USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1367 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 HIS : no HD1:sc= -1.73 K(o=-2.1,f=-3.3) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.374 K(o=-2.1,f=-6) USER MOD Set 2.1: A 91 GLN : amide:sc= -0.161 K(o=-2.3,f=-6.4) USER MOD Set 2.2: B 81 HIS : no HD1:sc= -2.19 X(o=-2.3,f=-2.2) USER MOD Set 3.1: A 102 CYS SG : rot -144:sc= 0.173 USER MOD Set 3.2: B 57 CYS SG : rot 66:sc= 0.0922 USER MOD Set 3.3: B 61 CYS SG : rot 135:sc= 0.482 USER MOD Set 4.1: B 39 GLN : amide:sc= -1.65! C(o=-1.6!,f=-1.5!) USER MOD Set 4.2: B 75 TYR OH : rot 130:sc= 0.0239 USER MOD Set 5.1: A 57 CYS SG : rot 150:sc= 0.033 USER MOD Set 5.2: A 61 CYS SG : rot 180:sc= 0.344 USER MOD Set 6.1: A 39 GLN : amide:sc= -0.998 K(o=-1.2,f=-5!) USER MOD Set 6.2: A 43 HIS : no HD1:sc= -1.05 K(o=-1.2,f=-2.5!) USER MOD Set 6.3: A 75 TYR OH : rot -62:sc= 0.854 USER MOD Set 7.1: A 22 THR OG1 : rot -139:sc= 0.0295 USER MOD Set 7.2: A 50 ASN : amide:sc= -0.913 K(o=-0.88,f=-2.6) USER MOD Single : A 24 CYS SG : rot -129:sc= 0.0496 USER MOD Single : A 35 CYS SG : rot 55:sc= 0.539 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc=0.000215 USER MOD Single : A 52 SER OG : rot -24:sc= 1.21 USER MOD Single : A 53 ASN : amide:sc= -0.0229 X(o=-0.023,f=-0.52) USER MOD Single : A 54 HIS : no HE2:sc= 0.0762 K(o=0.076,f=-2.9!) USER MOD Single : A 56 SER OG : rot 79:sc= 1.25 USER MOD Single : A 67 THR OG1 : rot 150:sc= 0.336 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.657 X(o=-0.66,f=-0.52) USER MOD Single : A 80 SER OG : rot -37:sc= 1.26 USER MOD Single : A 98 THR OG1 : rot -120:sc= 0.548 USER MOD Single : A 100 GLN : amide:sc= -0.265 X(o=-0.26,f=-0.31) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.00767 USER MOD Single : B 24 CYS SG : rot 150:sc= 0 USER MOD Single : B 35 CYS SG : rot 48:sc= 0.143 USER MOD Single : B 36 TYR OH : rot 180:sc= 0.382 USER MOD Single : B 43 HIS : no HD1:sc=-0.00655 K(o=-0.0065,f=-3!) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= -0.0176 K(o=-0.018,f=-1.1) USER MOD Single : B 52 SER OG : rot -13:sc= 1.21 USER MOD Single : B 53 ASN : amide:sc= -0.0272 K(o=-0.027,f=-1) USER MOD Single : B 54 HIS : no HE2:sc= 0.00513 X(o=0.0051,f=-0.39) USER MOD Single : B 56 SER OG : rot 67:sc= 0.974 USER MOD Single : B 67 THR OG1 : rot 81:sc= 0.618 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= -0.353 K(o=-0.35,f=-4.4!) USER MOD Single : B 80 SER OG : rot -49:sc= 1.31 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 0.938 -0.579 -10.113 1.00 0.00 N ATOM 12 CA LEU A 11 0.478 0.090 -8.886 1.00 0.00 C ATOM 13 C LEU A 11 0.917 -0.662 -7.613 1.00 0.00 C ATOM 14 O LEU A 11 1.312 -0.048 -6.623 1.00 0.00 O ATOM 15 CB LEU A 11 -1.048 0.273 -8.977 1.00 0.00 C ATOM 16 CG LEU A 11 -1.590 1.351 -8.020 1.00 0.00 C ATOM 17 CD1 LEU A 11 -1.131 2.751 -8.462 1.00 0.00 C ATOM 18 CD2 LEU A 11 -3.123 1.287 -7.990 1.00 0.00 C ATOM 0 HA LEU A 11 0.947 1.071 -8.805 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -1.315 0.538 -10.000 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.535 -0.677 -8.756 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.198 1.162 -7.021 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -1.525 3.498 -7.772 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.042 2.794 -8.460 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.501 2.955 -9.467 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.506 2.050 -7.312 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.514 1.462 -8.992 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.439 0.303 -7.644 1.00 0.00 H new ATOM 30 N ALA A 12 0.970 -1.998 -7.692 1.00 0.00 N ATOM 31 CA ALA A 12 1.552 -2.904 -6.691 1.00 0.00 C ATOM 32 C ALA A 12 2.962 -2.465 -6.253 1.00 0.00 C ATOM 33 O ALA A 12 3.297 -2.510 -5.067 1.00 0.00 O ATOM 34 CB ALA A 12 1.623 -4.308 -7.320 1.00 0.00 C ATOM 0 H ALA A 12 0.590 -2.501 -8.494 1.00 0.00 H new ATOM 0 HA ALA A 12 0.925 -2.892 -5.799 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.051 -5.007 -6.602 1.00 0.00 H new ATOM 0 HB2 ALA A 12 0.620 -4.636 -7.592 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.248 -4.276 -8.212 1.00 0.00 H new ATOM 40 N ARG A 13 3.766 -1.983 -7.207 1.00 0.00 N ATOM 41 CA ARG A 13 5.161 -1.569 -7.033 1.00 0.00 C ATOM 42 C ARG A 13 5.313 -0.371 -6.088 1.00 0.00 C ATOM 43 O ARG A 13 6.411 -0.115 -5.594 1.00 0.00 O ATOM 44 CB ARG A 13 5.745 -1.299 -8.429 1.00 0.00 C ATOM 45 CG ARG A 13 7.250 -1.515 -8.568 1.00 0.00 C ATOM 46 CD ARG A 13 8.063 -0.231 -8.738 1.00 0.00 C ATOM 47 NE ARG A 13 8.570 0.301 -7.454 1.00 0.00 N ATOM 48 CZ ARG A 13 9.755 0.881 -7.277 1.00 0.00 C ATOM 49 NH1 ARG A 13 10.663 0.910 -8.227 1.00 0.00 N ATOM 50 NH2 ARG A 13 10.046 1.436 -6.115 1.00 0.00 N ATOM 0 H ARG A 13 3.445 -1.866 -8.168 1.00 0.00 H new ATOM 0 HA ARG A 13 5.721 -2.368 -6.547 1.00 0.00 H new ATOM 0 HB2 ARG A 13 5.236 -1.942 -9.147 1.00 0.00 H new ATOM 0 HB3 ARG A 13 5.517 -0.270 -8.706 1.00 0.00 H new ATOM 0 HG2 ARG A 13 7.611 -2.044 -7.686 1.00 0.00 H new ATOM 0 HG3 ARG A 13 7.433 -2.162 -9.426 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.904 -0.425 -9.403 1.00 0.00 H new ATOM 0 HD3 ARG A 13 7.443 0.525 -9.220 1.00 0.00 H new ATOM 0 HE ARG A 13 7.963 0.217 -6.639 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.469 0.480 -9.131 1.00 0.00 H new ATOM 0 HH12 ARG A 13 11.562 1.363 -8.060 1.00 0.00 H new ATOM 0 HH21 ARG A 13 9.364 1.419 -5.357 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.953 1.881 -5.975 1.00 0.00 H new ATOM 64 N LEU A 14 4.221 0.344 -5.776 1.00 0.00 N ATOM 65 CA LEU A 14 4.173 1.325 -4.690 1.00 0.00 C ATOM 66 C LEU A 14 4.188 0.589 -3.358 1.00 0.00 C ATOM 67 O LEU A 14 5.077 0.824 -2.545 1.00 0.00 O ATOM 68 CB LEU A 14 2.912 2.201 -4.817 1.00 0.00 C ATOM 69 CG LEU A 14 2.729 3.319 -3.755 1.00 0.00 C ATOM 70 CD1 LEU A 14 1.980 2.817 -2.516 1.00 0.00 C ATOM 71 CD2 LEU A 14 4.034 4.025 -3.356 1.00 0.00 C ATOM 0 H LEU A 14 3.338 0.253 -6.279 1.00 0.00 H new ATOM 0 HA LEU A 14 5.042 1.980 -4.747 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.919 2.666 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.039 1.549 -4.778 1.00 0.00 H new ATOM 0 HG LEU A 14 2.115 4.073 -4.248 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.875 3.632 -1.800 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.992 2.460 -2.808 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.540 2.001 -2.058 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.820 4.791 -2.611 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.729 3.296 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.480 4.489 -4.236 1.00 0.00 H new ATOM 83 N GLY A 15 3.216 -0.299 -3.124 1.00 0.00 N ATOM 84 CA GLY A 15 2.993 -0.907 -1.813 1.00 0.00 C ATOM 85 C GLY A 15 4.225 -1.640 -1.300 1.00 0.00 C ATOM 86 O GLY A 15 4.495 -1.572 -0.109 1.00 0.00 O ATOM 0 H GLY A 15 2.562 -0.615 -3.841 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.710 -0.133 -1.099 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.158 -1.604 -1.876 1.00 0.00 H new ATOM 90 N ARG A 16 5.044 -2.232 -2.181 1.00 0.00 N ATOM 91 CA ARG A 16 6.292 -2.918 -1.808 1.00 0.00 C ATOM 92 C ARG A 16 7.345 -1.928 -1.279 1.00 0.00 C ATOM 93 O ARG A 16 8.195 -2.310 -0.485 1.00 0.00 O ATOM 94 CB ARG A 16 6.821 -3.770 -2.981 1.00 0.00 C ATOM 95 CG ARG A 16 7.539 -5.088 -2.602 1.00 0.00 C ATOM 96 CD ARG A 16 8.865 -4.995 -1.816 1.00 0.00 C ATOM 97 NE ARG A 16 8.684 -5.181 -0.360 1.00 0.00 N ATOM 98 CZ ARG A 16 9.503 -4.753 0.596 1.00 0.00 C ATOM 99 NH1 ARG A 16 10.676 -4.204 0.370 1.00 0.00 N ATOM 100 NH2 ARG A 16 9.168 -4.844 1.857 1.00 0.00 N ATOM 0 H ARG A 16 4.858 -2.249 -3.184 1.00 0.00 H new ATOM 0 HA ARG A 16 6.072 -3.601 -0.987 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.982 -4.013 -3.633 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.511 -3.160 -3.563 1.00 0.00 H new ATOM 0 HG2 ARG A 16 6.845 -5.689 -2.014 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.735 -5.637 -3.523 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.557 -5.749 -2.190 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.323 -4.023 -1.999 1.00 0.00 H new ATOM 0 HE ARG A 16 7.850 -5.686 -0.060 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.007 -4.085 -0.587 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.255 -3.897 1.152 1.00 0.00 H new ATOM 0 HH21 ARG A 16 8.268 -5.248 2.118 1.00 0.00 H new ATOM 0 HH22 ARG A 16 9.807 -4.511 2.580 1.00 0.00 H new ATOM 114 N ALA A 17 7.261 -0.637 -1.607 1.00 0.00 N ATOM 115 CA ALA A 17 8.110 0.403 -1.030 1.00 0.00 C ATOM 116 C ALA A 17 7.643 0.885 0.355 1.00 0.00 C ATOM 117 O ALA A 17 8.454 1.481 1.074 1.00 0.00 O ATOM 118 CB ALA A 17 8.190 1.562 -2.032 1.00 0.00 C ATOM 0 H ALA A 17 6.592 -0.282 -2.290 1.00 0.00 H new ATOM 0 HA ALA A 17 9.099 -0.021 -0.854 1.00 0.00 H new ATOM 0 HB1 ALA A 17 8.819 2.353 -1.624 1.00 0.00 H new ATOM 0 HB2 ALA A 17 8.618 1.204 -2.969 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.190 1.953 -2.216 1.00 0.00 H new ATOM 124 N LEU A 18 6.386 0.605 0.733 1.00 0.00 N ATOM 125 CA LEU A 18 5.866 0.865 2.088 1.00 0.00 C ATOM 126 C LEU A 18 5.769 -0.427 2.936 1.00 0.00 C ATOM 127 O LEU A 18 5.779 -0.334 4.156 1.00 0.00 O ATOM 128 CB LEU A 18 4.546 1.681 2.023 1.00 0.00 C ATOM 129 CG LEU A 18 4.743 3.157 1.566 1.00 0.00 C ATOM 130 CD1 LEU A 18 4.685 3.307 0.043 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.713 4.148 2.162 1.00 0.00 C ATOM 0 H LEU A 18 5.697 0.190 0.106 1.00 0.00 H new ATOM 0 HA LEU A 18 6.585 1.489 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.857 1.187 1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.076 1.674 3.007 1.00 0.00 H new ATOM 0 HG LEU A 18 5.734 3.408 1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.828 4.354 -0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.472 2.705 -0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.714 2.969 -0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.920 5.153 1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.708 3.852 1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.785 4.138 3.250 1.00 0.00 H new ATOM 143 N ALA A 19 5.784 -1.613 2.313 1.00 0.00 N ATOM 144 CA ALA A 19 5.764 -2.974 2.888 1.00 0.00 C ATOM 145 C ALA A 19 7.003 -3.388 3.715 1.00 0.00 C ATOM 146 O ALA A 19 7.228 -4.581 3.918 1.00 0.00 O ATOM 147 CB ALA A 19 5.530 -3.967 1.741 1.00 0.00 C ATOM 0 H ALA A 19 5.813 -1.652 1.294 1.00 0.00 H new ATOM 0 HA ALA A 19 4.957 -2.982 3.621 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.510 -4.982 2.137 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.578 -3.747 1.258 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.335 -3.877 1.012 1.00 0.00 H new ATOM 153 N ASP A 20 7.837 -2.435 4.123 1.00 0.00 N ATOM 154 CA ASP A 20 9.085 -2.627 4.860 1.00 0.00 C ATOM 155 C ASP A 20 8.855 -2.298 6.358 1.00 0.00 C ATOM 156 O ASP A 20 8.117 -1.352 6.655 1.00 0.00 O ATOM 157 CB ASP A 20 10.146 -1.678 4.272 1.00 0.00 C ATOM 158 CG ASP A 20 11.377 -2.300 3.619 1.00 0.00 C ATOM 159 OD1 ASP A 20 11.235 -3.326 2.923 1.00 0.00 O ATOM 160 OD2 ASP A 20 12.459 -1.675 3.758 1.00 0.00 O ATOM 0 H ASP A 20 7.649 -1.450 3.938 1.00 0.00 H new ATOM 0 HA ASP A 20 9.422 -3.660 4.774 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.656 -1.048 3.530 1.00 0.00 H new ATOM 0 HB3 ASP A 20 10.488 -1.021 5.072 1.00 0.00 H new ATOM 165 N PRO A 21 9.523 -3.008 7.291 1.00 0.00 N ATOM 166 CA PRO A 21 9.270 -2.988 8.738 1.00 0.00 C ATOM 167 C PRO A 21 9.508 -1.599 9.353 1.00 0.00 C ATOM 168 O PRO A 21 8.573 -0.800 9.468 1.00 0.00 O ATOM 169 CB PRO A 21 10.192 -4.085 9.307 1.00 0.00 C ATOM 170 CG PRO A 21 11.333 -4.166 8.296 1.00 0.00 C ATOM 171 CD PRO A 21 10.606 -3.931 6.983 1.00 0.00 C ATOM 0 HA PRO A 21 8.227 -3.189 8.982 1.00 0.00 H new ATOM 0 HB2 PRO A 21 10.556 -3.825 10.301 1.00 0.00 H new ATOM 0 HB3 PRO A 21 9.670 -5.038 9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 21 12.097 -3.411 8.481 1.00 0.00 H new ATOM 0 HG3 PRO A 21 11.831 -5.135 8.319 1.00 0.00 H new ATOM 0 HD2 PRO A 21 11.277 -3.511 6.234 1.00 0.00 H new ATOM 0 HD3 PRO A 21 10.220 -4.866 6.577 1.00 0.00 H new ATOM 179 N THR A 22 10.768 -1.292 9.707 1.00 0.00 N ATOM 180 CA THR A 22 11.252 0.026 10.131 1.00 0.00 C ATOM 181 C THR A 22 10.713 1.128 9.231 1.00 0.00 C ATOM 182 O THR A 22 10.319 2.185 9.709 1.00 0.00 O ATOM 183 CB THR A 22 12.789 -0.002 10.085 1.00 0.00 C ATOM 184 OG1 THR A 22 13.239 -0.969 11.004 1.00 0.00 O ATOM 185 CG2 THR A 22 13.447 1.344 10.401 1.00 0.00 C ATOM 0 H THR A 22 11.509 -1.992 9.704 1.00 0.00 H new ATOM 0 HA THR A 22 10.902 0.240 11.141 1.00 0.00 H new ATOM 0 HB THR A 22 13.077 -0.244 9.062 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.025 -0.628 11.479 1.00 0.00 H new ATOM 0 HG21 THR A 22 14.531 1.241 10.348 1.00 0.00 H new ATOM 0 HG22 THR A 22 13.118 2.089 9.677 1.00 0.00 H new ATOM 0 HG23 THR A 22 13.162 1.662 11.404 1.00 0.00 H new ATOM 193 N ARG A 23 10.665 0.890 7.916 1.00 0.00 N ATOM 194 CA ARG A 23 10.403 1.907 6.892 1.00 0.00 C ATOM 195 C ARG A 23 8.949 2.390 6.770 1.00 0.00 C ATOM 196 O ARG A 23 8.738 3.568 6.489 1.00 0.00 O ATOM 197 CB ARG A 23 10.905 1.368 5.561 1.00 0.00 C ATOM 198 CG ARG A 23 11.558 2.425 4.686 1.00 0.00 C ATOM 199 CD ARG A 23 12.222 1.718 3.504 1.00 0.00 C ATOM 200 NE ARG A 23 11.267 1.149 2.544 1.00 0.00 N ATOM 201 CZ ARG A 23 11.740 0.597 1.443 1.00 0.00 C ATOM 202 NH1 ARG A 23 12.794 -0.183 1.457 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.174 0.884 0.301 1.00 0.00 N ATOM 0 H ARG A 23 10.811 -0.040 7.524 1.00 0.00 H new ATOM 0 HA ARG A 23 10.938 2.804 7.205 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.623 0.569 5.749 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.069 0.925 5.019 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.814 3.140 4.333 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.296 2.988 5.256 1.00 0.00 H new ATOM 0 HD2 ARG A 23 12.868 2.426 2.984 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.862 0.921 3.882 1.00 0.00 H new ATOM 0 HE ARG A 23 10.263 1.180 2.724 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.273 -0.378 2.336 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.135 -0.595 0.588 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.381 1.525 0.272 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.525 0.467 -0.561 1.00 0.00 H new ATOM 217 N CYS A 24 7.936 1.554 7.018 1.00 0.00 N ATOM 218 CA CYS A 24 6.559 2.060 7.156 1.00 0.00 C ATOM 219 C CYS A 24 6.473 2.992 8.367 1.00 0.00 C ATOM 220 O CYS A 24 5.831 4.044 8.329 1.00 0.00 O ATOM 221 CB CYS A 24 5.598 0.884 7.332 1.00 0.00 C ATOM 222 SG CYS A 24 3.904 1.524 7.514 1.00 0.00 S ATOM 0 H CYS A 24 8.035 0.545 7.126 1.00 0.00 H new ATOM 0 HA CYS A 24 6.284 2.616 6.260 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.658 0.217 6.472 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.876 0.299 8.209 1.00 0.00 H new ATOM 0 HG CYS A 24 3.353 0.999 8.568 1.00 0.00 H new ATOM 228 N ARG A 25 7.164 2.606 9.441 1.00 0.00 N ATOM 229 CA ARG A 25 7.275 3.380 10.672 1.00 0.00 C ATOM 230 C ARG A 25 8.031 4.703 10.440 1.00 0.00 C ATOM 231 O ARG A 25 7.548 5.737 10.882 1.00 0.00 O ATOM 232 CB ARG A 25 7.840 2.452 11.758 1.00 0.00 C ATOM 233 CG ARG A 25 6.687 1.592 12.334 1.00 0.00 C ATOM 234 CD ARG A 25 7.128 0.292 13.027 1.00 0.00 C ATOM 235 NE ARG A 25 6.000 -0.657 13.150 1.00 0.00 N ATOM 236 CZ ARG A 25 6.068 -1.986 13.137 1.00 0.00 C ATOM 237 NH1 ARG A 25 7.205 -2.629 13.195 1.00 0.00 N ATOM 238 NH2 ARG A 25 4.977 -2.701 13.033 1.00 0.00 N ATOM 0 H ARG A 25 7.674 1.723 9.476 1.00 0.00 H new ATOM 0 HA ARG A 25 6.304 3.723 11.029 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.616 1.811 11.339 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.305 3.039 12.550 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.127 2.195 13.049 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.003 1.340 11.524 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.935 -0.170 12.459 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.524 0.520 14.016 1.00 0.00 H new ATOM 0 HE ARG A 25 5.071 -0.249 13.256 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.082 -2.111 13.253 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.215 -3.649 13.183 1.00 0.00 H new ATOM 0 HH21 ARG A 25 4.070 -2.240 12.961 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.034 -3.719 13.023 1.00 0.00 H new ATOM 252 N ILE A 26 9.103 4.721 9.637 1.00 0.00 N ATOM 253 CA ILE A 26 9.750 5.968 9.127 1.00 0.00 C ATOM 254 C ILE A 26 8.709 6.936 8.572 1.00 0.00 C ATOM 255 O ILE A 26 8.613 8.088 8.975 1.00 0.00 O ATOM 256 CB ILE A 26 10.814 5.680 8.015 1.00 0.00 C ATOM 257 CG1 ILE A 26 12.016 4.986 8.661 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.213 6.957 7.242 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.316 4.861 7.860 1.00 0.00 C ATOM 0 H ILE A 26 9.561 3.869 9.312 1.00 0.00 H new ATOM 0 HA ILE A 26 10.258 6.416 9.981 1.00 0.00 H new ATOM 0 HB ILE A 26 10.382 5.018 7.264 1.00 0.00 H new ATOM 0 HG12 ILE A 26 12.247 5.518 9.584 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.704 3.980 8.942 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.953 6.706 6.482 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.331 7.383 6.763 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.637 7.684 7.935 1.00 0.00 H new ATOM 0 HD11 ILE A 26 14.065 4.346 8.461 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.129 4.293 6.949 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.680 5.855 7.600 1.00 0.00 H new ATOM 271 N LEU A 27 7.948 6.427 7.616 1.00 0.00 N ATOM 272 CA LEU A 27 6.907 7.173 6.906 1.00 0.00 C ATOM 273 C LEU A 27 5.810 7.702 7.846 1.00 0.00 C ATOM 274 O LEU A 27 5.470 8.879 7.752 1.00 0.00 O ATOM 275 CB LEU A 27 6.368 6.328 5.737 1.00 0.00 C ATOM 276 CG LEU A 27 7.355 6.213 4.556 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.801 5.231 3.525 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.588 7.552 3.838 1.00 0.00 C ATOM 0 H LEU A 27 8.035 5.461 7.301 1.00 0.00 H new ATOM 0 HA LEU A 27 7.351 8.073 6.482 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.130 5.328 6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.436 6.767 5.380 1.00 0.00 H new ATOM 0 HG LEU A 27 8.303 5.876 4.976 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.497 5.149 2.690 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.672 4.252 3.987 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.839 5.590 3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.291 7.407 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.642 7.923 3.444 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.997 8.276 4.542 1.00 0.00 H new ATOM 290 N VAL A 28 5.298 6.910 8.795 1.00 0.00 N ATOM 291 CA VAL A 28 4.329 7.442 9.786 1.00 0.00 C ATOM 292 C VAL A 28 4.946 8.496 10.740 1.00 0.00 C ATOM 293 O VAL A 28 4.270 9.443 11.127 1.00 0.00 O ATOM 294 CB VAL A 28 3.563 6.318 10.532 1.00 0.00 C ATOM 295 CG1 VAL A 28 4.205 5.837 11.844 1.00 0.00 C ATOM 296 CG2 VAL A 28 2.116 6.750 10.818 1.00 0.00 C ATOM 0 H VAL A 28 5.525 5.922 8.905 1.00 0.00 H new ATOM 0 HA VAL A 28 3.580 7.984 9.209 1.00 0.00 H new ATOM 0 HB VAL A 28 3.600 5.470 9.848 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.590 5.052 12.284 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.202 5.446 11.639 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.279 6.672 12.540 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.594 5.949 11.342 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.120 7.647 11.438 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.607 6.961 9.878 1.00 0.00 H new ATOM 306 N ALA A 29 6.243 8.386 11.060 1.00 0.00 N ATOM 307 CA ALA A 29 7.046 9.349 11.838 1.00 0.00 C ATOM 308 C ALA A 29 7.637 10.502 11.008 1.00 0.00 C ATOM 309 O ALA A 29 8.436 11.299 11.506 1.00 0.00 O ATOM 310 CB ALA A 29 8.115 8.522 12.558 1.00 0.00 C ATOM 0 H ALA A 29 6.794 7.579 10.768 1.00 0.00 H new ATOM 0 HA ALA A 29 6.407 9.876 12.547 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.745 9.182 13.154 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.633 7.793 13.210 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.728 8.001 11.823 1.00 0.00 H new ATOM 316 N LEU A 30 7.243 10.590 9.738 1.00 0.00 N ATOM 317 CA LEU A 30 7.446 11.697 8.847 1.00 0.00 C ATOM 318 C LEU A 30 6.214 12.560 8.684 1.00 0.00 C ATOM 319 O LEU A 30 6.370 13.753 8.434 1.00 0.00 O ATOM 320 CB LEU A 30 7.894 11.135 7.489 1.00 0.00 C ATOM 321 CG LEU A 30 9.405 11.221 7.377 1.00 0.00 C ATOM 322 CD1 LEU A 30 9.844 10.704 6.019 1.00 0.00 C ATOM 323 CD2 LEU A 30 9.779 12.693 7.532 1.00 0.00 C ATOM 0 H LEU A 30 6.739 9.827 9.287 1.00 0.00 H new ATOM 0 HA LEU A 30 8.209 12.348 9.273 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.570 10.099 7.388 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.427 11.696 6.680 1.00 0.00 H new ATOM 0 HG LEU A 30 9.895 10.618 8.141 1.00 0.00 H new ATOM 0 HD11 LEU A 30 10.929 10.766 5.939 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.531 9.666 5.906 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.388 11.308 5.235 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.861 