATOM 0 HG23 THR B 98 8.320 -3.670 -15.776 1.00 0.00 H new ATOM 2812 N ASP B 99 9.939 -6.671 -13.430 1.00 0.00 N ATOM 2813 CA ASP B 99 11.127 -7.441 -13.055 1.00 0.00 C ATOM 2814 C ASP B 99 12.337 -6.548 -12.703 1.00 0.00 C ATOM 2815 O ASP B 99 13.244 -6.960 -11.982 1.00 0.00 O ATOM 2816 CB ASP B 99 11.462 -8.359 -14.257 1.00 0.00 C ATOM 2817 CG ASP B 99 11.381 -7.703 -15.659 1.00 0.00 C ATOM 2818 OD1 ASP B 99 11.274 -6.451 -15.746 1.00 0.00 O ATOM 2819 OD2 ASP B 99 11.387 -8.456 -16.653 1.00 0.00 O ATOM 0 H ASP B 99 9.843 -6.644 -14.445 1.00 0.00 H new ATOM 0 HA ASP B 99 10.915 -8.015 -12.153 1.00 0.00 H new ATOM 0 HB2 ASP B 99 12.470 -8.751 -14.119 1.00 0.00 H new ATOM 0 HB3 ASP B 99 10.783 -9.212 -14.237 1.00 0.00 H new ATOM 2824 N GLN B 100 12.331 -5.313 -13.205 1.00 0.00 N ATOM 2825 CA GLN B 100 13.395 -4.308 -13.081 1.00 0.00 C ATOM 2826 C GLN B 100 13.596 -3.790 -11.628 1.00 0.00 C ATOM 2827 O GLN B 100 12.966 -4.326 -10.719 1.00 0.00 O ATOM 2828 CB GLN B 100 13.112 -3.233 -14.164 1.00 0.00 C ATOM 2829 CG GLN B 100 14.167 -3.192 -15.294 1.00 0.00 C ATOM 2830 CD GLN B 100 14.634 -4.574 -15.756 1.00 0.00 C ATOM 2831 OE1 GLN B 100 15.806 -4.919 -15.632 1.00 0.00 O ATOM 2832 NE2 GLN B 100 13.736 -5.428 -16.189 1.00 0.00 N ATOM 0 H GLN B 100 11.537 -4.963 -13.742 1.00 0.00 H new ATOM 0 HA GLN B 100 14.377 -4.739 -13.273 1.00 0.00 H new ATOM 0 HB2 GLN B 100 12.132 -3.421 -14.602 1.00 0.00 H new ATOM 0 HB3 GLN B 100 13.066 -2.254 -13.687 1.00 0.00 H new ATOM 0 HG2 GLN B 100 13.751 -2.656 -16.147 1.00 0.00 H new ATOM 0 HG3 GLN B 100 15.031 -2.623 -14.951 1.00 0.00 H new ATOM 0 HE21 GLN B 100 12.763 -5.138 -16.291 1.00 0.00 H new ATOM 0 HE22 GLN B 100 14.011 -6.382 -16.424 1.00 0.00 H new ATOM 2841 N PRO B 101 14.481 -2.815 -11.320 1.00 0.00 N ATOM 2842 CA PRO B 101 14.615 -2.297 -9.955 1.00 0.00 C ATOM 2843 C PRO B 101 13.463 -1.357 -9.600 1.00 0.00 C ATOM 2844 O PRO B 101 12.940 -0.688 -10.493 1.00 0.00 O ATOM 2845 CB PRO B 101 15.960 -1.573 -9.940 1.00 0.00 C ATOM 2846 CG PRO B 101 16.087 -1.034 -11.357 1.00 0.00 C ATOM 2847 CD PRO B 101 15.418 -2.121 -12.199 1.00 0.00 C ATOM 0 HA PRO B 101 14.577 -3.092 -9.210 1.00 0.00 H new ATOM 0 HB2 PRO B 101 15.976 -0.771 -9.202 1.00 0.00 H new ATOM 0 HB3 PRO B 101 16.778 -2.250 -9.693 1.00 0.00 H new ATOM 0 HG2 PRO