USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 799 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 54 LYS NZ :NH3+ 171:sc= 0 (180deg=0) USER MOD Set 1.2: A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 10 GLN : amide:sc= -0.888 K(o=-1.4,f=-4.2!) USER MOD Set 2.2: A 15 LYS NZ :NH3+ -167:sc= -0.483 (180deg=-0.316) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -128:sc= -0.783 (180deg=-4.57!) USER MOD Single : A 25 GLN : amide:sc= -0.175 K(o=-0.17,f=1.2) USER MOD Single : A 26 ASN : amide:sc= -0.0203 K(o=-0.02,f=-2!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.0175 X(o=-0.018,f=-0.29) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -162:sc= -1.27 (180deg=-1.98) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 HIS : no HD1:sc= -3.97! C(o=-4!,f=-7.7!) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 85:sc= 1 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.415 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot -87:sc= 0.0963 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0589 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0472) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 34 N VAL A 3 -23.100 -11.156 6.454 1.00 0.00 N ATOM 35 CA VAL A 3 -23.244 -12.357 5.582 1.00 0.00 C ATOM 36 C VAL A 3 -21.877 -13.009 5.353 1.00 0.00 C ATOM 37 O VAL A 3 -20.942 -12.373 4.909 1.00 0.00 O ATOM 38 CB VAL A 3 -23.812 -11.826 4.266 1.00 0.00 C ATOM 39 CG1 VAL A 3 -23.969 -12.980 3.275 1.00 0.00 C ATOM 40 CG2 VAL A 3 -25.179 -11.189 4.525 1.00 0.00 C ATOM 0 HA VAL A 3 -23.888 -13.116 6.026 1.00 0.00 H new ATOM 0 HB VAL A 3 -23.133 -11.081 3.851 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -24.374 -12.601 2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -22.997 -13.437 3.092 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -24.648 -13.725 3.689 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -25.587 -10.809 3.588 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -25.856 -11.936 4.939 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -25.069 -10.367 5.233 1.00 0.00 H new ATOM 50 N LYS A 4 -21.756 -14.274 5.651 1.00 0.00 N ATOM 51 CA LYS A 4 -20.450 -14.964 5.451 1.00 0.00 C ATOM 52 C LYS A 4 -20.285 -15.378 3.986 1.00 0.00 C ATOM 53 O LYS A 4 -20.559 -16.501 3.613 1.00 0.00 O ATOM 54 CB LYS A 4 -20.513 -16.199 6.353 1.00 0.00 C ATOM 55 CG LYS A 4 -20.243 -15.786 7.801 1.00 0.00 C ATOM 56 CD LYS A 4 -21.257 -16.467 8.723 1.00 0.00 C ATOM 57 CE LYS A 4 -20.640 -17.737 9.313 1.00 0.00 C ATOM 58 NZ LYS A 4 -21.234 -17.856 10.673 1.00 0.00 N ATOM 0 H LYS A 4 -22.504 -14.859 6.024 1.00 0.00 H new ATOM 0 HA LYS A 4 -19.604 -14.322 5.695 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -21.493 -16.670 6.275 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -19.778 -16.936 6.031 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -19.229 -16.066 8.087 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -20.315 -14.703 7.901 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -21.551 -15.787 9.523 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -22.161 -16.714 8.167 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -20.873 -18.610 8.703 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -19.554 -17.663 9.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -20.859 -18.705 11.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -20.990 -17.014 11.