USER MOD reduce.3.24.130724 H: found=0, std=0, add=615, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 614 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 37 ASN : amide:sc= 0.938 K(o=0.86,f=-0.0044) USER MOD Set 1.2: A 59 ASN : amide:sc= -0.0764 X(o=0.86,f=0.99) USER MOD Single : A 1 SER N :NH3+ 148:sc= 0.0404 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0166 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0.12 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= 0.761 K(o=0.76,f=-0.04) USER MOD Single : A 33 TYR OH : rot -166:sc= 0.587 USER MOD Single : A 35 THR OG1 : rot -66:sc= 0.38 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 180:sc= -1.68 USER MOD Single : A 61 MET CE :methyl 177:sc= 0 (180deg=-0.0236) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 168:sc= 0.418 (180deg=0.347) USER MOD Single : A 75 LYS NZ :NH3+ 152:sc= 1.66 (180deg=0.462) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 22.231 35.593 -23.892 1.00 0.00 N ATOM 2 CA SER A 1 20.808 35.182 -23.824 1.00 0.00 C ATOM 3 C SER A 1 19.983 36.153 -22.983 1.00 0.00 C ATOM 4 O SER A 1 20.495 36.728 -22.021 1.00 0.00 O ATOM 5 CB SER A 1 20.673 33.761 -23.268 1.00 0.00 C ATOM 6 OG SER A 1 21.465 32.877 -24.045 1.00 0.00 O ATOM 0 H1 SER A 1 22.833 34.748 -23.961 1.00 0.00 H new ATOM 0 H2 SER A 1 22.379 36.193 -24.728 1.00 0.00 H new ATOM 0 H3 SER A 1 22.480 36.127 -23.035 1.00 0.00 H new ATOM 0 HA SER A 1 20.419 35.199 -24.842 1.00 0.00 H new ATOM 0 HB2 SER A 1 20.993 33.734 -22.226 1.00 0.00 H new ATOM 0 HB3 SER A 1 19.629 33.447 -23.290 1.00 0.00 H new ATOM 0 HG SER A 1 21.382 31.967 -23.691 1.00 0.00 H new ATOM 14 N MET A 2 18.703 36.342 -23.332 1.00 0.00 N ATOM 15 CA MET A 2 17.758 37.241 -22.634 1.00 0.00 C ATOM 16 C MET A 2 16.437 36.559 -22.228 1.00 0.00 C ATOM 17 O MET A 2 15.964 36.772 -21.110 1.00 0.00 O ATOM 18 CB MET A 2 17.456 38.467 -23.517 1.00 0.00 C ATOM 19 CG MET A 2 18.686 39.350 -23.757 1.00 0.00 C ATOM 20 SD MET A 2 18.336 40.835 -24.736 1.00 0.00 S ATOM 21 CE MET A 2 19.993 41.572 -24.769 1.00 0.00 C ATOM 0 H MET A 2 18.280 35.864 -24.128 1.00 0.00 H new ATOM 0 HA MET A 2 18.249 37.542 -21.709 1.00 0.00 H new ATOM 0 HB2 MET A 2 17.065 38.129 -24.477 1.00 0.00 H new ATOM 0 HB3 MET A 2 16.674 39.063 -23.046 1.00 0.00 H new ATOM 0 HG2 MET A 2 19.101 39.649 -22.795 1.00 0.00 H new ATOM 0 HG3 MET A 2 19.451 38.762 -24.265 1.00 0.00 H new ATOM 0 HE1 MET A 2 19.966 42.503 -25.335 1.00 0.00 H new ATOM 0 HE2 MET A 2 20.321 41.777 -23.750 1.00 0.00 H new ATOM 0 HE3 MET A 2 20.690 40.880 -25.242 1.00 0.00 H new ATOM 31 N ALA A 3 15.842 35.751 -23.118 1.00 0.00 N ATOM 32 CA ALA A 3 14.495 35.182 -22.957 1.00 0.00 C ATOM 33 C ALA A 3 14.264 33.678 -23.287 1.00 0.00 C ATOM 34 O ALA A 3 13.148 33.203 -23.087 1.00 0.00 O ATOM 35 CB ALA A 3 13.558 36.039 -23.812 1.00 0.00 C ATOM 0 H ALA A 3 16.293 35.469 -23.988 1.00 0.00 H new ATOM 0 HA ALA A 3 14.306 35.206 -21.884 1.00 0.00 H new ATOM 0 HB1 ALA A 3 12.540 35.659 -23.729 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.589 37.071 -23.463 1.00 0.00 H new ATOM 0 HB3 ALA A 3 13.877 35.998 -24.854 1.00 0.00 H new ATOM 41 N ASP A 4 15.174 32.853 -23.815 1.00 0.00 N ATOM 42 CA ASP A 4 16.610 33.033 -24.080 1.00 0.00 C ATOM 43 C ASP A 4 16.922 33.851 -25.346 1.00 0.00 C ATOM 44 O ASP A 4 17.966 34.503 -25.398 1.00 0.00 O ATOM 45 CB ASP A 4 17.268 31.649 -24.186 1.00 0.00 C ATOM 46 CG ASP A 4 17.294 30.915 -22.836 1.00 0.00 C ATOM 47 OD1 ASP A 4 18.072 31.325 -21.942 1.00 0.00 O ATOM 48 OD2 ASP A 4 16.542 29.924 -22.667 1.00 0.00 O ATOM 0 H ASP A 4 14.884 31.919 -24.106 1.00 0.00 H new ATOM 0 HA ASP A 4 17.014 33.609 -23.247 1.00 0.00 H new ATOM 0 HB2 ASP A 4 16.727 31.046 -24.915 1.00 0.00 H new ATOM 0 HB3 ASP A 4 18.287 31.760 -24.557 1.00 0.00 H new ATOM 53 N ARG A 5 16.012 33.883 -26.327 1.00 0.00 N ATOM 54 CA ARG A 5 16.213 34.509 -27.652 1.00 0.00 C ATOM 55 C ARG A 5 15.001 35.307 -28.150 1.00 0.00 C ATOM 56 O ARG A 5 13.867 35.034 -27.762 1.00 0.00 O ATOM 57 CB ARG A 5 16.660 33.432 -28.666 1.00 0.00 C ATOM 58 CG ARG A 5 15.616 32.323 -28.913 1.00 0.00 C ATOM 59 CD ARG A 5 16.134 31.236 -29.864 1.00 0.00 C ATOM 60 NE ARG A 5 16.337 31.734 -31.242 1.00 0.00 N ATOM 61 CZ ARG A 5 16.839 31.054 -32.259 1.00 0.00 C ATOM 62 NH1 ARG A 5 17.225 29.814 -32.142 1.00 0.00 N ATOM 63 NH2 ARG A 5 16.964 31.612 -33.429 1.00 0.00 N ATOM 0 H ARG A 5 15.088 33.464 -26.224 1.00 0.00 H new ATOM 0 HA ARG A 5 17.002 35.253 -27.547 1.00 0.00 H new ATOM 0 HB2 ARG A 5 16.891 33.916 -29.615 1.00 0.00 H new ATOM 0 HB3 ARG A 5 17.583 32.974 -28.309 1.00 0.00 H new ATOM 0 HG2 ARG A 5 15.340 31.869 -27.961 1.00 0.00 H new ATOM 0 HG3 ARG A 5 14.711 32.765 -29.329 1.00 0.00 H new ATOM 0 HD2 ARG A 5 17.076 30.843 -29.481 1.00 0.00 H new ATOM 0 HD3 ARG A 5 15.426 30.407 -29.882 1.00 0.00 H new ATOM 0 HE ARG A 5 16.062 32.699 -31.426 1.00 0.00 H new ATOM 0 HH11 ARG A 5 17.144 29.337 -31.244 1.00 0.00 H new ATOM 0 HH12 ARG A 5 17.608 29.321 -32.949 1.00 0.00 H new ATOM 0 HH21 ARG A 5 16.674 32.580 -33.566 1.00 0.00 H new ATOM 0 HH22 ARG A 5 17.352 31.081 -34.208 1.00 0.00 H new ATOM 77 N VAL A 6 15.255 36.292 -29.020 1.00 0.00 N ATOM 78 CA VAL A 6 14.265 37.147 -29.726 1.00 0.00 C ATOM 79 C VAL A 6 13.236 37.829 -28.793 1.00 0.00 C ATOM 80 O VAL A 6 12.123 38.160 -29.202 1.00 0.00 O ATOM 81 CB VAL A 6 13.614 36.403 -30.926 1.00 0.00 C ATOM 82 CG1 VAL A 6 13.163 37.372 -32.030 1.00 0.00 C ATOM 83 CG2 VAL A 6 14.560 35.408 -31.621 1.00 0.00 C ATOM 0 H VAL A 6 16.213 36.537 -29.272 1.00 0.00 H new ATOM 0 HA VAL A 6 14.832 37.980 -30.142 1.00 0.00 H new ATOM 0 HB VAL A 6 12.773 35.877 -30.473 1.00 0.00 H new ATOM 0 HG11 VAL A 6 12.714 36.808 -32.848 1.00 0.00 H new ATOM 0 HG12 VAL A 6 12.430 38.069 -31.625 1.00 0.00 H new ATOM 0 HG13 VAL A 6 14.025 37.927 -32.402 1.00 0.00 H new ATOM 0 HG21 VAL A 6 14.038 34.927 -32.448 1.00 0.00 H new ATOM 0 HG22 VAL A 6 15.431 35.940 -32.003 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.882 34.651 -30.905 1.00 0.00 H new ATOM 93 N LEU A 7 13.584 38.003 -27.510 1.00 0.00 N ATOM 94 CA LEU A 7 12.701 38.402 -26.393 1.00 0.00 C ATOM 95 C LEU A 7 11.466 37.492 -26.156 1.00 0.00 C ATOM 96 O LEU A 7 10.620 37.814 -25.318 1.00 0.00 O ATOM 97 CB LEU A 7 12.337 39.901 -26.500 1.00 0.00 C ATOM 98 CG LEU A 7 13.529 40.872 -26.616 1.00 0.00 C ATOM 99 CD1 LEU A 7 13.011 42.307 -26.720 1.00 0.00 C ATOM 100 CD2 LEU A 7 14.473 40.794 -25.413 1.00 0.00 C ATOM 0 H LEU A 7 14.546 37.862 -27.201 1.00 0.00 H new ATOM 0 HA LEU A 7 13.286 38.249 -25.486 1.00 0.00 H new ATOM 0 HB2 LEU A 7 11.694 40.039 -27.369 1.00 0.00 H new ATOM 0 HB3 LEU A 7 11.751 40.177 -25.623 1.00 0.00 H new ATOM 0 HG LEU A 7 14.086 40.582 -27.507 1.00 0.00 H new ATOM 0 HD11 LEU A 7 13.854 42.993 -26.802 1.00 0.00 H new ATOM 0 HD12 LEU A 7 12.378 42.402 -27.602 1.00 0.00 H new ATOM 0 HD13 LEU A 7 12.431 42.550 -25.830 1.00 0.00 H new ATOM 0 HD21 LEU A 7 15.294 41.499 -25.548 1.00 0.00 H new ATOM 0 HD22 LEU A 7 13.926 41.044 -24.504 1.00 0.00 H new ATOM 0 HD23 LEU A 7 14.873 39.783 -25.329 1.00 0.00 H new ATOM 112 N ARG A 8 11.355 36.356 -26.866 1.00 0.00 N ATOM 113 CA ARG A 8 10.176 35.461 -26.940 1.00 0.00 C ATOM 114 C ARG A 8 10.585 33.973 -26.970 1.00 0.00 C ATOM 115 O ARG A 8 9.997 33.157 -27.682 1.00 0.00 O ATOM 116 CB ARG A 8 9.324 35.869 -28.168 1.00 0.00 C ATOM 117 CG ARG A 8 8.480 37.138 -27.933 1.00 0.00 C ATOM 118 CD ARG A 8 8.143 37.866 -29.239 1.00 0.00 C ATOM 119 NE ARG A 8 9.341 38.540 -29.774 1.00 0.00 N ATOM 120 CZ ARG A 8 9.400 39.552 -30.615 1.00 0.00 C ATOM 121 NH1 ARG A 8 8.343 40.056 -31.188 1.00 0.00 N ATOM 122 NH2 ARG A 8 10.559 40.076 -30.883 1.00 0.00 N ATOM 0 H ARG A 8 12.127 36.014 -27.438 1.00 0.00 H new ATOM 0 HA ARG A 8 9.573 35.575 -26.039 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.983 36.033 -29.020 1.00 0.00 H new ATOM 0 HB3 ARG A 8 8.661 35.045 -28.431 1.00 0.00 H new ATOM 0 HG2 ARG A 8 7.556 36.867 -27.422 1.00 0.00 H new ATOM 0 HG3 ARG A 8 9.022 37.815 -27.273 1.00 0.00 H new ATOM 0 HD2 ARG A 8 7.760 37.155 -29.971 1.00 0.00 H new ATOM 0 HD3 ARG A 8 7.354 38.597 -29.062 1.00 0.00 H new ATOM 0 HE ARG A 8 10.238 38.176 -29.452 1.00 0.00 H new ATOM 0 HH11 ARG A 8 7.421 39.666 -30.991 1.00 0.00 H new ATOM 0 HH12 ARG A 8 8.438 40.841 -31.833 1.00 0.00 H new ATOM 0 HH21 ARG A 8 11.401 39.703 -30.445 1.00 0.00 H new ATOM 0 HH22 ARG A 8 10.626 40.860 -31.532 1.00 0.00 H new ATOM 136 N GLY A 9 11.595 33.610 -26.177 1.00 0.00 N ATOM 137 CA GLY A 9 12.150 32.249 -26.089 1.00 0.00 C ATOM 138 C GLY A 9 11.455 31.315 -25.084 1.00 0.00 C ATOM 139 O GLY A 9 11.874 30.165 -24.933 1.00 0.00 O ATOM 0 H GLY A 9 12.066 34.270 -25.559 1.00 0.00 H new ATOM 0 HA2 GLY A 9 12.102 31.791 -27.077 1.00 0.00 H new ATOM 0 HA3 GLY A 9 13.204 32.322 -25.822 1.00 0.00 H new ATOM 143 N SER A 10 10.417 31.790 -24.385 1.00 0.00 N ATOM 144 CA SER A 10 9.695 31.037 -23.347 1.00 0.00 C ATOM 145 C SER A 10 8.881 29.856 -23.904 1.00 0.00 C ATOM 146 O SER A 10 8.433 29.866 -25.056 1.00 0.00 O ATOM 147 CB SER A 10 8.787 31.989 -22.559 1.00 0.00 C ATOM 148 OG SER A 10 8.156 31.306 -21.487 1.00 0.00 O ATOM 0 H SER A 10 10.046 32.729 -24.527 1.00 0.00 H new ATOM 0 HA SER A 10 10.446 30.602 -22.688 1.00 0.00 H new ATOM 0 HB2 SER A 10 9.374 32.822 -22.171 1.00 0.00 H new ATOM 0 HB3 SER A 10 8.032 32.412 -23.222 1.00 0.00 H new ATOM 0 HG SER A 10 7.582 31.929 -20.995 1.00 0.00 H new ATOM 154 N ARG A 11 8.644 28.848 -23.052 1.00 0.00 N ATOM 155 CA ARG A 11 7.738 27.709 -23.302 1.00 0.00 C ATOM 156 C ARG A 11 6.250 28.101 -23.220 1.00 0.00 C ATOM 157 O ARG A 11 5.391 27.361 -23.703 1.00 0.00 O ATOM 158 CB ARG A 11 8.116 26.581 -22.320 1.00 0.00 C ATOM 159 CG ARG A 11 7.452 25.229 -22.635 1.00 0.00 C ATOM 160 CD ARG A 11 8.020 24.090 -21.776 1.00 0.00 C ATOM 161 NE ARG A 11 7.696 24.254 -20.342 1.00 0.00 N ATOM 162 CZ ARG A 11 8.158 23.524 -19.341 1.00 0.00 C ATOM 163 NH1 ARG A 11 8.982 22.532 -19.528 1.00 0.00 N ATOM 164 NH2 ARG A 11 7.793 23.779 -18.117 1.00 0.00 N ATOM 0 H ARG A 11 9.092 28.798 -22.137 1.00 0.00 H new ATOM 0 HA ARG A 11 7.866 27.358 -24.326 1.00 0.00 H new ATOM 0 HB2 ARG A 11 9.198 26.453 -22.328 1.00 0.00 H new ATOM 0 HB3 ARG A 11 7.839 26.884 -21.310 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.378 25.306 -22.469 1.00 0.00 H new ATOM 0 HG3 ARG A 11 7.595 24.993 -23.689 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.623 23.138 -22.130 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.102 24.050 -21.900 1.00 0.00 H new ATOM 0 HE ARG A 11 7.051 25.006 -20.101 1.00 0.00 H new ATOM 0 HH11 ARG A 11 9.291 22.297 -20.471 1.00 0.00 H new ATOM 0 HH12 ARG A 11 9.318 21.991 -18.731 1.00 0.00 H new ATOM 0 HH21 ARG A 11 7.147 24.545 -17.926 1.00 0.00 H new ATOM 0 HH22 ARG A 11 8.153 23.212 -17.349 1.00 0.00 H new ATOM 178 N LEU A 12 5.937 29.265 -22.637 1.00 0.00 N ATOM 179 CA LEU A 12 4.583 29.824 -22.533 1.00 0.00 C ATOM 180 C LEU A 12 3.942 30.051 -23.919 1.00 0.00 C ATOM 181 O LEU A 12 4.604 30.507 -24.853 1.00 0.00 O ATOM 182 CB LEU A 12 4.669 31.134 -21.720 1.00 0.00 C ATOM 183 CG LEU A 12 3.327 31.840 -21.440 1.00 0.00 C ATOM 184 CD1 LEU A 12 2.398 31.000 -20.560 1.00 0.00 C ATOM 185 CD2 LEU A 12 3.583 33.167 -20.726 1.00 0.00 C ATOM 0 H LEU A 12 6.644 29.864 -22.210 1.00 0.00 H new ATOM 0 HA LEU A 12 3.933 29.114 -22.022 1.00 0.00 H new ATOM 0 HB2 LEU A 12 5.149 30.916 -20.766 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.319 31.828 -22.253 1.00 0.00 H new ATOM 0 HG LEU A 12 2.844 31.995 -22.405 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.467 31.542 -20.393 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.183 30.054 -21.057 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.881 30.805 -19.603 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.633 33.664 -20.529 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.096 32.980 -19.783 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.203 33.805 -21.356 1.00 0.00 H new ATOM 197 N GLY A 13 2.635 29.789 -24.036 1.00 0.00 N ATOM 198 CA GLY A 13 1.829 29.951 -25.259 1.00 0.00 C ATOM 199 C GLY A 13 1.497 31.403 -25.639 1.00 0.00 C ATOM 200 O GLY A 13 0.363 31.698 -26.017 1.00 0.00 O ATOM 0 H GLY A 13 2.084 29.444 -23.250 1.00 0.00 H new ATOM 0 HA2 GLY A 13 2.362 29.488 -26.090 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.895 29.403 -25.134 1.00 0.00 H new ATOM 204 N ALA A 14 2.463 32.320 -25.525 1.00 0.00 N ATOM 205 CA ALA A 14 2.330 33.759 -25.784 1.00 0.00 C ATOM 206 C ALA A 14 2.351 34.103 -27.296 1.00 0.00 C ATOM 207 O ALA A 14 3.149 34.922 -27.764 1.00 0.00 O ATOM 208 CB ALA A 14 3.401 34.488 -24.958 1.00 0.00 C ATOM 0 H ALA A 14 3.407 32.067 -25.235 1.00 0.00 H new ATOM 0 HA ALA A 14 1.348 34.107 -25.464 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.326 35.562 -25.131 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.248 34.280 -23.899 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.390 34.141 -25.257 1.00 0.00 H new ATOM 214 N VAL A 15 1.492 33.438 -28.075 1.00 0.00 N ATOM 215 CA VAL A 15 1.383 33.575 -29.541 1.00 0.00 C ATOM 216 C VAL A 15 0.753 34.911 -29.964 1.00 0.00 C ATOM 217 O VAL A 15 -0.002 35.525 -29.204 1.00 0.00 O ATOM 218 CB VAL A 15 0.637 32.375 -30.167 1.00 0.00 C ATOM 219 CG1 VAL A 15 1.353 31.058 -29.839 1.00 0.00 C ATOM 220 CG2 VAL A 15 -0.825 32.260 -29.713 1.00 0.00 C ATOM 0 H VAL A 15 0.828 32.764 -27.694 1.00 0.00 H new ATOM 0 HA VAL A 15 2.401 33.575 -29.930 1.00 0.00 H new ATOM 0 HB VAL A 15 0.641 32.559 -31.241 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.810 30.227 -30.290 1.00 0.00 H new ATOM 0 HG12 VAL A 15 2.368 31.087 -30.236 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.390 30.923 -28.758 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -1.288 31.396 -30.191 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.861 32.138 -28.630 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -1.366 33.164 -29.995 1.00 0.00 H new ATOM 230 N SER A 16 1.058 35.365 -31.185 1.00 0.00 N ATOM 231 CA SER A 16 0.609 36.660 -31.738 1.00 0.00 C ATOM 232 C SER A 16 0.184 36.566 -33.220 1.00 0.00 C ATOM 233 O SER A 16 0.378 37.485 -34.021 1.00 0.00 O ATOM 234 CB SER A 16 1.688 37.726 -31.484 1.00 0.00 C ATOM 235 OG SER A 16 1.127 39.032 -31.483 1.00 0.00 O ATOM 0 H SER A 16 1.637 34.834 -31.836 1.00 0.00 H new ATOM 0 HA SER A 16 -0.299 36.963 -31.216 1.00 0.00 H new ATOM 0 HB2 SER A 16 2.174 37.535 -30.527 1.00 0.00 H new ATOM 0 HB3 SER A 16 2.458 37.658 -32.252 1.00 0.00 H new ATOM 0 HG SER A 16 1.833 39.691 -31.318 1.00 0.00 H new ATOM 241 N TYR A 17 -0.347 35.403 -33.607 1.00 0.00 N ATOM 242 CA TYR A 17 -0.661 35.004 -34.986 1.00 0.00 C ATOM 243 C TYR A 17 -1.752 33.918 -35.016 1.00 0.00 C ATOM 244 O TYR A 17 -2.100 33.337 -33.985 1.00 0.00 O ATOM 245 CB TYR A 17 0.631 34.521 -35.678 1.00 0.00 C ATOM 246 CG TYR A 17 1.436 33.505 -34.884 1.00 0.00 C ATOM 247 CD1 TYR A 17 1.177 32.127 -35.018 1.00 0.00 C ATOM 248 CD2 TYR A 17 2.430 33.949 -33.989 1.00 0.00 C ATOM 249 CE1 TYR A 17 1.909 31.195 -34.257 1.00 0.00 C ATOM 250 CE2 TYR A 17 3.142 33.024 -33.204 1.00 0.00 C ATOM 251 CZ TYR A 17 2.892 31.641 -33.345 1.00 0.00 C ATOM 252 OH TYR A 17 3.605 30.749 -32.606 1.00 0.00 O ATOM 0 H TYR A 17 -0.583 34.675 -32.933 1.00 0.00 H new ATOM 0 HA TYR A 17 -1.055 35.864 -35.528 1.00 0.00 H new ATOM 0 HB2 TYR A 17 0.369 34.084 -36.641 1.00 0.00 H new ATOM 0 HB3 TYR A 17 1.263 35.386 -35.882 1.00 0.00 H new ATOM 0 HD1 TYR A 17 0.417 31.785 -35.705 1.00 0.00 H new ATOM 0 HD2 TYR A 17 2.646 35.004 -33.905 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.719 30.138 -34.371 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.879 33.371 -32.495 1.00 0.00 H new ATOM 0 HH TYR A 17 4.238 31.231 -32.033 1.00 0.00 H new ATOM 262 N GLU A 18 -2.305 33.637 -36.200 1.00 0.00 N ATOM 263 CA GLU A 18 -3.359 32.633 -36.395 1.00 0.00 C ATOM 264 C GLU A 18 -2.816 31.203 -36.202 1.00 0.00 C ATOM 265 O GLU A 18 -2.118 30.656 -37.061 1.00 0.00 O ATOM 266 CB GLU A 18 -4.009 32.839 -37.774 1.00 0.00 C ATOM 267 CG GLU A 18 -5.239 31.944 -37.980 1.00 0.00 C ATOM 268 CD GLU A 18 -5.903 32.224 -39.343 1.00 0.00 C ATOM 269 OE1 GLU A 18 -5.531 31.577 -40.353 1.00 0.00 O ATOM 270 OE2 GLU A 18 -6.808 33.092 -39.416 1.00 0.00 O ATOM 0 H GLU A 18 -2.030 34.106 -37.063 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.129 32.764 -35.635 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.301 33.884 -37.883 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.276 32.630 -38.553 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.944 30.896 -37.923 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.958 32.117 -37.179 1.00 0.00 H new ATOM 277 N THR A 19 -3.128 30.600 -35.051 1.00 0.00 N ATOM 278 CA THR A 19 -2.752 29.227 -34.667 1.00 0.00 C ATOM 279 C THR A 19 -3.733 28.649 -33.631 1.00 0.00 C ATOM 280 O THR A 19 -4.556 29.379 -33.069 1.00 0.00 O ATOM 281 CB THR A 19 -1.299 29.202 -34.152 1.00 0.00 C ATOM 282 OG1 THR A 19 -0.812 27.877 -34.091 1.00 0.00 O ATOM 283 CG2 THR A 19 -1.107 29.836 -32.772 1.00 0.00 C ATOM 0 H THR A 19 -3.672 31.071 -34.328 1.00 0.00 H new ATOM 0 HA THR A 19 -2.811 28.590 -35.549 1.00 0.00 H new ATOM 0 HB THR A 19 -0.742 29.801 -34.873 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.112 27.883 -33.764 1.00 0.00 H new ATOM 0 HG21 THR A 19 -0.057 29.776 -32.487 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.414 30.881 -32.806 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.713 29.303 -32.039 1.00 0.00 H new ATOM 291 N ASP A 20 -3.663 27.342 -33.367 1.00 0.00 N ATOM 292 CA ASP A 20 -4.456 26.640 -32.345 1.00 0.00 C ATOM 293 C ASP A 20 -3.644 25.512 -31.671 1.00 0.00 C ATOM 294 O ASP A 20 -2.700 24.973 -32.259 1.00 0.00 O ATOM 295 CB ASP A 20 -5.758 26.113 -32.977 1.00 0.00 C ATOM 296 CG ASP A 20 -6.786 25.606 -31.951 1.00 0.00 C ATOM 297 OD1 ASP A 20 -6.675 25.937 -30.745 1.00 0.00 O ATOM 298 OD2 ASP A 20 -7.732 24.894 -32.360 1.00 0.00 O ATOM 0 H ASP A 20 -3.033 26.719 -33.873 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.715 27.344 -31.554 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.211 26.908 -33.569 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.515 25.303 -33.665 1.00 0.00 H new ATOM 303 N ARG A 21 -3.998 25.173 -30.423 1.00 0.00 N ATOM 304 CA ARG A 21 -3.213 24.311 -29.514 1.00 0.00 C ATOM 305 C ARG A 21 -4.040 23.282 -28.725 1.00 0.00 C ATOM 306 O ARG A 21 -3.471 22.302 -28.245 1.00 0.00 O ATOM 307 CB ARG A 21 -2.396 25.250 -28.596 1.00 0.00 C ATOM 308 CG ARG A 21 -1.331 24.567 -27.715 1.00 0.00 C ATOM 309 CD ARG A 21 -1.810 24.316 -26.278 1.00 0.00 C ATOM 310 NE ARG A 21 -0.781 23.615 -25.484 1.00 0.00 N ATOM 311 CZ ARG A 21 -0.853 23.290 -24.206 1.00 0.00 C ATOM 312 NH1 ARG A 21 -1.889 23.585 -23.470 1.00 0.00 N ATOM 313 NH2 ARG A 21 0.128 22.652 -23.632 1.00 0.00 N ATOM 0 H ARG A 21 -4.867 25.500 -30.000 1.00 0.00 H new ATOM 0 HA ARG A 21 -2.557 23.678 -30.111 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -1.902 25.996 -29.218 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -3.089 25.785 -27.947 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -1.047 23.617 -28.168 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -0.436 25.188 -27.690 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -2.054 25.266 -25.803 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -2.725 23.724 -26.296 1.00 0.00 H new ATOM 0 HE ARG A 21 0.075 23.355 -25.974 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -2.680 24.083 -23.879 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.908 23.317 -22.486 1.00 0.00 H new ATOM 0 HH21 ARG A 21 0.957 22.401 -24.170 1.00 0.00 H new ATOM 0 HH22 ARG A 21 0.066 22.404 -22.645 1.00 0.00 H new ATOM 327 N ASN A 22 -5.356 23.470 -28.585 1.00 0.00 N ATOM 328 CA ASN A 22 -6.230 22.634 -27.747 1.00 0.00 C ATOM 329 C ASN A 22 -7.533 22.235 -28.474 1.00 0.00 C ATOM 330 O ASN A 22 -8.069 23.016 -29.263 1.00 0.00 O ATOM 331 CB ASN A 22 -6.481 23.386 -26.425 1.00 0.00 C ATOM 332 CG ASN A 22 -7.288 22.582 -25.419 1.00 0.00 C ATOM 333 OD1 ASN A 22 -8.412 22.916 -25.076 1.00 0.00 O ATOM 334 ND2 ASN A 22 -6.742 21.500 -24.908 1.00 0.00 N ATOM 0 H ASN A 22 -5.856 24.222 -29.059 1.00 0.00 H new ATOM 0 HA ASN A 22 -5.739 21.685 -27.530 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -5.523 23.654 -25.980 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -7.005 24.318 -26.639 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -7.257 20.942 -24.227 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -5.804 21.219 -25.193 1.00 0.00 H new ATOM 341 N HIS A 23 -8.030 21.018 -28.202 1.00 0.00 N ATOM 342 CA HIS A 23 -9.072 20.321 -28.988 1.00 0.00 C ATOM 343 C HIS A 23 -8.706 20.183 -30.485 1.00 0.00 C ATOM 344 O HIS A 23 -7.562 20.415 -30.889 1.00 0.00 O ATOM 345 CB HIS A 23 -10.455 20.972 -28.757 1.00 0.00 C ATOM 346 CG HIS A 23 -10.863 21.139 -27.312 1.00 0.00 C ATOM 347 ND1 HIS A 23 -11.450 22.286 -26.767 1.00 0.00 N ATOM 348 CD2 HIS A 23 -10.773 20.187 -26.336 1.00 0.00 C ATOM 349 CE1 HIS A 23 -11.677 22.007 -25.472 1.00 0.00 C ATOM 350 NE2 HIS A 23 -11.284 20.753 -25.188 1.00 0.00 N ATOM 0 H HIS A 23 -7.710 20.470 -27.403 1.00 0.00 H new ATOM 0 HA HIS A 23 -9.131 19.296 -28.622 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -10.459 21.953 -29.233 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.210 20.369 -29.262 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -10.379 19.187 -26.443 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -12.113 22.693 -24.761 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -11.352 20.298 -24.278 1.00 0.00 H new ATOM 358 N ASP A 24 -9.657 19.757 -31.319 1.00 0.00 N ATOM 359 CA ASP A 24 -9.530 19.788 -32.782 1.00 0.00 C ATOM 360 C ASP A 24 -9.509 21.228 -33.337 1.00 0.00 C ATOM 361 O ASP A 24 -9.996 22.167 -32.700 1.00 0.00 O ATOM 362 CB ASP A 24 -10.642 18.950 -33.429 1.00 0.00 C ATOM 363 CG ASP A 24 -12.051 19.511 -33.165 1.00 0.00 C ATOM 364 OD1 ASP A 24 -12.552 19.373 -32.021 1.00 0.00 O ATOM 365 OD2 ASP A 24 -12.669 20.065 -34.105 1.00 0.00 O ATOM 0 H ASP A 24 -10.547 19.377 -30.997 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.568 19.346 -33.042 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -10.473 18.901 -34.505 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -10.587 17.929 -33.050 1.00 0.00 H new ATOM 370 N LEU A 25 -8.936 21.404 -34.530 1.00 0.00 N ATOM 371 CA LEU A 25 -8.706 22.721 -35.136 1.00 0.00 C ATOM 372 C LEU A 25 -10.016 23.304 -35.702 1.00 0.00 C ATOM 373 O LEU A 25 -10.469 22.912 -36.781 1.00 0.00 O ATOM 374 CB LEU A 25 -7.597 22.629 -36.206 1.00 0.00 C ATOM 375 CG LEU A 25 -6.157 22.607 -35.653 1.00 0.00 C ATOM 376 CD1 LEU A 25 -5.791 21.315 -34.918 1.00 0.00 C ATOM 377 CD2 LEU A 25 -5.169 22.770 -36.810 1.00 0.00 C ATOM 0 H LEU A 25 -8.615 20.629 -35.110 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.363 23.410 -34.365 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -7.757 21.727 -36.797 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.697 23.476 -36.885 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.102 23.425 -34.935 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.763 21.379 -34.560 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.462 21.176 -34.071 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.886 20.469 -35.599 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.150 22.755 -36.423 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.300 21.952 -37.519 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.352 23.719 -37.314 1.00 0.00 H new ATOM 389 N ALA A 26 -10.613 24.249 -34.970 1.00 0.00 N ATOM 390 CA ALA A 26 -11.842 24.959 -35.339 1.00 0.00 C ATOM 391 C ALA A 26 -11.899 26.374 -34.711 1.00 0.00 C ATOM 392 O ALA A 26 -11.320 26.581 -33.637 1.00 0.00 O ATOM 393 CB ALA A 26 -13.050 24.123 -34.892 1.00 0.00 C ATOM 0 H ALA A 26 -10.240 24.552 -34.070 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.859 25.090 -36.421 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.971 24.641 -35.161 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -13.023 23.151 -35.385 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.015 23.982 -33.812 1.00 0.00 H new ATOM 399 N PRO A 27 -12.609 27.352 -35.317 1.00 0.00 N ATOM 400 CA PRO A 27 -12.755 28.696 -34.766 1.00 0.00 C ATOM 401 C PRO A 27 -13.627 28.699 -33.503 1.00 0.00 C ATOM 402 O PRO A 27 -14.748 28.179 -33.486 1.00 0.00 O ATOM 403 CB PRO A 27 -13.350 29.571 -35.880 1.00 0.00 C ATOM 404 CG PRO A 27 -13.157 28.739 -37.146 1.00 0.00 C ATOM 405 CD PRO A 27 -13.256 27.314 -36.616 1.00 0.00 C ATOM 0 HA PRO A 27 -11.789 29.090 -34.450 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -14.403 29.785 -35.700 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -12.837 30.530 -35.951 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -13.923 28.950 -37.892 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -12.193 28.932 -37.616 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -14.295 26.996 -36.531 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.761 26.609 -37.284 1.00 0.00 H new ATOM 413 N ARG A 28 -13.094 29.300 -32.440 1.00 0.00 N ATOM 414 CA ARG A 28 -13.741 29.481 -31.130 1.00 0.00 C ATOM 415 C ARG A 28 -13.453 30.844 -30.480 1.00 0.00 C ATOM 416 O ARG A 28 -12.549 31.568 -30.895 1.00 0.00 O ATOM 417 CB ARG A 28 -13.395 28.281 -30.235 1.00 0.00 C ATOM 418 CG ARG A 28 -11.911 28.173 -29.862 1.00 0.00 C ATOM 419 CD ARG A 28 -11.669 26.984 -28.922 1.00 0.00 C ATOM 420 NE ARG A 28 -11.840 25.688 -29.609 1.00 0.00 N ATOM 421 CZ ARG A 28 -10.961 25.069 -30.382 1.00 0.00 C ATOM 422 NH1 ARG A 28 -9.764 25.533 -30.572 1.00 0.00 N ATOM 423 NH2 ARG A 28 -11.286 23.964 -30.981 1.00 0.00 N ATOM 0 H ARG A 28 -12.154 29.695 -32.464 1.00 0.00 H new ATOM 0 HA ARG A 28 -14.821 29.503 -31.276 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -13.983 28.345 -29.319 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -13.696 27.365 -30.744 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -11.312 28.056 -30.765 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -11.585 29.095 -29.381 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -10.661 27.046 -28.512 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -12.359 27.041 -28.081 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.735 25.217 -29.473 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -9.475 26.400 -30.119 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -9.112 25.030 -31.174 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.219 23.572 -30.856 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -10.608 23.488 -31.576 1.00 0.00 H new ATOM 437 N GLN A 29 -14.245 31.183 -29.465 1.00 0.00 N ATOM 438 CA GLN A 29 -14.291 32.468 -28.761 1.00 0.00 C ATOM 439 C GLN A 29 -14.207 32.233 -27.249 1.00 0.00 C ATOM 440 O GLN A 29 -15.180 31.849 -26.601 1.00 0.00 O ATOM 441 CB GLN A 29 -15.599 33.216 -29.077 1.00 0.00 C ATOM 442 CG GLN A 29 -15.897 33.436 -30.569 1.00 0.00 C ATOM 443 CD GLN A 29 -17.269 32.896 -30.951 1.00 0.00 C ATOM 444 OE1 GLN A 29 -18.124 33.594 -31.477 1.00 0.00 O ATOM 445 NE2 GLN A 29 -17.503 31.629 -30.685 1.00 0.00 N ATOM 0 H GLN A 29 -14.921 30.521 -29.084 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.446 33.070 -29.094 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -16.428 32.662 -28.638 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -15.568 34.188 -28.584 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.848 34.501 -30.798 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -15.132 32.945 -31.170 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -16.781 31.058 -30.246 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -18.407 31.217 -30.918 1.00 0.00 H new ATOM 454 N ILE A 30 -13.032 32.454 -26.676 1.00 0.00 N ATOM 455 CA ILE A 30 -12.811 32.416 -25.234 1.00 0.00 C ATOM 456 C ILE A 30 -13.243 33.760 -24.641 1.00 0.00 C ATOM 457 O ILE A 30 -12.562 34.778 -24.777 1.00 0.00 O ATOM 458 CB ILE A 30 -11.347 32.056 -24.914 1.00 0.00 C ATOM 459 CG1 ILE A 30 -10.954 30.618 -25.320 1.00 0.00 C ATOM 460 CG2 ILE A 30 -11.094 32.167 -23.396 1.00 0.00 C ATOM 461 CD1 ILE A 30 -11.141 30.182 -26.777 1.00 0.00 C ATOM 0 H ILE A 30 -12.189 32.669 -27.209 1.00 0.00 H new ATOM 0 HA ILE A 30 -13.414 31.633 -24.775 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.748 32.760 -25.492 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.903 30.480 -25.067 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -11.525 29.932 -24.695 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.057 31.911 -23.180 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -11.291 33.188 -23.068 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.755 31.481 -22.866 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.817 29.147 -26.892 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -12.193 30.266 -27.050 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -10.546 30.822 -27.428 1.00 0.00 H new ATOM 473 N ALA A 31 -14.371 33.735 -23.939 1.00 0.00 N ATOM 474 CA ALA A 31 -14.831 34.821 -23.086 1.00 0.00 C ATOM 475 C ALA A 31 -14.435 34.547 -21.629 1.00 0.00 C ATOM 476 O ALA A 31 -14.146 33.409 -21.247 1.00 0.00 O ATOM 477 CB ALA A 31 -16.346 34.965 -23.249 1.00 0.00 C ATOM 0 H ALA A 31 -15.006 32.937 -23.949 1.00 0.00 H new ATOM 0 HA ALA A 31 -14.361 35.760 -23.377 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -16.705 35.776 -22.615 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -16.580 35.187 -24.290 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -16.833 34.034 -22.958 1.00 0.00 H new ATOM 483 N ARG A 32 -14.447 35.586 -20.796 1.00 0.00 N ATOM 484 CA ARG A 32 -14.344 35.466 -19.338 1.00 0.00 C ATOM 485 C ARG A 32 -15.612 35.986 -18.678 1.00 0.00 C ATOM 486 O ARG A 32 -16.319 36.819 -19.246 1.00 0.00 O ATOM 487 CB ARG A 32 -13.067 36.154 -18.826 1.00 0.00 C ATOM 488 CG ARG A 32 -11.866 35.206 -18.942 1.00 0.00 C ATOM 489 CD ARG A 32 -10.520 35.911 -18.719 1.00 0.00 C ATOM 490 NE ARG A 32 -10.059 35.816 -17.321 1.00 0.00 N ATOM 491 CZ ARG A 32 -10.214 36.705 -16.358 1.00 0.00 C ATOM 492 NH1 ARG A 32 -10.835 37.836 -16.511 1.00 0.00 N ATOM 493 NH2 ARG A 32 -9.742 36.490 -15.170 1.00 0.00 N ATOM 0 H ARG A 32 -14.530 36.551 -21.117 1.00 0.00 H new ATOM 0 HA ARG A 32 -14.255 34.415 -19.064 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.879 37.061 -19.401 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.201 36.457 -17.787 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -11.973 34.402 -18.214 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -11.869 34.744 -19.929 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -9.770 35.472 -19.377 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -10.612 36.961 -18.997 1.00 0.00 H new ATOM 0 HE ARG A 32 -9.561 34.962 -17.069 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -11.237 38.079 -17.417 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -10.921 38.481 -15.726 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -9.242 35.624 -14.969 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -9.870 37.187 -14.436 1.00 0.00 H new ATOM 507 N TYR A 33 -15.878 35.504 -17.468 1.00 0.00 N ATOM 508 CA TYR A 33 -17.006 35.939 -16.640 1.00 0.00 C ATOM 509 C TYR A 33 -16.620 36.034 -15.154 1.00 0.00 C ATOM 510 O TYR A 33 -15.909 35.171 -14.639 1.00 0.00 O ATOM 511 CB TYR A 33 -18.201 35.003 -16.827 1.00 0.00 C ATOM 512 CG TYR A 33 -18.791 34.932 -18.219 1.00 0.00 C ATOM 513 CD1 TYR A 33 -18.201 34.125 -19.210 1.00 0.00 C ATOM 514 CD2 TYR A 33 -19.965 35.646 -18.505 1.00 0.00 C ATOM 515 CE1 TYR A 33 -18.809 34.010 -20.474 1.00 0.00 C ATOM 516 CE2 TYR A 33 -20.568 35.541 -19.766 1.00 0.00 C ATOM 517 CZ TYR A 33 -20.015 34.691 -20.739 1.00 0.00 C ATOM 518 OH TYR A 33 -20.681 34.495 -21.901 1.00 0.00 O ATOM 0 H TYR A 33 -15.306 34.786 -17.024 1.00 0.00 H new ATOM 0 HA TYR A 33 -17.289 36.939 -16.969 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -17.897 33.998 -16.534 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -18.987 35.312 -16.138 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -17.283 33.595 -19.001 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -20.406 36.280 -17.750 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -18.352 33.401 -21.240 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -21.457 36.113 -19.990 1.00 0.00 H new ATOM 0 HH TYR A 33 -21.357 35.195 -22.013 1.00 0.00 H new ATOM 528 N ARG A 34 -17.096 37.081 -14.464 1.00 0.00 N ATOM 529 CA ARG A 34 -16.858 37.354 -13.036 1.00 0.00 C ATOM 530 C ARG A 34 -18.084 37.027 -12.185 1.00 0.00 C ATOM 531 O ARG A 34 -19.161 37.568 -12.433 1.00 0.00 O ATOM 532 CB ARG A 34 -16.430 38.821 -12.864 1.00 0.00 C ATOM 533 CG ARG A 34 -16.137 39.162 -11.394 1.00 0.00 C ATOM 534 CD ARG A 34 -15.246 40.398 -11.247 1.00 0.00 C ATOM 535 NE ARG A 34 -15.844 41.613 -11.838 1.00 0.00 N ATOM 536 CZ ARG A 34 -15.267 42.462 -12.672 1.00 0.00 C ATOM 537 NH1 ARG A 34 -14.097 42.260 -13.208 1.00 0.00 N ATOM 538 NH2 ARG A 34 -15.879 43.566 -12.995 1.00 0.00 N ATOM 0 H ARG A 34 -17.682 37.791 -14.903 1.00 0.00 H new ATOM 0 HA ARG A 34 -16.056 36.705 -12.684 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -15.542 39.013 -13.466 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -17.217 39.475 -13.239 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -17.077 39.331 -10.869 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -15.653 38.310 -10.916 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -15.049 40.574 -10.189 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -14.284 40.205 -11.722 1.00 0.00 H new ATOM 0 HE ARG A 34 -16.807 41.820 -11.574 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -13.576 41.410 -12.990 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -13.702 42.951 -13.845 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -16.799 43.772 -12.605 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -15.438 44.224 -13.638 1.00 0.00 H new ATOM 552 N THR A 35 -17.913 36.169 -11.184 1.00 0.00 N ATOM 553 CA THR A 35 -18.961 35.744 -10.238 1.00 0.00 C ATOM 554 C THR A 35 -19.235 36.811 -9.178 1.00 0.00 C ATOM 555 O THR A 35 -18.555 37.836 -9.102 1.00 0.00 O ATOM 556 CB THR A 35 -18.613 34.437 -9.516 1.00 0.00 C ATOM 557 OG1 THR A 35 -17.474 34.618 -8.729 1.00 0.00 O ATOM 558 CG2 THR A 35 -18.379 33.276 -10.462 1.00 0.00 C ATOM 0 H THR A 35 -17.012 35.730 -10.995 1.00 0.00 H new ATOM 0 HA THR A 35 -19.849 35.587 -10.850 1.00 0.00 H new ATOM 0 HB THR A 35 -19.476 34.186 -8.899 1.00 0.00 H new ATOM 0 HG1 THR A 35 -16.701 34.788 -9.307 1.00 0.00 H new ATOM 0 HG21 THR A 35 -18.137 32.382 -9.888 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.280 33.098 -11.049 1.00 0.00 H new ATOM 0 HG23 THR A 35 -17.551 33.513 -11.131 1.00 0.00 H new ATOM 566 N ASP A 36 -20.200 36.547 -8.297 1.00 0.00 N ATOM 567 CA ASP A 36 -20.598 37.500 -7.263 1.00 0.00 C ATOM 568 C ASP A 36 -19.581 37.629 -6.111 1.00 0.00 C ATOM 569 O ASP A 36 -19.604 38.635 -5.399 1.00 0.00 O ATOM 570 CB ASP A 36 -22.001 37.134 -6.762 1.00 0.00 C ATOM 571 CG ASP A 36 -22.612 38.220 -5.857 1.00 0.00 C ATOM 572 OD1 ASP A 36 -22.880 39.341 -6.353 1.00 0.00 O ATOM 573 OD2 ASP A 36 -22.866 37.943 -4.660 1.00 0.00 O ATOM 0 H ASP A 36 -20.724 35.672 -8.280 1.00 0.00 H new ATOM 0 HA ASP A 36 -20.619 38.492 -7.713 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -22.656 36.969 -7.617 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -21.952 36.194 -6.212 1.00 0.00 H new ATOM 578 N ASN A 37 -18.640 36.681 -5.961 1.00 0.00 N ATOM 579 CA ASN A 37 -17.530 36.843 -5.003 1.00 0.00 C ATOM 580 C ASN A 37 -16.303 37.556 -5.625 1.00 0.00 C ATOM 581 O ASN A 37 -15.266 37.692 -4.971 1.00 0.00 O ATOM 582 CB ASN A 37 -17.129 35.510 -4.361 1.00 0.00 C ATOM 583 CG ASN A 37 -18.251 34.549 -4.014 1.00 0.00 C ATOM 584 OD1 ASN A 37 -19.330 34.906 -3.560 1.00 0.00 O ATOM 585 ND2 ASN A 37 -17.994 33.277 -4.198 1.00 0.00 N ATOM 0 H ASN A 37 -18.624 35.805 -6.483 1.00 0.00 H new ATOM 0 HA ASN A 37 -17.906 37.492 -4.213 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -16.443 35.000 -5.038 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -16.574 35.727 -3.448 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -18.696 32.576 -3.962 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -17.092 32.989 -4.577 1.00 0.00 H new ATOM 592 N GLY A 38 -16.386 37.961 -6.900 1.00 0.00 N ATOM 593 CA GLY A 38 -15.257 38.432 -7.712 1.00 0.00 C ATOM 594 C GLY A 38 -14.423 37.323 -8.351 1.00 0.00 C ATOM 595 O GLY A 38 -13.371 37.613 -8.919 1.00 0.00 O ATOM 0 H GLY A 38 -17.269 37.970 -7.410 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -15.640 39.080 -8.500 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.606 39.042 -7.086 1.00 0.00 H new ATOM 599 N GLU A 39 -14.850 36.061 -8.257 1.00 0.00 N ATOM 600 CA GLU A 39 -14.105 34.929 -8.827 1.00 0.00 C ATOM 601 C GLU A 39 -14.291 34.937 -10.350 1.00 0.00 C ATOM 602 O GLU A 39 -15.421 34.842 -10.832 1.00 0.00 O ATOM 603 CB GLU A 39 -14.554 33.581 -8.223 1.00 0.00 C ATOM 604 CG GLU A 39 -14.919 33.657 -6.735 1.00 0.00 C ATOM 605 CD GLU A 39 -14.687 32.382 -5.905 1.00 0.00 C ATOM 606 OE1 GLU A 39 -13.713 31.627 -6.142 1.00 0.00 O ATOM 607 OE2 GLU A 39 -15.478 32.175 -4.952 1.00 0.00 O ATOM 0 H GLU A 39 -15.715 35.793 -7.788 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.049 35.042 -8.581 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -15.416 33.214 -8.780 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.755 32.851 -8.354 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.345 34.467 -6.284 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -15.971 33.929 -6.655 1.00 0.00 H new ATOM 614 N GLU A 40 -13.210 35.069 -11.113 1.00 0.00 N ATOM 615 CA GLU A 40 -13.255 35.139 -12.581 1.00 0.00 C ATOM 616 C GLU A 40 -12.844 33.809 -13.234 1.00 0.00 C ATOM 617 O GLU A 40 -11.795 33.242 -12.913 1.00 0.00 O ATOM 618 CB GLU A 40 -12.370 36.276 -13.115 1.00 0.00 C ATOM 619 CG GLU A 40 -12.740 37.659 -12.562 1.00 0.00 C ATOM 620 CD GLU A 40 -12.029 38.809 -13.303 1.00 0.00 C ATOM 621 OE1 GLU A 40 -10.905 38.612 -13.825 1.00 0.00 O ATOM 622 OE2 GLU A 40 -12.597 39.923 -13.372 1.00 0.00 O ATOM 0 H GLU A 40 -12.266 35.132 -10.732 1.00 0.00 H new ATOM 0 HA GLU A 40 -14.291 35.344 -12.849 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -11.330 36.062 -12.867 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -12.440 36.299 -14.202 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -13.819 37.798 -12.635 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.484 37.702 -11.503 1.00 0.00 H new ATOM 629 N PHE A 41 -13.660 33.338 -14.182 1.00 0.00 N ATOM 630 CA PHE A 41 -13.463 32.095 -14.938 1.00 0.00 C ATOM 631 C PHE A 41 -13.598 32.312 -16.449 1.00 0.00 C ATOM 632 O