USER MOD reduce.3.24.130724 H: found=0, std=0, add=730, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 732 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 62 LYS NZ :NH3+ 160:sc= 0.938 (180deg=0) USER MOD Set 1.2: B 42 GLN : amide:sc= 0.82 K(o=1.8,f=-7.7!) USER MOD Set 2.1: A 49 MET CE :methyl 172:sc= -0.909 (180deg=-0.816) USER MOD Set 2.2: A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 140:sc= -0.0954 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.0889 X(o=-0.089,f=-0.3) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 1.49 K(o=1.5,f=-4.1!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 THR OG1 : rot 19:sc= 0.377 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0.0631 USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= 0.933 K(o=0.93,f=-6.6!) USER MOD Single : B 45 LYS NZ :NH3+ 177:sc= 1.25 (180deg=1.11) USER MOD Single : B 48 LYS NZ :NH3+ 153:sc= 0.941 (180deg=0.436) USER MOD Single : B 49 MET CE :methyl 178:sc= -0.695 (180deg=-0.715) USER MOD Single : B 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 60 TYR OH : rot -47:sc= 0.0138 USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 31 -8.109 13.805 -13.882 1.00 0.00 N ATOM 2 CA THR A 31 -7.556 12.503 -13.462 1.00 0.00 C ATOM 3 C THR A 31 -6.926 12.534 -12.057 1.00 0.00 C ATOM 4 O THR A 31 -6.737 13.594 -11.450 1.00 0.00 O ATOM 5 CB THR A 31 -6.569 11.974 -14.520 1.00 0.00 C ATOM 6 OG1 THR A 31 -6.171 10.651 -14.247 1.00 0.00 O ATOM 7 CG2 THR A 31 -5.302 12.819 -14.666 1.00 0.00 C ATOM 0 HA THR A 31 -8.394 11.809 -13.389 1.00 0.00 H new ATOM 0 HB THR A 31 -7.128 12.026 -15.454 1.00 0.00 H new ATOM 0 HG1 THR A 31 -6.127 10.143 -15.084 1.00 0.00 H new ATOM 0 HG21 THR A 31 -4.659 12.381 -15.429 1.00 0.00 H new ATOM 0 HG22 THR A 31 -5.573 13.834 -14.958 1.00 0.00 H new ATOM 0 HG23 THR A 31 -4.770 12.845 -13.715 1.00 0.00 H new ATOM 15 N ARG A 32 -6.599 11.350 -11.527 1.00 0.00 N ATOM 16 CA ARG A 32 -5.887 11.121 -10.260 1.00 0.00 C ATOM 17 C ARG A 32 -4.370 11.265 -10.427 1.00 0.00 C ATOM 18 O ARG A 32 -3.839 11.329 -11.534 1.00 0.00 O ATOM 19 CB ARG A 32 -6.286 9.729 -9.720 1.00 0.00 C ATOM 20 CG ARG A 32 -7.418 9.736 -8.677 1.00 0.00 C ATOM 21 CD ARG A 32 -8.510 10.804 -8.874 1.00 0.00 C ATOM 22 NE ARG A 32 -9.784 10.457 -8.210 1.00 0.00 N ATOM 23 CZ ARG A 32 -10.009 10.187 -6.934 1.00 0.00 C ATOM 24 NH1 ARG A 32 -9.084 10.242 -6.020 1.00 0.00 N ATOM 25 NH2 ARG A 32 -11.191 9.836 -6.538 1.00 0.00 N ATOM 0 H ARG A 32 -6.836 10.475 -11.995 1.00 0.00 H new ATOM 0 HA ARG A 32 -6.176 11.882 -9.535 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.590 9.104 -10.560 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -5.407 9.262 -9.276 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.893 8.755 -8.678 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -6.976 9.875 -7.691 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -8.152 11.757 -8.485 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -8.688 10.941 -9.941 1.00 0.00 H new ATOM 0 HE ARG A 32 -10.602 10.421 -8.818 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -8.131 10.503 -6.274 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -9.312 10.024 -5.050 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -11.954 9.766 -7.211 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -11.358 9.629 -5.553 1.00 0.00 H new ATOM 39 N ALA A 33 -3.684 11.303 -9.291 1.00 0.00 N ATOM 40 CA ALA A 33 -2.251 11.547 -9.148 1.00 0.00 C ATOM 41 C ALA A 33 -1.629 10.474 -8.236 1.00 0.00 C ATOM 42 O ALA A 33 -1.888 10.437 -7.031 1.00 0.00 O ATOM 43 CB ALA A 33 -2.070 12.976 -8.622 1.00 0.00 C ATOM 0 H ALA A 33 -4.139 11.156 -8.390 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.728 11.470 -10.101 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -1.007 13.189 -8.504 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -2.505 13.682 -9.329 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -2.569 13.075 -7.658 1.00 0.00 H new ATOM 49 N VAL A 34 -0.875 9.549 -8.833 1.00 0.00 N ATOM 50 CA VAL A 34 -0.581 8.218 -8.276 1.00 0.00 C ATOM 51 C VAL A 34 0.933 8.003 -8.236 1.00 0.00 C ATOM 52 O VAL A 34 1.502 7.363 -9.115 1.00 0.00 O ATOM 53 CB VAL A 34 -1.290 7.127 -9.104 1.00 0.00 C ATOM 54 CG1 VAL A 34 -1.248 5.781 -8.383 1.00 0.00 C ATOM 55 CG2 VAL A 34 -2.749 7.463 -9.442 1.00 0.00 C ATOM 0 H VAL A 34 -0.438 9.705 -9.742 1.00 0.00 H new ATOM 0 HA VAL A 34 -0.960 8.154 -7.256 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.739 7.073 -10.043 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -1.755 5.029 -8.987 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -0.211 5.484 -8.228 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.749 5.869 -7.419 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.184 6.651 -10.025 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.316 7.591 -8.520 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.785 8.386 -10.021 1.00 0.00 H new ATOM 65 N SER A 35 1.592 8.590 -7.239 1.00 0.00 N ATOM 66 CA SER A 35 3.050 8.781 -7.187 1.00 0.00 C ATOM 67 C SER A 35 3.721 7.864 -6.160 1.00 0.00 C ATOM 68 O SER A 35 3.385 7.887 -4.972 1.00 0.00 O ATOM 69 CB SER A 35 3.357 10.248 -6.890 1.00 0.00 C ATOM 70 OG SER A 35 4.751 10.504 -6.943 1.00 0.00 O ATOM 0 H SER A 35 1.116 8.960 -6.416 1.00 0.00 H new ATOM 0 HA SER A 35 3.462 8.510 -8.159 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.841 10.883 -7.610 1.00 0.00 H new ATOM 0 HB3 SER A 35 2.974 10.509 -5.903 1.00 0.00 H new ATOM 0 HG SER A 35 4.917 11.450 -6.751 1.00 0.00 H new ATOM 76 N LEU A 36 4.658 7.036 -6.631 1.00 0.00 N ATOM 77 CA LEU A 36 5.361 5.994 -5.885 1.00 0.00 C ATOM 78 C LEU A 36 6.876 6.004 -6.161 1.00 0.00 C ATOM 79 O LEU A 36 7.363 6.587 -7.134 1.00 0.00 O ATOM 80 CB LEU A 36 4.765 4.617 -6.247 1.00 0.00 C ATOM 81 CG LEU A 36 3.316 4.394 -5.773 1.00 0.00 C ATOM 82 CD1 LEU A 36 2.281 4.653 -6.866 1.00 0.00 C ATOM 83 CD2 LEU A 36 3.151 2.942 -5.339 1.00 0.00 C ATOM 0 H LEU A 36 4.963 7.080 -7.603 1.00 0.00 H new ATOM 0 HA LEU A 36 5.227 6.193 -4.822 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.801 4.495 -7.330 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.396 3.839 -5.817 1.00 0.00 H new ATOM 0 HG LEU A 36 3.146 5.098 -4.958 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.281 4.479 -6.469 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.361 5.685 -7.206 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.461 3.980 -7.704 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.128 2.777 -5.002 1.00 0.00 H new ATOM 0 HD22 LEU A 36 3.367 2.284 -6.181 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.841 2.725 -4.523 1.00 0.00 H new ATOM 95 N TYR A 37 7.603 5.282 -5.308 1.00 0.00 N ATOM 96 CA TYR A 37 9.058 5.129 -5.302 1.00 0.00 C ATOM 97 C TYR A 37 9.433 3.640 -5.260 1.00 0.00 C ATOM 98 O TYR A 37 9.545 3.038 -4.190 1.00 0.00 O ATOM 99 CB TYR A 37 9.643 5.920 -4.122 1.00 0.00 C ATOM 100 CG TYR A 37 9.681 7.418 -4.352 1.00 0.00 C ATOM 101 CD1 TYR A 37 10.786 7.987 -5.014 1.00 0.00 C ATOM 102 CD2 TYR A 37 8.621 8.241 -3.922 1.00 0.00 C ATOM 103 CE1 TYR A 37 10.845 9.373 -5.238 1.00 0.00 C ATOM 104 CE2 TYR A 37 8.669 9.630 -4.157 1.00 0.00 C ATOM 105 CZ TYR A 37 9.783 10.201 -4.813 1.00 0.00 C ATOM 106 OH TYR A 37 9.825 11.546 -5.028 1.00 0.00 O ATOM 0 H TYR A 37 7.163 4.754 -4.554 1.00 0.00 H new ATOM 0 HA TYR A 37 9.486 5.534 -6.219 1.00 0.00 H new ATOM 0 HB2 TYR A 37 9.053 5.713 -3.229 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.655 5.566 -3.924 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.593 7.354 -5.352 1.00 0.00 H new ATOM 0 HD2 TYR A 37 7.773 7.808 -3.413 1.00 0.00 H new ATOM 0 HE1 TYR A 37 11.702 9.804 -5.735 1.00 0.00 H new ATOM 0 HE2 TYR A 37 7.853 10.259 -3.835 1.00 0.00 H new ATOM 0 HH TYR A 37 9.011 11.960 -4.672 1.00 0.00 H new ATOM 116 N PHE A 38 9.561 3.026 -6.438 1.00 0.00 N ATOM 117 CA PHE A 38 10.000 1.646 -6.626 1.00 0.00 C ATOM 118 C PHE A 38 11.524 1.503 -6.471 1.00 0.00 C ATOM 119 O PHE A 38 12.256 2.495 -6.384 1.00 0.00 O ATOM 120 CB PHE A 38 9.539 1.204 -8.023 1.00 0.00 C ATOM 121 CG PHE A 38 8.171 0.544 -8.043 1.00 0.00 C ATOM 122 CD1 PHE A 38 7.017 1.283 -7.717 1.00 0.00 C ATOM 123 CD2 PHE A 38 8.051 -0.820 -8.374 1.00 0.00 C ATOM 124 CE1 PHE A 38 5.756 0.664 -7.727 1.00 0.00 C ATOM 125 CE2 PHE A 38 6.791 -1.444 -8.363 1.00 0.00 C ATOM 126 CZ PHE A 38 5.644 -0.701 -8.038 1.00 0.00 C ATOM 0 H PHE A 38 9.353 3.496 -7.319 1.00 0.00 H new ATOM 0 HA PHE A 38 9.560 1.009 -5.859 1.00 0.00 H new ATOM 0 HB2 PHE A 38 9.521 2.073 -8.680 1.00 0.00 H new ATOM 0 HB3 PHE A 38 10.272 0.509 -8.433 1.00 0.00 H new ATOM 0 HD1 PHE A 38 7.102 2.328 -7.459 1.00 0.00 H new ATOM 0 HD2 PHE A 38 8.930 -1.389 -8.637 1.00 0.00 H new ATOM 0 HE1 PHE A 38 4.871 1.239 -7.495 1.00 0.00 H new ATOM 0 HE2 PHE A 38 6.705 -2.493 -8.604 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.676 -1.180 -8.027 1.00 0.00 H new ATOM 136 N SER A 39 12.006 0.258 -6.518 1.00 0.00 N ATOM 137 CA SER A 39 13.429 -0.069 -6.552 1.00 0.00 C ATOM 138 C SER A 39 13.775 -0.846 -7.807 1.00 0.00 C ATOM 139 O SER A 39 12.907 -1.453 -8.435 1.00 0.00 O ATOM 140 CB SER A 39 13.855 -0.829 -5.288 1.00 0.00 C ATOM 141 OG SER A 39 13.657 -0.030 -4.130 1.00 0.00 O ATOM 0 H SER A 39 11.404 -0.565 -6.534 1.00 0.00 H new ATOM 0 HA SER A 39 13.988 0.866 -6.574 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.281 -1.752 -5.202 1.00 0.00 H new ATOM 0 HB3 SER A 39 14.905 -1.113 -5.365 1.00 0.00 H new ATOM 0 HG SER A 39 13.933 -0.532 -3.335 1.00 0.00 H new ATOM 147 N ASP A 40 15.053 -0.805 -8.182 1.00 0.00 N ATOM 148 CA ASP A 40 15.537 -1.285 -9.474 1.00 0.00 C ATOM 149 C ASP A 40 15.127 -2.729 -9.769 1.00 0.00 C ATOM 150 O ASP A 40 14.634 -2.997 -10.855 1.00 0.00 O ATOM 151 CB ASP A 40 17.055 -1.076 -9.563 1.00 0.00 C ATOM 152 CG ASP A 40 17.372 0.297 -10.172 1.00 0.00 C ATOM 153 OD1 ASP A 40 16.941 0.532 -11.327 1.00 0.00 O ATOM 154 OD2 ASP A 40 18.029 1.129 -9.503 1.00 0.00 O ATOM 0 H ASP A 40 15.792 -0.431 -7.587 1.00 0.00 H new ATOM 0 HA ASP A 40 15.057 -0.695 -10.255 1.00 0.00 H new ATOM 0 HB2 ASP A 40 17.498 -1.151 -8.570 1.00 0.00 H new ATOM 0 HB3 ASP A 40 17.502 -1.862 -10.171 1.00 0.00 H new ATOM 159 N GLU A 41 15.233 -3.644 -8.805 1.00 0.00 N ATOM 160 CA GLU A 41 14.796 -5.037 -8.967 1.00 0.00 C ATOM 161 C GLU A 41 13.307 -5.149 -9.326 1.00 0.00 C ATOM 162 O GLU A 41 12.948 -5.766 -10.331 1.00 0.00 O ATOM 163 CB GLU A 41 15.069 -5.808 -7.668 1.00 0.00 C ATOM 164 CG GLU A 41 16.555 -5.878 -7.306 1.00 0.00 C ATOM 165 CD GLU A 41 17.224 -7.154 -7.853 1.00 0.00 C ATOM 166 OE1 GLU A 41 17.561 -7.196 -9.062 1.00 0.00 O ATOM 167 OE2 GLU A 41 17.424 -8.121 -7.078 1.00 0.00 O ATOM 0 H GLU A 41 15.625 -3.442 -7.885 1.00 0.00 H new ATOM 0 HA GLU A 41 15.362 -5.464 -9.795 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.525 -5.334 -6.851 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.678 -6.821 -7.766 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.067 -5.002 -7.704 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.666 -5.847 -6.222 1.00 0.00 H new ATOM 174 N GLN A 42 12.444 -4.528 -8.514 1.00 0.00 N ATOM 175 CA GLN A 42 10.989 -4.510 -8.721 1.00 0.00 C ATOM 176 C GLN A 42 10.601 -3.848 -10.056 1.00 0.00 C ATOM 177 O GLN A 42 9.711 -4.339 -10.753 1.00 0.00 O ATOM 178 CB GLN A 42 10.284 -3.814 -7.542 1.00 0.00 C ATOM 179 CG GLN A 42 10.538 -4.472 -6.172 1.00 0.00 C ATOM 180 CD GLN A 42 10.146 -5.951 -6.127 1.00 0.00 C ATOM 181 OE1 GLN A 42 9.010 -6.334 -6.362 1.00 0.00 O ATOM 182 NE2 GLN A 42 11.064 -6.843 -5.818 1.00 0.00 N ATOM 0 H GLN A 42 12.739 -4.016 -7.683 1.00 0.00 H new ATOM 0 HA GLN A 42 10.655 -5.547 -8.768 1.00 0.00 H new ATOM 0 HB2 GLN A 42 10.613 -2.776 -7.499 1.00 0.00 H new ATOM 0 HB3 GLN A 42 9.211 -3.801 -7.732 1.00 0.00 H new ATOM 0 HG2 GLN A 42 11.594 -4.376 -5.921 1.00 0.00 H new ATOM 0 HG3 GLN A 42 9.978 -3.932 -5.408 1.00 0.00 H new ATOM 0 HE21 GLN A 42 12.019 -6.544 -5.618 1.00 0.00 H new ATOM 0 HE22 GLN A 42 10.821 -7.833 -5.778 1.00 0.00 H new ATOM 191 N TYR A 43 11.286 -2.764 -10.443 1.00 0.00 N ATOM 192 CA TYR A 43 11.069 -2.086 -11.724 1.00 0.00 C ATOM 193 C TYR A 43 11.487 -2.956 -12.906 1.00 0.00 C ATOM 194 O TYR A 43 10.710 -3.189 -13.830 1.00 0.00 O ATOM 195 CB TYR A 43 11.863 -0.779 -11.769 1.00 0.00 C ATOM 196 CG TYR A 43 11.323 0.184 -12.812 1.00 0.00 C ATOM 197 CD1 TYR A 43 10.236 1.026 -12.501 1.00 0.00 C ATOM 198 CD2 TYR A 43 11.869 0.196 -14.110 1.00 0.00 C ATOM 199 CE1 TYR A 43 9.706 1.887 -13.484 1.00 0.00 C ATOM 200 CE2 TYR A 43 11.341 1.052 -15.095 1.00 0.00 C ATOM 201 CZ TYR A 43 10.258 1.902 -14.785 1.00 0.00 C ATOM 202 OH TYR A 43 9.750 2.724 -15.742 1.00 0.00 O ATOM 0 H TYR A 43 12.011 -2.331 -9.871 1.00 0.00 H new ATOM 0 HA TYR A 43 10.001 -1.883 -11.804 1.00 0.00 H new ATOM 0 HB2 TYR A 43 11.834 -0.304 -10.788 1.00 0.00 H new ATOM 0 HB3 TYR A 43 12.908 -0.998 -11.986 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.809 1.012 -11.509 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.697 -0.455 -14.351 1.00 0.00 H new ATOM 0 HE1 TYR A 43 8.877 2.536 -13.242 1.00 0.00 H new ATOM 0 HE2 TYR A 43 11.765 1.058 -16.088 1.00 0.00 H new ATOM 0 HH TYR A 43 10.251 2.604 -16.576 1.00 0.00 H new ATOM 212 N GLN A 44 12.726 -3.442 -12.863 1.00 0.00 N ATOM 213 CA GLN A 44 13.346 -4.220 -13.939 1.00 0.00 C ATOM 214 C GLN A 44 12.565 -5.502 -14.237 1.00 0.00 C ATOM 215 O GLN A 44 12.367 -5.822 -15.407 1.00 0.00 O ATOM 216 CB GLN A 44 14.825 -4.556 -13.668 1.00 0.00 C ATOM 217 CG GLN A 44 15.822 -3.543 -14.259 1.00 0.00 C ATOM 218 CD GLN A 44 15.852 -2.184 -13.564 1.00 0.00 C ATOM 219 OE1 GLN A 44 14.998 -1.328 -13.748 1.00 0.00 O ATOM 220 NE2 GLN A 44 16.871 -1.888 -12.790 1.00 0.00 N ATOM 0 H GLN A 44 13.342 -3.304 -12.062 1.00 0.00 H new ATOM 0 HA GLN A 44 13.313 -3.576 -14.817 1.00 0.00 H new ATOM 0 HB2 GLN A 44 14.981 -4.616 -12.591 1.00 0.00 H new ATOM 0 HB3 GLN A 44 15.042 -5.543 -14.077 1.00 0.00 H new ATOM 0 HG2 GLN A 44 16.822 -3.976 -14.221 1.00 0.00 H new ATOM 0 HG3 GLN A 44 15.581 -3.391 -15.311 1.00 0.00 H new ATOM 0 HE21 GLN A 44 17.599 -2.581 -12.618 1.00 0.00 H new ATOM 0 HE22 GLN A 44 16.934 -0.965 -12.361 1.00 0.00 H new ATOM 229 N LYS A 45 12.060 -6.210 -13.217 1.00 0.00 N ATOM 230 CA LYS A 45 11.158 -7.347 -13.409 1.00 0.00 C ATOM 231 C LYS A 45 9.877 -6.959 -14.153 1.00 0.00 C ATOM 232 O LYS A 45 9.455 -7.714 -15.029 1.00 0.00 O ATOM 233 CB LYS A 45 10.855 -8.000 -12.051 1.00 0.00 C ATOM 234 CG LYS A 45 11.479 -9.393 -11.878 1.00 0.00 C ATOM 235 CD LYS A 45 10.793 -10.459 -12.749 1.00 0.00 C ATOM 236 CE LYS A 45 11.428 -11.831 -12.491 1.00 0.00 C ATOM 237 NZ LYS A 45 10.803 -12.895 -13.322 1.00 0.00 N ATOM 0 H LYS A 45 12.267 -6.009 -12.239 1.00 0.00 H new ATOM 0 HA LYS A 45 11.661 -8.075 -14.045 1.00 0.00 H new ATOM 0 HB2 LYS A 45 11.218 -7.348 -11.256 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.775 -8.079 -11.930 1.00 0.00 H new ATOM 0 HG2 LYS A 45 12.538 -9.347 -12.132 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.415 -9.688 -10.831 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.727 -10.494 -12.524 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.888 -10.197 -13.803 1.00 0.00 H new ATOM 0 HE2 LYS A 45 12.496 -11.783 -12.705 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.325 -12.086 -11.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.259 -13.807 -13.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.789 -12.958 -13.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 10.923 -12.664 -14.329 1.00 0.00 H new ATOM 251 N LEU A 46 9.281 -5.790 -13.871 1.00 0.00 N ATOM 252 CA LEU A 46 8.105 -5.342 -14.632 1.00 0.00 C ATOM 253 C LEU A 46 8.444 -4.838 -16.041 1.00 0.00 C ATOM 254 O LEU A 46 7.659 -5.026 -16.964 1.00 0.00 O ATOM 255 CB LEU A 46 7.267 -4.317 -13.849 1.00 0.00 C ATOM 256 CG LEU A 46 6.049 -4.942 -13.137 1.00 0.00 C ATOM 257 CD1 LEU A 46 5.136 -3.854 -12.562 1.00 0.00 C ATOM 258 CD2 LEU A 46 5.154 -5.789 -14.053 1.00 0.00 C ATOM 0 H LEU A 46 9.586 -5.150 -13.138 1.00 0.00 H new ATOM 0 HA LEU A 46 7.491 -6.232 -14.772 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.901 -3.829 -13.109 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.921 -3.542 -14.533 1.00 0.00 H new ATOM 0 HG LEU A 46 6.488 -5.577 -12.367 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.284 -4.319 -12.065 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.693 -3.254 -11.842 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.780 -3.214 -13.369 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.321 -6.192 -13.477 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.769 -5.167 -14.861 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.736 -6.610 -14.473 1.00 0.00 H new ATOM 270 N GLU A 47 9.629 -4.276 -16.244 1.00 0.00 N ATOM 271 CA GLU A 47 10.151 -3.953 -17.579 1.00 0.00 C ATOM 272 C GLU A 47 10.377 -5.211 -18.437 1.00 0.00 C ATOM 273 O GLU A 47 9.965 -5.259 -19.599 1.00 0.00 O ATOM 274 CB GLU A 47 11.417 -3.096 -17.454 1.00 0.00 C ATOM 275 CG GLU A 47 11.924 -2.595 -18.813 1.00 0.00 C ATOM 276 CD GLU A 47 13.158 -1.689 -18.642 1.00 0.00 C ATOM 277 OE1 GLU A 47 14.298 -2.214 -18.610 1.00 0.00 O ATOM 278 OE2 GLU A 47 13.000 -0.447 -18.556 1.00 0.00 O ATOM 0 H GLU A 47 10.264 -4.027 -15.486 1.00 0.00 H new ATOM 0 HA GLU A 47 9.398 -3.369 -18.107 1.00 0.00 H new ATOM 0 HB2 GLU A 47 11.211 -2.242 -16.809 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.200 -3.679 -16.970 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.178 -3.445 -19.446 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.132 -2.045 -19.320 1.00 0.00 H new ATOM 285 N LYS A 48 10.974 -6.259 -17.856 1.00 0.00 N ATOM 286 CA LYS A 48 11.235 -7.554 -18.500 1.00 0.00 C ATOM 287 C LYS A 48 9.939 -8.267 -18.902 1.00 0.00 C ATOM 288 O LYS A 48 9.872 -8.890 -19.959 1.00 0.00 O ATOM 289 CB LYS A 48 12.092 -8.430 -17.563 1.00 0.00 C ATOM 290 CG LYS A 48 12.984 -9.439 -18.306 1.00 0.00 C ATOM 291 CD LYS A 48 14.211 -8.757 -18.942 1.00 0.00 C ATOM 292 CE LYS A 48 15.223 -9.760 -19.513 1.00 0.00 C ATOM 293 NZ LYS A 48 14.723 -10.440 -20.740 1.00 0.00 N ATOM 0 H LYS A 48 11.301 -6.228 -16.890 1.00 0.00 H new ATOM 0 HA LYS A 48 11.786 -7.375 -19.423 1.00 0.00 H new ATOM 0 HB2 LYS A 48 12.721 -7.784 -16.951 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.434 -8.971 -16.883 1.00 0.00 H new ATOM 0 HG2 LYS A 48 13.316 -10.211 -17.612 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.402 -9.937 -19.082 1.00 0.00 H new ATOM 0 HD2 LYS A 48 13.878 -8.091 -19.738 1.00 0.00 H new ATOM 0 HD3 LYS A 48 14.704 -8.137 -18.193 1.00 0.00 H new ATOM 0 HE2 LYS A 48 16.154 -9.241 -19.743 1.00 0.00 H new ATOM 0 HE3 LYS A 48 15.454 -10.509 -18.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.443 -11.106 -21.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 13.849 -10.959 -20.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.527 -9.730 -21.475 1.00 0.00 H new ATOM 307 N MET A 49 8.895 -8.120 -18.085 1.00 0.00 N ATOM 308 CA MET A 49 7.521 -8.525 -18.343 1.00 0.00 C ATOM 309 C MET A 49 6.891 -7.700 -19.474 1.00 0.00 C ATOM 310 O MET A 49 6.338 -8.258 -20.420 1.00 0.00 O ATOM 311 CB MET A 49 6.760 -8.320 -17.030 1.00 0.00 C ATOM 312 CG MET A 49 6.918 -9.496 -16.062 1.00 0.00 C ATOM 313 SD MET A 49 5.826 -10.893 -16.423 1.00 0.00 S ATOM 314 CE MET A 49 4.274 -10.193 -15.791 1.00 0.00 C ATOM 0 H MET A 49 8.998 -7.686 -17.168 1.00 0.00 H new ATOM 0 HA MET A 49 7.481 -9.564 -18.669 1.00 0.00 H new ATOM 0 HB2 MET A 49 7.115 -7.409 -16.548 1.00 0.00 H new ATOM 0 HB3 MET A 49 5.702 -8.174 -17.248 1.00 0.00 H new ATOM 0 HG2 MET A 49 7.952 -9.839 -16.088 1.00 0.00 H new ATOM 0 HG3 MET A 49 6.723 -9.148 -15.048 1.00 0.00 H new ATOM 0 HE1 MET A 49 3.445 -10.851 -16.052 1.00 0.00 H new ATOM 0 HE2 MET A 49 4.333 -10.096 -14.707 1.00 0.00 H new ATOM 0 HE3 MET A 49 4.111 -9.211 -16.234 1.00 0.00 H new ATOM 324 N ALA A 50 7.003 -6.371 -19.409 1.00 0.00 N ATOM 325 CA ALA A 50 6.419 -5.444 -20.374 1.00 0.00 C ATOM 326 C ALA A 50 7.014 -5.543 -21.780 1.00 0.00 C ATOM 327 O ALA A 50 6.337 -5.188 -22.738 1.00 0.00 O ATOM 328 CB ALA A 50 6.507 -4.019 -19.819 1.00 0.00 C ATOM 0 H ALA A 50 7.516 -5.901 -18.664 1.00 0.00 H new ATOM 0 HA ALA A 50 5.375 -5.729 -20.503 1.00 0.00 H new ATOM 0 HB1 ALA A 50 6.072 -3.322 -20.535 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.960 -3.961 -18.878 1.00 0.00 H new ATOM 0 HB3 ALA A 50 7.552 -3.759 -19.648 1.00 0.00 H new ATOM 334 N ASN A 51 8.216 -6.098 -21.949 1.00 0.00 N ATOM 335 CA ASN A 51 8.751 -6.464 -23.261 1.00 0.00 C ATOM 336 C ASN A 51 7.840 -7.452 -24.029 1.00 0.00 C ATOM 337 O ASN A 51 7.829 -7.435 -25.259 1.00 0.00 O ATOM 338 CB ASN A 51 10.174 -6.998 -23.061 1.00 0.00 C ATOM 339 CG ASN A 51 10.866 -7.345 -24.369 1.00 0.00 C ATOM 340 OD1 ASN A 51 11.000 -8.502 -24.742 1.00 0.00 O ATOM 341 ND2 ASN A 51 11.334 -6.361 -25.104 1.00 0.00 N ATOM 0 H ASN A 51 8.848 -6.307 -21.176 1.00 0.00 H new ATOM 0 HA ASN A 51 8.782 -5.580 -23.898 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.765 -6.252 -22.530 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.138 -7.885 -22.429 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.808 -6.563 -25.984 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.223 -5.396 -24.794 1.00 0.00 H new ATOM 348 N GLU A 52 7.011 -8.243 -23.337 1.00 0.00 N ATOM 349 CA GLU A 52 5.982 -9.095 -23.948 1.00 0.00 C ATOM 350 C GLU A 52 4.813 -8.286 -24.556 1.00 0.00 C ATOM 351 O GLU A 52 4.296 -8.635 -25.618 1.00 0.00 O ATOM 352 CB GLU A 52 5.476 -10.120 -22.919 1.00 0.00 C ATOM 353 CG GLU A 52 4.686 -11.261 -23.575 1.00 0.00 C ATOM 354 CD GLU A 52 4.320 -12.349 -22.548 1.00 