B 101 15.587 -0.072 -11.469 1.00 0.00 H new ATOM 0 HG3 PRO B 101 17.129 -0.887 -11.641 1.00 0.00 H new ATOM 0 HD2 PRO B 101 14.898 -1.685 -13.052 1.00 0.00 H new ATOM 0 HD3 PRO B 101 16.160 -2.813 -12.598 1.00 0.00 H new ATOM 2855 N CYS B 102 13.110 -1.270 -8.301 1.00 0.00 N ATOM 2856 CA CYS B 102 12.230 -0.221 -7.768 1.00 0.00 C ATOM 2857 C CYS B 102 12.679 1.121 -8.361 1.00 0.00 C ATOM 2858 O CYS B 102 11.967 1.817 -9.083 1.00 0.00 O ATOM 2859 CB CYS B 102 12.315 -0.276 -6.210 1.00 0.00 C ATOM 2860 SG CYS B 102 13.867 0.162 -5.322 1.00 0.00 S ATOM 0 H CYS B 102 13.431 -1.930 -7.593 1.00 0.00 H new ATOM 0 HA CYS B 102 11.184 -0.360 -8.043 1.00 0.00 H new ATOM 0 HB2 CYS B 102 11.533 0.379 -5.826 1.00 0.00 H new ATOM 0 HB3 CYS B 102 12.055 -1.292 -5.913 1.00 0.00 H new ATOM 2865 N VAL B 103 13.957 1.319 -8.085 1.00 0.00 N ATOM 2866 CA VAL B 103 14.921 2.299 -8.554 1.00 0.00 C ATOM 2867 C VAL B 103 16.279 1.945 -7.926 1.00 0.00 C ATOM 2868 O VAL B 103 17.224 1.632 -8.643 1.00 0.00 O ATOM 2869 CB VAL B 103 14.445 3.755 -8.318 1.00 0.00 C ATOM 2870 CG1 VAL B 103 13.554 3.963 -7.081 1.00 0.00 C ATOM 2871 CG2 VAL B 103 15.652 4.696 -8.216 1.00 0.00 C ATOM 0 H VAL B 103 14.411 0.693 -7.420 1.00 0.00 H new ATOM 0 HA VAL B 103 15.028 2.257 -9.638 1.00 0.00 H new ATOM 0 HB VAL B 103 13.824 3.985 -9.184 1.00 0.00 H new ATOM 0 HG11 VAL B 103 13.275 5.014 -7.006 1.00 0.00 H new ATOM 0 HG12 VAL B 103 12.654 3.355 -7.174 1.00 0.00 H new ATOM 0 HG13 VAL B 103 14.100 3.667 -6.185 1.00 0.00 H new ATOM 0 HG21 VAL B 103 15.305 5.716 -8.050 1.00 0.00 H new ATOM 0 HG22 VAL B 103 16.284 4.388 -7.383 1.00 0.00 H new ATOM 0 HG23 VAL B 103 16.226 4.654 -9.142 1.00 0.00 H new ATOM 2881 N ALA B 104 16.358 1.894 -6.591 1.00 0.00 N ATOM 2882 CA ALA B 104 17.565 1.544 -5.829 1.00 0.00 C ATOM 2883 C ALA B 104 17.704 0.027 -5.563 1.00 0.00 C ATOM 2884 O ALA B 104 17.911 -0.402 -4.431 1.00 0.00 O ATOM 2885 CB ALA B 104 17.569 2.383 -4.548 1.00 0.00 C ATOM 0 H ALA B 104 15.559 2.101 -5.992 1.00 0.00 H new ATOM 0 HA ALA B 104 18.448 1.780 -6.423 1.00 0.00 H new ATOM 0 HB1 ALA B 104 18.455 2.145 -3.960 1.00 0.00 H new ATOM 0 HB2 ALA B 104 17.579 3.442 -4.807 1.00 0.00 H new ATOM 0 HB3 ALA B 104 16.676 2.160 -3.964 1.00 0.00 H new ATOM 2891 N GLU B 105 17.586 -0.782 -6.612 1.00 0.00 N ATOM 2892 