PHE A 41 -14.152 33.313 -16.900 1.00 0.00 O ATOM 633 CB PHE A 41 -14.475 31.046 -14.470 1.00 0.00 C ATOM 634 CG PHE A 41 -14.316 30.638 -13.019 1.00 0.00 C ATOM 635 CD1 PHE A 41 -14.969 31.344 -11.988 1.00 0.00 C ATOM 636 CD2 PHE A 41 -13.473 29.558 -12.694 1.00 0.00 C ATOM 637 CE1 PHE A 41 -14.779 30.955 -10.657 1.00 0.00 C ATOM 638 CE2 PHE A 41 -13.275 29.182 -11.354 1.00 0.00 C ATOM 639 CZ PHE A 41 -13.929 29.884 -10.331 1.00 0.00 C ATOM 0 H PHE A 41 -14.510 33.831 -14.455 1.00 0.00 H new ATOM 0 HA PHE A 41 -12.448 31.747 -14.748 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.482 31.436 -14.618 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -14.381 30.160 -15.098 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -15.612 32.179 -12.224 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -12.974 29.013 -13.482 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.293 31.485 -9.869 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -12.622 28.356 -11.113 1.00 0.00 H new ATOM 0 HZ PHE A 41 -13.780 29.603 -9.299 1.00 0.00 H new ATOM 649 N GLU A 42 -13.111 31.358 -17.239 1.00 0.00 N ATOM 650 CA GLU A 42 -13.063 31.409 -18.696 1.00 0.00 C ATOM 651 C GLU A 42 -14.059 30.409 -19.291 1.00 0.00 C ATOM 652 O GLU A 42 -14.110 29.247 -18.871 1.00 0.00 O ATOM 653 CB GLU A 42 -11.642 31.118 -19.219 1.00 0.00 C ATOM 654 CG GLU A 42 -10.495 31.747 -18.405 1.00 0.00 C ATOM 655 CD GLU A 42 -9.866 30.738 -17.417 1.00 0.00 C ATOM 656 OE1 GLU A 42 -10.561 30.268 -16.484 1.00 0.00 O ATOM 657 OE2 GLU A 42 -8.663 30.410 -17.570 1.00 0.00 O ATOM 0 H GLU A 42 -12.723 30.492 -16.864 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.337 32.417 -19.008 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.497 30.038 -19.244 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.572 31.473 -20.247 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.727 32.115 -19.085 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.872 32.608 -17.853 1.00 0.00 H new ATOM 664 N VAL A 43 -14.827 30.843 -20.288 1.00 0.00 N ATOM 665 CA VAL A 43 -15.803 30.011 -21.007 1.00 0.00 C ATOM 666 C VAL A 43 -15.493 30.029 -22.515 1.00 0.00 C ATOM 667 O VAL A 43 -15.675 31.064 -23.164 1.00 0.00 O ATOM 668 CB VAL A 43 -17.250 30.452 -20.728 1.00 0.00 C ATOM 669 CG1 VAL A 43 -18.243 29.462 -21.349 1.00 0.00 C ATOM 670 CG2 VAL A 43 -17.556 30.562 -19.227 1.00 0.00 C ATOM 0 H VAL A 43 -14.791 31.803 -20.630 1.00 0.00 H new ATOM 0 HA VAL A 43 -15.714 28.988 -20.641 1.00 0.00 H new ATOM 0 HB VAL A 43 -17.358 31.440 -21.177 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -19.262 29.790 -21.142 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -18.088 29.419 -22.427 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -18.086 28.472 -20.920 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -18.590 30.877 -19.089 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -17.405 29.592 -18.753 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -16.890 31.295 -18.773 1.00 0.00 H new ATOM 680 N PRO A 44 -15.018 28.909 -23.092 1.00 0.00 N ATOM 681 CA PRO A 44 -14.819 28.762 -24.532 1.00 0.00 C ATOM 682 C PRO A 44 -16.142 28.463 -25.264 1.00 0.00 C ATOM 683 O PRO A 44 -16.832 27.485 -24.965 1.00 0.00 O ATOM 684 CB PRO A 44 -13.789 27.638 -24.685 1.00 0.00 C ATOM 685 CG PRO A 44 -13.997 26.772 -23.441 1.00 0.00 C ATOM 686 CD PRO A 44 -14.494 27.753 -22.377 1.00 0.00 C ATOM 0 HA PRO A 44 -14.460 29.684 -24.990 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -13.953 27.068 -25.600 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.773 28.031 -24.732 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.724 25.981 -23.624 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -13.070 26.288 -23.134 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.267 27.296 -21.759 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -13.683 28.045 -21.709 1.00 0.00 H new ATOM 694 N PHE A 45 -16.468 29.292 -26.257 1.00 0.00 N ATOM 695 CA PHE A 45 -17.634 29.166 -27.146 1.00 0.00 C ATOM 696 C PHE A 45 -17.226 28.815 -28.579 1.00 0.00 C ATOM 697 O PHE A 45 -16.286 29.393 -29.119 1.00 0.00 O ATOM 698 CB PHE A 45 -18.416 30.483 -27.162 1.00 0.00 C ATOM 699 CG PHE A 45 -19.238 30.739 -25.917 1.00 0.00 C ATOM 700 CD1 PHE A 45 -18.642 31.337 -24.791 1.00 0.00 C ATOM 701 CD2 PHE A 45 -20.605 30.401 -25.888 1.00 0.00 C ATOM 702 CE1 PHE A 45 -19.420 31.624 -23.659 1.00 0.00 C ATOM 703 CE2 PHE A 45 -21.377 30.674 -24.744 1.00 0.00 C ATOM 704 CZ PHE A 45 -20.782 31.289 -23.629 1.00 0.00 C ATOM 0 H PHE A 45 -15.901 30.111 -26.477 1.00 0.00 H new ATOM 0 HA PHE A 45 -18.253 28.357 -26.759 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -17.714 31.306 -27.294 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -19.079 30.487 -28.027 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -17.588 31.574 -24.798 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -21.062 29.931 -26.746 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -18.967 32.106 -22.805 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -22.424 30.412 -24.723 1.00 0.00 H new ATOM 0 HZ PHE A 45 -21.372 31.503 -22.750 1.00 0.00 H new ATOM 714 N ALA A 46 -17.978 27.943 -29.240 1.00 0.00 N ATOM 715 CA ALA A 46 -17.773 27.590 -30.649 1.00 0.00 C ATOM 716 C ALA A 46 -18.376 28.649 -31.591 1.00 0.00 C ATOM 717 O ALA A 46 -19.256 29.409 -31.194 1.00 0.00 O ATOM 718 CB ALA A 46 -18.363 26.195 -30.894 1.00 0.00 C ATOM 0 H ALA A 46 -18.761 27.451 -28.810 1.00 0.00 H new ATOM 0 HA ALA A 46 -16.706 27.568 -30.870 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -18.219 25.917 -31.938 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -17.861 25.470 -30.253 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -19.429 26.205 -30.665 1.00 0.00 H new ATOM 724 N ASP A 47 -17.945 28.677 -32.854 1.00 0.00 N ATOM 725 CA ASP A 47 -18.434 29.609 -33.890 1.00 0.00 C ATOM 726 C ASP A 47 -19.950 29.490 -34.169 1.00 0.00 C ATOM 727 O ASP A 47 -20.577 30.423 -34.672 1.00 0.00 O ATOM 728 CB ASP A 47 -17.625 29.361 -35.171 1.00 0.00 C ATOM 729 CG ASP A 47 -17.962 30.355 -36.297 1.00 0.00 C ATOM 730 OD1 ASP A 47 -17.614 31.554 -36.171 1.00 0.00 O ATOM 731 OD2 ASP A 47 -18.534 29.931 -37.330 1.00 0.00 O ATOM 0 H ASP A 47 -17.228 28.039 -33.200 1.00 0.00 H new ATOM 0 HA ASP A 47 -18.291 30.626 -33.524 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.562 29.428 -34.941 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -17.812 28.346 -35.522 1.00 0.00 H new ATOM 736 N ASP A 48 -20.559 28.359 -33.797 1.00 0.00 N ATOM 737 CA ASP A 48 -22.013 28.128 -33.848 1.00 0.00 C ATOM 738 C ASP A 48 -22.794 28.916 -32.769 1.00 0.00 C ATOM 739 O ASP A 48 -24.022 29.024 -32.840 1.00 0.00 O ATOM 740 CB ASP A 48 -22.251 26.618 -33.714 1.00 0.00 C ATOM 741 CG ASP A 48 -23.710 26.211 -33.989 1.00 0.00 C ATOM 742 OD1 ASP A 48 -24.189 26.402 -35.134 1.00 0.00 O ATOM 743 OD2 ASP A 48 -24.369 25.656 -33.076 1.00 0.00 O ATOM 0 H ASP A 48 -20.043 27.554 -33.442 1.00 0.00 H new ATOM 0 HA ASP A 48 -22.393 28.498 -34.800 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -21.596 26.090 -34.407 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -21.975 26.300 -32.709 1.00 0.00 H new ATOM 748 N ALA A 49 -22.091 29.485 -31.782 1.00 0.00 N ATOM 749 CA ALA A 49 -22.632 30.256 -30.659 1.00 0.00 C ATOM 750 C ALA A 49 -22.013 31.667 -30.552 1.00 0.00 C ATOM 751 O ALA A 49 -20.918 31.930 -31.054 1.00 0.00 O ATOM 752 CB ALA A 49 -22.412 29.447 -29.374 1.00 0.00 C ATOM 0 H ALA A 49 -21.074 29.415 -31.745 1.00 0.00 H new ATOM 0 HA ALA A 49 -23.697 30.419 -30.823 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -22.807 30.001 -28.523 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -22.927 28.490 -29.454 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -21.345 29.274 -29.231 1.00 0.00 H new ATOM 758 N GLU A 50 -22.704 32.576 -29.856 1.00 0.00 N ATOM 759 CA GLU A 50 -22.251 33.948 -29.569 1.00 0.00 C ATOM 760 C GLU A 50 -22.439 34.283 -28.083 1.00 0.00 C ATOM 761 O GLU A 50 -23.482 33.984 -27.500 1.00 0.00 O ATOM 762 CB GLU A 50 -23.006 34.967 -30.439 1.00 0.00 C ATOM 763 CG GLU A 50 -22.524 34.955 -31.895 1.00 0.00 C ATOM 764 CD GLU A 50 -23.358 35.858 -32.833 1.00 0.00 C ATOM 765 OE1 GLU A 50 -24.550 36.137 -32.554 1.00 0.00 O ATOM 766 OE2 GLU A 50 -22.829 36.261 -33.898 1.00 0.00 O ATOM 0 H GLU A 50 -23.623 32.374 -29.463 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.189 34.006 -29.808 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.073 34.747 -30.410 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -22.875 35.966 -30.023 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -21.483 35.277 -31.927 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -22.553 33.932 -32.270 1.00 0.00 H new ATOM 773 N ILE A 51 -21.429 34.930 -27.498 1.00 0.00 N ATOM 774 CA ILE A 51 -21.260 35.219 -26.063 1.00 0.00 C ATOM 775 C ILE A 51 -22.470 35.973 -25.491 1.00 0.00 C ATOM 776 O ILE A 51 -22.666 37.148 -25.804 1.00 0.00 O ATOM 777 CB ILE A 51 -19.978 36.049 -25.800 1.00 0.00 C ATOM 778 CG1 ILE A 51 -18.759 35.591 -26.630 1.00 0.00 C ATOM 779 CG2 ILE A 51 -19.628 36.061 -24.299 1.00 0.00 C ATOM 780 CD1 ILE A 51 -18.322 34.139 -26.430 1.00 0.00 C ATOM 0 H ILE A 51 -20.651 35.293 -28.048 1.00 0.00 H new ATOM 0 HA ILE A 51 -21.173 34.255 -25.562 1.00 0.00 H new ATOM 0 HB ILE A 51 -20.211 37.062 -26.128 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -18.986 35.740 -27.686 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -17.916 36.240 -26.391 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.725 36.650 -24.141 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -20.451 36.502 -23.737 