12.803 7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.300 13.275 6.744 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.443 13.053 8.504 1.00 0.00 H new ATOM 335 N LEU A 31 5.026 11.968 8.829 1.00 0.00 N ATOM 336 CA LEU A 31 3.785 12.716 8.938 1.00 0.00 C ATOM 337 C LEU A 31 3.833 13.597 10.208 1.00 0.00 C ATOM 338 O LEU A 31 3.453 14.762 10.150 1.00 0.00 O ATOM 339 CB LEU A 31 2.622 11.713 9.010 1.00 0.00 C ATOM 340 CG LEU A 31 1.888 11.454 7.691 1.00 0.00 C ATOM 341 CD1 LEU A 31 0.798 10.436 8.037 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.226 12.723 7.135 1.00 0.00 C ATOM 0 H LEU A 31 4.904 10.956 8.873 1.00 0.00 H new ATOM 0 HA LEU A 31 3.645 13.366 8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.007 10.764 9.383 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.900 12.074 9.742 1.00 0.00 H new ATOM 0 HG LEU A 31 2.586 11.107 6.929 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.225 10.197 7.141 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.259 9.528 8.426 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.133 10.857 8.791 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.718 12.488 6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.501 13.101 7.856 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.988 13.481 6.954 1.00 0.00 H new ATOM 354 N ASP A 32 4.342 13.030 11.313 1.00 0.00 N ATOM 355 CA ASP A 32 4.685 13.704 12.572 1.00 0.00 C ATOM 356 C ASP A 32 6.159 13.439 12.956 1.00 0.00 C ATOM 357 O ASP A 32 6.500 12.486 13.654 1.00 0.00 O ATOM 358 CB ASP A 32 3.721 13.265 13.688 1.00 0.00 C ATOM 359 CG ASP A 32 4.007 13.976 15.021 1.00 0.00 C ATOM 360 OD1 ASP A 32 4.431 15.154 14.974 1.00 0.00 O ATOM 361 OD2 ASP A 32 3.768 13.350 16.079 1.00 0.00 O ATOM 0 H ASP A 32 4.536 12.029 11.352 1.00 0.00 H new ATOM 0 HA ASP A 32 4.575 14.780 12.435 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.696 13.472 13.381 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.800 12.187 13.830 1.00 0.00 H new ATOM 366 N GLY A 33 7.043 14.287 12.427 1.00 0.00 N ATOM 367 CA GLY A 33 8.490 14.354 12.701 1.00 0.00 C ATOM 368 C GLY A 33 9.161 15.572 12.086 1.00 0.00 C ATOM 369 O GLY A 33 9.388 16.573 12.757 1.00 0.00 O ATOM 0 H GLY A 33 6.754 14.994 11.751 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.649 14.366 13.779 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.968 13.452 12.318 1.00 0.00 H new ATOM 373 N VAL A 34 9.565 15.434 10.822 1.00 0.00 N ATOM 374 CA VAL A 34 10.256 16.440 9.981 1.00 0.00 C ATOM 375 C VAL A 34 11.288 17.336 10.681 1.00 0.00 C ATOM 376 O VAL A 34 11.428 18.526 10.409 1.00 0.00 O ATOM 377 CB VAL A 34 9.276 17.259 9.115 1.00 0.00 C ATOM 378 CG1 VAL A 34 8.428 16.311 8.263 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.323 18.070 10.000 1.00 0.00 C ATOM 0 H VAL A 34 9.413 14.562 10.316 1.00 0.00 H new ATOM 0 HA VAL A 34 10.866 15.821 9.324 1.00 0.00 H new ATOM 0 HB VAL A 34 9.860 17.930 8.486 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.736 16.891 7.652 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.079 15.723 7.616 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.864 15.643 8.914 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.640 18.641 9.371 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.752 17.393 10.635 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.899 18.754 10.624 1.00 0.00 H new ATOM 389 N CYS A 35 12.022 16.721 11.597 1.00 0.00 N ATOM 390 CA CYS A 35 13.020 17.334 12.454 1.00 0.00 C ATOM 391 C CYS A 35 14.363 17.437 11.727 1.00 0.00 C ATOM 392 O CYS A 35 14.720 18.483 11.208 1.00 0.00 O ATOM 393 CB CYS A 35 13.089 16.435 13.690 1.00 0.00 C ATOM 394 SG CYS A 35 11.792 16.869 14.879 1.00 0.00 S ATOM 0 H CYS A 35 11.929 15.720 11.770 1.00 0.00 H new ATOM 0 HA CYS A 35 12.765 18.356 12.733 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.981 15.392 13.392 1.00 0.00 H new ATOM 0 HB3 CYS A 35 14.067 16.532 14.161 1.00 0.00 H new ATOM 0 HG CYS A 35 10.634 16.839 14.289 1.00 0.00 H new ATOM 400 N TYR A 36 15.095 16.320 11.679 1.00 0.00 N ATOM 401 CA TYR A 36 16.479 16.219 11.180 1.00 0.00 C ATOM 402 C TYR A 36 16.713 14.839 10.535 1.00 0.00 C ATOM 403 O TYR A 36 16.165 13.864 11.039 1.00 0.00 O ATOM 404 CB TYR A 36 17.531 16.517 12.280 1.00 0.00 C ATOM 405 CG TYR A 36 17.055 17.241 13.532 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.655 18.587 13.466 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.988 16.559 14.767 1.00 0.00 C ATOM 408 CE1 TYR A 36 16.094 19.219 14.590 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.493 17.209 15.913 1.00 0.00 C ATOM 410 CZ TYR A 36 16.029 18.542 15.825 1.00 0.00 C ATOM 411 OH TYR A 36 15.544 19.180 16.924 1.00 0.00 O ATOM 0 H TYR A 36 14.729 15.423 11.998 1.00 0.00 H new ATOM 0 HA TYR A 36 16.610 16.988 10.418 1.00 0.00 H new ATOM 0 HB2 TYR A 36 17.973 15.569 12.587 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.328 17.110 11.831 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.779 19.139 12.546 1.00 0.00 H new ATOM 0 HD2 TYR A 36 17.318 15.533 14.832 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.712 20.226 14.507 1.00 0.00 H new ATOM 0 HE2 TYR A 36 16.468 16.690 16.860 1.00 0.00 H new ATOM 0 HH TYR A 36 15.567 18.572 17.692 1.00 0.00 H new ATOM 421 N PRO A 37 17.520 14.682 9.467 1.00 0.00 N ATOM 422 CA PRO A 37 17.586 13.438 8.690 1.00 0.00 C ATOM 423 C PRO A 37 18.103 12.188 9.428 1.00 0.00 C ATOM 424 O PRO A 37 17.961 11.101 8.875 1.00 0.00 O ATOM 425 CB PRO A 37 18.422 13.766 7.449 1.00 0.00 C ATOM 426 CG PRO A 37 19.239 14.982 7.863 1.00 0.00 C ATOM 427 CD PRO A 37 18.305 15.716 8.822 1.00 0.00 C ATOM 0 HA PRO A 37 16.568 13.133 8.449 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.064 12.931 7.169 1.00 0.00 H new ATOM 0 HB3 PRO A 37 17.790 13.985 6.589 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.171 14.695 8.349 1.00 0.00 H new ATOM 0 HG3 PRO A 37 19.504 15.601 7.006 1.00 0.00 H new ATOM 0 HD2 PRO A 37 18.869 16.294 9.554 1.00 0.00 H new ATOM 0 HD3 PRO A 37 17.665 16.418 8.287 1.00 0.00 H new ATOM 435 N GLY A 38 18.658 12.311 10.644 1.00 0.00 N ATOM 436 CA GLY A 38 18.977 11.177 11.534 1.00 0.00 C ATOM 437 C GLY A 38 18.026 11.007 12.732 1.00 0.00 C ATOM 438 O GLY A 38 18.181 10.068 13.507 1.00 0.00 O ATOM 0 H GLY A 38 18.903 13.216 11.046 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.966 10.259 10.947 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.992 11.303 11.910 1.00 0.00 H new ATOM 442 N GLN A 39 17.046 11.908 12.889 1.00 0.00 N ATOM 443 CA GLN A 39 16.158 11.996 14.061 1.00 0.00 C ATOM 444 C GLN A 39 15.334 10.734 14.289 1.00 0.00 C ATOM 445 O GLN A 39 15.034 10.416 15.436 1.00 0.00 O ATOM 446 CB GLN A 39 15.210 13.198 13.915 1.00 0.00 C ATOM 447 CG GLN A 39 14.070 12.992 12.885 1.00 0.00 C ATOM 448 CD GLN A 39 12.775 12.382 13.414 1.00 0.00 C ATOM 449 OE1 GLN A 39 12.201 11.514 12.790 1.00 0.00 O ATOM 450 NE2 GLN A 39 12.234 12.824 14.521 1.00 0.00 N ATOM 0 H GLN A 39 16.842 12.617 12.185 1.00 0.00 H new ATOM 0 HA GLN A 39 16.807 12.120 14.928 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.769 13.418 14.887 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.793 14.072 13.624 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.834 13.958 12.439 1.00 0.00 H new ATOM 0 HG3 GLN A 39 14.445 12.355 12.084 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.700 13.553 15.061 1.00 0.00 H new ATOM 0 HE22 GLN A 39 11.346 12.439 14.844 1.00 0.00 H new ATOM 459 N LEU A 40 15.027 10.019 13.200 1.00 0.00 N ATOM 460 CA LEU A 40 14.261 8.782 13.180 1.00 0.00 C ATOM 461 C LEU A 40 14.791 7.769 14.196 1.00 0.00 C ATOM 462 O LEU A 40 14.037 6.955 14.698 1.00 0.00 O ATOM 463 CB LEU A 40 14.390 8.185 11.774 1.00 0.00 C ATOM 464 CG LEU A 40 13.487 8.830 10.713 1.00 0.00 C ATOM 465 CD1 LEU A 40 14.041 8.387 9.364 1.00 0.00 C ATOM 466 CD2 LEU A 40 12.040 8.355 10.924 1.00 0.00 C ATOM 0 H LEU A 40 15.324 10.307 12.268 1.00 0.00 H new ATOM 0 HA LEU A 40 13.225 9.000 13.439 1.00 0.00 H new ATOM 0 HB2 LEU A 40 15.427 8.275 11.451 1.00 0.00 H new ATOM 0 HB3 LEU A 40 14.163 7.120 11.825 1.00 0.00 H new ATOM 0 HG LEU A 40 13.476 9.918 10.774 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.437 8.816 8.564 1.00 0.00 H new ATOM 0 HD12 LEU A 40 15.071 8.728 9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 40 14.011 7.299 9.298 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.394 8.810 10.173 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.996 7.270 10.831 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.702 8.648 11.918 1.00 0.00 H new ATOM 478 N ALA A 41 16.081 7.820 14.517 1.00 0.00 N ATOM 479 CA ALA A 41 16.691 6.806 15.370 1.00 0.00 C ATOM 480 C ALA A 41 16.319 6.961 16.853 1.00 0.00 C ATOM 481 O ALA A 41 16.166 5.967 17.553 1.00 0.00 O ATOM 482 CB ALA A 41 18.204 6.829 15.136 1.00 0.00 C ATOM 0 H ALA A 41 16.721 8.549 14.201 1.00 0.00 H new ATOM 0 HA ALA A 41 16.296 5.828 15.096 1.00 0.00 H new ATOM 0 HB1 ALA A 41 18.681 6.077 15.765 1.00 0.00 H new ATOM 0 HB2 ALA A 41 18.414 6.612 14.089 1.00 0.00 H new ATOM 0 HB3 ALA A 41 18.596 7.814 15.388 1.00 0.00 H new ATOM 488 N ALA A 42 16.124 8.195 17.324 1.00 0.00 N ATOM 489 CA ALA A 42 15.542 8.446 18.646 1.00 0.00 C ATOM 490 C ALA A 42 14.007 8.353 18.591 1.00 0.00 C ATOM 491 O ALA A 42 13.372 7.830 19.496 1.00 0.00 O ATOM 492 CB ALA A 42 16.010 9.827 19.123 1.00 0.00 C ATOM 0 H ALA A 42 16.362 9.041 16.806 1.00 0.00 H new ATOM 0 HA ALA A 42 15.877 7.689 19.355 1.00 0.00 H new ATOM 0 HB1 ALA A 42 15.588 10.035 20.106 1.00 0.00 H new ATOM 0 HB2 ALA A 42 17.098 9.841 19.185 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.677 10.588 18.417 1.00 0.00 H new ATOM 498 N HIS A 43 13.409 8.810 17.492 1.00 0.00 N ATOM 499 CA HIS A 43 11.955 8.908 17.333 1.00 0.00 C ATOM 500 C HIS A 43 11.259 7.539 17.131 1.00 0.00 C ATOM 501 O HIS A 43 10.111 7.350 17.527 1.00 0.00 O ATOM 502 CB HIS A 43 11.734 9.871 16.157 1.00 0.00 C ATOM 503 CG HIS A 43 10.357 10.461 16.069 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.591 10.908 17.143 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.728 10.789 14.907 1.00 0.00 C ATOM 506 CE1 HIS A 43 8.481 11.436 16.600 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.537 11.380 15.259 1.00 0.00 N ATOM 0 H HIS A 43 13.927 9.128 16.673 1.00 0.00 H new ATOM 0 HA HIS A 43 11.493 9.283 18.246 1.00 0.00 H new ATOM 0 HB2 HIS A 43 12.457 10.684 16.232 1.00 0.00 H new ATOM 0 HB3 HIS A 43 11.946 9.341 15.228 1.00 0.00 H new ATOM 0 HD2 HIS A 43 10.093 10.618 13.905 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.657 11.848 17.164 1.00 0.00 H new ATOM 0 HE2 HIS A 43 7.822 11.717 14.615 1.00 0.00 H new ATOM 515 N LEU A 44 11.957 6.590 16.496 1.00 0.00 N ATOM 516 CA LEU A 44 11.549 5.190 16.336 1.00 0.00 C ATOM 517 C LEU A 44 12.161 4.271 17.399 1.00 0.00 C ATOM 518 O LEU A 44 11.701 3.142 17.548 1.00 0.00 O ATOM 519 CB LEU A 44 12.006 4.672 14.954 1.00 0.00 C ATOM 520 CG LEU A 44 11.443 5.354 13.692 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.741 4.470 12.474 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.929 5.596 13.772 1.00 0.00 C ATOM 0 H LEU A 44 12.859 6.785 16.062 1.00 0.00 H new ATOM 0 HA LEU A 44 10.464 5.168 16.438 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.093 4.746 14.915 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.757 3.612 14.898 1.00 0.00 H new ATOM 0 HG LEU A 44 11.925 6.328 13.605 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.346 4.944 11.575 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.819 4.341 12.373 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.270 3.496 12.607 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.589 6.079 12.856 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.414 4.643 13.893 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.708 6.239 14.624 1.00 0.00 H new ATOM 534 N GLY A 45 13.242 4.690 18.063 1.00 0.00 N ATOM 535 CA GLY A 45 14.061 3.824 18.919 1.00 0.00 C ATOM 536 C GLY A 45 14.930 2.829 18.135 1.00 0.00 C ATOM 537 O GLY A 45 15.719 2.119 18.751 1.00 0.00 O ATOM 0 H GLY A 45 13.578 5.652 18.021 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.706 4.446 19.540 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.407 3.270 19.593 1.00 0.00 H new ATOM 541 N LEU A 46 14.801 2.756 16.804 1.00 0.00 N ATOM 542 CA LEU A 46 15.620 1.926 15.909 1.00 0.00 C ATOM 543 C LEU A 46 17.020 2.538 15.765 1.00 0.00 C ATOM 544 O LEU A 46 17.131 3.734 15.498 1.00 0.00 O ATOM 545 CB LEU A 46 14.935 1.837 14.523 1.00 0.00 C ATOM 546 CG LEU A 46 13.946 0.678 14.284 1.00 0.00 C ATOM 547 CD1 LEU A 46 14.668 -0.660 14.402 1.00 0.00 C ATOM 548 CD2 LEU A 46 12.705 0.684 15.183 1.00 0.00 C ATOM 0 H LEU A 46 14.096 3.294 16.301 1.00 0.00 H new ATOM 0 HA LEU A 46 15.716 0.925 16.329 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.403 2.773 14.352 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.717 1.772 13.766 1.00 0.00 H new ATOM 0 HG LEU A 46 13.569 0.829 13.272 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.961 -1.471 14.232 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.464 -0.711 13.659 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.096 -0.756 15.400 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.073 -0.170 14.937 1.00 0.00 H new ATOM 0 HD22 LEU A 46 13.012 0.620 16.227 1.00 0.00 H new ATOM 0 HD23 LEU A 46 12.146 1.606 15.025 1.00 0.00 H new ATOM 560 N THR A 47 18.100 1.753 15.869 1.00 0.00 N ATOM 561 CA THR A 47 19.464 2.295 15.798 1.00 0.00 C ATOM 562 C THR A 47 19.726 2.975 14.460 1.00 0.00 C ATOM 563 O THR A 47 19.246 2.553 13.404 1.00 0.00 O ATOM 564 CB THR A 47 20.507 1.232 16.155 1.00 0.00 C ATOM 565 OG1 THR A 47 21.687 1.887 16.560 1.00 0.00 O ATOM 566 CG2 THR A 47 20.883 0.286 15.015 1.00 0.00 C ATOM 0 H THR A 47 18.057 0.743 16.002 1.00 0.00 H new ATOM 0 HA THR A 47 19.559 3.075 16.553 1.00 0.00 H new ATOM 0 HB THR A 47 20.053 0.622 16.936 1.00 0.00 H new ATOM 0 HG1 THR A 47 22.367 1.221 16.795 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.627 -0.429 15.366 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.995 -0.249 14.679 1.00 0.00 H new ATOM 0 HG23 THR A 47 21.296 0.861 14.186 1.00 0.00 H new ATOM 574 N ARG A 48 20.535 4.036 14.502 1.00 0.00 N ATOM 575 CA ARG A 48 20.812 4.884 13.338 1.00 0.00 C ATOM 576 C ARG A 48 21.339 4.110 12.119 1.00 0.00 C ATOM 577 O ARG A 48 21.016 4.482 11.000 1.00 0.00 O ATOM 578 CB ARG A 48 21.701 6.087 13.701 1.00 0.00 C ATOM 579 CG ARG A 48 23.026 5.805 14.437 1.00 0.00 C ATOM 580 CD ARG A 48 22.855 5.528 15.943 1.00 0.00 C ATOM 581 NE ARG A 48 23.997 6.046 16.719 1.00 0.00 N ATOM 582 CZ ARG A 48 25.141 5.429 16.992 1.00 0.00 C ATOM 583 NH1 ARG A 48 25.352 4.162 16.701 1.00 0.00 N ATOM 584 NH2 ARG A 48 26.110 6.101 17.572 1.00 0.00 N ATOM 0 H ARG A 48 21.020 4.334 15.349 1.00 0.00 H new ATOM 0 HA ARG A 48 19.846 5.280 13.026 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.936 6.620 12.780 1.00 0.00 H new ATOM 0 HB3 ARG A 48 21.112 6.764 14.319 1.00 0.00 H new ATOM 0 HG2 ARG A 48 23.513 4.948 13.973 1.00 0.00 H new ATOM 0 HG3 ARG A 48 23.691 6.659 14.307 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.933 5.990 16.297 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.758 4.455 16.108 1.00 0.00 H new ATOM 0 HE ARG A 48 23.896 6.991 17.090 1.00 0.00 H new ATOM 0 HH11 ARG A 48 24.621 3.614 16.248 1.00 0.00 H new ATOM 0 HH12 ARG A 48 26.247 3.729 16.929 1.00 0.00 H new ATOM 0 HH21 ARG A 48 25.979 7.085 17.807 1.00 0.00 H new ATOM 0 HH22 ARG A 48 26.993 5.639 17.787 1.00 0.00 H new ATOM 598 N SER A 49 22.047 2.997 12.315 1.00 0.00 N ATOM 599 CA SER A 49 22.423 2.074 11.233 1.00 0.00 C ATOM 600 C SER A 49 21.196 1.417 10.569 1.00 0.00 C ATOM 601 O SER A 49 21.068 1.456 9.347 1.00 0.00 O ATOM 602 CB SER A 49 23.360 0.980 11.770 1.00 0.00 C ATOM 603 OG SER A 49 24.360 1.520 12.622 1.00 0.00 O ATOM 0 H SER A 49 22.380 2.705 13.234 1.00 0.00 H new ATOM 0 HA SER A 49 22.935 2.666 10.474 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.778 0.238 12.316 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.833 0.463 10.935 1.00 0.00 H new ATOM 0 HG SER A 49 24.937 0.798 12.947 1.00 0.00 H new ATOM 609 N ASN A 50 20.265 0.872 11.363 1.00 0.00 N ATOM 610 CA ASN A 50 19.013 0.240 10.917 1.00 0.00 C ATOM 611 C ASN A 50 18.088 1.269 10.233 1.00 0.00 C ATOM 612 O ASN A 50 17.641 1.059 9.102 1.00 0.00 O ATOM 613 CB ASN A 50 18.372 -0.412 12.162 1.00 0.00 C ATOM 614 CG ASN A 50 17.195 -1.345 11.889 1.00 0.00 C ATOM 615 OD1 ASN A 50 16.275 -1.027 11.142 1.00 0.00 O ATOM 616 ND2 ASN A 50 17.179 -2.494 12.541 1.00 0.00 N ATOM 0 H ASN A 50 20.367 0.858 12.378 1.00 0.00 H new ATOM 0 HA ASN A 50 19.198 -0.524 10.162 1.00 0.00 H new ATOM 0 HB2 ASN A 50 19.141 -0.973 12.692 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.036 0.380 12.832 1.00 0.00 H new ATOM 0 HD21 ASN A 50 16.393 -3.134 12.428 1.00 0.00 H new ATOM 0 HD22 ASN A 50 17.953 -2.741 13.158 1.00 0.00 H new ATOM 623 N VAL A 51 17.920 2.446 10.848 1.00 0.00 N ATOM 624 CA VAL A 51 17.245 3.611 10.240 1.00 0.00 C ATOM 625 C VAL A 51 17.904 4.028 8.909 1.00 0.00 C ATOM 626 O VAL A 51 17.190 4.246 7.934 1.00 0.00 O ATOM 627 CB VAL A 51 17.125 4.771 11.271 1.00 0.00 C ATOM 628 CG1 VAL A 51 17.317 6.192 10.715 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.753 4.684 11.965 1.00 0.00 C ATOM 0 H VAL A 51 18.252 2.624 11.796 1.00 0.00 H new ATOM 0 HA VAL A 51 16.227 3.325 9.974 1.00 0.00 H new ATOM 0 HB VAL A 51 17.955 4.624 11.962 1.00 0.00 H new ATOM 0 HG11 VAL A 51 17.211 6.916 11.523 1.00 0.00 H new ATOM 0 HG12 VAL A 51 18.311 6.280 10.276 1.00 0.00 H new ATOM 0 HG13 VAL A 51 16.565 6.389 9.951 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.660 5.493 12.689 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.962 4.771 11.220 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.665 3.726 12.478 1.00 0.00 H new ATOM 639 N SER A 52 19.241 4.095 8.821 1.00 0.00 N ATOM 640 CA SER A 52 19.947 4.473 7.582 1.00 0.00 C ATOM 641 C SER A 52 19.816 3.446 6.453 1.00 0.00 C ATOM 642 O SER A 52 19.628 3.840 5.301 1.00 0.00 O ATOM 643 CB SER A 52 21.430 4.780 7.842 1.00 0.00 C ATOM 644 OG SER A 52 22.205 3.676 8.288 1.00 0.00 O ATOM 0 H SER A 52 19.864 3.890 9.602 1.00 0.00 H new ATOM 0 HA SER A 52 19.447 5.380 7.243 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.871 5.166 6.923 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.496 5.574 8.586 1.00 0.00 H new ATOM 0 HG SER A 52 21.618 3.013 8.709 1.00 0.00 H new ATOM 650 N ASN A 53 19.845 2.147 6.772 1.00 0.00 N ATOM 651 CA ASN A 53 19.628 1.050 5.826 1.00 0.00 C ATOM 652 C ASN A 53 18.261 1.213 5.143 1.00 0.00 C ATOM 653 O ASN A 53 18.161 1.322 3.922 1.00 0.00 O ATOM 654 CB ASN A 53 19.747 -0.264 6.625 1.00 0.00 C ATOM 655 CG ASN A 53 19.444 -1.536 5.838 1.00 0.00 C ATOM 656 OD1 ASN A 53 19.413 -1.562 4.618 1.00 0.00 O ATOM 657 ND2 ASN A 53 19.205 -2.633 6.535 1.00 0.00 N ATOM 0 H ASN A 53 20.025 1.822 7.722 1.00 0.00 H new ATOM 0 HA ASN A 53 20.367 1.047 5.025 1.00 0.00 H new ATOM 0 HB2 ASN A 53 20.758 -0.336 7.025 1.00 0.00 H new ATOM 0 HB3 ASN A 53 19.070 -0.214 7.478 1.00 0.00 H new ATOM 0 HD21 ASN A 53 18.993 -3.507 6.054 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.232 -2.606 7.554 1.00 0.00 H new ATOM 664 N HIS A 54 17.198 1.378 5.934 1.00 0.00 N ATOM 665 CA HIS A 54 15.864 1.596 5.382 1.00 0.00 C ATOM 666 C HIS A 54 15.664 3.001 4.750 1.00 0.00 C ATOM 667 O HIS A 54 14.885 3.109 3.802 1.00 0.00 O ATOM 668 CB HIS A 54 14.827 1.235 6.458 1.00 0.00 C ATOM 669 CG HIS A 54 14.738 -0.254 6.736 1.00 0.00 C ATOM 670 ND1 HIS A 54 14.114 -1.216 5.962 1.00 0.00 N ATOM 671 CD2 HIS A 54 15.243 -0.910 7.829 1.00 0.00 C ATOM 672 CE1 HIS A 54 14.246 -2.402 6.578 1.00 0.00 C ATOM 673 NE2 HIS A 54 14.915 -2.263 7.730 1.00 0.00 N ATOM 0 H HIS A 54 17.237 1.365 6.953 1.00 0.00 H new ATOM 0 HA HIS A 54 15.723 0.934 4.528 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.078 1.755 7.382 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.848 1.597 6.144 1.00 0.00 H new ATOM 0 HD1 HIS A 54 13.636 -1.053 5.076 1.00 0.00 H new ATOM 0 HD2 HIS A 54 15.802 -0.455 8.633 1.00 0.00 H new ATOM 0 HE1 HIS A 54 13.865 -3.338 6.197 1.00 0.00 H new ATOM 681 N LEU A 55 16.368 4.066 5.170 1.00 0.00 N ATOM 682 CA LEU A 55 16.354 5.348 4.434 1.00 0.00 C ATOM 683 C LEU A 55 17.041 5.250 3.072 1.00 0.00 C ATOM 684 O LEU A 55 16.632 5.955 2.153 1.00 0.00 O ATOM 685 CB LEU A 55 17.056 6.472 5.213 1.00 0.00 C ATOM 686 CG LEU A 55 16.272 6.998 6.423 1.00 0.00 C ATOM 687 CD1 LEU A 55 17.258 7.710 7.362 1.00 0.00 C ATOM 688 CD2 LEU A 55 15.148 7.927 5.933 1.00 0.00 C ATOM 0 H LEU A 55 16.950 4.068 6.008 1.00 0.00 H new ATOM 0 HA LEU A 55 15.297 5.579 4.303 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.025 6.109 5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.249 7.302 4.533 1.00 0.00 H new ATOM 0 HG LEU A 55 15.800 6.187 6.978 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.722 8.093 8.230 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.022 7.005 7.689 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.730 8.538 6.834 