0.00 C ATOM 355 OE1 GLU A 52 5.126 -13.289 -22.340 1.00 0.00 O ATOM 356 OE2 GLU A 52 3.214 -12.286 -21.955 1.00 0.00 O ATOM 0 H GLU A 52 7.036 -8.310 -22.320 1.00 0.00 H new ATOM 0 HA GLU A 52 6.446 -9.622 -24.782 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.324 -10.534 -22.375 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.844 -9.616 -22.188 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.777 -10.864 -24.027 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.277 -11.700 -24.379 1.00 0.00 H new ATOM 363 N GLU A 53 4.429 -7.168 -23.927 1.00 0.00 N ATOM 364 CA GLU A 53 3.519 -6.140 -24.455 1.00 0.00 C ATOM 365 C GLU A 53 4.230 -5.142 -25.404 1.00 0.00 C ATOM 366 O GLU A 53 3.600 -4.221 -25.928 1.00 0.00 O ATOM 367 CB GLU A 53 2.888 -5.405 -23.259 1.00 0.00 C ATOM 368 CG GLU A 53 1.802 -6.201 -22.516 1.00 0.00 C ATOM 369 CD GLU A 53 0.416 -6.136 -23.188 1.00 0.00 C ATOM 370 OE1 GLU A 53 0.267 -6.570 -24.356 1.00 0.00 O ATOM 371 OE2 GLU A 53 -0.555 -5.683 -22.528 1.00 0.00 O ATOM 0 H GLU A 53 4.760 -6.943 -22.989 1.00 0.00 H new ATOM 0 HA GLU A 53 2.751 -6.626 -25.057 1.00 0.00 H new ATOM 0 HB2 GLU A 53 3.676 -5.145 -22.553 1.00 0.00 H new ATOM 0 HB3 GLU A 53 2.456 -4.469 -23.612 1.00 0.00 H new ATOM 0 HG2 GLU A 53 2.113 -7.243 -22.445 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.720 -5.823 -21.497 1.00 0.00 H new ATOM 378 N GLU A 54 5.532 -5.340 -25.650 1.00 0.00 N ATOM 379 CA GLU A 54 6.429 -4.562 -26.523 1.00 0.00 C ATOM 380 C GLU A 54 6.873 -3.217 -25.894 1.00 0.00 C ATOM 381 O GLU A 54 6.986 -2.188 -26.561 1.00 0.00 O ATOM 382 CB GLU A 54 5.865 -4.465 -27.959 1.00 0.00 C ATOM 383 CG GLU A 54 6.981 -4.355 -29.004 1.00 0.00 C ATOM 384 CD GLU A 54 6.399 -4.203 -30.423 1.00 0.00 C ATOM 385 OE1 GLU A 54 6.134 -5.234 -31.090 1.00 0.00 O ATOM 386 OE2 GLU A 54 6.212 -3.053 -30.893 1.00 0.00 O ATOM 0 H GLU A 54 6.029 -6.113 -25.207 1.00 0.00 H new ATOM 0 HA GLU A 54 7.366 -5.111 -26.617 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.255 -5.344 -28.170 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.210 -3.597 -28.034 1.00 0.00 H new ATOM 0 HG2 GLU A 54 7.616 -3.499 -28.774 1.00 0.00 H new ATOM 0 HG3 GLU A 54 7.613 -5.242 -28.960 1.00 0.00 H new ATOM 393 N GLU A 55 7.164 -3.261 -24.589 1.00 0.00 N ATOM 394 CA GLU A 55 7.566 -2.173 -23.682 1.00 0.00 C ATOM 395 C GLU A 55 6.491 -1.089 -23.492 1.00 0.00 C ATOM 396 O GLU A 55 6.289 -0.191 -24.314 1.00 0.00 O ATOM 397 CB GLU A 55 8.963 -1.641 -24.028 1.00 0.00 C ATOM 398 CG GLU A 55 9.614 -0.799 -22.919 1.00 0.00 C ATOM 399 CD GLU A 55 9.093 0.652 -22.863 1.00 0.00 C ATOM 400 OE1 GLU A 55 9.547 1.496 -23.676 1.00 0.00 O ATOM 401 OE2 GLU A 55 8.257 0.963 -21.981 1.00 0.00 O ATOM 0 H GLU A 55 7.120 -4.149 -24.088 1.00 0.00 H new ATOM 0 HA GLU A 55 7.651 -2.607 -22.686 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.614 -2.485 -24.256 1.00 0.00 H new ATOM 0 HB3 GLU A 55 8.895 -1.037 -24.933 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.435 -1.279 -21.957 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.693 -0.784 -23.071 1.00 0.00 H new ATOM 408 N SER A 56 5.792 -1.208 -22.363 1.00 0.00 N ATOM 409 CA SER A 56 4.689 -0.349 -21.911 1.00 0.00 C ATOM 410 C SER A 56 4.647 -0.216 -20.377 1.00 0.00 C ATOM 411 O SER A 56 3.570 -0.237 -19.785 1.00 0.00 O ATOM 412 CB SER A 56 3.368 -0.905 -22.474 1.00 0.00 C ATOM 413 OG SER A 56 3.090 -2.204 -21.966 1.00 0.00 O ATOM 0 H SER A 56 5.991 -1.953 -21.695 1.00 0.00 H new ATOM 0 HA SER A 56 4.847 0.661 -22.290 1.00 0.00 H new ATOM 0 HB2 SER A 56 2.550 -0.231 -22.219 1.00 0.00 H new ATOM 0 HB3 SER A 56 3.422 -0.943 -23.562 1.00 0.00 H new ATOM 0 HG SER A 56 2.245 -2.528 -22.341 1.00 0.00 H new ATOM 419 N VAL A 57 5.804 -0.152 -19.700 1.00 0.00 N ATOM 420 CA VAL A 57 5.961 -0.427 -18.247 1.00 0.00 C ATOM 421 C VAL A 57 4.944 0.291 -17.349 1.00 0.00 C ATOM 422 O VAL A 57 4.321 -0.346 -16.503 1.00 0.00 O ATOM 423 CB VAL A 57 7.392 -0.135 -17.737 1.00 0.00 C ATOM 424 CG1 VAL A 57 7.636 -0.794 -16.371 1.00 0.00 C ATOM 425 CG2 VAL A 57 8.479 -0.647 -18.688 1.00 0.00 C ATOM 0 H VAL A 57 6.684 0.098 -20.151 1.00 0.00 H new ATOM 0 HA VAL A 57 5.762 -1.496 -18.168 1.00 0.00 H new ATOM 0 HB VAL A 57 7.457 0.951 -17.667 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.649 -0.573 -16.036 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.921 -0.404 -15.646 1.00 0.00 H new ATOM 0 HG13 VAL A 57 7.511 -1.873 -16.460 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.461 -0.413 -18.277 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.382 -1.726 -18.804 1.00 0.00 H new ATOM 0 HG23 VAL A 57 8.368 -0.166 -19.660 1.00 0.00 H new ATOM 435 N GLY A 58 4.724 1.594 -17.550 1.00 0.00 N ATOM 436 CA GLY A 58 3.761 2.387 -16.771 1.00 0.00 C ATOM 437 C GLY A 58 2.319 1.884 -16.906 1.00 0.00 C ATOM 438 O GLY A 58 1.585 1.773 -15.922 1.00 0.00 O ATOM 0 H GLY A 58 5.212 2.135 -18.264 1.00 0.00 H new ATOM 0 HA2 GLY A 58 4.049 2.368 -15.720 1.00 0.00 H new ATOM 0 HA3 GLY A 58 3.809 3.427 -17.095 1.00 0.00 H new ATOM 442 N SER A 59 1.919 1.510 -18.118 1.00 0.00 N ATOM 443 CA SER A 59 0.638 0.862 -18.383 1.00 0.00 C ATOM 444 C SER A 59 0.605 -0.553 -17.817 1.00 0.00 C ATOM 445 O SER A 59 -0.411 -0.943 -17.252 1.00 0.00 O ATOM 446 CB SER A 59 0.397 0.790 -19.889 1.00 0.00 C ATOM 447 OG SER A 59 0.452 2.072 -20.498 1.00 0.00 O ATOM 0 H SER A 59 2.484 1.651 -18.956 1.00 0.00 H new ATOM 0 HA SER A 59 -0.139 1.454 -17.900 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.143 0.140 -20.345 1.00 0.00 H new ATOM 0 HB3 SER A 59 -0.577 0.340 -20.079 1.00 0.00 H new ATOM 0 HG SER A 59 0.295 1.984 -21.461 1.00 0.00 H new ATOM 453 N TYR A 60 1.705 -1.311 -17.911 1.00 0.00 N ATOM 454 CA TYR A 60 1.806 -2.671 -17.372 1.00 0.00 C ATOM 455 C TYR A 60 1.552 -2.697 -15.863 1.00 0.00 C ATOM 456 O TYR A 60 0.809 -3.543 -15.371 1.00 0.00 O ATOM 457 CB TYR A 60 3.169 -3.303 -17.689 1.00 0.00 C ATOM 458 CG TYR A 60 3.083 -4.817 -17.801 1.00 0.00 C ATOM 459 CD1 TYR A 60 2.836 -5.609 -16.662 1.00 0.00 C ATOM 460 CD2 TYR A 60 3.169 -5.429 -19.066 1.00 0.00 C ATOM 461 CE1 TYR A 60 2.630 -6.995 -16.786 1.00 0.00 C ATOM 462 CE2 TYR A 60 3.007 -6.822 -19.191 1.00 0.00 C ATOM 463 CZ TYR A 60 2.704 -7.606 -18.057 1.00 0.00 C ATOM 464 OH TYR A 60 2.463 -8.938 -18.192 1.00 0.00 O ATOM 0 H TYR A 60 2.559 -0.992 -18.369 1.00 0.00 H new ATOM 0 HA TYR A 60 1.032 -3.263 -17.861 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.551 -2.892 -18.623 1.00 0.00 H new ATOM 0 HB3 TYR A 60 3.882 -3.037 -16.909 1.00 0.00 H new ATOM 0 HD1 TYR A 60 2.805 -5.148 -15.686 1.00 0.00 H new ATOM 0 HD2 TYR A 60 3.360 -4.828 -19.943 1.00 0.00 H new ATOM 0 HE1 TYR A 60 2.416 -7.591 -15.911 1.00 0.00 H new ATOM 0 HE2 TYR A 60 3.115 -7.292 -20.157 1.00 0.00 H new ATOM 0 HH TYR A 60 2.555 -9.193 -19.134 1.00 0.00 H new ATOM 474 N ILE A 61 2.118 -1.727 -15.140 1.00 0.00 N ATOM 475 CA ILE A 61 1.869 -1.504 -13.706 1.00 0.00 C ATOM 476 C ILE A 61 0.365 -1.413 -13.467 1.00 0.00 C ATOM 477 O ILE A 61 -0.198 -2.230 -12.737 1.00 0.00 O ATOM 478 CB ILE A 61 2.611 -0.247 -13.188 1.00 0.00 C ATOM 479 CG1 ILE A 61 4.127 -0.509 -13.119 1.00 0.00 C ATOM 480 CG2 ILE A 61 2.097 0.206 -11.806 1.00 0.00 C ATOM 481 CD1 ILE A 61 4.936 0.780 -12.980 1.00 0.00 C ATOM 0 H ILE A 61 2.777 -1.059 -15.540 1.00 0.00 H new ATOM 0 HA ILE A 61 2.265 -2.347 -13.140 1.00 0.00 H new ATOM 0 HB ILE A 61 2.410 0.557 -13.896 1.00 0.00 H new ATOM 0 HG12 ILE A 61 4.342 -1.162 -12.273 1.00 0.00 H new ATOM 0 HG13 ILE A 61 4.443 -1.038 -14.018 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.647 1.090 -11.485 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.035 0.444 -11.873 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.244 -0.596 -11.082 1.00 0.00 H new ATOM 0 HD11 ILE A 61 5.998 0.540 -12.936 1.00 0.00 H new ATOM 0 HD12 ILE A 61 4.745 1.424 -13.839 1.00 0.00 H new ATOM 0 HD13 ILE A 61 4.643 1.297 -12.066 1.00 0.00 H new ATOM 493 N LYS A 62 -0.297 -0.447 -14.117 1.00 0.00 N ATOM 494 CA LYS A 62 -1.729 -0.218 -13.911 1.00 0.00 C ATOM 495 C LYS A 62 -2.565 -1.440 -14.319 1.00 0.00 C ATOM 496 O LYS A 62 -3.435 -1.873 -13.573 1.00 0.00 O ATOM 497 CB LYS A 62 -2.160 1.093 -14.598 1.00 0.00 C ATOM 498 CG LYS A 62 -3.335 1.733 -13.832 1.00 0.00 C ATOM 499 CD LYS A 62 -3.588 3.207 -14.194 1.00 0.00 C ATOM 500 CE LYS A 62 -4.111 3.457 -15.615 1.00 0.00 C ATOM 501 NZ LYS A 62 -5.483 2.921 -15.818 1.00 0.00 N ATOM 0 H LYS A 62 0.137 0.186 -14.788 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.921 -0.091 -12.846 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.320 1.786 -14.635 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.454 0.893 -15.628 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -4.241 1.160 -14.031 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -3.141 1.660 -12.762 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.305 3.620 -13.484 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.657 3.760 -14.065 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.109 4.528 -15.816 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.434 2.996 -16.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.921 3.389 -16.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.434 1.896 -15.