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -19.460 35.040 -23.956 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -17.459 33.928 -27.062 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -18.055 33.980 -25.385 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -19.141 33.472 -26.700 1.00 0.00 H new ATOM 792 N PRO A 52 -23.281 35.333 -24.640 1.00 0.00 N ATOM 793 CA PRO A 52 -24.333 35.999 -23.889 1.00 0.00 C ATOM 794 C PRO A 52 -23.737 36.888 -22.789 1.00 0.00 C ATOM 795 O PRO A 52 -22.682 36.577 -22.228 1.00 0.00 O ATOM 796 CB PRO A 52 -25.198 34.867 -23.340 1.00 0.00 C ATOM 797 CG PRO A 52 -24.226 33.699 -23.197 1.00 0.00 C ATOM 798 CD PRO A 52 -23.184 33.931 -24.286 1.00 0.00 C ATOM 0 HA PRO A 52 -24.929 36.677 -24.501 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -25.645 35.134 -22.383 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -26.017 34.625 -24.018 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -23.769 33.683 -22.208 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -24.732 32.743 -23.330 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -22.184 33.688 -23.927 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -23.376 33.296 -25.151 1.00 0.00 H new ATOM 806 N GLY A 53 -24.428 37.983 -22.458 1.00 0.00 N ATOM 807 CA GLY A 53 -24.031 38.973 -21.444 1.00 0.00 C ATOM 808 C GLY A 53 -23.625 38.392 -20.080 1.00 0.00 C ATOM 809 O GLY A 53 -22.774 38.963 -19.394 1.00 0.00 O ATOM 0 H GLY A 53 -25.315 38.216 -22.905 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -23.196 39.554 -21.835 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -24.859 39.666 -21.293 1.00 0.00 H new ATOM 813 N THR A 54 -24.193 37.247 -19.686 1.00 0.00 N ATOM 814 CA THR A 54 -23.761 36.476 -18.514 1.00 0.00 C ATOM 815 C THR A 54 -23.781 34.956 -18.774 1.00 0.00 C ATOM 816 O THR A 54 -24.455 34.482 -19.694 1.00 0.00 O ATOM 817 CB THR A 54 -24.671 36.757 -17.298 1.00 0.00 C ATOM 818 OG1 THR A 54 -26.011 36.398 -17.584 1.00 0.00 O ATOM 819 CG2 THR A 54 -24.752 38.228 -16.898 1.00 0.00 C ATOM 0 H THR A 54 -24.978 36.823 -20.180 1.00 0.00 H new ATOM 0 HA THR A 54 -22.739 36.794 -18.309 1.00 0.00 H new ATOM 0 HB THR A 54 -24.219 36.174 -16.496 1.00 0.00 H new ATOM 0 HG1 THR A 54 -26.573 36.581 -16.802 1.00 0.00 H new ATOM 0 HG21 THR A 54 -25.411 38.335 -16.037 1.00 0.00 H new ATOM 0 HG22 THR A 54 -23.757 38.590 -16.641 1.00 0.00 H new ATOM 0 HG23 THR A 54 -25.146 38.810 -17.731 1.00 0.00 H new ATOM 827 N TRP A 55 -23.039 34.181 -17.971 1.00 0.00 N ATOM 828 CA TRP A 55 -22.910 32.718 -18.074 1.00 0.00 C ATOM 829 C TRP A 55 -22.485 32.078 -16.738 1.00 0.00 C ATOM 830 O TRP A 55 -21.748 32.681 -15.956 1.00 0.00 O ATOM 831 CB TRP A 55 -21.887 32.373 -19.163 1.00 0.00 C ATOM 832 CG TRP A 55 -21.838 30.933 -19.566 1.00 0.00 C ATOM 833 CD1 TRP A 55 -21.024 30.000 -19.033 1.00 0.00 C ATOM 834 CD2 TRP A 55 -22.612 30.237 -20.590 1.00 0.00 C ATOM 835 NE1 TRP A 55 -21.204 28.794 -19.676 1.00 0.00 N ATOM 836 CE2 TRP A 55 -22.183 28.877 -20.642 1.00 0.00 C ATOM 837 CE3 TRP A 55 -23.623 30.627 -21.490 1.00 0.00 C ATOM 838 CZ2 TRP A 55 -22.728 27.952 -21.547 1.00 0.00 C ATOM 839 CZ3 TRP A 55 -24.185 29.709 -22.398 1.00 0.00 C ATOM 840 CH2 TRP A 55 -23.739 28.374 -22.429 1.00 0.00 C ATOM 0 H TRP A 55 -22.491 34.569 -17.203 1.00 0.00 H new ATOM 0 HA TRP A 55 -23.888 32.314 -18.333 1.00 0.00 H new ATOM 0 HB2 TRP A 55 -22.106 32.972 -20.047 1.00 0.00 H new ATOM 0 HB3 TRP A 55 -20.897 32.669 -18.815 1.00 0.00 H new ATOM 0 HD1 TRP A 55 -20.332 30.172 -18.221 1.00 0.00 H new ATOM 0 HE1 TRP A 55 -20.678 27.946 -19.463 1.00 0.00 H new ATOM 0 HE3 TRP A 55 -23.973 31.649 -21.484 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 -22.376 26.931 -21.566 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 -24.963 30.031 -23.075 1.00 0.00 H new ATOM 0 HH2 TRP A 55 -24.173 27.675 -23.129 1.00 0.00 H new ATOM 851 N LEU A 56 -22.926 30.848 -16.456 1.00 0.00 N ATOM 852 CA LEU A 56 -22.595 30.124 -15.222 1.00 0.00 C ATOM 853 C LEU A 56 -21.106 29.725 -15.176 1.00 0.00 C ATOM 854 O LEU A 56 -20.599 29.040 -16.065 1.00 0.00 O ATOM 855 CB LEU A 56 -23.525 28.904 -15.082 1.00 0.00 C ATOM 856 CG LEU A 56 -24.152 28.749 -13.687 1.00 0.00 C ATOM 857 CD1 LEU A 56 -25.221 27.658 -13.713 1.00 0.00 C ATOM 858 CD2 LEU A 56 -23.118 28.357 -12.634 1.00 0.00 C ATOM 0 H LEU A 56 -23.530 30.320 -17.085 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.756 30.784 -14.370 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -24.323 28.982 -15.820 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -22.961 28.002 -15.317 1.00 0.00 H new ATOM 0 HG LEU A 56 -24.580 29.717 -13.426 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -25.660 27.555 -12.721 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -25.999 27.928 -14.428 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -24.768 26.712 -14.009 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -23.606 28.259 -11.664 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -22.661 27.406 -12.909 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -22.348 29.126 -12.576 1.00 0.00 H new ATOM 870 N CYS A 57 -20.410 30.141 -14.121 1.00 0.00 N ATOM 871 CA CYS A 57 -18.982 29.895 -13.917 1.00 0.00 C ATOM 872 C CYS A 57 -18.705 28.593 -13.158 1.00 0.00 C ATOM 873 O CYS A 57 -19.583 28.022 -12.506 1.00 0.00 O ATOM 874 CB CYS A 57 -18.373 31.088 -13.177 1.00 0.00 C ATOM 875 SG CYS A 57 -18.279 32.498 -14.297 1.00 0.00 S ATOM 0 H CYS A 57 -20.835 30.674 -13.362 1.00 0.00 H new ATOM 0 HA CYS A 57 -18.518 29.781 -14.897 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -18.980 31.340 -12.307 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -17.379 30.834 -12.809 1.00 0.00 H new ATOM 0 HG CYS A 57 -17.764 33.515 -13.672 1.00 0.00 H new ATOM 881 N ARG A 58 -17.438 28.160 -13.179 1.00 0.00 N ATOM 882 CA ARG A 58 -16.988 26.882 -12.596 1.00 0.00 C ATOM 883 C ARG A 58 -17.072 26.839 -11.059 1.00 0.00 C ATOM 884 O ARG A 58 -17.096 25.757 -10.477 1.00 0.00 O ATOM 885 CB ARG A 58 -15.567 26.536 -13.091 1.00 0.00 C ATOM 886 CG ARG A 58 -15.349 26.753 -14.602 1.00 0.00 C ATOM 887 CD ARG A 58 -13.944 26.326 -15.042 1.00 0.00 C ATOM 888 NE ARG A 58 -13.631 26.820 -16.400 1.00 0.00 N ATOM 889 CZ ARG A 58 -12.565 26.525 -17.122 1.00 0.00 C ATOM 890 NH1 ARG A 58 -11.654 25.686 -16.712 1.00 0.00 N ATOM 891 NH2 ARG A 58 -12.397 27.078 -18.287 1.00 0.00 N ATOM 0 H ARG A 58 -16.682 28.694 -13.608 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.684 26.120 -12.946 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.846 27.142 -12.542 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.356 25.494 -12.852 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -16.093 26.186 -15.162 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -15.502 27.805 -14.844 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -13.208 26.709 -14.335 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -13.870 25.239 -15.022 1.00 0.00 H new ATOM 0 HE ARG A 58 -14.308 27.454 -16.823 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -11.751 25.231 -15.804 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -10.845 25.485 -17.299 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -13.088 27.739 -18.642 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -11.574 26.851 -18.845 1.00 0.00 H new ATOM 905 N ASN A 59 -17.184 28.005 -10.411 1.00 0.00 N ATOM 906 CA ASN A 59 -17.487 28.151 -8.978 1.00 0.00 C ATOM 907 C ASN A 59 -18.935 27.735 -8.611 1.00 0.00 C ATOM 908 O ASN A 59 -19.249 27.489 -7.445 1.00 0.00 O ATOM 909 CB ASN A 59 -17.216 29.621 -8.615 1.00 0.00 C ATOM 910 CG ASN A 59 -17.458 30.027 -7.168 1.00 0.00 C ATOM 911 OD1 ASN A 59 -17.270 29.271 -6.226 1.00 0.00 O ATOM 912 ND2 ASN A 59 -17.830 31.270 -6.950 1.00 0.00 N ATOM 0 H ASN A 59 -17.063 28.902 -10.882 1.00 0.00 H new ATOM 0 HA ASN A 59 -16.853 27.476 -8.403 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -16.178 29.846 -8.862 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -17.839 30.249 -9.253 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -17.962 31.603 -5.995 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -17.987 31.901 -7.736 1.00 0.00 H new ATOM 919 N GLY A 60 -19.825 27.641 -9.602 1.00 0.00 N ATOM 920 CA GLY A 60 -21.255 27.357 -9.429 1.00 0.00 C ATOM 921 C GLY A 60 -22.121 28.612 -9.251 1.00 0.00 C ATOM 922 O GLY A 60 -23.263 28.501 -8.800 1.00 0.00 O ATOM 0 H GLY A 60 -19.563 27.764 -10.580 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -21.612 26.801 -10.296 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -21.385 26.712 -8.560 1.00 0.00 H new ATOM 926 N MET A 61 -21.595 29.797 -9.596 1.00 0.00 N ATOM 927 CA MET A 61 -22.306 31.079 -9.559 1.00 0.00 C ATOM 928 C MET A 61 -22.440 31.685 -10.963 1.00 0.00 C ATOM 929 O MET A 61 -21.569 31.499 -11.815 1.00 0.00 O ATOM 930 CB MET A 61 -21.585 32.024 -8.580 1.00 0.00 C ATOM 931 CG MET A 61 -22.404 33.271 -8.213 1.00 0.00 C ATOM 932 SD MET A 61 -24.069 32.942 -7.565 1.00 0.00 S ATOM 933 CE MET A 61 -24.677 34.637 -7.360 1.00 0.00 C ATOM 0 H MET A 61 -20.632 29.890 -9.919 1.00 0.00 H new ATOM 0 HA MET A 61 -23.324 30.921 -9.202 1.00 0.00 H new ATOM 0 HB2 MET A 61 -21.345 31.476 -7.669 1.00 0.00 H new ATOM 0 HB3 MET A 61 -20.639 32.338 -9.021 1.00 0.00 H new ATOM 0 HG2 MET A 61 -21.849 33.844 -7.470 1.00 0.00 H new ATOM 0 HG3 MET A 61 -22.494 33.900 -9.099 1.00 0.00 H new ATOM 0 HE1 MET A 61 -25.712 34.614 -7.018 1.00 0.00 H new ATOM 0 HE2 MET A 61 -24.063 35.157 -6.624 1.00 0.00 H new ATOM 0 HE3 MET A 61 -24.622 35.161 -8.314 1.00 0.00 H new ATOM 943 N GLU A 62 -23.514 32.434 -11.212 1.00 0.00 N ATOM 944 CA GLU A 62 -23.715 33.175 -12.462 1.00 0.00 C ATOM 945 C GLU A 62 -22.681 