CA GLU B 105 17.745 -2.245 -6.599 1.00 0.00 C ATOM 2893 C GLU B 105 18.603 -2.642 -7.827 1.00 0.00 C ATOM 2894 O GLU B 105 19.085 -1.761 -8.544 1.00 0.00 O ATOM 2895 CB GLU B 105 16.340 -2.899 -6.579 1.00 0.00 C ATOM 2896 CG GLU B 105 15.675 -2.869 -5.185 1.00 0.00 C ATOM 2897 CD GLU B 105 14.171 -3.187 -5.162 1.00 0.00 C ATOM 2898 OE1 GLU B 105 13.552 -3.383 -6.232 1.00 0.00 O ATOM 2899 OE2 GLU B 105 13.591 -3.223 -4.053 1.00 0.00 O ATOM 0 H GLU B 105 17.367 -0.425 -7.542 1.00 0.00 H new ATOM 0 HA GLU B 105 18.265 -2.601 -5.710 1.00 0.00 H new ATOM 0 HB2 GLU B 105 15.697 -2.384 -7.293 1.00 0.00 H new ATOM 0 HB3 GLU B 105 16.423 -3.933 -6.913 1.00 0.00 H new ATOM 0 HG2 GLU B 105 16.189 -3.582 -4.541 1.00 0.00 H new ATOM 0 HG3 GLU B 105 15.826 -1.881 -4.751 1.00 0.00 H new ATOM 2906 N ARG B 106 18.802 -3.936 -8.143 1.00 0.00 N ATOM 2907 CA ARG B 106 19.543 -4.315 -9.366 1.00 0.00 C ATOM 2908 C ARG B 106 19.022 -5.557 -10.095 1.00 0.00 C ATOM 2909 O ARG B 106 19.141 -6.685 -9.622 1.00 0.00 O ATOM 2910 CB ARG B 106 21.073 -4.295 -9.144 1.00 0.00 C ATOM 2911 CG ARG B 106 21.720 -5.281 -8.143 1.00 0.00 C ATOM 2912 CD ARG B 106 22.095 -6.690 -8.646 1.00 0.00 C ATOM 2913 NE ARG B 106 22.787 -6.669 -9.953 1.00 0.00 N ATOM 2914 CZ ARG B 106 22.310 -7.133 -11.106 1.00 0.00 C ATOM 2915 NH1 ARG B 106 21.190 -7.812 -11.188 1.00 0.00 N ATOM 2916 NH2 ARG B 106 22.932 -6.893 -12.240 1.00 0.00 N ATOM 0 H ARG B 106 18.470 -4.722 -7.584 1.00 0.00 H new ATOM 0 HA ARG B 106 19.327 -3.526 -10.086 1.00 0.00 H new ATOM 0 HB2 ARG B 106 21.544 -4.461 -10.113 1.00 0.00 H new ATOM 0 HB3 ARG B 106 21.342 -3.287 -8.827 1.00 0.00 H new ATOM 0 HG2 ARG B 106 22.625 -4.815 -7.754 1.00 0.00 H new ATOM 0 HG3 ARG B 106 21.036 -5.399 -7.303 1.00 0.00 H new ATOM 0 HD2 ARG B 106 22.735 -7.175 -7.909 1.00 0.00 H new ATOM 0 HD3 ARG B 106 21.191 -7.293 -8.729 1.00 0.00 H new ATOM 0 HE ARG B 106 23.721 -6.259 -9.973 1.00 0.00 H new ATOM 0 HH11 ARG B 106 20.647 -8.003 -10.346 1.00 0.00 H new ATOM 0 HH12 ARG B 106 20.863 -8.148 -12.094 1.00 0.00 H new ATOM 0 HH21 ARG B 106 23.792 -6.345 -12.244 1.00 0.00 H new ATOM 0 HH22 ARG B 106 22.554 -7.255 -13.115 1.00 0.00 H new TER 2930 ARG B 106 HETATM 2931 CD CD A 107 14.006 1.403 -3.235 1.00 0.00 CD HETATM 2932 CD CD B 107 -2.404 -13.798 2.403 1.00 0.00 CD