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -6.056 3.102 -14.969 1.00 0.00 H new ATOM 515 N ARG A 63 -2.244 -2.070 -15.452 1.00 0.00 N ATOM 516 CA ARG A 63 -2.836 -3.323 -15.966 1.00 0.00 C ATOM 517 C ARG A 63 -2.747 -4.464 -14.953 1.00 0.00 C ATOM 518 O ARG A 63 -3.732 -5.170 -14.773 1.00 0.00 O ATOM 519 CB ARG A 63 -2.167 -3.733 -17.295 1.00 0.00 C ATOM 520 CG ARG A 63 -2.555 -2.836 -18.486 1.00 0.00 C ATOM 521 CD ARG A 63 -3.639 -3.462 -19.376 1.00 0.00 C ATOM 522 NE ARG A 63 -3.085 -4.511 -20.261 1.00 0.00 N ATOM 523 CZ ARG A 63 -3.704 -5.563 -20.762 1.00 0.00 C ATOM 524 NH1 ARG A 63 -4.936 -5.862 -20.458 1.00 0.00 N ATOM 525 NH2 ARG A 63 -3.087 -6.344 -21.599 1.00 0.00 N ATOM 0 H ARG A 63 -1.524 -1.705 -16.076 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.894 -3.128 -16.143 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.085 -3.707 -17.170 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.437 -4.764 -17.525 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.909 -1.876 -18.111 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -1.669 -2.636 -19.088 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.421 -3.891 -18.749 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.106 -2.685 -19.981 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.103 -4.408 -20.515 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.459 -5.273 -19.810 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.377 -6.685 -20.868 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.124 -6.143 -21.869 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.566 -7.157 -21.986 1.00 0.00 H new ATOM 539 N TYR A 64 -1.622 -4.635 -14.258 1.00 0.00 N ATOM 540 CA TYR A 64 -1.423 -5.716 -13.282 1.00 0.00 C ATOM 541 C TYR A 64 -2.309 -5.536 -12.044 1.00 0.00 C ATOM 542 O TYR A 64 -2.924 -6.475 -11.543 1.00 0.00 O ATOM 543 CB TYR A 64 0.055 -5.777 -12.866 1.00 0.00 C ATOM 544 CG TYR A 64 0.586 -7.095 -12.315 1.00 0.00 C ATOM 545 CD1 TYR A 64 -0.211 -8.260 -12.232 1.00 0.00 C ATOM 546 CD2 TYR A 64 1.927 -7.149 -11.882 1.00 0.00 C ATOM 547 CE1 TYR A 64 0.332 -9.460 -11.742 1.00 0.00 C ATOM 548 CE2 TYR A 64 2.477 -8.351 -11.396 1.00 0.00 C ATOM 549 CZ TYR A 64 1.681 -9.513 -11.335 1.00 0.00 C ATOM 550 OH TYR A 64 2.205 -10.679 -10.873 1.00 0.00 O ATOM 0 H TYR A 64 -0.812 -4.022 -14.355 1.00 0.00 H new ATOM 0 HA TYR A 64 -1.709 -6.653 -13.759 1.00 0.00 H new ATOM 0 HB2 TYR A 64 0.658 -5.510 -13.734 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.223 -5.008 -12.112 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -1.243 -8.227 -12.547 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.538 -6.260 -11.923 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -0.285 -10.344 -11.677 1.00 0.00 H new ATOM 0 HE2 TYR A 64 3.506 -8.383 -11.071 1.00 0.00 H new ATOM 0 HH TYR A 64 1.750 -11.434 -11.301 1.00 0.00 H new ATOM 560 N ILE A 65 -2.421 -4.289 -11.600 1.00 0.00 N ATOM 561 CA ILE A 65 -3.310 -3.836 -10.519 1.00 0.00 C ATOM 562 C ILE A 65 -4.772 -4.072 -10.905 1.00 0.00 C ATOM 563 O ILE A 65 -5.554 -4.581 -10.106 1.00 0.00 O ATOM 564 CB ILE A 65 -3.079 -2.345 -10.204 1.00 0.00 C ATOM 565 CG1 ILE A 65 -1.635 -2.046 -9.749 1.00 0.00 C ATOM 566 CG2 ILE A 65 -4.068 -1.850 -9.142 1.00 0.00 C ATOM 567 CD1 ILE A 65 -1.305 -0.550 -9.852 1.00 0.00 C ATOM 0 H ILE A 65 -1.873 -3.526 -11.997 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.080 -4.414 -9.624 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.247 -1.808 -11.137 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.502 -2.378 -8.719 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.935 -2.616 -10.361 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.884 -0.795 -8.937 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.087 -1.977 -9.507 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.936 -2.426 -8.226 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.280 -0.380 -9.523 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.413 -0.224 -10.887 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.988 0.018 -9.220 1.00 0.00 H new ATOM 579 N LEU A 66 -5.145 -3.731 -12.139 1.00 0.00 N ATOM 580 CA LEU A 66 -6.508 -3.891 -12.655 1.00 0.00 C ATOM 581 C LEU A 66 -6.849 -5.380 -12.815 1.00 0.00 C ATOM 582 O LEU A 66 -7.953 -5.808 -12.477 1.00 0.00 O ATOM 583 CB LEU A 66 -6.628 -3.103 -13.973 1.00 0.00 C ATOM 584 CG LEU A 66 -6.993 -1.603 -13.837 1.00 0.00 C ATOM 585 CD1 LEU A 66 -6.542 -0.878 -12.563 1.00 0.00 C ATOM 586 CD2 LEU A 66 -6.398 -0.832 -15.015 1.00 0.00 C ATOM 0 H LEU A 66 -4.500 -3.330 -12.820 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.237 -3.488 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -5.680 -3.179 -14.506 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -7.383 -3.585 -14.594 1.00 0.00 H new ATOM 0 HG LEU A 66 -8.082 -1.614 -13.804 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.865 0.162 -12.603 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.985 -1.362 -11.693 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.455 -0.918 -12.487 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.652 0.224 -14.924 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.314 -0.946 -15.014 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.803 -1.224 -15.948 1.00 0.00 H new ATOM 598 N LYS A 67 -5.867 -6.186 -13.236 1.00 0.00 N ATOM 599 CA LYS A 67 -5.941 -7.647 -13.318 1.00 0.00 C ATOM 600 C LYS A 67 -6.138 -8.293 -11.943 1.00 0.00 C ATOM 601 O LYS A 67 -6.964 -9.194 -11.798 1.00 0.00 O ATOM 602 CB LYS A 67 -4.684 -8.162 -14.034 1.00 0.00 C ATOM 603 CG LYS A 67 -4.768 -9.669 -14.325 1.00 0.00 C ATOM 604 CD LYS A 67 -3.611 -10.185 -15.194 1.00 0.00 C ATOM 605 CE LYS A 67 -3.723 -9.697 -16.647 1.00 0.00 C ATOM 606 NZ LYS A 67 -2.666 -10.295 -17.506 1.00 0.00 N ATOM 0 H LYS A 67 -4.964 -5.822 -13.541 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.820 -7.932 -13.896 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.550 -7.618 -14.969 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -3.807 -7.959 -13.419 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.776 -10.214 -13.381 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -5.713 -9.883 -14.825 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -2.663 -9.852 -14.771 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.602 -11.275 -15.177 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -4.705 -9.955 -17.044 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -3.644 -8.610 -16.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.771 -9.945 -18.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.730 -10.028 -17.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -2.758 -11.331 -17.499 1.00 0.00 H new ATOM 620 N ALA A 68 -5.431 -7.798 -10.927 1.00 0.00 N ATOM 621 CA ALA A 68 -5.625 -8.192 -9.534 1.00 0.00 C ATOM 622 C ALA A 68 -7.008 -7.766 -9.012 1.00 0.00 C ATOM 623 O ALA A 68 -7.695 -8.559 -8.370 1.00 0.00 O ATOM 624 CB ALA A 68 -4.491 -7.606 -8.687 1.00 0.00 C ATOM 0 H ALA A 68 -4.696 -7.101 -11.052 1.00 0.00 H new ATOM 0 HA ALA A 68 -5.595 -9.279 -9.462 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.628 -7.895 -7.645 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.535 -7.986 -9.046 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.502 -6.519 -8.766 1.00 0.00 H new ATOM 630 N LEU A 69 -7.470 -6.550 -9.327 1.00 0.00 N ATOM 631 CA LEU A 69 -8.754 -6.011 -8.890 1.00 0.00 C ATOM 632 C LEU A 69 -9.937 -6.835 -9.411 1.00 0.00 C ATOM 633 O LEU A 69 -10.910 -7.046 -8.687 1.00 0.00 O ATOM 634 CB LEU A 69 -8.833 -4.529 -9.281 1.00 0.00 C ATOM 635 CG LEU A 69 -8.424 -3.570 -8.145 1.00 0.00 C ATOM 636 CD1 LEU A 69 -8.339 -2.141 -8.681 1.00 0.00 C ATOM 637 CD2 LEU A 69 -9.436 -3.576 -6.994 1.00 0.00 C ATOM 0 H LEU A 69 -6.943 -5.899 -9.909 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.823 -6.082 -7.805 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.189 -4.354 -10.143 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.852 -4.297 -9.592 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.459 -3.913 -7.772 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.050 -1.467 -7.875 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.596 -2.095 -9.477 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.311 -1.841 -9.074 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.107 -2.886 -6.217 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.412 -3.265 -7.366 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.510 -4.581 -6.579 1.00 0.00 H new ATOM 649 N ARG A 70 -9.791 -7.411 -10.612 1.00 0.00 N ATOM 650 CA ARG A 70 -10.670 -8.413 -11.226 1.00 0.00 C ATOM 651 C ARG A 70 -10.895 -9.681 -10.388 1.00 0.00 C ATOM 652 O ARG A 70 -11.856 -10.407 -10.644 1.00 0.00 O ATOM 653 CB ARG A 70 -10.107 -8.755 -12.619 1.00 0.00 C ATOM 654 CG ARG A 70 -11.135 -8.506 -13.726 1.00 0.00 C ATOM 655 CD ARG A 70 -12.138 -9.650 -13.931 1.00 0.00 C ATOM 656 NE ARG A 70 -11.504 -10.850 -14.519 1.00 0.00 N ATOM 657 CZ ARG A 70 -11.303 -12.037 -13.971 1.00 0.00 C ATOM 658 NH1 ARG A 70 -11.592 -12.305 -12.730 1.00 0.00 N ATOM 659 NH2 ARG A 70 -10.787 -13.002 -14.678 1.00 0.00 N ATOM 0 H ARG A 70 -9.006 -7.174 -11.218 1.00 0.00 H new ATOM 0 HA ARG A 70 -11.663 -7.970 -11.299 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -9.217 -8.155 -12.808 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.797 -9.800 -12.639 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -11.685 -7.594 -13.495 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -10.606 -8.331 -14.663 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.589 -9.912 -12.974 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.945 -9.312 -14.581 1.00 0.00 H new ATOM 0 HE ARG A 70 -11.177 -10.748 -15.480 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -11.993 -11.582 -12.132 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -11.417 -13.238 -12.356 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -10.538 -12.842 -15.654 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -10.632 -13.917 -14.255 1.00 0.00 H new ATOM 673 N LYS A 71 -10.029 -9.947 -9.402 1.00 0.00 N ATOM 674 CA LYS A 71 -10.072 -11.088 -8.464 1.00 0.00 C ATOM 675 C LYS A 71 -10.301 -10.667 -7.001 1.00 0.00 C ATOM 676 O LYS A 71 -10.946 -11.398 -6.248 1.00 0.00 O ATOM 677 CB LYS A 71 -8.798 -11.915 -8.654 1.00 0.00 C ATOM 678 CG LYS A 71 -8.829 -13.271 -7.934 1.00 0.00 C ATOM 679 CD LYS A 71 -7.562 -14.081 -8.242 1.00 0.00 C ATOM 680 CE LYS A 71 -7.623 -15.443 -7.540 1.00 0.00 C ATOM 681 NZ LYS A 71 -6.418 -16.263 -7.832 1.00 0.00 N ATOM 0 H LYS A 71 -9.230 -9.338 -9.223 1.00 0.00 H new ATOM 0 HA LYS A 71 -10.941 -11.704 -8.697 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.640 -12.083 -9.719 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -7.945 -11.341 -8.292 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.914 -13.115 -6.859 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -9.710 -13.833 -8.245 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.464 -14.222 -9.318 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.681 -13.532 -7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.711 -15.295 -6.464 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.516 -15.979 -7.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -6.493 -17.177 -7.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.348 -16.425 -8.