34.307 -12.591 1.00 0.00 C ATOM 946 O GLU A 62 -22.702 35.283 -11.837 1.00 0.00 O ATOM 947 CB GLU A 62 -25.162 33.682 -12.555 1.00 0.00 C ATOM 948 CG GLU A 62 -25.465 34.280 -13.936 1.00 0.00 C ATOM 949 CD GLU A 62 -26.943 34.700 -14.043 1.00 0.00 C ATOM 950 OE1 GLU A 62 -27.804 33.834 -14.340 1.00 0.00 O ATOM 951 OE2 GLU A 62 -27.258 35.897 -13.833 1.00 0.00 O ATOM 0 H GLU A 62 -24.278 32.546 -10.546 1.00 0.00 H new ATOM 0 HA GLU A 62 -23.556 32.505 -13.307 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -25.849 32.860 -12.355 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -25.334 34.435 -11.786 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -24.824 35.144 -14.111 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -25.234 33.550 -14.711 1.00 0.00 H new ATOM 958 N GLY A 63 -21.747 34.147 -13.528 1.00 0.00 N ATOM 959 CA GLY A 63 -20.730 35.136 -13.863 1.00 0.00 C ATOM 960 C GLY A 63 -21.206 36.151 -14.904 1.00 0.00 C ATOM 961 O GLY A 63 -21.992 35.812 -15.789 1.00 0.00 O ATOM 0 H GLY A 63 -21.677 33.299 -14.090 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -20.432 35.665 -12.957 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -19.844 34.625 -14.240 1.00 0.00 H new ATOM 965 N THR A 64 -20.681 37.378 -14.858 1.00 0.00 N ATOM 966 CA THR A 64 -20.956 38.428 -15.859 1.00 0.00 C ATOM 967 C THR A 64 -19.747 38.702 -16.750 1.00 0.00 C ATOM 968 O THR A 64 -18.616 38.750 -16.268 1.00 0.00 O ATOM 969 CB THR A 64 -21.428 39.732 -15.196 1.00 0.00 C ATOM 970 OG1 THR A 64 -22.567 39.490 -14.394 1.00 0.00 O ATOM 971 CG2 THR A 64 -21.819 40.816 -16.207 1.00 0.00 C ATOM 0 H THR A 64 -20.046 37.680 -14.119 1.00 0.00 H new ATOM 0 HA THR A 64 -21.760 38.048 -16.489 1.00 0.00 H new ATOM 0 HB THR A 64 -20.581 40.083 -14.607 1.00 0.00 H new ATOM 0 HG1 THR A 64 -22.857 40.328 -13.976 1.00 0.00 H new ATOM 0 HG21 THR A 64 -22.143 41.710 -15.675 1.00 0.00 H new ATOM 0 HG22 THR A 64 -20.960 41.057 -16.832 1.00 0.00 H new ATOM 0 HG23 THR A 64 -22.633 40.452 -16.834 1.00 0.00 H new ATOM 979 N LEU A 65 -19.992 38.865 -18.054 1.00 0.00 N ATOM 980 CA LEU A 65 -18.992 38.926 -19.125 1.00 0.00 C ATOM 981 C LEU A 65 -18.003 40.094 -18.928 1.00 0.00 C ATOM 982 O LEU A 65 -18.402 41.261 -18.901 1.00 0.00 O ATOM 983 CB LEU A 65 -19.784 39.013 -20.449 1.00 0.00 C ATOM 984 CG LEU A 65 -19.060 38.830 -21.798 1.00 0.00 C ATOM 985 CD1 LEU A 65 -20.040 39.215 -22.913 1.00 0.00 C ATOM 986 CD2 LEU A 65 -17.796 39.660 -22.014 1.00 0.00 C ATOM 0 H LEU A 65 -20.943 38.963 -18.410 1.00 0.00 H new ATOM 0 HA LEU A 65 -18.357 38.040 -19.126 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -20.575 38.265 -20.402 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -20.269 39.989 -20.472 1.00 0.00 H new ATOM 0 HG LEU A 65 -18.739 37.788 -21.805 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -19.554 39.095 -23.882 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -20.918 38.570 -22.865 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -20.346 40.254 -22.786 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -17.381 39.442 -22.998 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -18.042 40.720 -21.951 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -17.062 39.411 -21.248 1.00 0.00 H new ATOM 998 N ILE A 66 -16.708 39.772 -18.841 1.00 0.00 N ATOM 999 CA ILE A 66 -15.570 40.700 -18.919 1.00 0.00 C ATOM 1000 C ILE A 66 -14.570 40.227 -19.988 1.00 0.00 C ATOM 1001 O ILE A 66 -14.514 39.042 -20.326 1.00 0.00 O ATOM 1002 CB ILE A 66 -14.878 40.918 -17.551 1.00 0.00 C ATOM 1003 CG1 ILE A 66 -14.062 39.712 -17.028 1.00 0.00 C ATOM 1004 CG2 ILE A 66 -15.875 41.430 -16.496 1.00 0.00 C ATOM 1005 CD1 ILE A 66 -14.858 38.513 -16.546 1.00 0.00 C ATOM 0 H ILE A 66 -16.407 38.807 -18.707 1.00 0.00 H new ATOM 0 HA ILE A 66 -15.964 41.673 -19.214 1.00 0.00 H new ATOM 0 HB ILE A 66 -14.132 41.691 -17.735 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -13.395 39.381 -17.824 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -13.433 40.056 -16.207 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -15.359 41.573 -15.547 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -16.298 42.379 -16.826 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -16.675 40.701 -16.368 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -14.174 37.736 -16.205 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -15.506 38.813 -15.722 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -15.467 38.128 -17.364 1.00 0.00 H new ATOM 1017 N GLU A 67 -13.768 41.138 -20.535 1.00 0.00 N ATOM 1018 CA GLU A 67 -12.803 40.796 -21.588 1.00 0.00 C ATOM 1019 C GLU A 67 -11.652 39.896 -21.088 1.00 0.00 C ATOM 1020 O GLU A 67 -10.986 40.189 -20.091 1.00 0.00 O ATOM 1021 CB GLU A 67 -12.310 42.058 -22.319 1.00 0.00 C ATOM 1022 CG GLU A 67 -11.560 43.075 -21.442 1.00 0.00 C ATOM 1023 CD GLU A 67 -11.208 44.341 -22.246 1.00 0.00 C ATOM 1024 OE1 GLU A 67 -10.133 44.378 -22.894 1.00 0.00 O ATOM 1025 OE2 GLU A 67 -11.999 45.316 -22.231 1.00 0.00 O ATOM 0 H GLU A 67 -13.764 42.123 -20.268 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.332 40.187 -22.321 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -11.654 41.753 -23.134 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.169 42.555 -22.770 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.175 43.344 -20.583 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.649 42.622 -21.052 1.00 0.00 H new ATOM 1032 N GLY A 68 -11.418 38.794 -21.808 1.00 0.00 N ATOM 1033 CA GLY A 68 -10.235 37.934 -21.679 1.00 0.00 C ATOM 1034 C GLY A 68 -9.482 37.751 -23.000 1.00 0.00 C ATOM 1035 O GLY A 68 -8.386 38.287 -23.172 1.00 0.00 O ATOM 0 H GLY A 68 -12.069 38.464 -22.521 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -9.560 38.363 -20.939 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -10.541 36.958 -21.303 1.00 0.00 H new ATOM 1039 N ASP A 69 -10.079 37.016 -23.946 1.00 0.00 N ATOM 1040 CA ASP A 69 -9.427 36.544 -25.183 1.00 0.00 C ATOM 1041 C ASP A 69 -10.393 36.536 -26.396 1.00 0.00 C ATOM 1042 O ASP A 69 -10.318 35.677 -27.280 1.00 0.00 O ATOM 1043 CB ASP A 69 -8.787 35.164 -24.927 1.00 0.00 C ATOM 1044 CG ASP A 69 -7.561 35.236 -24.002 1.00 0.00 C ATOM 1045 OD1 ASP A 69 -6.457 35.580 -24.491 1.00 0.00 O ATOM 1046 OD2 ASP A 69 -7.684 34.916 -22.795 1.00 0.00 O ATOM 0 H ASP A 69 -11.054 36.723 -23.875 1.00 0.00 H new ATOM 0 HA ASP A 69 -8.639 37.247 -25.452 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.531 34.500 -24.486 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.492 34.723 -25.879 1.00 0.00 H new ATOM 1051 N LEU A 70 -11.328 37.493 -26.439 1.00 0.00 N ATOM 1052 CA LEU A 70 -12.376 37.589 -27.455 1.00 0.00 C ATOM 1053 C LEU A 70 -11.784 37.895 -28.851 1.00 0.00 C ATOM 1054 O LEU A 70 -11.057 38.885 -28.989 1.00 0.00 O ATOM 1055 CB LEU A 70 -13.375 38.704 -27.068 1.00 0.00 C ATOM 1056 CG LEU A 70 -14.341 38.472 -25.890 1.00 0.00 C ATOM 1057 CD1 LEU A 70 -15.196 37.222 -26.075 1.00 0.00 C ATOM 1058 CD2 LEU A 70 -13.645 38.398 -24.531 1.00 0.00 C ATOM 0 H LEU A 70 -11.375 38.241 -25.747 1.00 0.00 H new ATOM 0 HA LEU A 70 -12.887 36.627 -27.503 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -12.796 39.601 -26.846 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.978 38.924 -27.949 1.00 0.00 H new ATOM 0 HG LEU A 70 -14.982 39.353 -25.894 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -15.859 37.104 -25.218 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -15.791 37.319 -26.983 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -14.550 36.348 -26.157 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -14.388 38.233 -23.750 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -12.931 37.574 -24.532 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -13.119 39.334 -24.340 1.00 0.00 H new ATOM 1070 N PRO A 71 -12.155 37.151 -29.914 1.00 0.00 N ATOM 1071 CA PRO A 71 -11.805 37.468 -31.306 1.00 0.00 C ATOM 1072 C PRO A 71 -12.740 38.552 -31.896 1.00 0.00 C ATOM 1073 O PRO A 71 -13.217 38.440 -33.026 1.00 0.00 O ATOM 1074 CB PRO A 71 -11.869 36.115 -32.025 1.00 0.00 C ATOM 1075 CG PRO A 71 -13.039 35.431 -31.322 1.00 0.00 C ATOM 1076 CD PRO A 71 -12.880 35.885 -29.870 1.00 0.00 C ATOM 0 HA PRO A 71 -10.816 37.913 -31.415 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.047 36.230 -33.094 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -10.942 35.551 -31.915 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -13.997 35.740 -31.739 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.987 34.346 -31.414 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.852 36.010 -29.393 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.332 35.143 -29.288 1.00 0.00 H new ATOM 1084 N GLU A 72 -13.056 39.576 -31.093 1.00 0.00 N ATOM 1085 CA GLU A 72 -14.055 40.631 -31.325 1.00 0.00 C ATOM 1086 C GLU A 72 -15.367 40.135 -31.993 1.00 0.00 C ATOM 1087 O GLU A 72 -15.724 40.597 -33.085 1.00 0.00 O ATOM 1088 CB GLU A 72 -13.370 41.794 -32.061 1.00 0.00 C ATOM 1089 CG GLU A 72 -12.338 42.520 -31.186 1.00 0.00 C ATOM 1090 CD GLU A 72 -11.714 43.708 -31.943 1.00 0.00 C ATOM 1091 OE1 GLU A 72 -10.686 43.521 -32.640 1.00 0.00 O ATOM 1092 OE2 GLU A 72 -12.242 44.844 -31.844 1.00 0.00 O ATOM 0 H GLU A 72 -12.585 39.699 -30.196 1.00 0.00 H new ATOM 0 HA GLU A 72 -14.415 40.990 -30.361 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.878 41.413 -32.956 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.126 42.506 -32.391 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -12.815 42.876 -30.273 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -11.555 41.823 -30.886 1.00 0.00 H new ATOM 1099 N PRO A 73 -16.108 39.195 -31.364 1.00 0.00 N ATOM 