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.588 8.303 6.789 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.581 8.765 5.386 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.478 7.372 5.276 1.00 0.00 H new ATOM 700 N SER A 56 18.075 4.425 2.942 1.00 0.00 N ATOM 701 CA SER A 56 18.839 4.279 1.701 1.00 0.00 C ATOM 702 C SER A 56 17.957 3.818 0.534 1.00 0.00 C ATOM 703 O SER A 56 18.125 4.308 -0.583 1.00 0.00 O ATOM 704 CB SER A 56 20.018 3.323 1.917 1.00 0.00 C ATOM 705 OG SER A 56 20.878 3.804 2.941 1.00 0.00 O ATOM 0 H SER A 56 18.412 3.832 3.700 1.00 0.00 H new ATOM 0 HA SER A 56 19.229 5.260 1.430 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.646 2.334 2.184 1.00 0.00 H new ATOM 0 HB3 SER A 56 20.578 3.213 0.988 1.00 0.00 H new ATOM 0 HG SER A 56 20.487 3.604 3.817 1.00 0.00 H new ATOM 711 N CYS A 57 16.946 2.974 0.788 1.00 0.00 N ATOM 712 CA CYS A 57 15.999 2.615 -0.252 1.00 0.00 C ATOM 713 C CYS A 57 14.992 3.747 -0.528 1.00 0.00 C ATOM 714 O CYS A 57 14.655 4.026 -1.677 1.00 0.00 O ATOM 715 CB CYS A 57 15.286 1.340 0.188 1.00 0.00 C ATOM 716 SG CYS A 57 14.300 0.709 -1.193 1.00 0.00 S ATOM 0 H CYS A 57 16.773 2.538 1.694 1.00 0.00 H new ATOM 0 HA CYS A 57 16.531 2.449 -1.189 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.013 0.592 0.504 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.645 1.544 1.046 1.00 0.00 H new ATOM 0 HG CYS A 57 14.218 -0.586 -1.112 1.00 0.00 H new ATOM 721 N LEU A 58 14.484 4.367 0.540 1.00 0.00 N ATOM 722 CA LEU A 58 13.360 5.306 0.526 1.00 0.00 C ATOM 723 C LEU A 58 13.717 6.651 -0.112 1.00 0.00 C ATOM 724 O LEU A 58 12.900 7.220 -0.840 1.00 0.00 O ATOM 725 CB LEU A 58 12.893 5.483 1.984 1.00 0.00 C ATOM 726 CG LEU A 58 11.388 5.738 2.167 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.529 4.558 1.705 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.168 6.047 3.653 1.00 0.00 C ATOM 0 H LEU A 58 14.860 4.222 1.477 1.00 0.00 H new ATOM 0 HA LEU A 58 12.559 4.901 -0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.164 4.589 2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.442 6.315 2.425 1.00 0.00 H new ATOM 0 HG LEU A 58 11.076 6.575 1.543 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.476 4.793 1.857 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.709 4.369 0.647 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.790 3.670 2.282 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.110 6.236 3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.492 5.197 4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.746 6.928 3.931 1.00 0.00 H new ATOM 740 N ARG A 59 14.932 7.147 0.162 1.00 0.00 N ATOM 741 CA ARG A 59 15.505 8.344 -0.466 1.00 0.00 C ATOM 742 C ARG A 59 15.946 8.072 -1.921 1.00 0.00 C ATOM 743 O ARG A 59 16.298 9.017 -2.617 1.00 0.00 O ATOM 744 CB ARG A 59 16.678 8.889 0.385 1.00 0.00 C ATOM 745 CG ARG A 59 16.330 9.294 1.840 1.00 0.00 C ATOM 746 CD ARG A 59 17.558 9.841 2.582 1.00 0.00 C ATOM 747 NE ARG A 59 17.168 10.417 3.884 1.00 0.00 N ATOM 748 CZ ARG A 59 17.893 10.492 4.993 1.00 0.00 C ATOM 749 NH1 ARG A 59 19.158 10.116 5.026 1.00 0.00 N ATOM 750 NH2 ARG A 59 17.315 10.932 6.094 1.00 0.00 N ATOM 0 H ARG A 59 15.558 6.716 0.843 1.00 0.00 H new ATOM 0 HA ARG A 59 14.727 9.106 -0.508 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.461 8.131 0.417 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.096 9.758 -0.123 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.544 10.049 1.830 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.936 8.430 2.375 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.283 9.041 2.735 1.00 0.00 H new ATOM 0 HD3 ARG A 59 18.047 10.602 1.974 1.00 0.00 H new ATOM 0 HE ARG A 59 16.226 10.805 3.938 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.605 9.755 4.183 1.00 0.00 H new ATOM 0 HH12 ARG A 59 19.688 10.186 5.894 1.00 0.00 H new ATOM 0 HH21 ARG A 59 16.332 11.205 6.080 1.00 0.00 H new ATOM 0 HH22 ARG A 59 17.851 10.999 6.959 1.00 0.00 H new ATOM 764 N GLY A 60 15.921 6.811 -2.383 1.00 0.00 N ATOM 765 CA GLY A 60 16.167 6.400 -3.775 1.00 0.00 C ATOM 766 C GLY A 60 14.882 6.123 -4.566 1.00 0.00 C ATOM 767 O GLY A 60 14.777 6.545 -5.709 1.00 0.00 O ATOM 0 H GLY A 60 15.721 6.019 -1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.735 7.181 -4.281 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.786 5.503 -3.777 1.00 0.00 H new ATOM 771 N CYS A 61 13.883 5.480 -3.948 1.00 0.00 N ATOM 772 CA CYS A 61 12.528 5.297 -4.465 1.00 0.00 C ATOM 773 C CYS A 61 11.673 6.589 -4.374 1.00 0.00 C ATOM 774 O CYS A 61 10.481 6.606 -4.676 1.00 0.00 O ATOM 775 CB CYS A 61 11.967 4.054 -3.755 1.00 0.00 C ATOM 776 SG CYS A 61 12.770 2.573 -4.428 1.00 0.00 S ATOM 0 H CYS A 61 14.008 5.054 -3.030 1.00 0.00 H new ATOM 0 HA CYS A 61 12.514 5.114 -5.539 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.143 4.122 -2.682 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.888 3.994 -3.898 1.00 0.00 H new ATOM 0 HG CYS A 61 12.303 1.517 -3.831 1.00 0.00 H new ATOM 781 N GLY A 62 12.300 7.653 -3.870 1.00 0.00 N ATOM 782 CA GLY A 62 11.855 9.050 -3.907 1.00 0.00 C ATOM 783 C GLY A 62 10.765 9.442 -2.919 1.00 0.00 C ATOM 784 O GLY A 62 10.332 10.585 -2.947 1.00 0.00 O ATOM 0 H GLY A 62 13.195 7.556 -3.391 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.721 9.689 -3.731 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.498 9.268 -4.913 1.00 0.00 H new ATOM 788 N LEU A 63 10.312 8.539 -2.041 1.00 0.00 N ATOM 789 CA LEU A 63 9.187 8.815 -1.130 1.00 0.00 C ATOM 790 C LEU A 63 9.526 9.802 -0.005 1.00 0.00 C ATOM 791 O LEU A 63 8.629 10.402 0.588 1.00 0.00 O ATOM 792 CB LEU A 63 8.697 7.500 -0.554 1.00 0.00 C ATOM 793 CG LEU A 63 8.291 6.496 -1.646 1.00 0.00 C ATOM 794 CD1 LEU A 63 7.834 5.276 -0.885 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.182 6.965 -2.602 1.00 0.00 C ATOM 0 H LEU A 63 10.708 7.605 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 63 8.406 9.301 -1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.481 7.063 0.064 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.844 7.688 0.098 1.00 0.00 H new ATOM 0 HG LEU A 63 9.141 6.329 -2.308 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.524 4.503 -1.589 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.654 4.901 -0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 63 6.994 5.541 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.974 6.181 -3.331 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.278 7.180 -2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.507 7.867 -3.121 1.00 0.00 H new ATOM 807 N VAL A 64 10.817 9.962 0.274 1.00 0.00 N ATOM 808 CA VAL A 64 11.356 10.834 1.332 1.00 0.00 C ATOM 809 C VAL A 64 12.406 11.811 0.843 1.00 0.00 C ATOM 810 O VAL A 64 13.260 11.462 0.032 1.00 0.00 O ATOM 811 CB VAL A 64 11.956 10.026 2.493 1.00 0.00 C ATOM 812 CG1 VAL A 64 10.795 9.440 3.290 1.00 0.00 C ATOM 813 CG2 VAL A 64 12.900 8.931 2.046 1.00 0.00 C ATOM 0 H VAL A 64 11.548 9.474 -0.244 1.00 0.00 H new ATOM 0 HA VAL A 64 10.492 11.403 1.675 1.00 0.00 H new ATOM 0 HB VAL A 64 12.564 10.696 3.101 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.184 8.858 4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.170 10.248 3.671 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.199 8.795 2.644 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.284 8.403 2.919 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.366 8.230 1.404 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.730 9.370 1.493 1.00 0.00 H new ATOM 823 N VAL A 65 12.336 13.034 1.376 1.00 0.00 N ATOM 824 CA VAL A 65 13.133 14.177 0.895 1.00 0.00 C ATOM 825 C VAL A 65 13.623 15.057 2.045 1.00 0.00 C ATOM 826 O VAL A 65 12.907 15.270 3.016 1.00 0.00 O ATOM 827 CB VAL A 65 12.316 15.007 -0.137 1.00 0.00 C ATOM 828 CG1 VAL A 65 12.971 16.343 -0.527 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.076 14.213 -1.434 1.00 0.00 C ATOM 0 H VAL A 65 11.723 13.265 2.158 1.00 0.00 H new ATOM 0 HA VAL A 65 14.020 13.780 0.401 1.00 0.00 H new ATOM 0 HB VAL A 65 11.377 15.220 0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 65 12.340 16.861 -1.249 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.090 16.963 0.362 1.00 0.00 H new ATOM 0 HG13 VAL A 65 13.949 16.153 -0.970 1.00 0.00 H new ATOM 0 HG21 VAL A 65 11.503 14.822 -2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.034 13.951 -1.883 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.521 13.303 -1.206 1.00 0.00 H new ATOM 839 N ALA A 66 14.854 15.571 1.928 1.00 0.00 N ATOM 840 CA ALA A 66 15.447 16.569 2.827 1.00 0.00 C ATOM 841 C ALA A 66 15.189 18.024 2.389 1.00 0.00 C ATOM 842 O ALA A 66 15.131 18.329 1.199 1.00 0.00 O ATOM 843 CB ALA A 66 16.950 16.282 2.946 1.00 0.00 C ATOM 0 H ALA A 66 15.487 15.293 1.178 1.00 0.00 H new ATOM 0 HA ALA A 66 14.963 16.477 3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 66 17.409 17.014 3.611 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.098 15.281 3.351 1.00 0.00 H new ATOM 0 HB3 ALA A 66 17.412 16.347 1.961 1.00 0.00 H new ATOM 849 N THR A 67 15.079 18.922 3.376 1.00 0.00 N ATOM 850 CA THR A 67 15.083 20.393 3.221 1.00 0.00 C ATOM 851 C THR A 67 15.986 20.948 4.300 1.00 0.00 C ATOM 852 O THR A 67 16.456 20.188 5.132 1.00 0.00 O ATOM 853 CB THR A 67 13.688 21.067 3.290 1.00 0.00 C ATOM 854 OG1 THR A 67 13.330 21.575 4.562 1.00 0.00 O ATOM 855 CG2 THR A 67 12.535 20.153 2.899 1.00 0.00 C ATOM 0 H THR A 67 14.980 18.636 4.350 1.00 0.00 H new ATOM 0 HA THR A 67 15.439 20.618 2.216 1.00 0.00 H new ATOM 0 HB THR A 67 13.821 21.878 2.574 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.740 22.349 4.451 1.00 0.00 H new ATOM 0 HG21 THR A 67 11.595 20.700 2.974 1.00 0.00 H new ATOM 0 HG22 THR A 67 12.674 19.810 1.874 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.509 19.294 3.569 1.00 0.00 H new ATOM 863 N TYR A 68 16.179 22.259 4.355 1.00 0.00 N ATOM 864 CA TYR A 68 16.786 22.905 5.518 1.00 0.00 C ATOM 865 C TYR A 68 15.666 23.431 6.435 1.00 0.00 C ATOM 866 O TYR A 68 14.721 24.051 5.944 1.00 0.00 O ATOM 867 CB TYR A 68 17.795 23.959 5.042 1.00 0.00 C ATOM 868 CG TYR A 68 19.115 23.919 5.784 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.033 22.901 5.463 1.00 0.00 C ATOM 870 CD2 TYR A 68 19.444 24.871 6.765 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.263 22.814 6.130 1.00 0.00 C ATOM 872 CE2 TYR A 68 20.672 24.781 7.453 1.00 0.00 C ATOM 873 CZ TYR A 68 21.584 23.751 7.141 1.00 0.00 C ATOM 874 OH TYR A 68 22.765 23.650 7.810 1.00 0.00 O ATOM 0 H TYR A 68 15.923 22.901 3.605 1.00 0.00 H new ATOM 0 HA TYR A 68 17.363 22.207 6.125 1.00 0.00 H new ATOM 0 HB2 TYR A 68 17.982 23.815 3.978 1.00 0.00 H new ATOM 0 HB3 TYR A 68 17.354 24.949 5.157 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.788 22.181 4.696 1.00 0.00 H new ATOM 0 HD2 TYR A 68 18.756 25.672 6.992 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.964 22.034 5.873 1.00 0.00 H new ATOM 0 HE2 TYR A 68 20.914 25.502 8.220 1.00 0.00 H new ATOM 0 HH TYR A 68 22.830 24.371 8.470 1.00 0.00 H new ATOM 884 N GLU A 69 15.712 23.100 7.730 1.00 0.00 N ATOM 885 CA GLU A 69 14.862 23.704 8.771 1.00 0.00 C ATOM 886 C GLU A 69 15.314 25.130 9.148 1.00 0.00 C ATOM 887 O GLU A 69 14.496 25.923 9.611 1.00 0.00 O ATOM 888 CB GLU A 69 14.639 22.769 9.989 1.00 0.00 C ATOM 889 CG GLU A 69 15.766 21.906 10.599 1.00 0.00 C ATOM 890 CD GLU A 69 16.720 22.636 11.543 1.00 0.00 C ATOM 891 OE1 GLU A 69 17.013 23.817 11.295 1.00 0.00 O ATOM 892 OE2 GLU A 69 17.261 22.021 12.494 1.00 0.00 O ATOM 0 H GLU A 69 16.351 22.393 8.094 1.00 0.00 H new ATOM 0 HA GLU A 69 13.872 23.824 8.331 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.257 23.395 10.795 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.839 22.083 9.711 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.311 21.077 11.141 1.00 0.00 H new ATOM 0 HG3 GLU A 69 16.349 21.474 9.786 1.00 0.00 H new ATOM 899 N GLY A 70 16.567 25.489 8.837 1.00 0.00 N ATOM 900 CA GLY A 70 17.129 26.841 8.979 1.00 0.00 C ATOM 901 C GLY A 70 18.442 26.846 9.759 1.00 0.00 C ATOM 902 O GLY A 70 19.393 27.517 9.366 1.00 0.00 O ATOM 0 H GLY A 70 17.243 24.821 8.466 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.295 27.268 7.990 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.406 27.481 9.485 1.00 0.00 H new ATOM 906 N ARG A 71 18.512 26.051 10.827 1.00 0.00 N ATOM 907 CA ARG A 71 19.708 25.762 11.625 1.00 0.00 C ATOM 908 C ARG A 71 20.424 24.507 11.098 1.00 0.00 C ATOM 909 O ARG A 71 21.652 24.466 11.063 1.00 0.00 O ATOM 910 CB ARG A 71 19.230 25.642 13.087 1.00 0.00 C ATOM 911 CG ARG A 71 20.278 25.287 14.158 1.00 0.00 C ATOM 912 CD ARG A 71 20.709 23.814 14.225 1.00 0.00 C ATOM 913 NE ARG A 71 19.564 22.887 14.257 1.00 0.00 N ATOM 914 CZ ARG A 71 19.410 21.812 15.016 1.00 0.00 C ATOM 915 NH1 ARG A 71 20.336 21.358 15.838 1.00 0.00 N ATOM 916 NH2 ARG A 71 18.274 21.177 14.903 1.00 0.00 N ATOM 0 H ARG A 71 17.689 25.562 11.180 1.00 0.00 H new ATOM 0 HA ARG A 71 20.456 26.552 11.556 1.00 0.00 H new ATOM 0 HB2 ARG A 71 18.771 26.590 13.368 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.446 24.886 13.122 1.00 0.00 H new ATOM 0 HG2 ARG A 71 21.165 25.896 13.984 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.882 25.572 15.133 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.334 23.583 13.362 1.00 0.00 H new ATOM 0 HD3 ARG A 71 21.322 23.659 15.113 1.00 0.00 H new ATOM 0 HE ARG A 71 18.798 23.098 13.618 1.00 0.00 H new ATOM 0 HH11 ARG A 71 21.231 21.841 15.915 1.00 0.00 H new ATOM 0 HH12 ARG A 71 20.157 20.524 16.397 1.00 0.00 H new ATOM 0 HH21 ARG A 71 17.563 21.516 14.255 1.00 0.00 H new ATOM 0 HH22 ARG A 71 18.099 20.342 15.462 1.00 0.00 H new ATOM 930 N GLN A 72 19.682 23.489 10.669 1.00 0.00 N ATOM 931 CA GLN A 72 20.162 22.232 10.092 1.00 0.00 C ATOM 932 C GLN A 72 19.241 21.771 8.954 1.00 0.00 C ATOM 933 O GLN A 72 18.292 22.450 8.570 1.00 0.00 O ATOM 934 CB GLN A 72 20.270 21.140 11.192 1.00 0.00 C ATOM 935 CG GLN A 72 21.690 20.594 11.416 1.00 0.00 C ATOM 936 CD GLN A 72 22.519 21.406 12.412 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.463 21.200 13.612 1.00 0.00 O ATOM 938 NE2 GLN A 72 23.295 22.374 11.983 1.00 0.00 N ATOM 0 H GLN A 72 18.664 23.520 10.717 1.00 0.00 H new ATOM 0 HA GLN A 72 21.155 22.399 9.675 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.901 21.552 12.131 1.00 0.00 H new ATOM 0 HB3 GLN A 72 19.614 20.311 10.928 1.00 0.00 H new ATOM 0 HG2 GLN A 72 21.621 19.565 11.770 1.00 0.00 H new ATOM 0 HG3 GLN A 72 22.213 20.568 10.460 1.00 0.00 H new ATOM 0 HE21 GLN A 72 23.362 22.569 10.984 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.831 22.931 12.649 1.00 0.00 H new ATOM 947 N VAL A 73 19.533 20.591 8.411 1.00 0.00 N ATOM 948 CA VAL A 73 18.638 19.878 7.505 1.00 0.00 C ATOM 949 C VAL A 73 17.525 19.204 8.301 1.00 0.00 C ATOM 950 O VAL A 73 17.744 18.770 9.432 1.00 0.00 O ATOM 951 CB VAL A 73 19.340 18.779 6.676 1.00 0.00 C ATOM 952 CG1 VAL A 73 19.820 19.287 5.308 1.00 0.00 C ATOM 953 CG2 VAL A 73 20.547 18.157 7.408 1.00 0.00 C ATOM 0 H VAL A 73 20.408 20.098 8.590 1.00 0.00 H new ATOM 0 HA VAL A 73 18.255 20.632 6.817 1.00 0.00 H new ATOM 0 HB VAL A 73 18.575 18.016 6.532 1.00 0.00 H new ATOM 0 HG11 VAL A 73 20.306 18.474 4.768 1.00 0.00 H new ATOM 0 HG12 VAL A 73 18.966 19.646 4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.529 20.102 5.451 1.00 0.00 H new ATOM 0 HG21 VAL A 73 21.000 17.392 6.778 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.282 18.933 7.622 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.213 17.706 8.343 1.00 0.00 H new ATOM 963 N ARG A 74 16.374 19.046 7.646 1.00 0.00 N ATOM 964 CA ARG A 74 15.249 18.225 8.048 1.00 0.00 C ATOM 965 C ARG A 74 14.981 17.194 6.964 1.00 0.00 C ATOM 966 O ARG A 74 15.739 17.030 6.011 1.00 0.00 O ATOM 967 CB ARG A 74 14.008 19.055 8.414 1.00 0.00 C ATOM 968 CG ARG A 74 13.154 19.598 7.265 1.00 0.00 C ATOM 969 CD ARG A 74 11.987 20.426 7.805 1.00 0.00 C ATOM 970 NE ARG A 74 11.411 21.271 6.753 1.00 0.00 N ATOM 971 CZ ARG A 74 10.470 22.189 6.925 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.859 22.355 8.082 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.136 22.975 5.924 1.00 0.00 N ATOM 0 H ARG A 74 16.199 19.524 6.762 1.00 0.00 H new ATOM 0 HA ARG A 74 15.503 17.701 8.969 1.00 0.00 H new ATOM 0 HB2 ARG A 74 13.368 18.441 9.047 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.336 19.901 9.018 1.00 0.00 H new ATOM 0 HG2 ARG A 74 13.769 20.212 6.607 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.773 18.771 6.666 1.00 0.00 H new ATOM 0 HD2 ARG A 74 11.220 19.763 8.204 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.330 21.050 8.630 1.00 0.00 H new ATOM 0 HE ARG A 74 11.766 21.141 5.806 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.106 21.768 8.878 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.139 23.071 8.181 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.600 22.876 5.021 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.413 23.683 6.051 1.00 0.00 H new ATOM 987 N TYR A 75 13.897 16.463 7.129 1.00 0.00 N ATOM 988 CA TYR A 75 13.462 15.416 6.223 1.00 0.00 C ATOM 989 C TYR A 75 11.915 15.421 6.189 1.00 0.00 C ATOM 990 O TYR A 75 11.327 16.047 7.064 1.00 0.00 O ATOM 991 CB TYR A 75 14.202 14.145 6.674 1.00 0.00 C ATOM 992 CG TYR A 75 13.583 13.346 7.763 1.00 0.00 C ATOM 993 CD1 TYR A 75 13.277 13.917 9.006 1.00 0.00 C ATOM 994 CD2 TYR A 75 13.243 12.018 7.463 1.00 0.00 C ATOM 995 CE1 TYR A 75 12.514 13.182 9.917 1.00 0.00 C ATOM 996 CE2 TYR A 75 12.486 11.291 8.366 1.00 0.00 C ATOM 997 CZ TYR A 75 12.078 11.876 9.581 1.00 0.00 C ATOM 998 OH TYR A 75 11.205 11.183 10.349 1.00 0.00 O ATOM 0 H TYR A 75 13.272 16.585 7.926 1.00 0.00 H new ATOM 0 HA TYR A 75 13.719 15.535 5.171 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.320 13.497 5.805 1.00 0.00 H new ATOM 0 HB3 TYR A 75 15.203 14.433 6.994 1.00 0.00 H new ATOM 0 HD1 TYR A 75 13.625 14.908 9.255 1.00 0.00 H new ATOM 0 HD2 TYR A 75 13.569 11.568 6.537 1.00 0.00 H new ATOM 0 HE1 TYR A 75 12.257 13.608 10.875 1.00 0.00 H new ATOM 0 HE2 TYR A 75 12.208 10.273 8.138 1.00 0.00 H new ATOM 0 HH TYR A 75 11.596 11.033 11.235 1.00 0.00 H new ATOM 1008 N ALA A 76 11.253 14.835 5.186 1.00 0.00 N ATOM 1009 CA ALA A 76 9.807 14.980 4.936 1.00 0.00 C ATOM 1010 C ALA A 76 9.269 13.954 3.924 1.00 0.00 C ATOM 1011 O ALA A 76 10.054 13.420 3.130 1.00 0.00 O ATOM 1012 CB ALA A 76 9.535 16.411 4.433 1.00 0.00 C ATOM 0 H ALA A 76 11.715 14.231 4.506 1.00 0.00 H new ATOM 0 HA ALA A 76 9.284 14.792 5.874 1.00 0.00 H new ATOM 0 HB1 ALA A 76 8.469 16.534 4.244 1.00 0.00 H new ATOM 0 HB2 ALA A 76 9.854 17.129 5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.090 16.584 3.511 1.00 0.00 H new ATOM 1018 N LEU A 77 7.942 13.712 3.938 1.00 0.00 N ATOM 1019 CA LEU A 77 7.254 13.004 2.846 1.00 0.00 C ATOM 1020 C LEU A 77 7.468 13.849 1.579 1.00 0.00 C ATOM 1021 O LEU A 77 7.337 15.072 1.635 1.00 0.00 O ATOM 1022 CB LEU A 77 5.720 12.847 3.086 1.00 0.00 C ATOM 1023 CG LEU A 77 5.173 11.914 4.173 1.00 0.00 C ATOM 1024 CD1 LEU A 77 5.956 10.616 4.326 1.00 0.00 C ATOM 1025 CD2 LEU A 77 5.038 12.656 5.502 1.00 0.00 C ATOM 0 H LEU A 77 7.326 13.999 4.698 1.00 0.00 H new ATOM 0 HA LEU A 77 7.662 11.996 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.328 13.842 3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.282 12.524 2.141 1.00 0.00 H new ATOM 0 HG LEU A 77 4.181 11.607 3.842 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.507 10.011 5.114 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.932 10.064 3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.990 10.843 4.587 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.648 11.977 6.260 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.015 13.025 5.813 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.354 13.496 5.382 1.00 0.00 H new ATOM 1037 N ALA A 78 7.772 13.224 0.438 1.00 0.00 N ATOM 1038 CA ALA A 78 8.126 13.945 -0.796 1.00 0.00 C ATOM 1039 C ALA A 78 7.010 14.851 -1.359 1.00 0.00 C ATOM 1040 O ALA A 78 7.291 15.825 -2.066 1.00 0.00 O ATOM 1041 CB ALA A 78 8.585 12.910 -1.823 1.00 0.00 C ATOM 0 H ALA A 78 7.781 12.209 0.340 1.00 0.00 H new ATOM 0 HA ALA A 78 8.926 14.645 -0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.855 13.413 -2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.451 12.373 -1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.777 12.205 -2.015 1.00 0.00 H new ATOM 1047 N ASP A 79 5.750 14.564 -1.021 1.00 0.00 N ATOM 1048 CA ASP A 79 4.611 15.445 -1.268 1.00 0.00 C ATOM 1049 C ASP A 79 3.405 15.140 -0.368 1.00 0.00 C ATOM 1050 O ASP A 79 3.242 14.031 0.151 1.00 0.00 O ATOM 1051 CB ASP A 79 4.168 15.400 -2.748 1.00 0.00 C ATOM 1052 CG ASP A 79 3.208 16.561 -3.031 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.686 17.714 -2.926 1.00 0.00 O ATOM 1054 OD2 ASP A 79 1.984 16.315 -3.121 1.00 0.00 O ATOM 0 H ASP A 79 5.490 13.693 -0.558 1.00 0.00 H new ATOM 0 HA ASP A 79 4.964 16.447 -1.024 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.038 15.466 -3.401 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.680 14.450 -2.964 1.00 0.00 H new ATOM 1059 N SER A 80 2.514 16.134 -0.288 1.00 0.00 N ATOM 1060 CA SER A 80 1.161 16.049 0.259 1.00 0.00 C ATOM 1061 C SER A 80 0.422 14.778 -0.180 1.00 0.00 C ATOM 1062 O SER A 80 -0.300 14.196 0.621 1.00 0.00 O ATOM 1063 CB SER A 80 0.360 17.275 -0.212 1.00 0.00 C ATOM 1064 OG SER A 80 -0.007 17.207 -1.587 1.00 0.00 O ATOM 0 H SER A 80 2.733 17.072 -0.623 1.00 0.00 H new ATOM 0 HA SER A 80 1.247 16.019 1.345 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.541 17.368 0.394 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.952 18.175 -0.044 1.00 0.00 H new ATOM 0 HG SER A 80 0.716 16.788 -2.098 1.00 0.00 H new ATOM 1070 N HIS A 81 0.650 14.311 -1.417 1.00 0.00 N ATOM 1071 CA HIS A 81 0.077 13.097 -1.984 1.00 0.00 C ATOM 1072 C HIS A 81 0.390 11.849 -1.152 1.00 0.00 C ATOM 1073 O HIS A 81 -0.535 11.094 -0.860 1.00 0.00 O ATOM 1074 CB HIS A 81 0.571 12.947 -3.441 1.00 0.00 C ATOM 1075 CG HIS A 81 -0.456 13.195 -4.520 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -1.820 13.363 -4.376 1.00 0.00 N ATOM 1077 CD2 HIS A 81 -0.218 12.988 -5.847 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -2.394 13.189 -5.582 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -1.430 13.021 -6.507 1.00 0.00 N ATOM 0 H HIS A 81 1.266 14.795 -2.071 1.00 0.00 H new ATOM 0 HA HIS A 81 -1.009 13.190 -1.972 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.402 13.635 -3.594 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.965 11.939 -3.568 1.00 0.00 H new ATOM 0 HD2 HIS A 81 0.748 12.827 -6.301 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -3.456 13.185 -5.776 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -1.570 12.934 -7.514 1.00 0.00 H new ATOM 1088 N LEU A 82 1.651 11.610 -0.758 1.00 0.00 N ATOM 1089 CA LEU A 82 1.977 10.425 0.058 1.00 0.00 C ATOM 1090 C LEU A 82 1.390 10.605 1.449 1.00 0.00 C ATOM 1091 O LEU A 82 0.655 9.736 1.895 1.00 0.00 O ATOM 1092 CB LEU A 82 3.491 10.120 0.134 1.00 0.00 C ATOM 1093 CG LEU A 82 4.272 10.341 -1.176 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.758 10.096 -0.916 1.00 0.00 C ATOM 1095 CD2 LEU A 82 3.770 9.428 -2.307 1.00 0.00 C ATOM 0 H LEU A 82 2.447 12.206 -0.984 1.00 0.00 H new ATOM 0 HA LEU A 82 1.532 9.559 -0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.932 10.744 0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.621 9.084 0.445 1.00 0.00 H new ATOM 0 HG LEU A 82 4.113 11.369 -1.502 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.319 10.250 -1.838 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.113 10.790 -0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.903 9.073 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.348 9.617 -3.211 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.888 8.385 -2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.717 9.633 -2.500 1.00 0.00 H new ATOM 1107 N ALA A 83 1.598 11.782 2.052 1.00 0.00 N ATOM 1108 CA ALA A 83 0.995 12.218 3.314 1.00 0.00 C ATOM 1109 C ALA A 83 -0.551 12.162 3.341 1.00 0.00 C ATOM 1110 O ALA A 83 -1.134 12.217 4.420 1.00 0.00 O ATOM 1111 CB ALA A 83 1.502 13.642 3.577 1.00 0.00 C ATOM 0 H ALA A 83 2.219 12.487 1.654 1.00 0.00 H new ATOM 0 HA ALA A 83 1.295 11.524 4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.079 14.012 4.511 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.590 13.633 3.650 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.199 14.293 2.757 1.00 0.00 H new ATOM 1117 N ARG A 84 -1.219 12.071 2.182 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.671 11.934 2.063 1.00 0.00 C ATOM 1119 C ARG A 84 -3.083 10.483 2.324 1.00 0.00 C ATOM 1120 O ARG A 84 -3.598 10.213 3.406 1.00 0.00 O ATOM 1121 CB ARG A 84 -3.139 12.491 0.700 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.630 12.809 0.543 1.00 0.00 C ATOM 1123 CD ARG A 84 -5.168 13.773 1.607 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.704 13.030 2.747 1.00 0.00 N ATOM 1125 CZ ARG A 84 -5.457 13.131 4.042 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -4.572 13.962 4.551 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -6.147 12.349 4.832 1.00 0.00 N ATOM 0 H ARG A 84 -0.747 12.092 1.278 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.178 12.529 2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.577 13.403 0.498 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.865 11.770 -0.070 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.799 13.240 -0.444 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.198 11.879 0.587 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.371 14.437 1.941 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.947 14.402 1.176 1.00 0.00 H new ATOM 0 HE ARG A 84 -6.385 12.311 2.501 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -4.033 14.573 3.937 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -4.425 13.995 5.560 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.833 11.705 4.439 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -5.999 12.384 5.841 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.711 9.540 1.449 1.00 0.00 N ATOM 1142 CA ALA A 85 -3.027 8.110 1.603 1.00 0.00 C ATOM 1143 C ALA A 85 -2.417 7.483 2.871 1.00 0.00 C ATOM 1144 O ALA A 85 -3.016 6.605 3.486 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.576 7.378 0.334 1.00 0.00 C ATOM 0 H ALA A 85 -2.177 9.748 0.605 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.104 8.007 1.733 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.801 6.316 0.427 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.103 7.786 -0.528 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.503 7.511 0.199 1.00 0.00 H new ATOM 1151 N LEU A 86 -1.244 7.962 3.293 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.605 7.657 4.580 1.00 0.00 C ATOM 1153 C LEU A 86 -1.395 8.263 5.760 1.00 0.00 C ATOM 1154 O LEU A 86 -1.469 7.653 6.824 1.00 0.00 O ATOM 1155 CB LEU A 86 0.829 8.209 4.442 1.00 0.00 C ATOM 1156 CG LEU A 86 1.870 8.105 5.563 1.00 0.00 C ATOM 1157 CD1 LEU A 86 1.898 6.854 6.436 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.245 8.348 4.935 1.00 0.00 C ATOM 0 H LEU A 86 -0.688 8.601 2.724 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.586 6.590 4.804 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.265 7.726 3.568 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.732 9.269 4.205 1.00 0.00 H new ATOM 0 HG LEU A 86 1.567 8.861 6.288 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.693 6.945 7.177 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.940 6.743 6.944 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.082 5.979 5.812 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.014 8.282 5.705 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.433 7.596 4.169 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.269 9.340 4.483 1.00 0.00 H new ATOM 1170 N GLY A 87 -2.035 9.421 5.547 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.707 10.262 6.545 1.00 0.00 C ATOM 1172 C GLY A 87 -4.160 9.894 6.850 1.00 0.00 C ATOM 1173 O GLY A 87 -4.569 10.015 8.001 1.00 0.00 O ATOM 0 H GLY A 87 -2.101 9.821 4.611 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.138 10.218 7.473 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.677 11.296 6.201 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.956 9.458 5.865 1.00 0.00 N ATOM 1178 CA GLU A 88 -6.285 8.870 6.146 1.00 0.00 C ATOM 1179 C GLU A 88 -6.200 7.436 6.689 1.00 0.00 C ATOM 1180 O GLU A 88 -7.220 6.885 7.116 1.00 0.00 O ATOM 1181 CB GLU A 88 -7.252 8.935 4.943 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.703 8.558 3.544 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.593 9.743 2.571 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -7.230 10.789 2.829 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.800 9.668 1.609 1.00 0.00 O ATOM 0 H GLU A 88 -4.713 9.498 4.875 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.703 9.501 6.931 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -8.096 8.279 5.158 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.644 9.950 4.885 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.718 8.106 3.662 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.351 7.800 3.104 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.996 6.843 6.646 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.696 5.440 6.925 1.00 0.00 C ATOM 1194 C LEU A 89 -5.325 4.590 5.814 1.00 0.00 C ATOM 1195 O LEU A 89 -6.453 4.819 5.388 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.135 5.076 8.368 1.00 0.00 C ATOM 1197 CG LEU A 89 -4.530 3.801 8.995 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -4.579 3.908 10.527 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.273 2.514 8.591 1.00 0.00 C ATOM 0 H LEU A 89 -4.157 7.369 6.399 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.625 5.236 6.907 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.892 5.918 9.016 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.220 4.972 8.374 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.507 3.734 8.624 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.152 3.008 10.968 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -4.006 4.777 10.850 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -5.614 4.015 10.851 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -4.798 1.655 9.065 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -6.312 2.577 8.913 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.236 2.397 7.508 1.00 0.00 H new ATOM 1211 N VAL A 90 -4.649 3.528 5.387 1.00 0.00 N ATOM 1212 CA VAL A 90 -5.065 2.667 4.256 1.00 0.00 C ATOM 1213 C VAL A 90 -6.309 1.817 4.541 1.00 0.00 C ATOM 1214 O VAL A 90 -6.531 0.778 3.919 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.956 1.713 3.790 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.702 2.448 3.297 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -3.612 0.758 4.944 1.00 0.00 C ATOM 0 H VAL A 90 -3.776 3.225 5.819 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.298 3.388 3.472 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.329 1.153 2.932 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.954 1.720 2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.963 3.089 2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.297 3.058 4.104 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.825 0.074 4.628 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -3.268 1.334 5.803 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.499 0.188 5.221 1.00 0.00 H new ATOM 1227 N GLN A 91 -7.102 2.192 5.542 1.00 0.00 N ATOM 1228 CA GLN A 91 -8.500 1.829 5.630 1.00 0.00 C ATOM 1229 C GLN A 91 -8.735 0.380 6.090 1.00 0.00 C ATOM 1230 O GLN A 91 -9.845 0.074 6.496 1.00 0.00 O ATOM 1231 CB GLN A 91 -9.168 2.123 4.276 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.194 3.605 3.844 1.00 0.00 C ATOM 1233 CD GLN A 91 -9.939 4.567 4.769 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.153 4.681 4.710 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.293 5.239 5.700 1.00 0.00 N ATOM 0 H GLN A 91 -6.780 2.765 6.322 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.960 2.436 6.410 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.652 1.549 3.506 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.194 1.757 4.312 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.165 3.951 3.747 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.645 3.665 2.853 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.278 5.163 5.773 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.807 5.835 6.348 1.00 0.00 H new ATOM 1244 N VAL A 92 -7.729 -0.501 6.103 1.00 0.00 N ATOM 1245 CA VAL A 92 -7.807 -1.940 6.460 1.00 0.00 C ATOM 1246 C VAL A 92 -8.103 -2.243 7.939 1.00 0.00 C ATOM 1247 O VAL A 92 -7.598 -3.180 8.542 1.00 0.00 O ATOM 1248 CB VAL A 92 -6.590 -2.712 5.904 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -5.331 -2.441 6.742 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -6.895 -4.212 5.727 1.00 0.00 C ATOM 0 H VAL A 92 -6.780 -0.223 5.852 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.701 -2.316 5.962 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.379 -2.335 4.903 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.491 -2.998 6.327 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.104 -1.375 6.724 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -5.503 -2.758 7.771 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.014 -4.719 5.334 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -7.163 -4.645 6.691 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -7.725 -4.335 5.031 1.00 0.00 H new ATOM 1260 N VAL A 93 -8.930 -1.402 8.548 1.00 0.00 N ATOM 1261 CA VAL A 93 -9.474 -1.558 9.901 1.00 0.00 C ATOM 1262 C VAL A 93 -8.395 -1.393 10.996 1.00 0.00 C ATOM 1263 O VAL A 93 -8.706 -1.570 12.171 1.00 0.00 O ATOM 1264 CB VAL A 93 -10.273 -2.889 10.071 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -11.381 -2.725 11.125 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -10.996 -3.366 8.789 1.00 0.00 C ATOM 0 H VAL A 93 -9.258 -0.550 8.094 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.185 -0.743 10.036 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.515 -3.619 10.354 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -11.926 -3.663 11.229 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -10.935 -2.456 12.083 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -12.068 -1.939 10.811 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -11.526 -4.296 8.995 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -11.708 -2.606 8.469 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.264 -3.533 7.999 1.00 0.00 H new ATOM 1276 N LEU A 94 -7.163 -1.039 10.579 1.00 0.00 N ATOM 1277 CA LEU A 94 -5.880 -0.974 11.291 1.00 0.00 C ATOM 1278 C LEU A 94 -5.064 -2.251 11.035 1.00 0.00 C ATOM 1279 O LEU A 94 -5.334 -3.317 11.586 1.00 0.00 O ATOM 1280 CB LEU A 94 -5.962 -0.641 12.791 1.00 0.00 C ATOM 1281 CG LEU A 94 -6.178 0.851 13.112 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -7.371 1.518 12.415 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -6.352 0.974 14.626 1.00 0.00 C ATOM 0 H LEU A 94 -7.033 -0.756 9.608 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.363 -0.113 10.868 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.777 -1.215 13.232 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.042 -0.972 13.273 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.303 1.378 12.731 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.428 2.565 12.713 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.243 1.455 11.334 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -8.291 1.009 12.702 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.508 2.020 14.891 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.215 0.388 14.942 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.458 0.602 15.126 1.00 0.00 H new ATOM 1295 N ALA A 95 -4.034 -2.120 10.200 1.00 0.00 N ATOM 1296 CA ALA A 95 -3.057 -3.148 9.840 1.00 0.00 C ATOM 1297 C ALA A 95 -2.183 -3.644 11.020 1.00 0.00 C ATOM 1298 O ALA A 95 -0.963 -3.480 11.017 1.00 0.00 O ATOM 1299 CB ALA A 95 -2.211 -2.589 8.687 1.00 0.00 C ATOM 0 H ALA A 95 -3.847 -1.236 9.726 1.00 0.00 H new ATOM 0 HA ALA A 95 -3.594 -4.045 9.532 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.468 -3.329 8.389 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.857 -2.361 7.839 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.707 -1.680 9.013 1.00 0.00 H new ATOM 1305 N VAL A 96 -2.796 -4.309 12.001 1.00 0.00 N ATOM 1306 CA VAL A 96 -2.069 -5.045 13.052 1.00 0.00 C ATOM 1307 C VAL A 96 -1.058 -6.017 12.424 1.00 0.00 C ATOM 1308 O VAL A 96 -1.387 -6.687 11.447 1.00 0.00 O ATOM 1309 CB VAL A 96 -3.003 -5.805 14.018 1.00 0.00 C ATOM 1310 CG1 VAL A 96 -3.745 -4.804 14.908 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -4.018 -6.732 13.325 1.00 0.00 C ATOM 0 H VAL A 96 -3.811 -4.356 12.094 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.543 -4.297 13.645 1.00 0.00 H new ATOM 0 HB VAL A 96 -2.359 -6.455 14.610 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.404 -5.342 15.589 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.023 -4.224 15.483 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.337 -4.133 14.286 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.633 -7.226 14.078 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.655 -6.144 12.664 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.485 -7.483 12.742 1.00 0.00 H new ATOM 1321 N ASP A 97 0.154 -6.112 12.986 1.00 0.00 N ATOM 1322 CA ASP A 97 1.292 -6.809 12.352 1.00 0.00 C ATOM 1323 C ASP A 97 0.992 -8.293 12.076 1.00 0.00 C ATOM 1324 O ASP A 97 1.444 -8.837 11.069 1.00 0.00 O ATOM 1325 CB ASP A 97 2.572 -6.684 13.215 1.00 0.00 C ATOM 1326 CG ASP A 97 3.541 -5.554 12.817 1.00 0.00 C ATOM 1327 OD1 ASP A 97 3.174 -4.676 12.007 1.00 0.00 O ATOM 1328 OD2 ASP A 97 4.664 -5.524 13.371 1.00 0.00 O ATOM 0 H ASP A 97 0.378 -5.708 13.895 1.00 0.00 H new ATOM 0 HA ASP A 97 1.457 -6.319 11.392 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.275 -6.533 14.253 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.110 -7.631 13.172 1.00 0.00 H new ATOM 1333 N THR A 98 0.151 -8.885 12.942 1.00 0.00 N ATOM 1334 CA THR A 98 -0.351 -10.280 12.928 1.00 0.00 C ATOM 1335 C THR A 98 0.755 -11.283 13.284 1.00 0.00 C ATOM 1336 O THR A 98 1.935 -11.071 13.026 1.00 0.00 O ATOM 1337 CB THR A 98 -1.026 -10.676 11.596 1.00 0.00 C ATOM 1338 OG1 THR A 98 -1.678 -9.556 11.026 1.00 0.00 O ATOM 1339 CG2 THR A 98 -2.118 -11.729 11.788 1.00 0.00 C ATOM 0 H THR A 98 -0.228 -8.364 13.733 1.00 0.00 H new ATOM 0 HA THR A 98 -1.122 -10.319 13.697 1.00 0.00 H new ATOM 0 HB THR A 98 -0.228 -11.064 10.963 1.00 0.00 H new ATOM 0 HG1 THR A 98 -2.635 -9.747 10.932 1.00 0.00 H new ATOM 0 HG21 THR A 98 -2.562 -11.973 10.823 1.00 0.00 H new ATOM 0 HG22 THR A 98 -1.684 -12.628 12.226 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.888 -11.337 12.452 1.00 0.00 H new ATOM 1347 N ASP A 99 0.365 -12.412 13.864 1.00 0.00 N ATOM 1348 CA ASP A 99 1.233 -13.553 14.202 1.00 0.00 C ATOM 1349 C ASP A 99 1.408 -14.577 13.055 1.00 0.00 C ATOM 1350 O ASP A 99 2.075 -15.599 13.229 1.00 0.00 O ATOM 1351 CB ASP A 99 0.629 -14.235 15.450 1.00 0.00 C ATOM 1352 CG ASP A 99 -0.763 -14.837 15.193 1.00 0.00 C ATOM 1353 OD1 ASP A 99 -1.658 -14.069 14.764 1.00 0.00 O ATOM 1354 OD2 ASP A 99 -0.935 -16.062 15.375 1.00 0.00 O ATOM 0 H ASP A 99 -0.607 -12.572 14.127 1.00 0.00 H new ATOM 0 HA ASP A 99 2.237 -13.173 14.391 1.00 0.00 H new ATOM 0 HB2 ASP A 99 1.302 -15.023 15.788 1.00 0.00 H new ATOM 0 HB3 ASP A 99 0.560 -13.506 16.258 1.00 0.00 H new ATOM 1359 N GLN A 100 0.801 -14.334 11.886 1.00 0.00 N ATOM 1360 CA GLN A 100 0.656 -15.336 10.824 1.00 0.00 C ATOM 1361 C GLN A 100 1.812 -15.374 9.796 1.00 0.00 C ATOM 1362 O GLN A 100 2.387 -14.337 9.460 1.00 0.00 O ATOM 1363 CB GLN A 100 -0.719 -15.152 10.136 1.00 0.00 C ATOM 1364 CG GLN A 100 -1.674 -16.357 10.263 1.00 0.00 C ATOM 1365 CD GLN A 100 -1.712 -16.983 11.660 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -1.467 -18.168 11.822 1.00 0.00 O ATOM 1367 NE2 GLN A 100 -1.939 -16.199 12.692 1.00 0.00 N ATOM 0 H GLN A 100 0.394 -13.429 11.650 1.00 0.00 H new ATOM 0 HA GLN A 100 0.709 -16.312 11.307 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.207 -14.274 10.560 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -0.555 -14.946 9.078 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.681 -16.039 9.992 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -1.376 -17.120 9.543 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -2.143 -15.210 12.546 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -1.911 -16.580 13.638 1.00 0.00 H new ATOM 1376 N PRO A 101 2.145 -16.565 9.252 1.00 0.00 N ATOM 1377 CA PRO A 101 3.237 -16.752 8.297 1.00 0.00 C ATOM 1378 C PRO A 101 2.806 -16.705 6.819 1.00 0.00 C ATOM 1379 O PRO A 101 3.556 -17.196 5.974 1.00 0.00 O ATOM 1380 CB PRO A 101 3.821 -18.119 8.680 1.00 0.00 C ATOM 1381 CG PRO A 101 2.561 -18.915 9.011 1.00 0.00 C ATOM 1382 CD PRO A 101 1.695 -17.875 9.721 1.00 0.00 C ATOM 0 HA PRO A 101 3.957 -15.936 8.361 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.384 -18.567 7.861 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.497 -18.051 9.532 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.078 -19.303 8.114 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.777 -19.770 9.652 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.640 -18.027 9.491 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.801 -17.956 10.803 1.00 0.00 H new ATOM 1390 N CYS A 102 1.627 -16.161 6.471 1.00 0.00 N ATOM 1391 CA CYS A 102 1.169 -16.142 5.085 1.00 0.00 C ATOM 1392 C CYS A 102 1.954 -15.164 4.179 1.00 0.00 C ATOM 1393 O CYS A 102 2.777 -14.341 4.584 1.00 0.00 O ATOM 1394 CB CYS A 102 -0.356 -15.921 5.021 1.00 0.00 C ATOM 1395 SG CYS A 102 -1.125 -16.305 3.390 1.00 0.00 S ATOM 0 H CYS A 102 0.981 -15.732 7.133 1.00 0.00 H new ATOM 0 HA CYS A 102 1.385 -17.126 4.669 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -0.831 -16.537 5.785 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -0.569 -14.882 5.272 1.00 0.00 H new ATOM 0 HG CYS A 102 -2.084 -15.460 3.153 1.00 0.00 H new ATOM 1476 N LEU B 11 1.206 -0.272 8.406 1.00 0.00 N ATOM 1477 CA LEU B 11 0.663 -0.391 7.055 1.00 0.00 C ATOM 1478 C LEU B 11 1.591 -1.213 6.144 1.00 0.00 C ATOM 1479 O LEU B 11 1.154 -1.657 5.091 1.00 0.00 O ATOM 1480 CB LEU B 11 0.309 0.993 6.470 1.00 0.00 C ATOM 1481 CG LEU B 11 -0.647 1.889 7.297 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -1.714 1.087 8.055 1.00 0.00 C ATOM 1483 CD2 LEU B 11 0.102 2.810 8.274 1.00 0.00 C ATOM 0 HA LEU B 11 -0.272 -0.948 7.113 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.238 1.542 6.316 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.137 0.840 5.487 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.154 2.511 6.559 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -2.353 1.770 8.615 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -2.320 0.524 7.344 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -1.228 0.396 8.744 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -0.616 3.415 8.827 1.00 0.00 H new ATOM 0 HD22 LEU B 11 0.681 2.206 8.972 1.00 0.00 H new ATOM 0 HD23 LEU B 11 0.773 3.463 7.716 1.00 0.00 H new ATOM 1495 N ALA B 12 2.827 -1.513 6.569 1.00 0.00 N ATOM 1496 CA ALA B 12 3.701 -2.492 5.920 1.00 0.00 C ATOM 1497 C ALA B 12 2.986 -3.839 5.715 1.00 0.00 C ATOM 1498 O ALA B 12 2.977 -4.388 4.612 1.00 0.00 O ATOM 1499 CB ALA B 12 4.958 -2.718 6.778 1.00 0.00 C ATOM 0 H ALA B 12 3.251 -1.074 7.386 1.00 0.00 H new ATOM 0 HA ALA B 12 3.976 -2.094 4.943 1.00 0.00 H new ATOM 0 HB1 ALA B 12 5.605 -3.447 6.291 1.00 0.00 H new ATOM 0 HB2 ALA B 12 5.495 -1.776 6.892 1.00 0.00 H new ATOM 0 HB3 ALA B 12 4.666 -3.091 7.760 1.00 0.00 H new ATOM 1505 N ARG B 13 2.299 -4.305 6.768 1.00 0.00 N ATOM 1506 CA ARG B 13 1.464 -5.508 6.793 1.00 0.00 C ATOM 1507 C ARG B 13 0.335 -5.444 5.755 1.00 0.00 C ATOM 1508 O ARG B 13 -0.051 -6.469 5.198 1.00 0.00 O ATOM 1509 CB ARG B 13 0.937 -5.653 8.235 1.00 0.00 C ATOM 1510 CG ARG B 13 0.253 -6.982 8.582 1.00 0.00 C ATOM 1511 CD ARG B 13 -1.245 -7.064 8.257 1.00 0.00 C ATOM 1512 NE ARG B 13 -1.480 -7.909 7.083 1.00 0.00 N ATOM 1513 CZ ARG B 13 -1.704 -9.211 7.091 1.00 0.00 C ATOM 1514 NH1 ARG B 13 -1.962 -9.901 8.176 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -1.591 -9.868 5.965 1.00 0.00 N ATOM 0 H ARG B 13 2.313 -3.827 7.669 1.00 0.00 H new ATOM 0 HA ARG B 13 2.044 -6.388 6.516 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.773 -5.510 8.920 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.229 -4.846 8.423 1.00 0.00 H new ATOM 0 HG2 ARG B 13 0.766 -7.783 8.050 1.00 0.00 H new ATOM 0 HG3 ARG B 13 0.386 -7.171 9.647 1.00 0.00 H new ATOM 0 HD2 ARG B 13 -1.786 -7.466 9.114 1.00 0.00 H new ATOM 0 HD3 ARG B 13 -1.637 -6.063 8.074 1.00 0.00 H new ATOM 0 HE ARG B 13 -1.470 -7.448 6.173 1.00 0.00 H new ATOM 0 HH11 ARG B 13 -1.999 -9.433 9.081 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -2.126 -10.906 8.114 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -1.336 -9.374 5.110 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -1.758 -10.874 5.942 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.168 -4.248 5.426 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.134 -4.054 4.338 1.00 0.00 C ATOM 1531 C LEU B 14 -0.437 -3.993 2.979 1.00 0.00 C ATOM 1532 O LEU B 14 -0.857 -4.677 2.051 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.980 -2.793 4.607 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.190 -2.572 3.666 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.837 -1.875 2.342 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.976 -3.865 3.415 1.00 0.00 C ATOM 0 H LEU B 14 0.084 -3.385 5.908 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.804 -4.913 4.307 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.346 -2.838 5.633 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.329 -1.922 4.539 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.837 -1.881 4.207 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.739 -1.758 1.741 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.410 -0.894 2.550 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.112 -2.478 1.795 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -4.814 -3.658 2.750 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.321 -4.605 2.955 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.352 -4.252 4.362 1.00 0.00 H new ATOM 1548 N GLY B 15 0.646 -3.224 2.849 1.00 0.00 N ATOM 1549 CA GLY B 15 1.386 -3.042 1.604 1.00 0.00 C ATOM 1550 C GLY B 15 1.905 -4.363 1.057 1.00 0.00 C ATOM 1551 O GLY B 15 1.887 -4.551 -0.147 1.00 0.00 O ATOM 0 H GLY B 15 1.041 -2.698 3.629 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.740 -2.570 0.863 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.223 -2.365 1.774 1.00 0.00 H new ATOM 1555 N ARG B 16 2.249 -5.326 1.912 1.00 0.00 N ATOM 1556 CA ARG B 16 2.634 -6.679 1.499 1.00 0.00 C ATOM 1557 C ARG B 16 1.431 -7.447 0.918 1.00 0.00 C ATOM 1558 O ARG B 16 1.597 -8.218 -0.015 1.00 0.00 O ATOM 1559 CB ARG B 16 3.285 -7.416 2.689 1.00 0.00 C ATOM 1560 CG ARG B 16 4.514 -8.276 2.338 1.00 0.00 C ATOM 1561 CD ARG B 16 4.256 -9.424 1.352 1.00 0.00 C ATOM 1562 NE ARG B 16 4.422 -9.014 -0.059 1.00 0.00 N ATOM 1563 CZ ARG B 16 3.896 -9.631 -1.110 1.00 0.00 C ATOM 1564 NH1 ARG B 16 3.223 -10.752 -0.999 1.00 0.00 N ATOM 1565 NH2 ARG B 16 4.001 -9.144 -2.325 1.00 0.00 N ATOM 0 H ARG B 16 2.269 -5.189 2.923 1.00 0.00 H new ATOM 0 HA ARG B 16 3.371 -6.616 0.698 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.580 -6.678 3.435 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.535 -8.056 3.153 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.283 -7.627 1.920 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.918 -8.695 3.260 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.939 -10.245 1.570 1.00 0.00 H new ATOM 0 HD3 ARG B 16 3.245 -9.803 1.499 1.00 0.00 H new ATOM 0 HE ARG B 16 4.989 -8.186 -0.240 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.090 -11.178 -0.082 1.00 0.00 H new ATOM 0 HH12 ARG B 16 2.833 -11.197 -1.830 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.498 -8.267 -2.482 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.585 -9.643 -3.112 1.00 0.00 H new ATOM 1579 N ALA B 17 0.207 -7.207 1.387 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.005 -7.823 0.848 1.00 0.00 C ATOM 1581 C ALA B 17 -1.555 -7.166 -0.433 1.00 0.00 C ATOM 1582 O ALA B 17 -2.310 -7.834 -1.151 1.00 0.00 O ATOM 1583 CB ALA B 17 -2.055 -7.816 1.967 1.00 0.00 C ATOM 0 H ALA B 17 0.027 -6.570 2.163 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.753 -8.835 0.531 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.977 -8.269 1.603 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.683 -8.385 2.819 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.252 -6.789 2.275 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.195 -5.904 -0.723 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.594 -5.240 -1.981 1.00 0.00 C ATOM 1591 C LEU B 18 -0.456 -5.203 -3.024 1.00 0.00 C ATOM 1592 O LEU B 18 -0.741 -5.185 -4.219 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.268 -3.863 -1.708 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.807 -3.977 -1.511 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.181 -4.705 -0.216 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.582 -2.642 -1.557 1.00 0.00 C ATOM 0 H LEU B 18 -0.629 -5.322 -0.106 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.362 -5.854 -2.451 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.824 -3.416 -0.819 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.061 -3.190 -2.540 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.114 -4.560 -2.379 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.266 -4.757 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.770 -5.714 -0.234 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.773 -4.163 0.637 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.645 -2.833 -1.409 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.219 -1.983 -0.768 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.430 -2.166 -2.526 1.00 0.00 H new ATOM 1608 N ALA B 19 0.812 -5.298 -2.619 1.00 0.00 N ATOM 1609 CA ALA B 19 1.984 -5.316 -3.498 1.00 0.00 C ATOM 1610 C ALA B 19 2.330 -6.693 -4.086 1.00 0.00 C ATOM 1611 O ALA B 19 3.504 -7.049 -4.201 1.00 0.00 O ATOM 1612 CB ALA B 19 3.163 -4.710 -2.749 1.00 0.00 C ATOM 0 H ALA B 19 1.061 -5.367 -1.632 1.00 0.00 H new ATOM 0 HA ALA B 19 1.738 -4.716 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA B 19 4.044 -4.716 -3.391 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.927 -3.684 -2.467 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.364 -5.295 -1.852 1.00 0.00 H new ATOM 1618 N ASP B 20 1.306 -7.467 -4.432 1.00 0.00 N ATOM 1619 CA ASP B 20 1.406 -8.690 -5.223 1.00 0.00 C ATOM 1620 C ASP B 20 1.033 -8.309 -6.678 1.00 0.00 C ATOM 1621 O ASP B 20 0.093 -7.525 -6.865 1.00 0.00 O ATOM 1622 CB ASP B 20 0.443 -9.756 -4.668 1.00 0.00 C ATOM 1623 CG ASP B 20 1.045 -10.991 -4.006 1.00 0.00 C ATOM 1624 OD1 ASP B 20 2.190 -10.921 -3.514 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.308 -12.010 -3.959 1.00 0.00 O ATOM 0 H ASP B 20 0.347 -7.252 -4.159 1.00 0.00 H new ATOM 0 HA ASP B 20 2.411 -9.111 -5.183 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.208 -9.271 -3.940 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.191 -10.093 -5.488 1.00 0.00 H new ATOM 1630 N PRO B 21 1.702 -8.889 -7.693 1.00 0.00 N ATOM 1631 CA PRO B 21 1.665 -8.466 -9.099 1.00 0.00 C ATOM 1632 C PRO B 21 0.244 -8.497 -9.691 1.00 0.00 C ATOM 1633 O PRO B 21 -0.479 -7.497 -9.673 1.00 0.00 O ATOM 1634 CB PRO B 21 2.667 -9.404 -9.798 1.00 0.00 C ATOM 1635 CG PRO B 21 2.651 -10.668 -8.940 1.00 0.00 C ATOM 1636 CD PRO B 21 2.537 -10.073 -7.544 1.00 0.00 C ATOM 0 HA PRO B 21 1.946 -7.422 -9.234 1.00 0.00 H new ATOM 0 HB2 PRO B 21 2.367 -9.615 -10.825 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.663 -8.963 -9.841 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.810 -11.319 -9.180 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.558 -11.261 -9.062 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.089 -10.784 -6.850 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.518 -9.814 -7.146 1.00 0.00 H new ATOM 1644 N THR B 22 -0.173 -9.669 -10.180 1.00 0.00 N ATOM 1645 CA THR B 22 -1.537 -9.998 -10.603 1.00 0.00 C ATOM 1646 C THR B 22 -2.580 -9.619 -9.557 1.00 0.00 C ATOM 1647 O THR B 22 -3.683 -9.209 -9.911 1.00 0.00 O ATOM 1648 CB THR B 22 -1.584 -11.511 -10.841 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.589 -11.853 -11.774 1.00 0.00 O ATOM 1650 CG2 THR B 22 -2.940 -12.000 -11.338 1.00 0.00 C ATOM 0 H THR B 22 0.466 -10.455 -10.297 1.00 0.00 H new ATOM 0 HA THR B 22 -1.775 -9.432 -11.504 1.00 0.00 H new ATOM 0 HB THR B 22 -1.410 -11.998 -9.882 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.608 -12.820 -11.933 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.905 -13.079 -11.486 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.706 -11.759 -10.601 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.179 -11.511 -12.282 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.242 -9.720 -8.267 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.203 -9.576 -7.170 1.00 0.00 C ATOM 1660 C ARG B 23 -3.685 -8.139 -6.951 1.00 0.00 C ATOM 1661 O ARG B 23 -4.883 -7.940 -6.755 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.627 -10.189 -5.908 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.705 -10.794 -5.021 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.031 -11.540 -3.866 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.549 -10.639 -2.803 1.00 0.00 N ATOM 1666 CZ ARG B 23 -2.056 -11.140 -1.680 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -1.281 -12.197 -1.688 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -2.383 -10.610 -0.529 1.00 0.00 N ATOM 0 H ARG B 23 -1.289 -9.905 -7.954 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.104 -10.121 -7.453 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.905 -10.960 -6.177 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.085 -9.426 -5.350 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.359 -10.012 -4.635 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -4.330 -11.476 -5.598 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.737 -12.252 -3.439 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -2.192 -12.117 -4.254 1.00 0.00 H new ATOM 0 HE ARG B 23 -2.595 -9.628 -2.932 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -1.046 -12.651 -2.571 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -0.912 -12.566 -0.811 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -3.017 -9.812 -0.497 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -2.004 -10.995 0.336 1.00 0.00 H new ATOM 1682 N CYS B 24 -2.813 -7.130 -7.076 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.243 -5.726 -7.122 1.00 0.00 C ATOM 1684 C CYS B 24 -4.242 -5.510 -8.269 1.00 0.00 C ATOM 1685 O CYS B 24 -5.257 -4.828 -8.110 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.001 -4.852 -7.311 1.00 0.00 C ATOM 1687 SG CYS B 24 -2.455 -3.101 -7.133 1.00 0.00 S ATOM 0 H CYS B 24 -1.804 -7.260 -7.147 1.00 0.00 H new ATOM 0 HA CYS B 24 -3.746 -5.456 -6.193 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.242 -5.118 -6.576 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -1.567 -5.027 -8.295 1.00 0.00 H new ATOM 0 HG CYS B 24 -1.442 -2.436 -6.663 1.00 0.00 H new ATOM 1693 N ARG B 25 -3.986 -6.150 -9.415 1.00 0.00 N ATOM 1694 CA ARG B 25 -4.892 -6.128 -10.559 1.00 0.00 C ATOM 1695 C ARG B 25 -6.235 -6.803 -10.273 1.00 0.00 C ATOM 1696 O ARG B 25 -7.257 -6.248 -10.646 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.204 -6.687 -11.810 1.00 0.00 C ATOM 1698 CG ARG B 25 -3.585 -5.509 -12.571 1.00 0.00 C ATOM 1699 CD ARG B 25 -2.849 -5.904 -13.856 1.00 0.00 C ATOM 1700 NE ARG B 25 -1.866 -4.870 -14.216 1.00 0.00 N ATOM 1701 CZ ARG B 25 -2.097 -3.584 -14.465 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -3.280 -3.051 -14.686 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -1.096 -2.753 -14.461 1.00 0.00 N ATOM 0 H ARG B 25 -3.140 -6.699 -9.572 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.136 -5.084 -10.756 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.436 -7.409 -11.533 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -4.923 -7.212 -12.439 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.373 -4.799 -12.821 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -2.888 -4.992 -11.912 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -2.347 -6.861 -13.717 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -3.564 -6.035 -14.668 1.00 0.00 H new ATOM 0 HE ARG B 25 -0.895 -5.175 -14.282 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -4.114 -3.638 -14.674 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -3.363 -2.051 -14.869 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.153 -3.091 -14.269 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -1.254 -1.763 -14.650 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.281 -7.916 -9.537 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.563 -8.488 -9.033 1.00 0.00 C ATOM 1719 C ILE B 26 -8.398 -7.445 -8.291 1.00 0.00 C ATOM 1720 O ILE B 26 -9.588 -7.292 -8.545 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.347 -9.720 -8.113 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.503 -10.763 -8.862 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.709 -10.278 -7.665 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -6.612 -12.237 -8.457 1.00 0.00 C ATOM 0 H ILE B 26 -5.454 -8.449 -9.269 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.105 -8.815 -9.920 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.804 -9.437 -7.211 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.756 -10.693 -9.920 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.457 -10.471 -8.765 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.554 -11.142 -7.020 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.255 -9.510 -7.117 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.285 -10.578 -8.540 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -5.952 -12.836 -9.084 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -6.321 -12.350 -7.413 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -7.640 -12.575 -8.586 1.00 0.00 H new ATOM 1736 N LEU B 27 -7.749 -6.750 -7.361 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.405 -5.735 -6.527 1.00 0.00 C ATOM 1738 C LEU B 27 -8.887 -4.539 -7.354 1.00 0.00 C ATOM 1739 O LEU B 27 -10.047 -4.157 -7.231 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.486 -5.292 -5.374 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.232 -6.377 -4.310 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.210 -5.864 -3.298 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.496 -6.781 -3.540 1.00 0.00 C ATOM 0 H LEU B 27 -6.756 -6.870 -7.161 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.292 -6.194 -6.090 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.529 -4.976 -5.789 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -7.926 -4.421 -4.889 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.871 -7.255 -4.846 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.029 -6.630 -2.544 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.277 -5.631 -3.810 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.594 -4.965 -2.817 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.246 -7.548 -2.807 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.904 -5.910 -3.028 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.237 -7.173 -4.237 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.054 -3.990 -8.241 1.00 0.00 N ATOM 1756 CA VAL B 28 -8.478 -2.860 -9.097 1.00 0.00 C ATOM 1757 C VAL B 28 -9.563 -3.266 -10.121 1.00 0.00 C ATOM 1758 O VAL B 28 -10.478 -2.493 -10.390 1.00 0.00 O ATOM 1759 CB VAL B 28 -7.271 -2.144 -9.753 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -6.861 -2.697 -11.127 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -7.533 -0.635 -9.877 1.00 0.00 C ATOM 0 H VAL B 28 -7.093 -4.298 -8.391 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.949 -2.129 -8.440 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.437 -2.340 -9.079 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.009 -2.133 -11.506 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.587 -3.747 -11.029 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.696 -2.603 -11.821 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -6.672 -0.153 -10.340 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -8.417 -0.469 -10.493 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -7.696 -0.211 -8.886 1.00 0.00 H new ATOM 1771 N ALA B 29 -9.520 -4.505 -10.631 1.00 0.00 N ATOM 1772 CA ALA B 29 -10.536 -5.082 -11.515 1.00 0.00 C ATOM 1773 C ALA B 29 -11.792 -5.549 -10.775 1.00 0.00 C ATOM 1774 O ALA B 29 -12.775 -5.904 -11.419 1.00 0.00 O ATOM 1775 CB ALA B 29 -9.886 -6.225 -12.297 1.00 0.00 C ATOM 0 H ALA B 29 -8.755 -5.150 -10.433 1.00 0.00 H new ATOM 0 HA ALA B 29 -10.887 -4.305 -12.194 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -10.622 -6.674 -12.965 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.053 -5.837 -12.883 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -9.520 -6.980 -11.601 1.00 0.00 H new ATOM 1781 N LEU B 30 -11.777 -5.571 -9.440 1.00 0.00 N ATOM 1782 CA LEU B 30 -12.942 -5.726 -8.610 1.00 0.00 C ATOM 1783 C LEU B 30 -13.672 -4.421 -8.395 1.00 0.00 C ATOM 1784 O LEU B 30 -14.904 -4.457 -8.379 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.523 -6.337 -7.259 1.00 0.00 C ATOM 1786 CG LEU B 30 -12.875 -7.817 -7.259 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -12.421 -8.464 -5.960 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -14.389 -7.934 -7.446 1.00 0.00 C ATOM 0 H LEU B 30 -10.915 -5.477 -8.902 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.636 -6.393 -9.123 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.453 -6.204 -7.100 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.032 -5.828 -6.441 1.00 0.00 H new ATOM 0 HG LEU B 30 -12.366 -8.338 -8.070 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -12.678 -9.523 -5.972 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -11.342 -8.354 -5.857 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.917 -7.979 -5.119 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -14.675 -8.986 -7.451 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -14.897 -7.423 -6.628 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -14.675 -7.476 -8.393 1.00 0.00 H new ATOM 1800 N LEU B 31 -12.931 -3.318 -8.243 1.00 0.00 N ATOM 1801 CA LEU B 31 -13.486 -1.983 -8.123 1.00 0.00 C ATOM 1802 C LEU B 31 -14.390 -1.657 -9.328 1.00 0.00 C ATOM 1803 O LEU B 31 -15.507 -1.177 -9.165 1.00 0.00 O ATOM 1804 CB LEU B 31 -12.309 -1.004 -8.054 1.00 0.00 C ATOM 1805 CG LEU B 31 -12.233 -0.233 -6.735 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -11.078 0.739 -6.947 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -13.501 0.568 -6.401 1.00 0.00 C ATOM 0 H LEU B 31 -11.912 -3.338 -8.200 1.00 0.00 H new ATOM 0 HA LEU B 31 -14.102 -1.907 -7.227 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -11.380 -1.555 -8.198 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -12.389 -0.294 -8.877 1.00 0.00 H new ATOM 0 HG LEU B 31 -12.109 -0.927 -5.904 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -10.941 1.343 -6.050 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -10.165 0.180 -7.151 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -11.301 1.390 -7.792 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -13.365 1.085 -5.451 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -13.688 1.298 -7.188 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -14.351 -0.110 -6.326 1.00 0.00 H new ATOM 1819 N ASP B 32 -13.868 -1.973 -10.516 1.00 0.00 N ATOM 1820 CA ASP B 32 -14.463 -1.844 -11.850 1.00 0.00 C ATOM 1821 C ASP B 32 -14.853 -3.235 -12.405 1.00 0.00 C ATOM 1822 O ASP B 32 -14.482 -3.628 -13.510 1.00 0.00 O ATOM 1823 CB ASP B 32 -13.436 -1.109 -12.732 1.00 0.00 C ATOM 1824 CG ASP B 32 -13.964 -0.700 -14.114 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -15.157 -0.326 -14.199 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -13.142 -0.698 -15.059 1.00 0.00 O ATOM 0 H ASP B 32 -12.927 -2.363 -10.574 1.00 0.00 H new ATOM 0 HA ASP B 32 -15.389 -1.269 -11.826 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -13.098 -0.216 -12.207 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -12.564 -1.750 -12.865 1.00 0.00 H new ATOM 1831 N GLY B 33 -15.511 -4.051 -11.569 1.00 0.00 N ATOM 1832 CA GLY B 33 -15.881 -5.431 -11.916 1.00 0.00 C ATOM 1833 C GLY B 33 -17.128 -5.998 -11.256 1.00 0.00 C ATOM 1834 O GLY B 33 -18.162 -6.082 -11.900 1.00 0.00 O ATOM 0 H GLY B 33 -15.802 -3.772 -10.632 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -16.016 -5.484 -12.996 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -15.041 -6.080 -11.667 1.00 0.00 H new ATOM 1838 N VAL B 34 -16.975 -6.523 -10.036 1.00 0.00 N ATOM 1839 CA VAL B 34 -17.925 -7.349 -9.242 1.00 0.00 C ATOM 1840 C VAL B 34 -18.589 -8.564 -9.910 1.00 0.00 C ATOM 1841 O VAL B 34 -19.140 -9.394 -9.196 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.031 -6.527 -8.538 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.390 -5.556 -7.549 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.990 -5.797 -9.489 1.00 0.00 C ATOM 0 H VAL B 34 -16.107 -6.374 -9.521 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.215 -7.762 -8.526 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.661 -7.244 -8.011 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -19.168 -4.976 -7.052 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.824 -6.116 -6.805 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.720 -4.882 -8.083 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.731 -5.248 -8.908 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.427 -5.100 -10.110 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.495 -6.524 -10.126 1.00 0.00 H new ATOM 1854 N CYS B 35 -18.506 -8.722 -11.231 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.277 -9.656 -12.059 1.00 0.00 C ATOM 1856 C CYS B 35 -19.573 -11.038 -11.439 1.00 0.00 C ATOM 1857 O CYS B 35 -20.651 -11.272 -10.909 1.00 0.00 O ATOM 1858 CB CYS B 35 -18.519 -9.766 -13.378 1.00 0.00 C ATOM 1859 SG CYS B 35 -18.775 -8.313 -14.419 1.00 0.00 S ATOM 0 H CYS B 35 -17.858 -8.167 -11.789 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.283 -9.255 -12.182 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -17.455 -9.887 -13.177 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -18.846 -10.658 -13.912 1.00 0.00 H new ATOM 0 HG CYS B 35 -18.605 -7.236 -13.711 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.600 -11.951 -11.527 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.686 -13.360 -11.113 1.00 0.00 C ATOM 1867 C TYR B 36 -17.294 -13.858 -10.655 1.00 0.00 C ATOM 1868 O TYR B 36 -16.301 -13.481 -11.283 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.237 -14.254 -12.255 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.348 -13.687 -13.126 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -21.648 -13.530 -12.616 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.072 -13.312 -14.459 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -22.661 -12.967 -13.412 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -21.083 -12.760 -15.267 1.00 0.00 C ATOM 1875 CZ TYR B 36 -22.382 -12.580 -14.742 1.00 0.00 C ATOM 1876 OH TYR B 36 -23.355 -12.033 -15.523 1.00 0.00 O ATOM 0 H TYR B 36 -17.683 -11.718 -11.908 1.00 0.00 H new ATOM 0 HA TYR B 36 -19.383 -13.429 -10.278 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -18.403 -14.518 -12.905 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -19.600 -15.180 -11.810 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -21.870 -13.844 -11.607 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -19.079 -13.450 -14.861 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -23.653 -12.830 -13.007 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.866 -12.475 -16.286 1.00 0.00 H new ATOM 0 HH TYR B 36 -22.987 -11.826 -16.407 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.169 -14.729 -9.631 1.00 0.00 N ATOM 1887 CA PRO B 37 -15.891 -15.063 -8.985 1.00 0.00 C ATOM 1888 C PRO B 37 -14.848 -15.803 -9.845 1.00 0.00 C ATOM 1889 O PRO B 37 -13.720 -15.953 -9.378 1.00 0.00 O ATOM 1890 CB PRO B 37 -16.259 -15.866 -7.729 1.00 0.00 C ATOM 1891 CG PRO B 37 -17.631 -16.445 -8.045 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.263 -15.372 -8.926 1.00 0.00 C ATOM 0 HA PRO B 37 -15.371 -14.129 -8.769 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.531 -16.653 -7.531 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -16.289 -15.230 -6.844 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -17.556 -17.400 -8.564 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -18.214 -16.619 -7.140 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -18.972 -15.812 -9.627 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.816 -14.650 -8.324 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.175 -16.240 -11.070 1.00 0.00 N ATOM 1901 CA GLY B 38 -14.200 -16.785 -12.035 1.00 0.00 C ATOM 1902 C GLY B 38 -13.849 -15.854 -13.205 1.00 0.00 C ATOM 1903 O GLY B 38 -12.861 -16.086 -13.898 1.00 0.00 O ATOM 0 H GLY B 38 -16.131 -16.226 -11.425 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.283 -17.032 -11.500 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -14.595 -17.717 -12.439 1.00 0.00 H new ATOM 1907 N GLN B 39 -14.636 -14.792 -13.425 1.00 0.00 N ATOM 1908 CA GLN B 39 -14.560 -13.955 -14.633 1.00 0.00 C ATOM 1909 C GLN B 39 -13.302 -13.090 -14.747 1.00 0.00 C ATOM 1910 O GLN B 39 -12.973 -12.683 -15.857 1.00 0.00 O ATOM 1911 CB GLN B 39 -15.803 -13.077 -14.758 1.00 0.00 C ATOM 1912 CG GLN B 39 -15.776 -11.847 -13.838 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.540 -10.512 -14.548 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.206 -10.171 -15.505 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -14.683 -9.651 -14.046 1.00 0.00 N ATOM 0 H GLN B 39 -15.350 -14.486 -12.764 1.00 0.00 H new ATOM 0 HA GLN B 39 -14.505 -14.665 -15.459 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -15.903 -12.746 -15.792 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -16.685 -13.674 -14.528 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -16.723 -11.793 -13.301 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -14.994 -11.987 -13.092 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -14.111 -9.910 -13.242 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -14.590 -8.723 -14.460 1.00 0.00 H new ATOM 1924 N LEU B 40 -12.600 -12.837 -13.628 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.330 -12.100 -13.578 1.00 0.00 C ATOM 1926 C LEU B 40 -10.362 -12.535 -14.679 1.00 0.00 C ATOM 1927 O LEU B 40 -9.581 -11.730 -15.166 1.00 0.00 O ATOM 1928 CB LEU B 40 -10.656 -12.377 -12.223 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.279 -11.621 -11.034 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -10.916 -12.381 -9.765 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -10.740 -10.178 -11.022 1.00 0.00 C ATOM 0 H LEU B 40 -12.912 -13.150 -12.709 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.556 -11.043 -13.717 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.701 -13.447 -12.021 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.602 -12.110 -12.295 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.365 -11.563 -11.110 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.343 -11.871 -8.901 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -11.314 -13.394 -9.821 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -9.832 -12.422 -9.663 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.175 -9.634 -10.184 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -9.655 -10.196 -10.919 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.008 -9.682 -11.955 1.00 0.00 H new ATOM 1943 N ALA B 41 -10.424 -13.809 -15.053 1.00 0.00 N ATOM 1944 CA ALA B 41 -9.549 -14.388 -16.053 1.00 0.00 C ATOM 1945 C ALA B 41 -9.611 -13.670 -17.412 1.00 0.00 C ATOM 1946 O ALA B 41 -8.578 -13.425 -18.026 1.00 0.00 O ATOM 1947 CB ALA B 41 -9.923 -15.872 -16.157 1.00 0.00 C ATOM 0 H ALA B 41 -11.093 -14.472 -14.662 1.00 0.00 H new ATOM 0 HA ALA B 41 -8.510 -14.269 -15.747 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -9.290 -16.356 -16.901 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -9.778 -16.352 -15.189 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -10.967 -15.964 -16.455 1.00 0.00 H new ATOM 1953 N ALA B 42 -10.808 -13.274 -17.852 1.00 0.00 N ATOM 1954 CA ALA B 42 -10.976 -12.483 -19.076 1.00 0.00 C ATOM 1955 C ALA B 42 -10.597 -11.014 -18.836 1.00 0.00 C ATOM 1956 O ALA B 42 -9.885 -10.407 -19.625 1.00 0.00 O ATOM 1957 CB ALA B 42 -12.427 -12.632 -19.556 1.00 0.00 C ATOM 0 H ALA B 42 -11.683 -13.490 -17.375 1.00 0.00 H new ATOM 0 HA ALA B 42 -10.306 -12.850 -19.854 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -12.571 -12.050 -20.466 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -12.637 -13.682 -19.760 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -13.105 -12.270 -18.783 1.00 0.00 H new ATOM 1963 N HIS B 43 -11.035 -10.461 -17.704 1.00 0.00 N ATOM 1964 CA HIS B 43 -10.832 -9.057 -17.324 1.00 0.00 C ATOM 1965 C HIS B 43 -9.346 -8.679 -17.098 1.00 0.00 C ATOM 1966 O HIS B 43 -8.966 -7.514 -17.201 1.00 0.00 O ATOM 1967 CB HIS B 43 -11.677 -8.827 -16.057 1.00 0.00 C ATOM 1968 CG HIS B 43 -12.097 -7.401 -15.815 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -12.193 -6.402 -16.783 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -12.572 -6.921 -14.629 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -12.698 -5.332 -16.147 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -12.940 -5.613 -14.857 1.00 0.00 N ATOM 0 H HIS B 43 -11.556 -10.990 -17.005 1.00 0.00 H new ATOM 0 HA HIS B 43 -11.145 -8.408 -18.142 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -12.572 -9.447 -16.119 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.109 -9.173 -15.193 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -12.645 -7.460 -13.696 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -12.884 -4.375 -16.611 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -13.328 -4.971 -14.166 1.00 0.00 H new ATOM 1980 N LEU B 44 -8.507 -9.674 -16.777 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.063 -9.549 -16.539 1.00 0.00 C ATOM 1982 C LEU B 44 -6.199 -10.173 -17.639 1.00 0.00 C ATOM 1983 O LEU B 44 -5.003 -9.901 -17.669 1.00 0.00 O ATOM 1984 CB LEU B 44 -6.709 -10.242 -15.206 1.00 0.00 C ATOM 1985 CG LEU B 44 -7.379 -9.672 -13.948 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -6.698 -10.207 -12.689 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.350 -8.137 -13.903 1.00 0.00 C ATOM 0 H LEU B 44 -8.833 -10.635 -16.671 1.00 0.00 H new ATOM 0 HA LEU B 44 -6.848 -8.481 -16.520 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -6.973 -11.296 -15.287 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -5.629 -10.193 -15.071 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.420 -9.993 -13.987 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.186 -9.792 -11.807 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -6.774 -11.294 -12.668 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.647 -9.917 -12.692 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.838 -7.790 -12.992 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.316 -7.792 -13.915 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -7.876 -7.738 -14.770 1.00 0.00 H new ATOM 1999 N GLY B 45 -6.760 -11.056 -18.471 1.00 0.00 N ATOM 2000 CA GLY B 45 -6.008 -11.880 -19.423 1.00 0.00 C ATOM 2001 C GLY B 45 -5.373 -13.138 -18.813 1.00 0.00 C ATOM 2002 O GLY B 45 -4.897 -13.980 -19.573 1.00 0.00 O ATOM 0 H GLY B 45 -7.766 -11.221 -18.503 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -6.676 -12.180 -20.231 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -5.222 -11.271 -19.869 1.00 0.00 H new ATOM 2006 N LEU B 46 -5.374 -13.290 -17.482 1.00 0.00 N ATOM 2007 CA LEU B 46 -4.863 -14.440 -16.726 1.00 0.00 C ATOM 2008 C LEU B 46 -5.742 -15.682 -16.916 1.00 0.00 C ATOM 2009 O LEU B 46 -6.941 -15.619 -16.669 1.00 0.00 O ATOM 2010 CB LEU B 46 -4.895 -14.059 -15.227 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.698 -13.282 -14.653 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -2.563 -14.255 -14.326 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -3.178 -12.127 -15.516 1.00 0.00 C ATOM 0 H LEU B 46 -5.755 -12.570 -16.868 1.00 0.00 H new ATOM 0 HA LEU B 46 -3.858 -14.674 -17.078 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.793 -13.466 -15.052 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.003 -14.978 -14.651 1.00 0.00 H new ATOM 0 HG LEU B 46 -4.076 -12.799 -13.752 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -1.716 -13.702 -13.919 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -2.908 -14.983 -13.591 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -2.256 -14.774 -15.234 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -2.335 -11.650 -15.016 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -2.856 -12.512 -16.483 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -3.973 -11.396 -15.663 1.00 0.00 H new ATOM 2025 N THR B 47 -5.182 -16.858 -17.209 1.00 0.00 N ATOM 2026 CA THR B 47 -5.947 -18.112 -17.165 1.00 0.00 C ATOM 2027 C THR B 47 -6.486 -18.322 -15.756 1.00 0.00 C ATOM 2028 O THR B 47 -5.796 -18.066 -14.765 1.00 0.00 O ATOM 2029 CB THR B 47 -5.111 -19.289 -17.673 1.00 0.00 C ATOM 2030 OG1 THR B 47 -5.993 -20.360 -17.945 1.00 0.00 O ATOM 2031 CG2 THR B 47 -4.047 -19.796 -16.696 1.00 0.00 C ATOM 0 H THR B 47 -4.205 -16.971 -17.479 1.00 0.00 H new ATOM 0 HA THR B 47 -6.801 -18.048 -17.840 1.00 0.00 H new ATOM 0 HB THR B 47 -4.575 -18.928 -18.551 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.482 -21.129 -18.275 1.00 0.00 H new ATOM 0 HG21 THR B 47 -3.508 -20.630 -17.146 1.00 0.00 H new ATOM 0 HG22 THR B 47 -3.348 -18.991 -16.470 1.00 0.00 H new ATOM 0 HG23 THR B 47 -4.527 -20.129 -15.776 1.00 0.00 H new ATOM 2039 N ARG B 48 -7.724 -18.814 -15.644 1.00 0.00 N ATOM 2040 CA ARG B 48 -8.384 -18.943 -14.336 1.00 0.00 C ATOM 2041 C ARG B 48 -7.636 -19.845 -13.340 1.00 0.00 C ATOM 2042 O ARG B 48 -7.821 -19.673 -12.145 1.00 0.00 O ATOM 2043 CB ARG B 48 -9.875 -19.312 -14.434 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.217 -20.618 -15.164 1.00 0.00 C ATOM 2045 CD ARG B 48 -10.390 -20.410 -16.673 1.00 0.00 C ATOM 2046 NE ARG B 48 -11.005 -21.587 -17.295 1.00 0.00 N ATOM 2047 CZ ARG B 48 -10.388 -22.694 -17.684 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -9.093 -22.891 -17.537 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -11.103 -23.638 -18.251 1.00 0.00 N ATOM 0 H ARG B 48 -8.287 -19.128 -16.434 1.00 0.00 H new ATOM 0 HA ARG B 48 -8.338 -17.937 -13.920 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.277 -19.372 -13.423 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -10.395 -18.496 -14.936 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -9.427 -21.348 -14.988 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.135 -21.035 -14.749 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -11.010 -19.532 -16.855 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.420 -20.216 -17.131 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.013 -21.550 -17.444 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -8.513 -22.171 -17.105 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -8.670 -23.763 -17.855 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -12.106 -23.509 -18.382 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -10.655 -24.501 -18.560 1.00 0.00 H new ATOM 2063 N SER B 49 -6.757 -20.744 -13.786 1.00 0.00 N ATOM 2064 CA SER B 49 -5.854 -21.469 -12.879 1.00 0.00 C ATOM 2065 C SER B 49 -4.868 -20.509 -12.187 1.00 0.00 C ATOM 2066 O SER B 49 -4.765 -20.511 -10.961 1.00 0.00 O ATOM 2067 CB SER B 49 -5.076 -22.552 -13.644 1.00 0.00 C ATOM 2068 OG SER B 49 -5.922 -23.311 -14.496 1.00 0.00 O ATOM 0 H SER B 49 -6.648 -20.990 -14.770 1.00 0.00 H new ATOM 0 HA SER B 49 -6.467 -21.943 -12.113 1.00 0.00 H new ATOM 0 HB2 SER B 49 -4.290 -22.084 -14.237 1.00 0.00 H new ATOM 0 HB3 SER B 49 -4.586 -23.217 -12.933 1.00 0.00 H new ATOM 0 HG SER B 49 -5.391 -23.987 -14.966 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.207 -19.624 -12.944 1.00 0.00 N ATOM 2075 CA ASN B 50 -3.307 -18.612 -12.385 1.00 0.00 C ATOM 2076 C ASN B 50 -4.095 -17.522 -11.622 1.00 0.00 C ATOM 2077 O ASN B 50 -3.705 -17.134 -10.519 1.00 0.00 O ATOM 2078 CB ASN B 50 -2.423 -18.047 -13.516 1.00 0.00 C ATOM 2079 CG ASN B 50 -1.139 -17.375 -13.016 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -0.848 -17.348 -11.829 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -0.324 -16.848 -13.907 1.00 0.00 N ATOM 0 H ASN B 50 -4.282 -19.591 -13.961 1.00 0.00 H new ATOM 0 HA ASN B 50 -2.650 -19.066 -11.644 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -2.158 -18.856 -14.197 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.001 -17.324 -14.091 1.00 0.00 H new ATOM 0 HD21 ASN B 50 0.550 -16.417 -13.607 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -0.567 -16.871 -14.897 1.00 0.00 H new ATOM 2088 N VAL B 51 -5.266 -17.101 -12.126 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.157 -16.186 -11.374 1.00 0.00 C ATOM 2090 C VAL B 51 -6.651 -16.817 -10.050 1.00 0.00 C ATOM 2091 O VAL B 51 -6.727 -16.116 -9.046 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.294 -15.578 -12.250 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -8.727 -15.991 -11.870 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.215 -14.036 -12.258 1.00 0.00 C ATOM 0 H VAL B 51 -5.621 -17.374 -13.043 1.00 0.00 H new ATOM 0 HA VAL B 51 -5.552 -15.327 -11.085 1.00 0.00 H new ATOM 0 HB VAL B 51 -7.109 -15.997 -13.239 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.435 -15.510 -12.544 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -8.827 -17.073 -11.951 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -8.935 -15.683 -10.845 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.018 -13.634 -12.876 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.318 -13.661 -11.240 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -6.253 -13.723 -12.664 1.00 0.00 H new ATOM 2104 N SER B 52 -6.916 -18.131 -9.990 1.00 0.00 N ATOM 2105 CA SER B 52 -7.300 -18.817 -8.742 1.00 0.00 C ATOM 2106 C SER B 52 -6.183 -18.897 -7.693 1.00 0.00 C ATOM 2107 O SER B 52 -6.474 -18.852 -6.495 1.00 0.00 O ATOM 2108 CB SER B 52 -7.855 -20.222 -9.015 1.00 0.00 C ATOM 2109 OG SER B 52 -6.916 -21.151 -9.540 1.00 0.00 O ATOM 0 H SER B 52 -6.871 -18.748 -10.801 1.00 0.00 H new ATOM 0 HA SER B 52 -8.083 -18.189 -8.317 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.258 -20.623 -8.085 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.688 -20.137 -9.713 1.00 0.00 H new ATOM 0 HG SER B 52 -6.109 -20.674 -9.827 1.00 0.00 H new ATOM 2115 N ASN B 53 -4.917 -18.951 -8.120 1.00 0.00 N ATOM 2116 CA ASN B 53 -3.759 -19.007 -7.224 1.00 0.00 C ATOM 2117 C ASN B 53 -3.712 -17.760 -6.321 1.00 0.00 C ATOM 2118 O ASN B 53 -3.903 -17.838 -5.108 1.00 0.00 O ATOM 2119 CB ASN B 53 -2.502 -19.164 -8.099 1.00 0.00 C ATOM 2120 CG ASN B 53 -1.209 -19.354 -7.317 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.183 -19.441 -6.101 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -0.094 -19.423 -8.019 1.00 0.00 N ATOM 0 H ASN B 53 -4.666 -18.957 -9.109 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.824 -19.858 -6.546 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -2.640 -20.018 -8.762 