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -5.569 -15.762 -7.502 1.00 0.00 H new ATOM 695 N ILE A 72 -9.816 -9.485 -6.607 1.00 0.00 N ATOM 696 CA ILE A 72 -10.063 -8.835 -5.305 1.00 0.00 C ATOM 697 C ILE A 72 -11.563 -8.546 -5.105 1.00 0.00 C ATOM 698 O ILE A 72 -12.110 -8.846 -4.040 1.00 0.00 O ATOM 699 CB ILE A 72 -9.218 -7.542 -5.205 1.00 0.00 C ATOM 700 CG1 ILE A 72 -7.703 -7.858 -5.152 1.00 0.00 C ATOM 701 CG2 ILE A 72 -9.574 -6.658 -4.001 1.00 0.00 C ATOM 702 CD1 ILE A 72 -6.810 -6.645 -5.453 1.00 0.00 C ATOM 0 H ILE A 72 -9.213 -8.926 -7.210 1.00 0.00 H new ATOM 0 HA ILE A 72 -9.760 -9.512 -4.506 1.00 0.00 H new ATOM 0 HB ILE A 72 -9.459 -6.985 -6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.455 -8.244 -4.163 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.480 -8.649 -5.868 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.939 -5.772 -4.000 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -10.619 -6.356 -4.068 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -9.417 -7.218 -3.079 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -5.763 -6.942 -5.398 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.029 -6.271 -6.453 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -7.004 -5.860 -4.722 1.00 0.00 H new ATOM 714 N GLU A 73 -12.233 -7.967 -6.112 1.00 0.00 N ATOM 715 CA GLU A 73 -13.676 -7.647 -6.116 1.00 0.00 C ATOM 716 C GLU A 73 -14.586 -8.893 -6.009 1.00 0.00 C ATOM 717 O GLU A 73 -14.452 -9.825 -6.836 1.00 0.00 O ATOM 718 CB GLU A 73 -14.004 -6.805 -7.363 1.00 0.00 C ATOM 719 CG GLU A 73 -15.444 -6.265 -7.356 1.00 0.00 C ATOM 720 CD GLU A 73 -15.718 -5.369 -8.584 1.00 0.00 C ATOM 721 OE1 GLU A 73 -16.118 -5.894 -9.655 1.00 0.00 O ATOM 722 OE2 GLU A 73 -15.560 -4.125 -8.487 1.00 0.00 O ATOM 0 H GLU A 73 -11.771 -7.697 -6.981 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.889 -7.068 -5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -13.308 -5.969 -7.424 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -13.853 -7.412 -8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -16.146 -7.099 -7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -15.616 -5.695 -6.443 1.00 0.00 H new TER 729 GLU A 73 ATOM 730 N THR B 31 16.815 5.498 -6.455 1.00 0.00 N ATOM 731 CA THR B 31 15.393 5.111 -6.397 1.00 0.00 C ATOM 732 C THR B 31 14.711 5.416 -7.735 1.00 0.00 C ATOM 733 O THR B 31 15.066 6.386 -8.412 1.00 0.00 O ATOM 734 CB THR B 31 14.659 5.915 -5.299 1.00 0.00 C ATOM 735 OG1 THR B 31 15.481 6.145 -4.166 1.00 0.00 O ATOM 736 CG2 THR B 31 13.403 5.223 -4.780 1.00 0.00 C ATOM 0 HA THR B 31 15.345 4.044 -6.177 1.00 0.00 H new ATOM 0 HB THR B 31 14.393 6.850 -5.793 1.00 0.00 H new ATOM 0 HG1 THR B 31 16.421 6.025 -4.414 1.00 0.00 H new ATOM 0 HG21 THR B 31 12.938 5.841 -4.012 1.00 0.00 H new ATOM 0 HG22 THR B 31 12.702 5.076 -5.602 1.00 0.00 H new ATOM 0 HG23 THR B 31 13.670 4.256 -4.354 1.00 0.00 H new ATOM 744 N ARG B 32 13.709 4.618 -8.109 1.00 0.00 N ATOM 745 CA ARG B 32 12.801 4.874 -9.240 1.00 0.00 C ATOM 746 C ARG B 32 11.681 5.855 -8.890 1.00 0.00 C ATOM 747 O ARG B 32 11.436 6.166 -7.726 1.00 0.00 O ATOM 748 CB ARG B 32 12.245 3.528 -9.758 1.00 0.00 C ATOM 749 CG ARG B 32 12.822 3.117 -11.117 1.00 0.00 C ATOM 750 CD ARG B 32 14.351 3.232 -11.188 1.00 0.00 C ATOM 751 NE ARG B 32 14.912 2.317 -12.190 1.00 0.00 N ATOM 752 CZ ARG B 32 14.846 2.409 -13.507 1.00 0.00 C ATOM 753 NH1 ARG B 32 14.364 3.461 -14.109 1.00 0.00 N ATOM 754 NH2 ARG B 32 15.260 1.436 -14.261 1.00 0.00 N ATOM 0 H ARG B 32 13.497 3.748 -7.621 1.00 0.00 H new ATOM 0 HA ARG B 32 13.371 5.357 -10.033 1.00 0.00 H new ATOM 0 HB2 ARG B 32 12.462 2.748 -9.028 1.00 0.00 H new ATOM 0 HB3 ARG B 32 11.160 3.597 -9.838 1.00 0.00 H new ATOM 0 HG2 ARG B 32 12.532 2.088 -11.331 1.00 0.00 H new ATOM 0 HG3 ARG B 32 12.381 3.741 -11.895 1.00 0.00 H new ATOM 0 HD2 ARG B 32 14.629 4.257 -11.433 1.00 0.00 H new ATOM 0 HD3 ARG B 32 14.780 3.011 -10.211 1.00 0.00 H new ATOM 0 HE ARG B 32 15.416 1.509 -11.824 1.00 0.00 H new ATOM 0 HH11 ARG B 32 14.021 4.250 -13.561 1.00 0.00 H new ATOM 0 HH12 ARG B 32 14.330 3.495 -15.128 1.00 0.00 H new ATOM 0 HH21 ARG B 32 15.641 0.590 -13.838 1.00 0.00 H new ATOM 0 HH22 ARG B 32 15.204 1.518 -15.276 1.00 0.00 H new ATOM 768 N ALA B 33 10.995 6.312 -9.931 1.00 0.00 N ATOM 769 CA ALA B 33 9.933 7.312 -9.908 1.00 0.00 C ATOM 770 C ALA B 33 8.745 6.809 -10.748 1.00 0.00 C ATOM 771 O ALA B 33 8.869 6.603 -11.958 1.00 0.00 O ATOM 772 CB ALA B 33 10.523 8.628 -10.425 1.00 0.00 C ATOM 0 H ALA B 33 11.177 5.972 -10.875 1.00 0.00 H new ATOM 0 HA ALA B 33 9.551 7.484 -8.902 1.00 0.00 H new ATOM 0 HB1 ALA B 33 9.752 9.399 -10.421 1.00 0.00 H new ATOM 0 HB2 ALA B 33 11.347 8.935 -9.781 1.00 0.00 H new ATOM 0 HB3 ALA B 33 10.890 8.488 -11.442 1.00 0.00 H new ATOM 778 N VAL B 34 7.618 6.535 -10.089 1.00 0.00 N ATOM 779 CA VAL B 34 6.492 5.748 -10.604 1.00 0.00 C ATOM 780 C VAL B 34 5.204 6.526 -10.392 1.00 0.00 C ATOM 781 O VAL B 34 4.609 6.495 -9.324 1.00 0.00 O ATOM 782 CB VAL B 34 6.477 4.345 -9.969 1.00 0.00 C ATOM 783 CG1 VAL B 34 5.273 3.512 -10.403 1.00 0.00 C ATOM 784 CG2 VAL B 34 7.739 3.575 -10.383 1.00 0.00 C ATOM 0 H VAL B 34 7.456 6.870 -9.139 1.00 0.00 H new ATOM 0 HA VAL B 34 6.599 5.585 -11.676 1.00 0.00 H new ATOM 0 HB VAL B 34 6.429 4.497 -8.891 1.00 0.00 H new ATOM 0 HG11 VAL B 34 5.316 2.534 -9.924 1.00 0.00 H new ATOM 0 HG12 VAL B 34 4.354 4.020 -10.109 1.00 0.00 H new ATOM 0 HG13 VAL B 34 5.288 3.387 -11.486 1.00 0.00 H new ATOM 0 HG21 VAL B 34 7.724 2.583 -9.932 1.00 0.00 H new ATOM 0 HG22 VAL B 34 7.767 3.479 -11.468 1.00 0.00 H new ATOM 0 HG23 VAL B 34 8.623 4.115 -10.043 1.00 0.00 H new ATOM 794 N SER B 35 4.815 7.282 -11.414 1.00 0.00 N ATOM 795 CA SER B 35 3.706 8.236 -11.388 1.00 0.00 C ATOM 796 C SER B 35 2.669 7.919 -12.461 1.00 0.00 C ATOM 797 O SER B 35 2.920 8.064 -13.661 1.00 0.00 O ATOM 798 CB SER B 35 4.206 9.672 -11.479 1.00 0.00 C ATOM 799 OG SER B 35 3.142 10.573 -11.221 1.00 0.00 O ATOM 0 H SER B 35 5.281 7.247 -12.321 1.00 0.00 H new ATOM 0 HA SER B 35 3.205 8.134 -10.425 1.00 0.00 H new ATOM 0 HB2 SER B 35 5.011 9.832 -10.761 1.00 0.00 H new ATOM 0 HB3 SER B 35 4.620 9.860 -12.470 1.00 0.00 H new ATOM 0 HG SER B 35 3.472 11.494 -11.280 1.00 0.00 H new ATOM 805 N LEU B 36 1.522 7.418 -12.004 1.00 0.00 N ATOM 806 CA LEU B 36 0.408 6.916 -12.811 1.00 0.00 C ATOM 807 C LEU B 36 -0.850 7.794 -12.666 1.00 0.00 C ATOM 808 O LEU B 36 -0.881 8.776 -11.918 1.00 0.00 O ATOM 809 CB LEU B 36 0.130 5.430 -12.458 1.00 0.00 C ATOM 810 CG LEU B 36 1.172 4.369 -12.867 1.00 0.00 C ATOM 811 CD1 LEU B 36 1.722 4.565 -14.279 1.00 0.00 C ATOM 812 CD2 LEU B 36 2.345 4.273 -11.899 1.00 0.00 C ATOM 0 H LEU B 36 1.334 7.347 -11.004 1.00 0.00 H new ATOM 0 HA LEU B 36 0.691 6.970 -13.862 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -0.003 5.365 -11.378 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -0.821 5.153 -12.913 1.00 0.00 H new ATOM 0 HG LEU B 36 0.609 3.436 -12.838 1.00 0.00 H new ATOM 0 HD11 LEU B 36 2.449 3.783 -14.498 1.00 0.00 H new ATOM 0 HD12 LEU B 36 0.905 4.513 -14.998 1.00 0.00 H new ATOM 0 HD13 LEU B 36 2.205 5.540 -14.349 1.00 0.00 H new ATOM 0 HD21 LEU B 36 3.041 3.509 -12.245 1.00 0.00 H new ATOM 0 HD22 LEU B 36 2.857 5.234 -11.851 1.00 0.00 H new ATOM 0 HD23 LEU B 36 1.978 4.007 -10.908 1.00 0.00 H new ATOM 824 N TYR B 37 -1.890 7.419 -13.414 1.00 0.00 N ATOM 825 CA TYR B 37 -3.136 8.158 -13.604 1.00 0.00 C ATOM 826 C TYR B 37 -4.324 7.178 -13.570 1.00 0.00 C ATOM 827 O TYR B 37 -4.758 6.660 -14.603 1.00 0.00 O ATOM 828 CB TYR B 37 -3.035 8.953 -14.921 1.00 0.00 C ATOM 829 CG TYR B 37 -1.837 9.889 -14.978 1.00 0.00 C ATOM 830 CD1 TYR B 37 -1.906 11.157 -14.371 1.00 0.00 C ATOM 831 CD2 TYR B 37 -0.631 9.463 -15.571 1.00 0.00 C ATOM 832 CE1 TYR B 37 -0.778 12.000 -14.350 1.00 0.00 C ATOM 833 CE2 TYR B 37 0.506 10.293 -15.536 1.00 0.00 C ATOM 834 CZ TYR B 37 0.437 11.565 -14.928 1.00 0.00 C ATOM 835 OH TYR B 37 1.540 12.363 -14.904 1.00 0.00 O ATOM 0 H TYR B 37 -1.883 6.541 -13.932 1.00 0.00 H new ATOM 0 HA TYR B 37 -3.304 8.875 -12.800 1.00 0.00 H new ATOM 0 HB2 TYR B 37 -2.978 8.253 -15.755 1.00 0.00 H new ATOM 0 HB3 TYR B 37 -3.947 9.535 -15.055 1.00 0.00 H new ATOM 0 HD1 TYR B 37 -2.830 11.486 -13.918 1.00 0.00 H new ATOM 0 HD2 TYR B 37 -0.579 8.498 -16.053 1.00 0.00 H new ATOM 0 HE1 TYR B 37 -0.841 12.977 -13.893 1.00 0.00 H new ATOM 0 HE2 TYR B 37 1.433 9.956 -15.975 1.00 0.00 H new ATOM 0 HH TYR B 37 2.285 11.904 -15.345 1.00 0.00 H new ATOM 845 N PHE B 38 -4.808 6.854 -12.366 1.00 0.00 N ATOM 846 CA PHE B 38 -6.039 6.101 -12.137 1.00 0.00 C ATOM 847 C PHE B 38 -7.279 6.921 -12.560 1.00 0.00 C ATOM 848 O PHE B 38 -7.187 8.086 -12.954 1.00 0.00 O ATOM 849 CB PHE B 38 -6.098 5.728 -10.638 1.00 0.00 C ATOM 850 CG PHE B 38 -5.356 4.469 -10.202 1.00 0.00 C ATOM 851 CD1 PHE B 38 -5.617 3.222 -10.807 1.00 0.00 C ATOM 852 CD2 PHE B 38 -4.449 4.517 -9.127 1.00 0.00 C ATOM 853 CE1 PHE B 38 -4.957 2.059 -10.370 1.00 0.00 C ATOM 854 CE2 PHE B 38 -3.729 3.376 -8.744 1.00 0.00 C ATOM 855 CZ PHE B 38 -3.980 2.148 -9.368 1.00 0.00 C ATOM 0 H PHE B 38 -4.337 7.118 -11.500 1.00 0.00 H new ATOM 0 HA PHE B 38 -6.041 5.196 -12.744 1.00 0.00 H new ATOM 0 HB2 PHE B 38 -5.704 6.568 -10.065 1.00 0.00 H new ATOM 0 HB3 PHE B 38 -7.146 5.616 -10.359 1.00 0.00 H new ATOM 0 HD1 PHE B 38 -6.331 3.159 -11.615 1.00 0.00 H new ATOM 0 HD2 PHE B 38 -4.306 5.443 -8.591 1.00 0.00 H new ATOM 0 HE1 PHE B 38 -5.202 1.101 -10.805 1.00 0.00 H new ATOM 0 HE2 PHE B 38 -2.981 3.445 -7.968 1.00 0.00 H new ATOM 0 HZ PHE B 38 -3.422 1.270 -9.078 1.00 0.00 H new ATOM 865 N SER B 39 -8.462 6.324 -12.417 1.00 0.00 N ATOM 866 CA SER B 39 -9.749 7.014 -12.453 1.00 0.00 C ATOM 867 C SER B 39 -10.568 6.649 -11.221 1.00 0.00 C ATOM 868 O SER B 39 -10.165 5.791 -10.433 1.00 0.00 O ATOM 869 CB SER B 39 -10.472 6.728 -13.776 1.00 0.00 C ATOM 870 OG SER B 39 -11.585 7.594 -13.931 1.00 0.00 O ATOM 0 H SER B 39 -8.553 5.319 -12.269 1.00 0.00 H new ATOM 0 HA SER B 39 -9.596 8.093 -12.418 1.00 0.00 H new ATOM 0 HB2 SER B 39 -9.782 6.859 -14.610 1.00 0.00 H new ATOM 0 HB3 SER B 39 -10.805 5.690 -13.798 1.00 0.00 H new ATOM 0 HG SER B 39 -12.034 7.400 -14.780 1.00 0.00 H new ATOM 876 N ASP B 40 -11.680 7.349 -11.020 1.00 0.00 N ATOM 877 CA ASP B 40 -12.388 7.455 -9.746 1.00 0.00 C ATOM 878 C ASP B 40 -12.681 6.089 -9.106 1.00 0.00 C ATOM 879 O ASP B 40 -12.288 5.841 -7.967 1.00 0.00 O ATOM 880 CB ASP B 40 -13.655 8.293 -9.974 1.00 0.00 C ATOM 881 CG ASP B 40 -14.269 8.750 -8.650 1.00 0.00 C ATOM 882 OD1 ASP B 40 -13.546 9.420 -7.874 1.00 0.00 O ATOM 883 OD2 ASP B 40 -15.452 8.439 -8.380 1.00 0.00 O ATOM 0 H ASP B 40 -12.131 7.878 -11.767 1.00 0.00 H new ATOM 0 HA ASP B 40 -11.749 7.956 -9.019 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.412 9.163 -10.584 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -14.385 7.707 -10.532 1.00 0.00 H new ATOM 888 N GLU B 41 -13.282 5.169 -9.867 1.00 0.00 N ATOM 889 CA GLU B 41 -13.523 3.780 -9.470 1.00 0.00 C ATOM 890 C GLU B 41 -12.236 3.059 -9.057 1.00 0.00 C ATOM 891 O GLU B 41 -12.078 2.715 -7.890 1.00 0.00 O ATOM 892 CB GLU B 41 -14.203 3.041 -10.632 1.00 0.00 C ATOM 893 CG GLU B 41 -15.616 3.568 -10.907 1.00 0.00 C ATOM 894 CD GLU B 41 -16.692 2.856 -10.061 1.00 0.00 C ATOM 895 OE1 GLU B 41 -16.416 2.495 -8.890 1.00 0.00 O ATOM 896 OE2 GLU B 41 -17.826 2.658 -10.563 1.00 0.00 O ATOM 0 H GLU B 41 -13.624 5.378 -10.805 1.00 0.00 H new ATOM 0 HA GLU B 41 -14.172 3.784 -8.594 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -13.597 3.146 -11.532 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -14.252 1.976 -10.404 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -15.647 4.638 -10.701 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -15.848 3.440 -11.964 1.00 0.00 H new ATOM 903 N GLN B 42 -11.316 2.833 -10.001 1.00 0.00 N ATOM 904 CA GLN B 42 -10.062 2.082 -9.805 1.00 0.00 C ATOM 905 C GLN B 42 -9.125 2.666 -8.722 1.00 0.00 C ATOM 906 O GLN B 42 -8.383 1.910 -8.095 1.00 0.00 O ATOM 907 CB GLN B 42 -9.373 1.821 -11.160 1.00 0.00 C ATOM 908 CG GLN B 42 -9.174 3.058 -12.053 1.00 0.00 C ATOM 909 CD GLN B 42 -8.595 2.722 -13.430 1.00 0.00 C ATOM 910 OE1 GLN B 42 -7.510 3.149 -13.805 1.00 0.00 O ATOM 911 NE2 GLN B 42 -9.303 1.977 -14.252 1.00 0.00 N ATOM 0 H GLN B 42 -11.423 3.177 -10.955 1.00 0.00 H new ATOM 0 HA GLN B 42 -10.335 1.114 -9.385 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -8.398 1.371 -10.971 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -9.961 1.088 -11.711 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -10.132 3.563 -12.182 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -8.510 3.759 -11.548 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -10.209 1.612 -13.958 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -8.946 1.764 -15.183 1.00 0.00 H new ATOM 920 N TYR B 43 -9.214 3.967 -8.415 1.00 0.00 N ATOM 921 CA TYR B 43 -8.570 4.588 -7.252 1.00 0.00 C ATOM 922 C TYR B 43 -9.259 4.178 -5.938 1.00 0.00 C ATOM 923 O TYR B 43 -8.626 3.611 -5.045 1.00 0.00 O ATOM 924 CB TYR B 43 -8.562 6.115 -7.419 1.00 0.00 C ATOM 925 CG TYR B 43 -7.677 6.824 -6.409 1.00 0.00 C ATOM 926 CD1 TYR B 43 -8.190 7.202 -5.152 1.00 0.00 C ATOM 927 CD2 TYR B 43 -6.331 7.096 -6.725 1.00 0.00 C ATOM 928 CE1 TYR B 43 -7.362 7.852 -4.217 1.00 0.00 C ATOM 929 CE2 TYR B 43 -5.501 7.750 -5.794 1.00 0.00 C ATOM 930 CZ TYR B 43 -6.015 8.129 -4.535 1.00 0.00 C ATOM 931 OH TYR B 43 -5.209 8.767 -3.642 1.00 0.00 O ATOM 0 H TYR B 43 -9.746 4.629 -8.980 1.00 0.00 H new ATOM 0 HA TYR B 43 -7.541 4.233 -7.196 1.00 0.00 H new ATOM 0 HB2 TYR B 43 -8.223 6.362 -8.425 1.00 0.00 H new ATOM 0 HB3 TYR B 43 -9.581 6.489 -7.325 1.00 0.00 H new ATOM 0 HD1 TYR B 43 -9.220 6.993 -4.905 1.00 0.00 H new ATOM 0 HD2 TYR B 43 -5.934 6.802 -7.685 1.00 0.00 H new ATOM 0 HE1 TYR B 43 -7.758 8.139 -3.254 1.00 0.00 H new ATOM 0 HE2 TYR B 43 -4.472 7.962 -6.043 1.00 0.00 H new ATOM 0 HH TYR B 43 -4.314 8.874 -4.027 1.00 0.00 H new ATOM 941 N GLN B 44 -10.574 4.409 -5.824 1.00 0.00 N ATOM 942 CA GLN B 44 -11.367 4.072 -4.636 1.00 0.00 C ATOM 943 C GLN B 44 -11.402 2.567 -4.351 1.00 0.00 C ATOM 944 O GLN B 44 -11.530 2.147 -3.204 1.00 0.00 O ATOM 945 CB GLN B 44 -12.814 4.571 -4.773 1.00 0.00 C ATOM 946 CG GLN B 44 -13.082 5.897 -4.045 1.00 0.00 C ATOM 947 CD GLN B 44 -12.738 7.131 -4.872 1.00 0.00 C ATOM 948 OE1 GLN B 44 -11.726 7.796 -4.683 1.00 0.00 O ATOM 949 NE2 GLN B 44 -13.600 7.505 -5.790 1.00 0.00 N ATOM 0 H GLN B 44 -11.124 4.842 -6.566 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.872 4.572 -3.804 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -13.048 4.694 -5.831 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -13.490 3.810 -4.383 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -14.134 5.941 -3.764 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -12.504 5.917 -3.121 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -14.444 6.955 -5.951 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -13.425 8.345 -6.341 1.00 0.00 H new ATOM 958 N LYS B 45 -11.275 1.748 -5.394 1.00 0.00 N ATOM 959 CA LYS B 45 -11.257 0.287 -5.341 1.00 0.00 C ATOM 960 C LYS B 45 -10.030 -0.220 -4.590 1.00 0.00 C ATOM 961 O LYS B 45 -10.121 -1.233 -3.896 1.00 0.00 O ATOM 962 CB LYS B 45 -11.320 -0.296 -6.767 1.00 0.00 C ATOM 963 CG LYS B 45 -12.577 -1.134 -7.056 1.00 0.00 C ATOM 964 CD LYS B 45 -13.832 -0.332 -7.448 1.00 0.00 C ATOM 965 CE LYS B 45 -14.351 0.593 -6.339 1.00 0.00 C ATOM 966 NZ LYS B 45 -15.728 1.076 -6.622 1.00 0.00 N ATOM 0 H LYS B 45 -11.177 2.103 -6.345 1.00 0.00 H new ATOM 0 HA LYS B 45 -12.136 -0.051 -4.792 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -11.272 0.524 -7.484 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -10.439 -0.916 -6.932 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -12.349 -1.834 -7.859 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -12.808 -1.728 -6.172 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -13.608 0.266 -8.331 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -14.623 -1.028 -7.727 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -14.341 0.061 -5.388 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -13.681 1.446 -6.234 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -16.063 1.657 -5.827 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -15.724 1.648 -7.490 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -16.363 0.262 -6.747 1.00 0.00 H new ATOM 980 N LEU B 46 -8.911 0.511 -4.668 1.00 0.00 N ATOM 981 CA LEU B 46 -7.782 0.273 -3.775 1.00 0.00 C ATOM 982 C LEU B 46 -7.953 0.980 -2.417 1.00 0.00 C ATOM 983 O LEU B 46 -7.635 0.405 -1.377 1.00 0.00 O ATOM 984 CB LEU B 46 -6.484 0.663 -4.477 1.00 0.00 C ATOM 985 CG LEU B 46 -6.006 -0.246 -5.632 1.00 0.00 C ATOM 986 CD1 LEU B 46 -4.534 0.061 -5.895 1.00 0.00 C ATOM 987 CD2 LEU B 46 -6.086 -1.746 -5.349 1.00 0.00 C ATOM 0 H LEU B 46 -8.768 1.267 -5.338 1.00 0.00 H new ATOM 0 HA LEU B 46 -7.740 -0.791 -3.544 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -6.602 1.673 -4.869 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.693 0.702 -3.728 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.670 -0.034 -6.470 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -4.171 -0.568 -6.707 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.425 1.110 -6.171 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.954 -0.139 -4.994 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -5.729 -2.300 -6.218 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -5.466 -1.987 -4.485 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -7.120 -2.023 -5.142 1.00 0.00 H new ATOM 999 N GLU B 47 -8.499 2.199 -2.395 1.00 0.00 N ATOM 1000 CA GLU B 47 -8.717 2.977 -1.163 1.00 0.00 C ATOM 1001 C GLU B 47 -9.601 2.250 -0.130 1.00 0.00 C ATOM 1002 O GLU B 47 -9.332 2.299 1.073 1.00 0.00 O ATOM 1003 CB GLU B 47 -9.320 4.344 -1.516 1.00 0.00 C ATOM 1004 CG GLU B 47 -9.117 5.370 -0.398 1.00 0.00 C ATOM 1005 CD GLU B 47 -9.931 6.653 -0.660 1.00 0.00 C ATOM 1006 OE1 GLU B 47 -11.141 6.682 -0.322 1.00 0.00 O ATOM 1007 OE2 GLU B 47 -9.377 7.638 -1.204 1.00 0.00 O ATOM 0 H GLU B 47 -8.807 2.682 -3.239 1.00 0.00 H new ATOM 0 HA GLU B 47 -7.743 3.107 -0.691 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -8.864 4.714 -2.434 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -10.386 4.229 -1.713 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -9.416 4.936 0.556 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -8.059 5.618 -0.317 1.00 0.00 H new ATOM 1014 N LYS B 48 -10.632 1.527 -0.587 1.00 0.00 N ATOM 1015 CA LYS B 48 -11.581 0.798 0.263 1.00 0.00 C ATOM 1016 C LYS B 48 -10.907 -0.311 1.067 1.00 0.00 C ATOM 1017 O LYS B 48 -11.308 -0.568 2.202 1.00 0.00 O ATOM 1018 CB LYS B 48 -12.747 0.257 -0.587 1.00 0.00 C ATOM 1019 CG LYS B 48 -14.013 -0.027 0.248 1.00 0.00 C ATOM 1020 CD LYS B 48 -14.534 -1.473 0.165 1.00 0.00 C ATOM 1021 CE LYS B 48 -13.651 -2.533 0.845 1.00 0.00 C ATOM 1022 NZ LYS B 48 -13.549 -2.337 2.320 1.00 0.00 N ATOM 0 H LYS B 48 -10.834 1.431 -1.582 1.00 0.00 H new ATOM 0 HA LYS B 48 -11.982 1.501 0.994 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -12.987 0.978 -1.368 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -12.433 -0.660 -1.085 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -13.803 0.209 1.291 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -14.804 0.648 -0.078 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -15.527 -1.510 0.614 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -14.649 -1.740 -0.886 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.058 -3.524 0.642 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.653 -2.503 0.409 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.364 -3.251 2.780 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.771 -1.680 2.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -14.442 -1.943 2.680 1.00 0.00 H new ATOM 1036 N MET B 49 -9.882 -0.959 0.506 1.00 0.00 N ATOM 1037 CA MET B 49 -9.014 -1.887 1.207 1.00 0.00 C ATOM 1038 C MET B 49 -8.033 -1.159 2.130 1.00 0.00 C ATOM 1039 O MET B 49 -7.833 -1.572 3.269 1.00 0.00 O ATOM 1040 CB MET B 49 -8.212 -2.645 0.161 1.00 0.00 C ATOM 1041 CG MET B 49 -9.012 -3.659 -0.656 1.00 0.00 C ATOM 1042 SD MET B 49 -7.935 -4.773 -1.595 1.00 0.00 S ATOM 1043 CE MET B 49 -7.148 -3.570 -2.696 1.00 0.00 C ATOM 0 H MET B 49 -9.633 -0.844 -0.476 1.00 0.00 H new ATOM 0 HA MET B 49 -9.627 -2.550 1.818 1.00 0.00 H new ATOM 0 HB2 MET B 49 -7.762 -1.925 -0.522 1.00 0.00 H new ATOM 0 HB3 MET B 49 -7.394 -3.166 0.659 1.00 0.00 H new ATOM 0 HG2 MET B 49 -9.645 -4.244 0.011 1.00 0.00 H new ATOM 0 HG3 MET B 49 -9.674 -3.131 -1.342 1.00 0.00 H new ATOM 0 HE1 MET B 49 -6.420 -4.078 -3.328 1.00 0.00 H new ATOM 0 HE2 MET B 49 -7.906 -3.099 -3.322 1.00 0.00 H new ATOM 0 HE3 MET B 49 -6.644 -2.808 -2.102 1.00 0.00 H new ATOM 1053 N ALA B 50 -7.438 -0.057 1.664 1.00 0.00 N ATOM 1054 CA ALA B 50 -6.485 0.738 2.434 1.00 0.00 C ATOM 1055 C ALA B 50 -7.070 1.308 3.733 1.00 0.00 C ATOM 1056 O ALA B 50 -6.344 1.457 4.711 1.00 0.00 O ATOM 1057 CB ALA B 50 -5.912 1.830 1.536 1.00 0.00 C ATOM 0 H ALA B 50 -7.609 0.311 0.728 1.00 0.00 H new ATOM 0 HA ALA B 50 -5.683 0.077 2.762 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.199 2.429 2.102 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -5.407 1.373 0.685 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -6.720 2.469 1.179 1.00 0.00 H new ATOM 1063 N ASN B 51 -8.379 1.557 3.801 1.00 0.00 N ATOM 1064 CA ASN B 51 -9.071 1.920 5.039 1.00 0.00 C ATOM 1065 C ASN B 51 -8.967 0.837 6.138 1.00 0.00 C ATOM 1066 O ASN B 51 -8.971 1.170 7.322 1.00 0.00 O ATOM 1067 CB ASN B 51 -10.523 2.261 4.686 1.00 0.00 C ATOM 1068 CG ASN B 51 -11.304 2.772 5.888 1.00 0.00 C ATOM 1069 OD1 ASN B 51 -11.034 3.837 6.424 1.00 0.00 O ATOM 1070 ND2 ASN B 51 -12.297 2.043 6.345 1.00 0.00 N ATOM 0 H ASN B 51 -8.995 1.512 2.989 1.00 0.00 H new ATOM 0 HA ASN B 51 -8.582 2.790 5.477 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -10.536 3.016 3.899 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -11.015 1.375 4.286 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -12.841 2.366 7.145 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -12.524 1.154 5.899 1.00 0.00 H new ATOM 1077 N GLU B 52 -8.799 -0.440 5.776 1.00 0.00 N ATOM 1078 CA GLU B 52 -8.527 -1.537 6.714 1.00 0.00 C ATOM 1079 C GLU B 52 -7.100 -1.481 7.301 1.00 0.00 C ATOM 1080 O GLU B 52 -6.888 -1.824 8.465 1.00 0.00 O ATOM 1081 CB GLU B 52 -8.794 -2.889 6.027 1.00 0.00 C ATOM 1082 CG GLU B 52 -8.943 -4.039 7.031 1.00 0.00 C ATOM 1083 CD GLU B 52 -9.333 -5.348 