1100 CA PRO A 73 -17.361 38.666 -31.908 1.00 0.00 C ATOM 1101 C PRO A 73 -18.517 39.678 -31.808 1.00 0.00 C ATOM 1102 O PRO A 73 -18.519 40.572 -30.954 1.00 0.00 O ATOM 1103 CB PRO A 73 -17.640 37.394 -31.100 1.00 0.00 C ATOM 1104 CG PRO A 73 -17.052 37.720 -29.728 1.00 0.00 C ATOM 1105 CD PRO A 73 -15.834 38.584 -30.066 1.00 0.00 C ATOM 0 HA PRO A 73 -17.275 38.457 -32.974 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -18.707 37.180 -31.041 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -17.164 36.521 -31.546 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -17.765 38.256 -29.102 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -16.768 36.817 -29.187 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -15.676 39.347 -29.304 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -14.928 37.979 -30.105 1.00 0.00 H new ATOM 1113 N LYS A 74 -19.537 39.514 -32.661 1.00 0.00 N ATOM 1114 CA LYS A 74 -20.771 40.323 -32.644 1.00 0.00 C ATOM 1115 C LYS A 74 -21.587 40.056 -31.369 1.00 0.00 C ATOM 1116 O LYS A 74 -21.863 38.898 -31.040 1.00 0.00 O ATOM 1117 CB LYS A 74 -21.582 40.035 -33.925 1.00 0.00 C ATOM 1118 CG LYS A 74 -22.892 40.836 -34.001 1.00 0.00 C ATOM 1119 CD LYS A 74 -23.677 40.535 -35.286 1.00 0.00 C ATOM 1120 CE LYS A 74 -25.021 41.267 -35.213 1.00 0.00 C ATOM 1121 NZ LYS A 74 -25.895 41.010 -36.385 1.00 0.00 N ATOM 0 H LYS A 74 -19.531 38.806 -33.395 1.00 0.00 H new ATOM 0 HA LYS A 74 -20.514 41.382 -32.630 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -20.969 40.268 -34.796 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -21.811 38.970 -33.972 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -23.511 40.602 -33.135 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -22.668 41.902 -33.954 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -23.114 40.862 -36.160 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -23.835 39.462 -35.392 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -25.543 40.963 -34.306 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -24.839 42.339 -35.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -26.854 41.361 -36.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -25.512 41.501 -37.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -25.932 39.988 -36.573 1.00 0.00 H new ATOM 1135 N LYS A 75 -22.008 41.126 -30.678 1.00 0.00 N ATOM 1136 CA LYS A 75 -22.896 41.063 -29.496 1.00 0.00 C ATOM 1137 C LYS A 75 -23.849 42.277 -29.382 1.00 0.00 C ATOM 1138 O LYS A 75 -24.114 42.790 -28.292 1.00 0.00 O ATOM 1139 CB LYS A 75 -22.028 40.861 -28.236 1.00 0.00 C ATOM 1140 CG LYS A 75 -22.869 40.234 -27.113 1.00 0.00 C ATOM 1141 CD LYS A 75 -22.399 40.517 -25.680 1.00 0.00 C ATOM 1142 CE LYS A 75 -22.387 42.020 -25.360 1.00 0.00 C ATOM 1143 NZ LYS A 75 -23.762 42.573 -25.272 1.00 0.00 N ATOM 0 H LYS A 75 -21.739 42.078 -30.925 1.00 0.00 H new ATOM 0 HA LYS A 75 -23.566 40.210 -29.608 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -21.179 40.218 -28.468 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -21.622 41.818 -27.907 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -23.895 40.588 -27.214 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -22.889 39.154 -27.261 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -23.053 40.003 -24.976 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -21.398 40.109 -25.541 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -21.866 42.187 -24.417 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -21.829 42.552 -26.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -23.767 43.389 -24.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -24.076 42.875 -26.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -24.408 41.842 -24.910 1.00 0.00 H new ATOM 1157 N VAL A 76 -24.378 42.715 -30.525 1.00 0.00 N ATOM 1158 CA VAL A 76 -25.378 43.787 -30.699 1.00 0.00 C ATOM 1159 C VAL A 76 -26.249 43.485 -31.927 1.00 0.00 C ATOM 1160 O VAL A 76 -25.791 42.790 -32.833 1.00 0.00 O ATOM 1161 CB VAL A 76 -24.728 45.180 -30.874 1.00 0.00 C ATOM 1162 CG1 VAL A 76 -24.086 45.693 -29.580 1.00 0.00 C ATOM 1163 CG2 VAL A 76 -23.676 45.241 -31.992 1.00 0.00 C ATOM 0 H VAL A 76 -24.105 42.307 -31.419 1.00 0.00 H new ATOM 0 HA VAL A 76 -25.983 43.813 -29.792 1.00 0.00 H new ATOM 0 HB VAL A 76 -25.563 45.822 -31.154 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -23.644 46.674 -29.757 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -24.846 45.772 -28.803 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -23.310 44.998 -29.259 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -23.267 46.250 -32.052 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -22.873 44.536 -31.775 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -24.140 44.981 -32.943 1.00 0.00 H new ATOM 1173 N LYS A 77 -27.479 44.021 -31.979 1.00 0.00 N ATOM 1174 CA LYS A 77 -28.399 43.959 -33.139 1.00 0.00 C ATOM 1175 C LYS A 77 -28.593 42.535 -33.727 1.00 0.00 C ATOM 1176 O LYS A 77 -28.077 42.261 -34.820 1.00 0.00 O ATOM 1177 CB LYS A 77 -27.966 44.995 -34.202 1.00 0.00 C ATOM 1178 CG LYS A 77 -28.011 46.442 -33.683 1.00 0.00 C ATOM 1179 CD LYS A 77 -27.639 47.437 -34.791 1.00 0.00 C ATOM 1180 CE LYS A 77 -27.692 48.871 -34.252 1.00 0.00 C ATOM 1181 NZ LYS A 77 -27.341 49.863 -35.302 1.00 0.00 N ATOM 0 H LYS A 77 -27.879 44.528 -31.190 1.00 0.00 H new ATOM 0 HA LYS A 77 -29.393 44.222 -32.776 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -26.954 44.765 -34.534 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -28.615 44.907 -35.073 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -29.010 46.667 -33.308 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -27.324 46.553 -32.844 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -26.639 47.218 -35.166 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -28.325 47.331 -35.631 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -28.692 49.081 -33.872 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -27.004 48.970 -33.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -27.387 50.822 -34.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -26.378 49.677 -35.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -28.013 49.784 -36.092 1.00 0.00 H new ATOM 1195 N PRO A 78 -29.330 41.623 -33.054 1.00 0.00 N ATOM 1196 CA PRO A 78 -30.097 41.824 -31.812 1.00 0.00 C ATOM 1197 C PRO A 78 -29.235 41.900 -30.533 1.00 0.00 C ATOM 1198 O PRO A 78 -28.121 41.366 -30.513 1.00 0.00 O ATOM 1199 CB PRO A 78 -31.073 40.637 -31.726 1.00 0.00 C ATOM 1200 CG PRO A 78 -31.115 40.074 -33.144 1.00 0.00 C ATOM 1201 CD PRO A 78 -29.694 40.333 -33.626 1.00 0.00 C ATOM 0 HA PRO A 78 -30.598 42.791 -31.858 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -30.727 39.889 -31.012 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -32.061 40.959 -31.397 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -31.363 39.013 -33.155 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -31.855 40.581 -33.763 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -29.015 39.548 -33.293 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -29.645 40.356 -34.715 1.00 0.00 H new ATOM 1209 N PRO A 79 -29.728 42.534 -29.448 1.00 0.00 N ATOM 1210 CA PRO A 79 -29.042 42.565 -28.153 1.00 0.00 C ATOM 1211 C PRO A 79 -28.906 41.159 -27.536 1.00 0.00 C ATOM 1212 O PRO A 79 -29.762 40.288 -27.731 1.00 0.00 O ATOM 1213 CB PRO A 79 -29.864 43.511 -27.272 1.00 0.00 C ATOM 1214 CG PRO A 79 -31.274 43.391 -27.850 1.00 0.00 C ATOM 1215 CD PRO A 79 -31.016 43.211 -29.345 1.00 0.00 C ATOM 0 HA PRO A 79 -28.016 42.919 -28.256 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -29.832 43.214 -26.224 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -29.493 44.535 -27.325 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -31.813 42.543 -27.428 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -31.871 44.280 -27.647 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -31.806 42.621 -29.810 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -30.994 44.173 -29.857 1.00 0.00 H new ATOM 1223 N ARG A 80 -27.809 40.944 -26.801 1.00 0.00 N ATOM 1224 CA ARG A 80 -27.341 39.638 -26.296 1.00 0.00 C ATOM 1225 C ARG A 80 -26.516 39.783 -25.008 1.00 0.00 C ATOM 1226 O ARG A 80 -25.805 40.804 -24.865 1.00 0.00 O ATOM 1227 CB ARG A 80 -26.568 38.956 -27.444 1.00 0.00 C ATOM 1228 CG ARG A 80 -25.824 37.678 -27.035 1.00 0.00 C ATOM 1229 CD ARG A 80 -25.135 36.999 -28.227 1.00 0.00 C ATOM 1230 NE ARG A 80 -26.105 36.403 -29.163 1.00 0.00 N ATOM 1231 CZ ARG A 80 -26.622 35.189 -29.117 1.00 0.00 C ATOM 1232 NH1 ARG A 80 -26.204 34.272 -28.293 1.00 0.00 N ATOM 1233 NH2 ARG A 80 -27.593 34.868 -29.919 1.00 0.00 N ATOM 1234 OXT ARG A 80 -26.600 38.879 -24.149 1.00 0.00 O ATOM 0 H ARG A 80 -27.191 41.708 -26.527 1.00 0.00 H new ATOM 0 HA ARG A 80 -28.184 39.010 -26.006 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -27.268 38.714 -28.244 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -25.849 39.665 -27.853 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -25.079 37.921 -26.277 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -26.527 36.981 -26.579 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -24.524 37.730 -28.756 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -24.461 36.224 -27.862 1.00 0.00 H new ATOM 0 HE ARG A 80 -26.412 36.996 -29.934 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -25.444 34.477 -27.644 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -26.636 33.348 -28.296 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -27.954 35.553 -30.582 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -27.994 33.931 -29.885 1.00 0.00 H new TER 1248 ARG A 80