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.403 -18.282 -8.732 1.00 0.00 H new ATOM 0 HD21 ASN B 53 0.800 -19.550 -7.545 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.126 -19.349 -9.036 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.622 -16.568 -6.918 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.647 -15.321 -6.149 1.00 0.00 C ATOM 2131 C HIS B 54 -5.006 -15.003 -5.471 1.00 0.00 C ATOM 2132 O HIS B 54 -5.005 -14.228 -4.512 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.150 -14.165 -7.030 1.00 0.00 C ATOM 2134 CG HIS B 54 -1.648 -14.121 -7.204 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -0.707 -13.679 -6.286 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -0.957 -14.477 -8.332 1.00 0.00 C ATOM 2137 CE1 HIS B 54 0.504 -13.774 -6.852 1.00 0.00 C ATOM 2138 NE2 HIS B 54 0.400 -14.245 -8.102 1.00 0.00 N ATOM 0 H HIS B 54 -3.532 -16.441 -7.926 1.00 0.00 H new ATOM 0 HA HIS B 54 -2.967 -15.456 -5.308 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -3.616 -14.245 -8.012 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -3.482 -13.222 -6.595 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -0.903 -13.340 -5.344 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.388 -14.869 -9.242 1.00 0.00 H new ATOM 0 HE1 HIS B 54 1.433 -13.508 -6.369 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.150 -15.584 -5.885 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.406 -15.473 -5.117 1.00 0.00 C ATOM 2148 C LEU B 55 -7.397 -16.332 -3.856 1.00 0.00 C ATOM 2149 O LEU B 55 -8.060 -15.964 -2.890 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.630 -15.887 -5.950 1.00 0.00 C ATOM 2151 CG LEU B 55 -8.987 -14.901 -7.069 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -9.873 -15.605 -8.105 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -9.697 -13.679 -6.470 1.00 0.00 C ATOM 0 H LEU B 55 -6.230 -16.132 -6.742 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.476 -14.420 -4.844 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.443 -16.867 -6.389 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.488 -15.994 -5.287 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.081 -14.558 -7.568 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -10.128 -14.906 -8.901 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -9.335 -16.454 -8.526 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -10.786 -15.956 -7.624 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -9.950 -12.979 -7.266 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.608 -13.999 -5.965 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.037 -13.190 -5.753 1.00 0.00 H new ATOM 2165 N SER B 56 -6.672 -17.444 -3.854 1.00 0.00 N ATOM 2166 CA SER B 56 -6.531 -18.286 -2.666 1.00 0.00 C ATOM 2167 C SER B 56 -5.858 -17.533 -1.510 1.00 0.00 C ATOM 2168 O SER B 56 -6.205 -17.780 -0.356 1.00 0.00 O ATOM 2169 CB SER B 56 -5.785 -19.578 -3.018 1.00 0.00 C ATOM 2170 OG SER B 56 -6.475 -20.273 -4.048 1.00 0.00 O ATOM 0 H SER B 56 -6.166 -17.789 -4.670 1.00 0.00 H new ATOM 0 HA SER B 56 -7.529 -18.555 -2.319 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.771 -19.345 -3.342 1.00 0.00 H new ATOM 0 HB3 SER B 56 -5.700 -20.211 -2.135 1.00 0.00 H new ATOM 0 HG SER B 56 -6.436 -19.752 -4.877 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.984 -16.549 -1.796 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.498 -15.654 -0.761 1.00 0.00 C ATOM 2178 C CYS B 57 -5.525 -14.536 -0.453 1.00 0.00 C ATOM 2179 O CYS B 57 -5.901 -14.344 0.701 1.00 0.00 O ATOM 2180 CB CYS B 57 -3.118 -15.132 -1.178 1.00 0.00 C ATOM 2181 SG CYS B 57 -2.290 -14.382 0.264 1.00 0.00 S ATOM 0 H CYS B 57 -4.611 -16.365 -2.728 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.381 -16.189 0.182 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.513 -15.948 -1.574 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -3.222 -14.396 -1.975 1.00 0.00 H new ATOM 0 HG CYS B 57 -2.032 -15.303 1.144 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.022 -13.834 -1.483 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.882 -12.646 -1.335 1.00 0.00 C ATOM 2188 C LEU B 58 -8.169 -12.930 -0.540 1.00 0.00 C ATOM 2189 O LEU B 58 -8.575 -12.103 0.280 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.188 -12.102 -2.749 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.251 -10.573 -2.938 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.987 -9.876 -2.447 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.503 -10.327 -4.431 1.00 0.00 C ATOM 0 H LEU B 58 -5.836 -14.078 -2.456 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.352 -11.895 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.430 -12.491 -3.428 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.144 -12.518 -3.067 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.054 -10.147 -2.336 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.081 -8.801 -2.602 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.849 -10.079 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.127 -10.249 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.556 -9.255 -4.619 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -6.688 -10.757 -5.013 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.444 -10.794 -4.723 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.802 -14.087 -0.789 1.00 0.00 N ATOM 2206 CA ARG B 59 -10.034 -14.548 -0.128 1.00 0.00 C ATOM 2207 C ARG B 59 -9.776 -15.215 1.241 1.00 0.00 C ATOM 2208 O ARG B 59 -10.736 -15.535 1.934 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.807 -15.515 -1.057 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.183 -14.963 -2.452 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.971 -15.989 -3.268 1.00 0.00 C ATOM 2212 NE ARG B 59 -12.488 -15.390 -4.507 1.00 0.00 N ATOM 2213 CZ ARG B 59 -12.748 -16.026 -5.641 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -12.666 -17.336 -5.747 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -13.080 -15.321 -6.699 1.00 0.00 N ATOM 0 H ARG B 59 -8.458 -14.752 -1.482 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.636 -13.661 0.066 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -10.205 -16.413 -1.194 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.723 -15.819 -0.550 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.776 -14.055 -2.337 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.277 -14.686 -2.991 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.330 -16.837 -3.509 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -12.799 -16.374 -2.673 1.00 0.00 H new ATOM 0 HE ARG B 59 -12.664 -14.385 -4.493 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.395 -17.897 -4.939 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -12.874 -17.790 -6.637 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -13.134 -14.304 -6.638 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -13.284 -15.791 -7.581 1.00 0.00 H new ATOM 2229 N GLY B 60 -8.514 -15.432 1.634 1.00 0.00 N ATOM 2230 CA GLY B 60 -8.121 -15.902 2.972 1.00 0.00 C ATOM 2231 C GLY B 60 -7.694 -14.743 3.875 1.00 0.00 C ATOM 2232 O GLY B 60 -8.142 -14.651 5.012 1.00 0.00 O ATOM 0 H GLY B 60 -7.717 -15.282 1.016 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -8.955 -16.433 3.431 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -7.301 -16.614 2.881 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.895 -13.817 3.333 1.00 0.00 N ATOM 2237 CA CYS B 61 -6.396 -12.597 3.961 1.00 0.00 C ATOM 2238 C CYS B 61 -7.458 -11.464 4.067 1.00 0.00 C ATOM 2239 O CYS B 61 -7.153 -10.307 4.360 1.00 0.00 O ATOM 2240 CB CYS B 61 -5.113 -12.252 3.193 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.784 -13.442 3.582 1.00 0.00 S ATOM 0 H CYS B 61 -6.558 -13.911 2.375 1.00 0.00 H new ATOM 0 HA CYS B 61 -6.166 -12.740 5.017 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -5.312 -12.260 2.121 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.790 -11.243 3.450 1.00 0.00 H new ATOM 0 HG CYS B 61 -3.195 -13.809 2.483 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.708 -11.821 3.750 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.955 -11.076 3.984 1.00 0.00 C ATOM 2248 C GLY B 62 -10.225 -9.868 3.090 1.00 0.00 C ATOM 2249 O GLY B 62 -11.140 -9.104 3.374 1.00 0.00 O ATOM 0 H GLY B 62 -8.891 -12.710 3.285 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.788 -11.770 3.875 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.956 -10.737 5.020 1.00 0.00 H new ATOM 2253 N LEU B 63 -9.458 -9.681 2.011 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.537 -8.486 1.149 1.00 0.00 C ATOM 2255 C LEU B 63 -10.683 -8.524 0.128 1.00 0.00 C ATOM 2256 O LEU B 63 -11.106 -7.482 -0.370 1.00 0.00 O ATOM 2257 CB LEU B 63 -8.195 -8.293 0.461 1.00 0.00 C ATOM 2258 CG LEU B 63 -7.091 -7.974 1.485 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.786 -7.996 0.729 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -7.248 -6.624 2.209 1.00 0.00 C ATOM 0 H LEU B 63 -8.758 -10.357 1.705 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.765 -7.635 1.790 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.933 -9.195 -0.092 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.268 -7.483 -0.265 1.00 0.00 H new ATOM 0 HG LEU B 63 -7.143 -8.720 2.278 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.966 -7.775 1.412 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.636 -8.982 0.290 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.811 -7.247 -0.062 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -6.424 -6.489 2.909 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -7.239 -5.816 1.478 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -8.192 -6.611 2.753 1.00 0.00 H new ATOM 2272 N VAL B 64 -11.172 -9.719 -0.193 1.00 0.00 N ATOM 2273 CA VAL B 64 -12.193 -9.974 -1.234 1.00 0.00 C ATOM 2274 C VAL B 64 -13.257 -10.980 -0.821 1.00 0.00 C ATOM 2275 O VAL B 64 -12.972 -11.913 -0.075 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.561 -10.499 -2.535 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -10.876 -9.347 -3.259 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.563 -11.613 -2.287 1.00 0.00 C ATOM 0 H VAL B 64 -10.865 -10.572 0.274 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.663 -9.002 -1.385 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.361 -10.915 -3.147 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.426 -9.713 -4.182 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.611 -8.577 -3.494 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.100 -8.925 -2.620 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.147 -11.947 -3.237 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.760 -11.246 -1.648 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.064 -12.448 -1.797 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.468 -10.801 -1.363 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.642 -11.633 -1.036 1.00 0.00 C ATOM 2290 C VAL B 65 -16.585 -11.873 -2.221 1.00 0.00 C ATOM 2291 O VAL B 65 -16.749 -11.008 -3.070 1.00 0.00 O ATOM 2292 CB VAL B 65 -16.427 -11.016 0.163 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -17.749 -11.730 0.498 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -15.593 -10.967 1.458 1.00 0.00 C ATOM 0 H VAL B 65 -14.666 -10.070 -2.046 1.00 0.00 H new ATOM 0 HA VAL B 65 -15.249 -12.612 -0.761 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.653 -10.009 -0.189 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -18.226 -11.234 1.343 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -18.412 -11.693 -0.366 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -17.546 -12.770 0.755 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -16.189 -10.529 2.258 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -15.296 -11.978 1.738 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.703 -10.360 1.295 1.00 0.00 H new ATOM 2304 N ALA B 66 -17.218 -13.054 -2.247 1.00 0.00 N ATOM 2305 CA ALA B 66 -18.317 -13.467 -3.133 1.00 0.00 C ATOM 2306 C ALA B 66 -19.662 -13.531 -2.393 1.00 0.00 C ATOM 2307 O ALA B 66 -19.722 -13.851 -1.209 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.948 -14.832 -3.732 1.00 0.00 C ATOM 0 H ALA B 66 -16.957 -13.800 -1.603 1.00 0.00 H new ATOM 0 HA ALA B 66 -18.445 -12.727 -3.923 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -18.746 -15.166 -4.395 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -17.020 -14.743 -4.297 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.816 -15.558 -2.930 1.00 0.00 H new ATOM 2314 N THR B 67 -20.741 -13.236 -3.125 1.00 0.00 N ATOM 2315 CA THR B 67 -22.145 -13.310 -2.682 1.00 0.00 C ATOM 2316 C THR B 67 -22.939 -13.943 -3.801 1.00 0.00 C ATOM 2317 O THR B 67 -22.426 -14.044 -4.903 1.00 0.00 O ATOM 2318 CB THR B 67 -22.759 -11.920 -2.370 1.00 0.00 C ATOM 2319 OG1 THR B 67 -23.362 -11.311 -3.498 1.00 0.00 O ATOM 2320 CG2 THR B 67 -21.754 -10.891 -1.871 1.00 0.00 C ATOM 0 H THR B 67 -20.659 -12.923 -4.092 1.00 0.00 H new ATOM 0 HA THR B 67 -22.179 -13.889 -1.759 1.00 0.00 H new ATOM 0 HB THR B 67 -23.487 -12.162 -1.596 1.00 0.00 H new ATOM 0 HG1 THR B 67 -24.261 -11.679 -3.627 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.265 -9.948 -1.677 1.00 0.00 H new ATOM 0 HG22 THR B 67 -21.292 -11.250 -0.951 1.00 0.00 H new ATOM 0 HG23 THR B 67 -20.984 -10.738 -2.627 1.00 0.00 H new ATOM 2328 N TYR B 68 -24.199 -14.294 -3.578 1.00 0.00 N ATOM 2329 CA TYR B 68 -25.110 -14.557 -4.697 1.00 0.00 C ATOM 2330 C TYR B 68 -25.624 -13.188 -5.197 1.00 0.00 C ATOM 2331 O TYR B 68 -25.955 -12.333 -4.371 1.00 0.00 O ATOM 2332 CB TYR B 68 -26.233 -15.509 -4.261 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.166 -16.877 -4.915 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -26.759 -17.093 -6.175 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -25.508 -17.938 -4.264 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -26.689 -18.359 -6.786 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -25.439 -19.210 -4.864 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.027 -19.422 -6.132 1.00 0.00 C ATOM 2339 OH TYR B 68 -25.953 -20.644 -6.726 1.00 0.00 O ATOM 0 H TYR B 68 -24.613 -14.403 -2.652 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.606 -15.064 -5.520 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -26.192 -15.632 -3.179 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -27.195 -15.052 -4.494 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -27.270 -16.283 -6.674 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -25.053 -17.775 -3.298 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -27.141 -18.518 -7.754 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -24.938 -20.021 -4.357 1.00 0.00 H new ATOM 0 HH TYR B 68 -25.464 -21.262 -6.144 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.622 -12.928 -6.509 1.00 0.00 N ATOM 2350 CA GLU B 69 -26.325 -11.766 -7.098 1.00 0.00 C ATOM 2351 C GLU B 69 -27.817 -12.044 -7.370 1.00 0.00 C ATOM 2352 O GLU B 69 -28.575 -11.106 -7.604 1.00 0.00 O ATOM 2353 CB GLU B 69 -25.575 -11.142 -8.299 1.00 0.00 C ATOM 2354 CG GLU B 69 -25.073 -12.021 -9.451 1.00 0.00 C ATOM 2355 CD GLU B 69 -26.175 -12.457 -10.410 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.874 -13.437 -10.089 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -26.288 -11.891 -11.516 1.00 0.00 O ATOM 0 H GLU B 69 -25.139 -13.508 -7.195 1.00 0.00 H new ATOM 0 HA GLU B 69 -26.314 -10.990 -6.332 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -26.234 -10.390 -8.733 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.710 -10.614 -7.898 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -24.312 -11.475 -10.009 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -24.591 -12.907 -9.038 1.00 0.00 H new ATOM 2364 N GLY B 70 -28.243 -13.308 -7.231 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.639 -13.769 -7.308 1.00 0.00 C ATOM 2366 C GLY B 70 -29.860 -14.903 -8.315 1.00 0.00 C ATOM 2367 O GLY B 70 -30.877 -15.585 -8.260 1.00 0.00 O ATOM 0 H GLY B 70 -27.593 -14.074 -7.053 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.956 -14.105 -6.321 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -30.276 -12.927 -7.578 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.892 -15.120 -9.209 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.934 -16.040 -10.352 1.00 0.00 C ATOM 2373 C ARG B 71 -27.593 -16.789 -10.496 1.00 0.00 C ATOM 2374 O ARG B 71 -27.568 -17.991 -10.754 1.00 0.00 O ATOM 2375 CB ARG B 71 -29.353 -15.168 -11.558 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.091 -15.689 -12.977 1.00 0.00 C ATOM 2377 CD ARG B 71 -27.644 -15.541 -13.461 1.00 0.00 C ATOM 2378 NE ARG B 71 -27.129 -14.160 -13.395 1.00 0.00 N ATOM 2379 CZ ARG B 71 -26.225 -13.634 -14.212 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -25.558 -14.353 -15.087 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -25.941 -12.359 -14.118 1.00 0.00 N ATOM 0 H ARG B 71 -28.001 -14.627 -9.152 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.655 -16.851 -10.243 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -30.422 -14.976 -11.470 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.847 -14.207 -11.461 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -29.367 -16.743 -13.018 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.746 -15.161 -13.669 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -27.003 -16.186 -12.861 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -27.578 -15.894 -14.490 1.00 0.00 H new ATOM 0 HE ARG B 71 -27.499 -13.558 -12.659 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -25.727 -15.356 -15.157 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -24.872 -13.907 -15.696 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -26.413 -11.781 -13.422 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -25.248 -11.944 -14.741 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.470 -16.102 -10.299 1.00 0.00 N ATOM 2396 CA GLN B 72 -25.107 -16.612 -10.134 1.00 0.00 C ATOM 2397 C GLN B 72 -24.524 -16.006 -8.848 1.00 0.00 C ATOM 2398 O GLN B 72 -25.153 -15.196 -8.170 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.197 -16.246 -11.348 1.00 0.00 C ATOM 2400 CG GLN B 72 -23.877 -17.424 -12.287 1.00 0.00 C ATOM 2401 CD GLN B 72 -24.981 -17.736 -13.298 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -25.157 -17.035 -14.282 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -25.797 -18.746 -13.086 1.00 0.00 N ATOM 0 H GLN B 72 -26.491 -15.084 -10.246 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.142 -17.700 -10.074 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -24.683 -15.460 -11.926 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.261 -15.833 -10.972 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -22.956 -17.204 -12.827 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -23.689 -18.313 -11.685 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -25.667 -19.344 -12.270 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -26.559 -18.931 -13.738 1.00 0.00 H new ATOM 2412 N VAL B 73 -23.299 -16.405 -8.511 1.00 0.00 N ATOM 2413 CA VAL B 73 -22.484 -15.722 -7.512 1.00 0.00 C ATOM 2414 C VAL B 73 -21.705 -14.582 -8.176 1.00 0.00 C ATOM 2415 O VAL B 73 -21.243 -14.729 -9.308 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.529 -16.663 -6.754 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.262 -17.420 -5.636 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.849 -17.697 -7.672 1.00 0.00 C ATOM 0 H VAL B 73 -22.842 -17.217 -8.927 1.00 0.00 H new ATOM 0 HA VAL B 73 -23.166 -15.321 -6.763 1.00 0.00 H new ATOM 0 HB VAL B 73 -20.761 -16.015 -6.332 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -21.561 -18.076 -5.120 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.680 -16.706 -4.927 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -23.066 -18.016 -6.067 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -20.189 -18.331 -7.080 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -21.609 -18.313 -8.152 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -20.267 -17.179 -8.435 1.00 0.00 H new ATOM 2428 N ARG B 74 -21.545 -13.474 -7.452 1.00 0.00 N ATOM 2429 CA ARG B 74 -20.721 -12.320 -7.782 1.00 0.00 C ATOM 2430 C ARG B 74 -19.481 -12.338 -6.897 1.00 0.00 C ATOM 2431 O ARG B 74 -19.269 -13.249 -6.099 1.00 0.00 O ATOM 2432 CB ARG B 74 -21.547 -11.021 -7.659 1.00 0.00 C ATOM 2433 CG ARG B 74 -21.462 -10.270 -6.318 1.00 0.00 C ATOM 2434 CD ARG B 74 -22.657 -9.324 -6.186 1.00 0.00 C ATOM 2435 NE ARG B 74 -22.530 -8.426 -5.026 1.00 0.00 N ATOM 2436 CZ ARG B 74 -23.377 -7.453 -4.710 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -24.477 -7.247 -5.409 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -23.128 -6.667 -3.680 1.00 0.00 N ATOM 0 H ARG B 74 -22.022 -13.355 -6.559 1.00 0.00 H new ATOM 0 HA ARG B 74 -20.386 -12.363 -8.818 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -21.231 -10.341 -8.450 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -22.593 -11.264 -7.847 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.454 -10.980 -5.491 