6.319 1.00 0.00 C ATOM 1084 OE1 GLU B 52 -10.548 -5.596 6.118 1.00 0.00 O ATOM 1085 OE2 GLU B 52 -8.431 -6.148 5.967 1.00 0.00 O ATOM 0 H GLU B 52 -8.849 -0.746 4.804 1.00 0.00 H new ATOM 0 HA GLU B 52 -9.206 -1.423 7.559 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -9.701 -2.815 5.427 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -7.976 -3.113 5.342 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -8.006 -4.179 7.570 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -9.701 -3.784 7.771 1.00 0.00 H new ATOM 1092 N GLU B 53 -6.123 -0.984 6.531 1.00 0.00 N ATOM 1093 CA GLU B 53 -4.773 -0.619 6.978 1.00 0.00 C ATOM 1094 C GLU B 53 -4.726 0.769 7.661 1.00 0.00 C ATOM 1095 O GLU B 53 -3.676 1.194 8.144 1.00 0.00 O ATOM 1096 CB GLU B 53 -3.841 -0.658 5.758 1.00 0.00 C ATOM 1097 CG GLU B 53 -3.500 -2.074 5.271 1.00 0.00 C ATOM 1098 CD GLU B 53 -2.387 -2.743 6.098 1.00 0.00 C ATOM 1099 OE1 GLU B 53 -2.637 -3.170 7.251 1.00 0.00 O ATOM 1100 OE2 GLU B 53 -1.252 -2.864 5.576 1.00 0.00 O ATOM 0 H GLU B 53 -6.259 -0.818 5.534 1.00 0.00 H new ATOM 0 HA GLU B 53 -4.449 -1.335 7.734 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -4.307 -0.107 4.941 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -2.915 -0.138 6.005 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -4.397 -2.692 5.312 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -3.192 -2.029 4.227 1.00 0.00 H new ATOM 1107 N GLU B 54 -5.873 1.459 7.729 1.00 0.00 N ATOM 1108 CA GLU B 54 -6.130 2.767 8.354 1.00 0.00 C ATOM 1109 C GLU B 54 -5.669 3.946 7.466 1.00 0.00 C ATOM 1110 O GLU B 54 -5.101 4.934 7.932 1.00 0.00 O ATOM 1111 CB GLU B 54 -5.633 2.805 9.816 1.00 0.00 C ATOM 1112 CG GLU B 54 -6.457 3.776 10.669 1.00 0.00 C ATOM 1113 CD GLU B 54 -5.910 3.855 12.107 1.00 0.00 C ATOM 1114 OE1 GLU B 54 -6.317 3.031 12.963 1.00 0.00 O ATOM 1115 OE2 GLU B 54 -5.078 4.749 12.403 1.00 0.00 O ATOM 0 H GLU B 54 -6.723 1.082 7.310 1.00 0.00 H new ATOM 0 HA GLU B 54 -7.209 2.905 8.425 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -5.689 1.805 10.246 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -4.584 3.102 9.836 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -6.440 4.767 10.216 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -7.498 3.453 10.690 1.00 0.00 H new ATOM 1122 N GLU B 55 -5.957 3.826 6.164 1.00 0.00 N ATOM 1123 CA GLU B 55 -5.593 4.708 5.046 1.00 0.00 C ATOM 1124 C GLU B 55 -4.079 4.815 4.795 1.00 0.00 C ATOM 1125 O GLU B 55 -3.331 5.527 5.472 1.00 0.00 O ATOM 1126 CB GLU B 55 -6.299 6.066 5.127 1.00 0.00 C ATOM 1127 CG GLU B 55 -5.977 7.009 3.955 1.00 0.00 C ATOM 1128 CD GLU B 55 -6.380 6.408 2.598 1.00 0.00 C ATOM 1129 OE1 GLU B 55 -5.574 5.640 2.015 1.00 0.00 O ATOM 1130 OE2 GLU B 55 -7.505 6.701 2.131 1.00 0.00 O ATOM 0 H GLU B 55 -6.504 3.031 5.834 1.00 0.00 H new ATOM 0 HA GLU B 55 -5.973 4.218 4.150 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.376 5.903 5.163 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -6.019 6.554 6.060 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -6.497 7.956 4.100 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -4.909 7.229 3.950 1.00 0.00 H new ATOM 1137 N SER B 56 -3.647 4.088 3.768 1.00 0.00 N ATOM 1138 CA SER B 56 -2.276 4.031 3.258 1.00 0.00 C ATOM 1139 C SER B 56 -2.217 3.749 1.746 1.00 0.00 C ATOM 1140 O SER B 56 -1.251 3.129 1.298 1.00 0.00 O ATOM 1141 CB SER B 56 -1.488 2.978 4.061 1.00 0.00 C ATOM 1142 OG SER B 56 -1.989 1.664 3.852 1.00 0.00 O ATOM 0 H SER B 56 -4.279 3.488 3.238 1.00 0.00 H new ATOM 0 HA SER B 56 -1.818 5.011 3.392 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.437 3.015 3.774 1.00 0.00 H new ATOM 0 HB3 SER B 56 -1.537 3.220 5.123 1.00 0.00 H new ATOM 0 HG SER B 56 -1.462 1.026 4.377 1.00 0.00 H new ATOM 1148 N VAL B 57 -3.240 4.101 0.942 1.00 0.00 N ATOM 1149 CA VAL B 57 -3.393 3.524 -0.418 1.00 0.00 C ATOM 1150 C VAL B 57 -2.178 3.715 -1.339 1.00 0.00 C ATOM 1151 O VAL B 57 -1.829 2.794 -2.075 1.00 0.00 O ATOM 1152 CB VAL B 57 -4.742 3.855 -1.101 1.00 0.00 C ATOM 1153 CG1 VAL B 57 -4.908 5.235 -1.739 1.00 0.00 C ATOM 1154 CG2 VAL B 57 -5.028 2.832 -2.204 1.00 0.00 C ATOM 0 H VAL B 57 -3.964 4.771 1.201 1.00 0.00 H new ATOM 0 HA VAL B 57 -3.426 2.450 -0.233 1.00 0.00 H new ATOM 0 HB VAL B 57 -5.437 3.830 -0.262 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -5.903 5.317 -2.176 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -4.781 6.005 -0.978 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -4.158 5.368 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -5.978 3.069 -2.682 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -4.230 2.865 -2.946 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -5.079 1.834 -1.770 1.00 0.00 H new ATOM 1164 N GLY B 58 -1.441 4.825 -1.211 1.00 0.00 N ATOM 1165 CA GLY B 58 -0.156 5.058 -1.889 1.00 0.00 C ATOM 1166 C GLY B 58 0.879 3.943 -1.668 1.00 0.00 C ATOM 1167 O GLY B 58 1.558 3.524 -2.603 1.00 0.00 O ATOM 0 H GLY B 58 -1.727 5.606 -0.620 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -0.336 5.166 -2.959 1.00 0.00 H new ATOM 0 HA3 GLY B 58 0.262 6.002 -1.539 1.00 0.00 H new ATOM 1171 N SER B 59 0.984 3.424 -0.444 1.00 0.00 N ATOM 1172 CA SER B 59 1.793 2.260 -0.078 1.00 0.00 C ATOM 1173 C SER B 59 1.095 0.934 -0.382 1.00 0.00 C ATOM 1174 O SER B 59 1.761 -0.020 -0.782 1.00 0.00 O ATOM 1175 CB SER B 59 2.074 2.306 1.423 1.00 0.00 C ATOM 1176 OG SER B 59 2.745 3.498 1.805 1.00 0.00 O ATOM 0 H SER B 59 0.487 3.820 0.354 1.00 0.00 H new ATOM 0 HA SER B 59 2.707 2.307 -0.669 1.00 0.00 H new ATOM 0 HB2 SER B 59 1.134 2.228 1.970 1.00 0.00 H new ATOM 0 HB3 SER B 59 2.679 1.444 1.705 1.00 0.00 H new ATOM 0 HG SER B 59 2.904 3.488 2.772 1.00 0.00 H new ATOM 1182 N TYR B 60 -0.232 0.864 -0.225 1.00 0.00 N ATOM 1183 CA TYR B 60 -1.035 -0.338 -0.491 1.00 0.00 C ATOM 1184 C TYR B 60 -0.865 -0.821 -1.934 1.00 0.00 C ATOM 1185 O TYR B 60 -0.694 -2.012 -2.178 1.00 0.00 O ATOM 1186 CB TYR B 60 -2.518 -0.063 -0.206 1.00 0.00 C ATOM 1187 CG TYR B 60 -3.328 -1.307 0.110 1.00 0.00 C ATOM 1188 CD1 TYR B 60 -3.713 -2.193 -0.917 1.00 0.00 C ATOM 1189 CD2 TYR B 60 -3.677 -1.593 1.444 1.00 0.00 C ATOM 1190 CE1 TYR B 60 -4.397 -3.382 -0.603 1.00 0.00 C ATOM 1191 CE2 TYR B 60 -4.376 -2.776 1.758 1.00 0.00 C ATOM 1192 CZ TYR B 60 -4.714 -3.688 0.737 1.00 0.00 C ATOM 1193 OH TYR B 60 -5.342 -4.858 1.036 1.00 0.00 O ATOM 0 H TYR B 60 -0.789 1.655 0.096 1.00 0.00 H new ATOM 0 HA TYR B 60 -0.678 -1.125 0.174 1.00 0.00 H new ATOM 0 HB2 TYR B 60 -2.594 0.630 0.632 1.00 0.00 H new ATOM 0 HB3 TYR B 60 -2.957 0.434 -1.071 1.00 0.00 H new ATOM 0 HD1 TYR B 60 -3.483 -1.959 -1.946 1.00 0.00 H new ATOM 0 HD2 TYR B 60 -3.408 -0.903 2.230 1.00 0.00 H new ATOM 0 HE1 TYR B 60 -4.681 -4.063 -1.392 1.00 0.00 H new ATOM 0 HE2 TYR B 60 -4.653 -2.984 2.781 1.00 0.00 H new ATOM 0 HH TYR B 60 -6.095 -4.991 0.423 1.00 0.00 H new ATOM 1203 N ILE B 61 -0.843 0.128 -2.875 1.00 0.00 N ATOM 1204 CA ILE B 61 -0.579 -0.072 -4.309 1.00 0.00 C ATOM 1205 C ILE B 61 0.713 -0.862 -4.467 1.00 0.00 C ATOM 1206 O ILE B 61 0.712 -1.968 -5.011 1.00 0.00 O ATOM 1207 CB ILE B 61 -0.499 1.315 -5.013 1.00 0.00 C ATOM 1208 CG1 ILE B 61 -1.888 1.956 -5.191 1.00 0.00 C ATOM 1209 CG2 ILE B 61 0.183 1.286 -6.395 1.00 0.00 C ATOM 1210 CD1 ILE B 61 -1.860 3.485 -5.311 1.00 0.00 C ATOM 0 H ILE B 61 -1.017 1.107 -2.649 1.00 0.00 H new ATOM 0 HA ILE B 61 -1.384 -0.639 -4.777 1.00 0.00 H new ATOM 0 HB ILE B 61 0.117 1.909 -4.338 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -2.357 1.541 -6.083 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -2.515 1.680 -4.343 1.00 0.00 H new ATOM 0 HG21 ILE B 61 0.197 2.292 -6.815 1.00 0.00 H new ATOM 0 HG22 ILE B 61 1.205 0.923 -6.289 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -0.370 0.623 -7.060 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -2.876 3.859 -5.434 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -1.422 3.913 -4.409 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -1.261 3.771 -6.176 1.00 0.00 H new ATOM 1222 N LYS B 62 1.807 -0.320 -3.924 1.00 0.00 N ATOM 1223 CA LYS B 62 3.124 -0.942 -3.981 1.00 0.00 C ATOM 1224 C LYS B 62 3.116 -2.324 -3.349 1.00 0.00 C ATOM 1225 O LYS B 62 3.498 -3.295 -3.992 1.00 0.00 O ATOM 1226 CB LYS B 62 4.161 -0.015 -3.313 1.00 0.00 C ATOM 1227 CG LYS B 62 5.461 0.027 -4.135 1.00 0.00 C ATOM 1228 CD LYS B 62 6.721 0.451 -3.365 1.00 0.00 C ATOM 1229 CE LYS B 62 6.712 1.902 -2.857 1.00 0.00 C ATOM 1230 NZ LYS B 62 6.183 2.027 -1.471 1.00 0.00 N ATOM 0 H LYS B 62 1.798 0.572 -3.429 1.00 0.00 H new ATOM 0 HA LYS B 62 3.403 -1.081 -5.026 1.00 0.00 H new ATOM 0 HB2 LYS B 62 3.751 0.991 -3.220 1.00 0.00 H new ATOM 0 HB3 LYS B 62 4.374 -0.367 -2.304 1.00 0.00 H new ATOM 0 HG2 LYS B 62 5.633 -0.962 -4.560 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.319 0.713 -4.970 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.850 -0.216 -2.513 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.588 0.313 -4.011 1.00 0.00 H new ATOM 0 HE2 LYS B 62 7.726 2.300 -2.891 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.108 2.513 -3.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.200 3.026 -1.182 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 5.205 1.674 -1.440 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 6.773 1.468 -0.822 1.00 0.00 H new ATOM 1244 N ARG B 63 2.627 -2.427 -2.114 1.00 0.00 N ATOM 1245 CA ARG B 63 2.546 -3.674 -1.345 1.00 0.00 C ATOM 1246 C ARG B 63 1.795 -4.764 -2.110 1.00 0.00 C ATOM 1247 O ARG B 63 2.233 -5.907 -2.087 1.00 0.00 O ATOM 1248 CB ARG B 63 1.970 -3.371 0.051 1.00 0.00 C ATOM 1249 CG ARG B 63 1.940 -4.602 0.978 1.00 0.00 C ATOM 1250 CD ARG B 63 2.255 -4.281 2.450 1.00 0.00 C ATOM 1251 NE ARG B 63 1.304 -3.337 3.078 1.00 0.00 N ATOM 1252 CZ ARG B 63 1.517 -2.081 3.433 1.00 0.00 C ATOM 1253 NH1 ARG B 63 2.602 -1.433 3.110 1.00 0.00 N ATOM 1254 NH2 ARG B 63 0.637 -1.446 4.145 1.00 0.00 N ATOM 0 H ARG B 63 2.265 -1.622 -1.603 1.00 0.00 H new ATOM 0 HA ARG B 63 3.545 -4.085 -1.199 1.00 0.00 H new ATOM 0 HB2 ARG B 63 2.564 -2.586 0.519 1.00 0.00 H new ATOM 0 HB3 ARG B 63 0.958 -2.982 -0.058 1.00 0.00 H new ATOM 0 HG2 ARG B 63 0.955 -5.065 0.920 1.00 0.00 H new ATOM 0 HG3 ARG B 63 2.659 -5.336 0.614 1.00 0.00 H new ATOM 0 HD2 ARG B 63 2.259 -5.210 3.021 1.00 0.00 H new ATOM 0 HD3 ARG B 63 3.260 -3.864 2.513 1.00 0.00 H new ATOM 0 HE ARG B 63 0.368 -3.700 3.260 1.00 0.00 H new ATOM 0 HH11 ARG B 63 3.328 -1.895 2.562 1.00 0.00 H new ATOM 0 HH12 ARG B 63 2.725 -0.464 3.405 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -0.222 -1.916 4.432 1.00 0.00 H new ATOM 0 HH22 ARG B 63 0.804 -0.477 4.417 1.00 0.00 H new ATOM 1268 N TYR B 64 0.742 -4.426 -2.858 1.00 0.00 N ATOM 1269 CA TYR B 64 -0.031 -5.396 -3.634 1.00 0.00 C ATOM 1270 C TYR B 64 0.703 -5.901 -4.880 1.00 0.00 