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -20.531 -9.706 -6.263 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -22.750 -8.730 -7.095 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -23.572 -9.908 -6.092 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.725 -8.562 -4.415 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -24.691 -7.841 -6.210 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -25.113 -6.494 -5.148 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -22.284 -6.806 -3.125 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -23.780 -5.920 -3.439 1.00 0.00 H new ATOM 2452 N TYR B 75 -18.659 -11.316 -7.018 1.00 0.00 N ATOM 2453 CA TYR B 75 -17.524 -11.061 -6.150 1.00 0.00 C ATOM 2454 C TYR B 75 -17.364 -9.541 -5.936 1.00 0.00 C ATOM 2455 O TYR B 75 -18.118 -8.770 -6.516 1.00 0.00 O ATOM 2456 CB TYR B 75 -16.327 -11.885 -6.661 1.00 0.00 C ATOM 2457 CG TYR B 75 -15.673 -11.437 -7.929 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -16.399 -11.115 -9.087 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.288 -11.263 -7.894 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -15.760 -10.468 -10.150 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -13.656 -10.599 -8.937 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.390 -10.148 -10.062 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.811 -9.363 -11.014 1.00 0.00 O ATOM 0 H TYR B 75 -18.766 -10.614 -7.750 1.00 0.00 H new ATOM 0 HA TYR B 75 -17.652 -11.416 -5.127 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.569 -11.899 -5.878 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -16.661 -12.913 -6.800 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -17.447 -11.366 -9.157 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.713 -11.642 -7.062 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -16.317 -10.213 -11.039 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -12.591 -10.424 -8.890 1.00 0.00 H new ATOM 0 HH TYR B 75 -13.311 -8.639 -10.582 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.487 -9.095 -5.036 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.376 -7.707 -4.563 1.00 0.00 C ATOM 2475 C ALA B 76 -15.167 -7.519 -3.632 1.00 0.00 C ATOM 2476 O ALA B 76 -14.674 -8.493 -3.045 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.667 -7.304 -3.820 1.00 0.00 C ATOM 0 H ALA B 76 -15.805 -9.713 -4.596 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.233 -7.069 -5.435 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.580 -6.275 -3.471 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.517 -7.387 -4.497 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.817 -7.965 -2.966 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.716 -6.262 -3.487 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.799 -5.853 -2.412 1.00 0.00 C ATOM 2485 C LEU B 77 -14.536 -6.143 -1.091 1.00 0.00 C ATOM 2486 O LEU B 77 -15.745 -5.925 -1.021 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.479 -4.335 -2.479 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.586 -3.753 -3.581 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.353 -4.597 -3.863 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -13.381 -3.461 -4.856 1.00 0.00 C ATOM 0 H LEU B 77 -14.978 -5.500 -4.113 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.855 -6.392 -2.500 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.434 -3.812 -2.536 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.024 -4.065 -1.526 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.214 -2.803 -3.198 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.765 -4.129 -4.652 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -10.750 -4.674 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.659 -5.594 -4.181 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -12.715 -3.050 -5.614 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -13.826 -4.384 -5.227 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -14.169 -2.741 -4.636 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.850 -6.607 -0.042 1.00 0.00 N ATOM 2503 CA ALA B 78 -14.522 -7.006 1.207 1.00 0.00 C ATOM 2504 C ALA B 78 -15.286 -5.858 1.902 1.00 0.00 C ATOM 2505 O ALA B 78 -16.242 -6.105 2.647 1.00 0.00 O ATOM 2506 CB ALA B 78 -13.493 -7.649 2.136 1.00 0.00 C ATOM 0 H ALA B 78 -12.836 -6.717 -0.028 1.00 0.00 H new ATOM 0 HA ALA B 78 -15.296 -7.730 0.951 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -13.978 -7.949 3.065 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -13.063 -8.526 1.652 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -12.702 -6.932 2.355 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.899 -4.607 1.627 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.660 -3.422 2.001 1.00 0.00 C ATOM 2514 C ASP B 79 -15.344 -2.183 1.152 1.00 0.00 C ATOM 2515 O ASP B 79 -14.254 -2.025 0.592 1.00 0.00 O ATOM 2516 CB ASP B 79 -15.459 -3.068 3.489 1.00 0.00 C ATOM 2517 CG ASP B 79 -16.606 -2.162 3.939 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -17.731 -2.698 4.009 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -16.408 -0.928 4.020 1.00 0.00 O ATOM 0 H ASP B 79 -14.034 -4.392 1.131 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.699 -3.693 1.814 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.435 -3.975 4.093 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.503 -2.565 3.632 1.00 0.00 H new ATOM 2524 N SER B 80 -16.303 -1.254 1.181 1.00 0.00 N ATOM 2525 CA SER B 80 -16.161 0.131 0.732 1.00 0.00 C ATOM 2526 C SER B 80 -14.848 0.761 1.217 1.00 0.00 C ATOM 2527 O SER B 80 -14.228 1.517 0.479 1.00 0.00 O ATOM 2528 CB SER B 80 -17.340 0.954 1.282 1.00 0.00 C ATOM 2529 OG SER B 80 -17.237 1.207 2.681 1.00 0.00 O ATOM 0 H SER B 80 -17.239 -1.456 1.533 1.00 0.00 H new ATOM 0 HA SER B 80 -16.153 0.133 -0.358 1.00 0.00 H new ATOM 0 HB2 SER B 80 -17.393 1.904 0.749 1.00 0.00 H new ATOM 0 HB3 SER B 80 -18.271 0.424 1.082 1.00 0.00 H new ATOM 0 HG SER B 80 -17.039 0.370 3.151 1.00 0.00 H new ATOM 2535 N HIS B 81 -14.385 0.404 2.425 1.00 0.00 N ATOM 2536 CA HIS B 81 -13.166 0.906 3.049 1.00 0.00 C ATOM 2537 C HIS B 81 -11.917 0.574 2.217 1.00 0.00 C ATOM 2538 O HIS B 81 -11.107 1.469 1.990 1.00 0.00 O ATOM 2539 CB HIS B 81 -13.096 0.347 4.490 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.864 1.347 5.599 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.930 2.727 5.550 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -12.441 1.011 6.852 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -12.502 3.209 6.735 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -12.227 2.178 7.556 1.00 0.00 N ATOM 0 H HIS B 81 -14.875 -0.271 3.012 1.00 0.00 H new ATOM 0 HA HIS B 81 -13.192 1.995 3.094 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -14.029 -0.178 4.696 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -12.298 -0.394 4.528 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -12.299 0.008 7.227 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.397 4.254 6.985 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -11.916 2.247 8.525 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.765 -0.665 1.719 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.646 -1.007 0.819 1.00 0.00 C ATOM 2555 C LEU B 82 -10.838 -0.310 -0.518 1.00 0.00 C ATOM 2556 O LEU B 82 -9.912 0.341 -0.986 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.469 -2.526 0.588 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.705 -3.432 1.810 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.566 -4.894 1.388 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -9.741 -3.114 2.963 1.00 0.00 C ATOM 0 H LEU B 82 -12.395 -1.441 1.921 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.738 -0.663 1.314 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.152 -2.834 -0.204 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.457 -2.701 0.222 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.713 -3.245 2.179 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -10.732 -5.539 2.251 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -11.302 -5.122 0.617 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.564 -5.065 0.995 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -9.946 -3.779 3.802 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -8.714 -3.258 2.629 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -9.879 -2.079 3.277 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.057 -0.360 -1.066 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.439 0.286 -2.324 1.00 0.00 C ATOM 2574 C ALA B 83 -12.231 1.815 -2.327 1.00 0.00 C ATOM 2575 O ALA B 83 -12.124 2.404 -3.398 1.00 0.00 O ATOM 2576 CB ALA B 83 -13.896 -0.091 -2.619 1.00 0.00 C ATOM 0 H ALA B 83 -12.828 -0.867 -0.632 1.00 0.00 H new ATOM 0 HA ALA B 83 -11.780 -0.075 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.211 0.376 -3.552 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.981 -1.174 -2.709 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.534 0.257 -1.806 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.154 2.443 -1.149 1.00 0.00 N ATOM 2583 CA ARG B 84 -11.909 3.872 -0.961 1.00 0.00 C ATOM 2584 C ARG B 84 -10.434 4.200 -1.220 1.00 0.00 C ATOM 2585 O ARG B 84 -10.147 4.764 -2.273 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.418 4.272 0.442 1.00 0.00 C ATOM 2587 CG ARG B 84 -12.524 5.763 0.780 1.00 0.00 C ATOM 2588 CD ARG B 84 -13.377 6.565 -0.209 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.578 7.061 -1.332 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.799 6.993 -2.636 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -13.774 6.280 -3.163 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -12.006 7.680 -3.420 1.00 0.00 N ATOM 0 H ARG B 84 -12.266 1.946 -0.265 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.461 4.471 -1.685 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.405 3.830 0.576 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.760 3.810 1.178 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.947 5.870 1.779 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -11.522 6.191 0.810 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -14.185 5.938 -0.586 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.841 7.405 0.308 1.00 0.00 H new ATOM 0 HE ARG B 84 -11.714 7.534 -1.068 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -14.400 5.748 -2.559 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -13.902 6.261 -4.175 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -11.253 8.240 -3.020 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.142 7.655 -4.431 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.504 3.715 -0.386 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.061 3.945 -0.560 1.00 0.00 C ATOM 2608 C ALA B 85 -7.510 3.374 -1.881 1.00 0.00 C ATOM 2609 O ALA B 85 -6.658 3.988 -2.518 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.326 3.364 0.653 1.00 0.00 C ATOM 0 H ALA B 85 -9.731 3.150 0.432 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.891 5.020 -0.622 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.254 3.526 0.541 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.674 3.858 1.560 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.526 2.295 0.722 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.026 2.222 -2.320 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.784 1.650 -3.652 1.00 0.00 C ATOM 2618 C LEU B 86 -8.307 2.588 -4.765 1.00 0.00 C ATOM 2619 O LEU B 86 -7.655 2.737 -5.796 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.488 0.278 -3.638 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.561 -0.545 -4.927 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.288 -1.121 -5.524 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -9.530 -1.711 -4.702 1.00 0.00 C ATOM 0 H LEU B 86 -8.640 1.645 -1.745 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.722 1.533 -3.869 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -7.992 -0.336 -2.886 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.510 0.439 -3.295 1.00 0.00 H new ATOM 0 HG LEU B 86 -8.873 0.197 -5.661 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.529 -1.673 -6.432 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -6.599 -0.311 -5.764 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -6.821 -1.793 -4.805 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -9.596 -2.310 -5.610 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -9.168 -2.332 -3.883 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -10.517 -1.321 -4.452 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.457 3.234 -4.525 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.243 4.039 -5.467 1.00 0.00 C ATOM 2637 C GLY B 87 -9.713 5.450 -5.707 1.00 0.00 C ATOM 2638 O GLY B 87 -9.697 5.889 -6.852 1.00 0.00 O ATOM 0 H GLY B 87 -9.892 3.205 -3.603 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.285 3.515 -6.422 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.266 4.109 -5.097 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.283 6.172 -4.663 1.00 0.00 N ATOM 2643 CA GLU B 88 -8.540 7.436 -4.857 1.00 0.00 C ATOM 2644 C GLU B 88 -7.114 7.205 -5.368 1.00 0.00 C ATOM 2645 O GLU B 88 -6.463 8.160 -5.804 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.532 8.352 -3.617 1.00 0.00 C ATOM 2647 CG GLU B 88 -8.228 7.714 -2.239 1.00 0.00 C ATOM 2648 CD GLU B 88 -9.417 7.746 -1.269 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -10.323 8.587 -1.460 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -9.522 6.859 -0.399 1.00 0.00 O ATOM 0 H GLU B 88 -9.431 5.912 -3.688 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.097 7.964 -5.631 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -7.798 9.139 -3.789 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -9.507 8.834 -3.553 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -7.919 6.679 -2.388 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -7.386 8.236 -1.785 1.00 0.00 H new ATOM 2657 N LEU B 89 -6.661 5.942 -5.327 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.390 5.438 -5.829 1.00 0.00 C ATOM 2659 C LEU B 89 -4.267 5.923 -4.908 1.00 0.00 C ATOM 2660 O LEU B 89 -4.258 7.067 -4.468 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.252 5.813 -7.327 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.065 5.199 -8.086 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -4.440 4.992 -9.561 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -2.813 6.091 -8.015 1.00 0.00 C ATOM 0 H LEU B 89 -7.221 5.198 -4.910 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.330 4.350 -5.805 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.170 5.520 -7.837 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.178 6.898 -7.401 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.836 4.245 -7.611 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -3.595 4.557 -10.094 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -5.296 4.320 -9.628 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -4.696 5.952 -10.010 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -1.998 5.619 -8.564 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -3.033 7.063 -8.456 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -2.519 6.224 -6.974 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.259 5.087 -4.663 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.152 5.315 -3.697 1.00 0.00 C ATOM 2678 C VAL B 90 -1.259 6.547 -3.941 1.00 0.00 C ATOM 2679 O VAL B 90 -0.159 6.649 -3.396 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.209 4.107 -3.605 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.927 2.836 -3.138 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -0.552 3.883 -4.978 1.00 0.00 C ATOM 0 H VAL B 90 -3.175 4.192 -5.145 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.706 5.489 -2.774 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.449 4.325 -2.854 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -1.215 2.012 -3.090 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -2.356 3.003 -2.150 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.722 2.588 -3.841 1.00 0.00 H new ATOM 0 HG21 VAL B 90 0.120 3.027 -4.924 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -1.324 3.692 -5.724 1.00 0.00 H new ATOM 0 HG23 VAL B 90 0.013 4.771 -5.260 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.665 7.466 -4.812 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.245 8.858 -4.800 1.00 0.00 C ATOM 2694 C GLN B 91 0.151 9.101 -5.389 1.00 0.00 C ATOM 2695 O GLN B 91 0.425 10.215 -5.813 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.358 9.407 -3.370 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.794 9.607 -2.854 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.706 10.501 -3.688 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -3.768 11.703 -3.493 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.399 9.986 -4.682 1.00 0.00 N ATOM 0 H GLN B 91 -2.316 7.253 -5.568 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.918 9.401 -5.463 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.838 8.727 -2.695 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.836 10.363 -3.323 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.264 8.627 -2.769 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.739 10.022 -1.848 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.362 8.983 -4.864 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.973 10.590 -5.271 1.00 0.00 H new ATOM 2709 N VAL B 92 1.008 8.086 -5.506 1.00 0.00 N ATOM 2710 CA VAL B 92 2.369 8.135 -6.097 1.00 0.00 C ATOM 2711 C VAL B 92 2.415 8.412 -7.614 1.00 0.00 C ATOM 2712 O VAL B 92 3.262 7.919 -8.347 1.00 0.00 O ATOM 2713 CB VAL B 92 3.152 6.866 -5.678 1.00 0.00 C ATOM 2714 CG1 VAL B 92 2.798 5.643 -6.541 1.00 0.00 C ATOM 2715 CG2 VAL B 92 4.671 7.107 -5.635 1.00 0.00 C ATOM 0 H VAL B 92 0.769 7.151 -5.176 1.00 0.00 H new ATOM 0 HA VAL B 92 2.867 9.013 -5.686 1.00 0.00 H new ATOM 0 HB VAL B 92 2.834 6.637 -4.661 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.375 4.781 -6.205 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.734 5.427 -6.446 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.034 5.853 -7.584 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.177 6.189 -5.336 1.00 0.00 H new ATOM 0 HG22 VAL B 92 5.020 7.408 -6.623 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.894 7.895 -4.915 1.00 0.00 H new ATOM 2725 N VAL B 93 1.453 9.191 -8.104 1.00 0.00 N ATOM 2726 CA VAL B 93 1.299 9.580 -9.518 1.00 0.00 C ATOM 2727 C VAL B 93 1.067 8.378 -10.468 1.00 0.00 C ATOM 2728 O VAL B 93 1.119 8.549 -11.683 1.00 0.00 O ATOM 2729 CB VAL B 93 2.477 10.468 -10.025 1.00 0.00 C ATOM 2730 CG1 VAL B 93 1.908 11.567 -10.930 1.00 0.00 C ATOM 2731 CG2 VAL B 93 3.277 11.205 -8.931 1.00 0.00 C ATOM 0 H VAL B 93 0.726 9.588 -7.509 1.00 0.00 H new ATOM 0 HA VAL B 93 0.391 10.182 -9.545 1.00 0.00 H new ATOM 0 HB VAL B 93 3.154 9.771 -10.519 1.00 0.00 H new ATOM 0 HG11 VAL B 93 2.720 12.197 -11.293 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.396 11.111 -11.778 1.00 0.00 H new ATOM 0 HG13 VAL B 93 1.202 12.175 -10.364 1.00 0.00 H new ATOM 0 HG21 VAL B 93 4.071 11.792 -9.394 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.611 11.867 -8.377 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.715 10.477 -8.248 1.00 0.00 H new ATOM 2741 N LEU B 94 0.809 7.195 -9.876 1.00 0.00 N ATOM 2742 CA LEU B 94 0.758 5.826 -10.418 1.00 0.00 C ATOM 2743 C LEU B 94 2.161 5.218 -10.416 1.00 0.00 C ATOM 2744 O LEU B 94 3.036 5.664 -11.150 1.00 0.00 O ATOM 2745 CB LEU B 94 0.190 5.672 -11.848 1.00 0.00 C ATOM 2746 CG LEU B 94 -1.337 5.718 -11.991 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -1.953 7.078 -11.650 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -1.673 5.348 -13.436 1.00 0.00 C ATOM 0 H LEU B 94 0.605 7.178 -8.877 1.00 0.00 H new ATOM 0 HA LEU B 94 0.061 5.311 -9.756 1.00 0.00 H new ATOM 0 HB2 LEU B 94 0.614 6.461 -12.469 1.00 0.00 H new ATOM 0 HB3 LEU B 94 0.541 4.723 -12.253 1.00 0.00 H new ATOM 0 HG LEU B 94 -1.762 5.016 -11.274 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -3.035 7.029 -11.775 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -1.719 7.335 -10.617 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -1.545 7.839 -12.315 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -2.754 5.370 -13.575 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -1.205 6.063 -14.113 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -1.300 4.347 -13.651 1.00 0.00 H new ATOM 2760 N ALA B 95 2.365 4.158 -9.632 1.00 0.00 N ATOM 2761 CA ALA B 95 3.578 3.354 -9.779 1.00 0.00 C ATOM 2762 C ALA B 95 3.526 2.520 -11.079 1.00 0.00 C ATOM 2763 O ALA B 95 2.462 2.072 -11.515 1.00 0.00 O ATOM 2764 CB ALA B 95 3.827 2.517 -8.519 1.00 0.00 C ATOM 0 H ALA B 95 1.723 3.842 -8.905 1.00 0.00 H new ATOM 0 HA ALA B 95 4.440 4.014 -9.879 1.00 0.00 H new ATOM 0 HB1 ALA B 95 4.734 1.926 -8.648 1.00 0.00 H new ATOM 0 HB2 ALA B 95 3.944 3.178 -7.660 1.00 0.00 H new ATOM 0 HB3 ALA B 95 2.981 1.851 -8.351 1.00 0.00 H new