C ATOM 1271 O TYR B 64 0.735 -7.094 -5.178 1.00 0.00 O ATOM 1272 CB TYR B 64 -1.385 -4.798 -4.024 1.00 0.00 C ATOM 1273 CG TYR B 64 -2.435 -5.894 -3.993 1.00 0.00 C ATOM 1274 CD1 TYR B 64 -2.550 -6.796 -5.071 1.00 0.00 C ATOM 1275 CD2 TYR B 64 -3.143 -6.136 -2.801 1.00 0.00 C ATOM 1276 CE1 TYR B 64 -3.351 -7.948 -4.945 1.00 0.00 C ATOM 1277 CE2 TYR B 64 -3.973 -7.268 -2.683 1.00 0.00 C ATOM 1278 CZ TYR B 64 -4.068 -8.186 -3.751 1.00 0.00 C ATOM 1279 OH TYR B 64 -4.828 -9.307 -3.613 1.00 0.00 O ATOM 0 H TYR B 64 0.401 -3.468 -2.942 1.00 0.00 H new ATOM 0 HA TYR B 64 -0.178 -6.263 -2.990 1.00 0.00 H new ATOM 0 HB2 TYR B 64 -1.656 -3.997 -3.336 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -1.330 -4.357 -5.019 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -2.023 -6.603 -5.994 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -3.049 -5.450 -1.972 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -3.417 -8.651 -5.763 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -4.536 -7.433 -1.776 1.00 0.00 H new ATOM 0 HH TYR B 64 -5.250 -9.309 -2.728 1.00 0.00 H new ATOM 1289 N ILE B 65 1.333 -4.974 -5.592 1.00 0.00 N ATOM 1290 CA ILE B 65 2.176 -5.215 -6.768 1.00 0.00 C ATOM 1291 C ILE B 65 3.364 -6.092 -6.376 1.00 0.00 C ATOM 1292 O ILE B 65 3.657 -7.077 -7.048 1.00 0.00 O ATOM 1293 CB ILE B 65 2.632 -3.872 -7.375 1.00 0.00 C ATOM 1294 CG1 ILE B 65 1.444 -3.090 -7.971 1.00 0.00 C ATOM 1295 CG2 ILE B 65 3.722 -4.058 -8.441 1.00 0.00 C ATOM 1296 CD1 ILE B 65 1.786 -1.606 -8.145 1.00 0.00 C ATOM 0 H ILE B 65 1.270 -3.983 -5.357 1.00 0.00 H new ATOM 0 HA ILE B 65 1.604 -5.744 -7.531 1.00 0.00 H new ATOM 0 HB ILE B 65 3.057 -3.294 -6.555 1.00 0.00 H new ATOM 0 HG12 ILE B 65 1.171 -3.518 -8.936 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.576 -3.192 -7.320 1.00 0.00 H new ATOM 0 HG21 ILE B 65 4.011 -3.085 -8.839 1.00 0.00 H new ATOM 0 HG22 ILE B 65 4.591 -4.539 -7.993 1.00 0.00 H new ATOM 0 HG23 ILE B 65 3.338 -4.682 -9.249 1.00 0.00 H new ATOM 0 HD11 ILE B 65 0.928 -1.082 -8.567 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.034 -1.174 -7.176 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.639 -1.505 -8.816 1.00 0.00 H new ATOM 1308 N LEU B 66 4.013 -5.773 -5.254 1.00 0.00 N ATOM 1309 CA LEU B 66 5.185 -6.483 -4.744 1.00 0.00 C ATOM 1310 C LEU B 66 4.783 -7.876 -4.243 1.00 0.00 C ATOM 1311 O LEU B 66 5.490 -8.851 -4.501 1.00 0.00 O ATOM 1312 CB LEU B 66 5.850 -5.615 -3.660 1.00 0.00 C ATOM 1313 CG LEU B 66 6.812 -4.518 -4.184 1.00 0.00 C ATOM 1314 CD1 LEU B 66 6.507 -3.898 -5.553 1.00 0.00 C ATOM 1315 CD2 LEU B 66 6.854 -3.362 -3.187 1.00 0.00 C ATOM 0 H LEU B 66 3.729 -4.993 -4.661 1.00 0.00 H new ATOM 0 HA LEU B 66 5.917 -6.647 -5.534 1.00 0.00 H new ATOM 0 HB2 LEU B 66 5.068 -5.137 -3.071 1.00 0.00 H new ATOM 0 HB3 LEU B 66 6.404 -6.268 -2.985 1.00 0.00 H new ATOM 0 HG LEU B 66 7.752 -5.057 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU B 66 7.262 -3.148 -5.789 1.00 0.00 H new ATOM 0 HD12 LEU B 66 6.518 -4.677 -6.316 1.00 0.00 H new ATOM 0 HD13 LEU B 66 5.524 -3.428 -5.529 1.00 0.00 H new ATOM 0 HD21 LEU B 66 7.530 -2.590 -3.554 1.00 0.00 H new ATOM 0 HD22 LEU B 66 5.854 -2.944 -3.072 1.00 0.00 H new ATOM 0 HD23 LEU B 66 7.208 -3.726 -2.223 1.00 0.00 H new ATOM 1327 N LYS B 67 3.601 -7.997 -3.625 1.00 0.00 N ATOM 1328 CA LYS B 67 2.986 -9.274 -3.242 1.00 0.00 C ATOM 1329 C LYS B 67 2.738 -10.179 -4.453 1.00 0.00 C ATOM 1330 O LYS B 67 3.043 -11.369 -4.403 1.00 0.00 O ATOM 1331 CB LYS B 67 1.700 -8.991 -2.453 1.00 0.00 C ATOM 1332 CG LYS B 67 1.065 -10.264 -1.874 1.00 0.00 C ATOM 1333 CD LYS B 67 -0.182 -9.966 -1.021 1.00 0.00 C ATOM 1334 CE LYS B 67 0.102 -9.207 0.287 1.00 0.00 C ATOM 1335 NZ LYS B 67 0.842 -10.037 1.277 1.00 0.00 N ATOM 0 H LYS B 67 3.032 -7.189 -3.371 1.00 0.00 H new ATOM 0 HA LYS B 67 3.676 -9.825 -2.603 1.00 0.00 H new ATOM 0 HB2 LYS B 67 1.922 -8.299 -1.640 1.00 0.00 H new ATOM 0 HB3 LYS B 67 0.981 -8.496 -3.105 1.00 0.00 H new ATOM 0 HG2 LYS B 67 0.792 -10.933 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS B 67 1.801 -10.788 -1.265 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.884 -9.384 -1.618 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -0.674 -10.908 -0.779 1.00 0.00 H new ATOM 0 HE2 LYS B 67 0.680 -8.310 0.065 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -0.841 -8.878 0.725 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 1.009 -9.481 2.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 0.281 -10.881 1.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 1.754 -10.330 0.872 1.00 0.00 H new ATOM 1349 N ALA B 68 2.232 -9.614 -5.548 1.00 0.00 N ATOM 1350 CA ALA B 68 2.054 -10.325 -6.816 1.00 0.00 C ATOM 1351 C ALA B 68 3.400 -10.727 -7.462 1.00 0.00 C ATOM 1352 O ALA B 68 3.549 -11.848 -7.950 1.00 0.00 O ATOM 1353 CB ALA B 68 1.193 -9.455 -7.740 1.00 0.00 C ATOM 0 H ALA B 68 1.931 -8.640 -5.582 1.00 0.00 H new ATOM 0 HA ALA B 68 1.541 -11.269 -6.632 1.00 0.00 H new ATOM 0 HB1 ALA B 68 1.048 -9.967 -8.691 1.00 0.00 H new ATOM 0 HB2 ALA B 68 0.224 -9.276 -7.273 1.00 0.00 H new ATOM 0 HB3 ALA B 68 1.694 -8.502 -7.913 1.00 0.00 H new ATOM 1359 N LEU B 69 4.411 -9.852 -7.401 1.00 0.00 N ATOM 1360 CA LEU B 69 5.744 -10.017 -7.993 1.00 0.00 C ATOM 1361 C LEU B 69 6.558 -11.156 -7.374 1.00 0.00 C ATOM 1362 O LEU B 69 7.387 -11.762 -8.056 1.00 0.00 O ATOM 1363 CB LEU B 69 6.490 -8.674 -7.876 1.00 0.00 C ATOM 1364 CG LEU B 69 6.635 -7.938 -9.218 1.00 0.00 C ATOM 1365 CD1 LEU B 69 6.506 -6.428 -9.055 1.00 0.00 C ATOM 1366 CD2 LEU B 69 7.997 -8.210 -9.842 1.00 0.00 C ATOM 0 H LEU B 69 4.316 -8.962 -6.911 1.00 0.00 H new ATOM 0 HA LEU B 69 5.617 -10.301 -9.038 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.959 -8.032 -7.173 1.00 0.00 H new ATOM 0 HB3 LEU B 69 7.481 -8.852 -7.459 1.00 0.00 H new ATOM 0 HG LEU B 69 5.834 -8.311 -9.856 1.00 0.00 H new ATOM 0 HD11 LEU B 69 6.615 -5.947 -10.027 1.00 0.00 H new ATOM 0 HD12 LEU B 69 5.527 -6.189 -8.639 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.284 -6.067 -8.382 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.075 -7.678 -10.790 1.00 0.00 H new ATOM 0 HD22 LEU B 69 8.781 -7.866 -9.168 1.00 0.00 H new ATOM 0 HD23 LEU B 69 8.111 -9.280 -10.015 1.00 0.00 H new ATOM 1378 N ARG B 70 6.273 -11.508 -6.115 1.00 0.00 N ATOM 1379 CA ARG B 70 6.802 -12.711 -5.453 1.00 0.00 C ATOM 1380 C ARG B 70 6.434 -14.019 -6.173 1.00 0.00 C ATOM 1381 O ARG B 70 7.146 -15.014 -6.022 1.00 0.00 O ATOM 1382 CB ARG B 70 6.343 -12.771 -3.985 1.00 0.00 C ATOM 1383 CG ARG B 70 7.014 -11.702 -3.112 1.00 0.00 C ATOM 1384 CD ARG B 70 6.445 -11.727 -1.689 1.00 0.00 C ATOM 1385 NE ARG B 70 7.032 -10.659 -0.858 1.00 0.00 N ATOM 1386 CZ ARG B 70 6.852 -10.465 0.437 1.00 0.00 C ATOM 1387 NH1 ARG B 70 6.097 -11.248 1.156 1.00 0.00 N ATOM 1388 NH2 ARG B 70 7.434 -9.470 1.042 1.00 0.00 N ATOM 0 H ARG B 70 5.658 -10.957 -5.516 1.00 0.00 H new ATOM 0 HA ARG B 70 7.888 -12.624 -5.496 1.00 0.00 H new ATOM 0 HB2 ARG B 70 5.261 -12.644 -3.941 1.00 0.00 H new ATOM 0 HB3 ARG B 70 6.565 -13.758 -3.579 1.00 0.00 H new ATOM 0 HG2 ARG B 70 8.090 -11.874 -3.081 1.00 0.00 H new ATOM 0 HG3 ARG B 70 6.861 -10.717 -3.553 1.00 0.00 H new ATOM 0 HD2 ARG B 70 5.362 -11.608 -1.726 1.00 0.00 H new ATOM 0 HD3 ARG B 70 6.644 -12.697 -1.233 1.00 0.00 H new ATOM 0 HE ARG B 70 7.644 -9.997 -1.335 1.00 0.00 H new ATOM 0 HH11 ARG B 70 5.623 -12.040 0.721 1.00 0.00 H new ATOM 0 HH12 ARG B 70 5.980 -11.069 2.153 1.00 0.00 H new ATOM 0 HH21 ARG B 70 8.034 -8.834 0.516 1.00 0.00 H new ATOM 0 HH22 ARG B 70 7.290 -9.327 2.042 1.00 0.00 H new ATOM 1402 N LYS B 71 5.331 -14.027 -6.937 1.00 0.00 N ATOM 1403 CA LYS B 71 4.728 -15.207 -7.583 1.00 0.00 C ATOM 1404 C LYS B 71 3.950 -14.873 -8.873 1.00 0.00 C ATOM 1405 O LYS B 71 2.801 -15.291 -9.037 1.00 0.00 O ATOM 1406 CB LYS B 71 3.887 -15.978 -6.537 1.00 0.00 C ATOM 1407 CG LYS B 71 2.802 -15.141 -5.831 1.00 0.00 C ATOM 1408 CD LYS B 71 1.960 -16.028 -4.905 1.00 0.00 C ATOM 1409 CE LYS B 71 0.885 -15.196 -4.198 1.00 0.00 C ATOM 1410 NZ LYS B 71 0.039 -16.041 -3.314 1.00 0.00 N ATOM 0 H LYS B 71 4.810 -13.172 -7.131 1.00 0.00 H new ATOM 0 HA LYS B 71 5.529 -15.858 -7.932 1.00 0.00 H new ATOM 0 HB2 LYS B 71 3.409 -16.825 -7.030 1.00 0.00 H new ATOM 0 HB3 LYS B 71 4.559 -16.386 -5.782 1.00 0.00 H new ATOM 0 HG2 LYS B 71 3.268 -14.342 -5.255 1.00 0.00 H new ATOM 0 HG3 LYS B 71 2.160 -14.666 -6.573 1.00 0.00 H new ATOM 0 HD2 LYS B 71 1.491 -16.825 -5.482 1.00 0.00 H new ATOM 0 HD3 LYS B 71 2.603 -16.506 -4.166 1.00 0.00 H new ATOM 0 HE2 LYS B 71 1.359 -14.411 -3.609 1.00 0.00 H new ATOM 0 HE3 LYS B 71 0.258 -14.702 -4.940 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -0.679 -15.448 -2.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -0.432 -16.774 -3.882 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 0.635 -16.492 -2.591 1.00 0.00 H new ATOM 1424 N ILE B 72 4.578 -14.135 -9.803 1.00 0.00 N ATOM 1425 CA ILE B 72 4.004 -13.799 -11.124 1.00 0.00 C ATOM 1426 C ILE B 72 3.469 -15.053 -11.850 1.00 0.00 C ATOM 1427 O ILE B 72 2.302 -15.091 -12.249 1.00 0.00 O ATOM 1428 CB ILE B 72 5.026 -13.041 -12.008 1.00 0.00 C ATOM 1429 CG1 ILE B 72 5.597 -11.793 -11.295 1.00 0.00 C ATOM 1430 CG2 ILE B 72 4.382 -12.629 -13.344 1.00 0.00 C ATOM 1431 CD1 ILE B 72 6.495 -10.901 -12.165 1.00 0.00 C ATOM 0 H ILE B 72 5.511 -13.748 -9.660 1.00 0.00 H new ATOM 0 HA ILE B 72 3.158 -13.136 -10.946 1.00 0.00 H new ATOM 0 HB ILE B 72 5.853 -13.724 -12.199 1.00 0.00 H new ATOM 0 HG12 ILE B 72 4.766 -11.193 -10.924 1.00 0.00 H new ATOM 0 HG13 ILE B 72 6.168 -12.119 -10.426 1.00 0.00 H new ATOM 0 HG21 ILE B 72 5.114 -12.098 -13.952 1.00 0.00 H new ATOM 0 HG22 ILE B 72 4.046 -13.519 -13.876 1.00 0.00 H new ATOM 0 HG23 ILE B 72 3.529 -11.978 -13.151 1.00 0.00 H new ATOM 0 HD11 ILE B 72 6.846 -10.053 -11.576 1.00 0.00 H new ATOM 0 HD12 ILE B 72 7.351 -11.478 -12.516 1.00 0.00 H new ATOM 0 HD13 ILE B 72 5.927 -10.538 -13.021 1.00 0.00 H new ATOM 1443 N GLU B 73 4.314 -16.079 -12.010 1.00 0.00 N ATOM 1444 CA GLU B 73 3.973 -17.414 -12.533 1.00 0.00 C ATOM 1445 C GLU B 73 3.492 -18.378 -11.430 1.00 0.00 C ATOM 1446 O GLU B 73 2.410 -18.985 -11.606 1.00 0.00 O ATOM 1447 CB GLU B 73 5.194 -17.999 -13.264 1.00 0.00 C ATOM 1448 CG GLU B 73 5.500 -17.325 -14.613 1.00 0.00 C ATOM 1449 CD GLU B 73 4.428 -17.634 -15.686 1.00 0.00 C ATOM 1450 OE1 GLU B 73 4.417 -18.765 -16.237 1.00 0.00 O ATOM 1451 OE2 GLU B 73 3.600 -16.747 -16.011 1.00 0.00 O ATOM 0 H GLU B 73 5.302 -16.000 -11.768 1.00 0.00 H new ATOM 0 HA GLU B 73 3.141 -17.298 -13.228 1.00 0.00 H new ATOM 0 HB2 GLU B 73 6.068 -17.909 -12.619 1.00 0.00 H new ATOM 0 HB3 GLU B 73 5.029 -19.063 -13.431 1.00 0.00 H new ATOM 0 HG2 GLU B 73 5.566 -16.246 -14.470 1.00 0.00 H new ATOM 0 HG3 GLU B 73 6.474 -17.660 -14.970 1.00 0.00 H new TER 1458 GLU B 73