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -22.268 -17.932 10.595 1.00 0.00 H new ATOM 72 N CYS A 5 -19.840 -14.478 3.153 1.00 0.00 N ATOM 73 CA CYS A 5 -19.657 -14.821 1.713 1.00 0.00 C ATOM 74 C CYS A 5 -18.313 -15.531 1.507 1.00 0.00 C ATOM 75 O CYS A 5 -17.394 -15.342 2.278 1.00 0.00 O ATOM 76 CB CYS A 5 -19.674 -13.478 0.983 1.00 0.00 C ATOM 77 SG CYS A 5 -21.146 -12.545 1.471 1.00 0.00 S ATOM 0 H CYS A 5 -19.595 -13.521 3.406 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.431 -15.494 1.344 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -18.775 -12.910 1.222 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -19.673 -13.638 -0.095 1.00 0.00 H new ATOM 82 N PRO A 6 -18.236 -16.327 0.466 1.00 0.00 N ATOM 83 CA PRO A 6 -19.388 -16.528 -0.450 1.00 0.00 C ATOM 84 C PRO A 6 -20.436 -17.440 0.195 1.00 0.00 C ATOM 85 O PRO A 6 -20.170 -18.111 1.173 1.00 0.00 O ATOM 86 CB PRO A 6 -18.764 -17.204 -1.667 1.00 0.00 C ATOM 87 CG PRO A 6 -17.535 -17.883 -1.151 1.00 0.00 C ATOM 88 CD PRO A 6 -17.063 -17.107 0.055 1.00 0.00 C ATOM 0 HA PRO A 6 -19.902 -15.599 -0.697 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -19.452 -17.921 -2.115 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.517 -16.475 -2.439 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.752 -18.917 -0.881 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.761 -17.909 -1.918 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.729 -17.773 0.851 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -16.222 -16.460 -0.193 1.00 0.00 H new ATOM 96 N GLY A 7 -21.624 -17.470 -0.344 1.00 0.00 N ATOM 97 CA GLY A 7 -22.686 -18.337 0.240 1.00 0.00 C ATOM 98 C GLY A 7 -23.952 -18.242 -0.614 1.00 0.00 C ATOM 99 O GLY A 7 -24.129 -17.315 -1.379 1.00 0.00 O ATOM 0 H GLY A 7 -21.905 -16.932 -1.163 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.342 -19.370 0.285 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.901 -18.028 1.263 1.00 0.00 H new ATOM 103 N GLU A 8 -24.836 -19.195 -0.491 1.00 0.00 N ATOM 104 CA GLU A 8 -26.090 -19.158 -1.296 1.00 0.00 C ATOM 105 C GLU A 8 -27.272 -18.735 -0.420 1.00 0.00 C ATOM 106 O GLU A 8 -27.282 -18.959 0.774 1.00 0.00 O ATOM 107 CB GLU A 8 -26.280 -20.589 -1.798 1.00 0.00 C ATOM 108 CG GLU A 8 -25.057 -21.011 -2.616 1.00 0.00 C ATOM 109 CD GLU A 8 -25.488 -21.989 -3.711 1.00 0.00 C ATOM 110 OE1 GLU A 8 -25.544 -23.174 -3.428 1.00 0.00 O ATOM 111 OE2 GLU A 8 -25.752 -21.536 -4.812 1.00 0.00 O ATOM 0 H GLU A 8 -24.744 -19.997 0.132 1.00 0.00 H new ATOM 0 HA GLU A 8 -26.032 -18.442 -2.116 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -26.418 -21.266 -0.955 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -27.180 -20.654 -2.410 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -24.584 -20.136 -3.061 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -24.316 -21.478 -1.967 1.00 0.00 H new ATOM 118 N TYR A 9 -28.268 -18.127 -1.003 1.00 0.00 N ATOM 119 CA TYR A 9 -29.447 -17.691 -0.202 1.00 0.00 C ATOM 120 C TYR A 9 -30.699 -17.647 -1.084 1.00 0.00 C ATOM 121 O TYR A 9 -30.639 -17.309 -2.249 1.00 0.00 O ATOM 122 CB TYR A 9 -29.093 -16.290 0.295 1.00 0.00 C ATOM 123 CG TYR A 9 -28.157 -16.394 1.474 1.00 0.00 C ATOM 124 CD1 TYR A 9 -28.672 -16.584 2.763 1.00 0.00 C ATOM 125 CD2 TYR A 9 -26.772 -16.302 1.279 1.00 0.00 C ATOM 126 CE1 TYR A 9 -27.803 -16.681 3.858 1.00 0.00 C ATOM 127 CE2 TYR A 9 -25.902 -16.398 2.374 1.00 0.00 C ATOM 128 CZ TYR A 9 -26.417 -16.588 3.664 1.00 0.00 C ATOM 129 OH TYR A 9 -25.562 -16.682 4.742 1.00 0.00 O ATOM 0 H TYR A 9 -28.317 -17.913 -1.999 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.662 -18.373 0.621 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -28.624 -15.717 -0.505 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -29.998 -15.755 0.582 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -29.739 -16.656 2.913 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -26.375 -16.157 0.285 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -28.201 -16.827 4.851 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -24.835 -16.326 2.224 1.00 0.00 H new ATOM 0 HH TYR A 9 -24.636 -16.598 4.433 1.00 0.00 H new ATOM 139 N GLN A 10 -31.835 -17.981 -0.534 1.00 0.00 N ATOM 140 CA GLN A 10 -33.091 -17.955 -1.337 1.00 0.00 C ATOM 141 C GLN A 10 -33.876 -16.676 -1.038 1.00 0.00 C ATOM 142 O GLN A 10 -34.071 -16.310 0.104 1.00 0.00 O ATOM 143 CB GLN A 10 -33.876 -19.187 -0.885 1.00 0.00 C ATOM 144 CG GLN A 10 -33.400 -20.412 -1.669 1.00 0.00 C ATOM 145 CD GLN A 10 -33.079 -21.549 -0.697 1.00 0.00 C ATOM 146 OE1 GLN A 10 -33.167 -21.381 0.503 1.00 0.00 O ATOM 147 NE2 GLN A 10 -32.708 -22.709 -1.168 1.00 0.00 N ATOM 0 H GLN A 10 -31.948 -18.271 0.437 1.00 0.00 H new ATOM 0 HA GLN A 10 -32.899 -17.968 -2.410 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -33.735 -19.349 0.184 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -34.943 -19.031 -1.046 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -34.170 -20.728 -2.373 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -32.516 -20.161 -2.255 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -32.634 -22.850 -2.175 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -32.492 -23.474 -0.528 1.00 0.00 H new ATOM 156 N VAL A 11 -34.326 -15.988 -2.053 1.00 0.00 N ATOM 157 CA VAL A 11 -35.093 -14.731 -1.816 1.00 0.00 C ATOM 158 C VAL A 11 -36.403 -14.741 -2.611 1.00 0.00 C ATOM 159 O VAL A 11 -36.407 -14.638 -3.821 1.00 0.00 O ATOM 160 CB VAL A 11 -34.177 -13.611 -2.308 1.00 0.00 C ATOM 161 CG1 VAL A 11 -34.787 -12.256 -1.947 1.00 0.00 C ATOM 162 CG2 VAL A 11 -32.807 -13.746 -1.642 1.00 0.00 C ATOM 0 H VAL A 11 -34.196 -16.241 -3.033 1.00 0.00 H new ATOM 0 HA VAL A 11 -35.364 -14.609 -0.767 1.00 0.00 H new ATOM 0 HB VAL A 11 -34.065 -13.682 -3.390 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -34.133 -11.458 -2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -35.764 -12.159 -2.420 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -34.899 -12.184 -0.865 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -32.152 -12.948 -1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -32.920 -13.675 -0.560 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -32.371 -14.712 -1.899 1.00 0.00 H new ATOM 172 N ASP A 12 -37.516 -14.858 -1.939 1.00 0.00 N ATOM 173 CA ASP A 12 -38.824 -14.868 -2.655 1.00 0.00 C ATOM 174 C ASP A 12 -38.929 -16.097 -3.561 1.00 0.00 C ATOM 175 O ASP A 12 -39.608 -16.081 -4.570 1.00 0.00 O ATOM 176 CB ASP A 12 -38.828 -13.586 -3.488 1.00 0.00 C ATOM 177 CG ASP A 12 -40.179 -12.882 -3.338 1.00 0.00 C ATOM 178 OD1 ASP A 12 -41.174 -13.576 -3.206 1.00 0.00 O ATOM 179 OD2 ASP A 12 -40.195 -11.663 -3.358 1.00 0.00 O ATOM 0 H ASP A 12 -37.576 -14.947 -0.925 1.00 0.00 H new ATOM 0 HA ASP A 12 -39.668 -14.912 -1.967 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -38.024 -12.926 -3.162 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -38.643 -13.821 -4.536 1.00 0.00 H new ATOM 184 N GLY A 13 -38.264 -17.165 -3.213 1.00 0.00 N ATOM 185 CA GLY A 13 -38.332 -18.392 -4.056 1.00 0.00 C ATOM 186 C GLY A 13 -37.295 -18.307 -5.176 1.00 0.00 C ATOM 187 O GLY A 13 -37.256 -19.137 -6.062 1.00 0.00 O ATOM 0 H GLY A 13 -37.677 -17.241 -2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.149 -19.275 -3.444 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.331 -18.499 -4.480 1.00 0.00 H new ATOM 191 N LYS A 14 -36.449 -17.313 -5.144 1.00 0.00 N ATOM 192 CA LYS A 14 -35.414 -17.182 -6.210 1.00 0.00 C ATOM 193 C LYS A 14 -34.077 -17.736 -5.715 1.00 0.00 C ATOM 194 O LYS A 14 -33.918 -18.052 -4.552 1.00 0.00 O ATOM 195 CB LYS A 14 -35.305 -15.682 -6.481 1.00 0.00 C ATOM 196 CG LYS A 14 -36.472 -15.234 -7.363 1.00 0.00 C ATOM 197 CD LYS A 14 -35.938 -14.427 -8.547 1.00 0.00 C ATOM 198 CE LYS A 14 -36.928 -14.509 -9.711 1.00 0.00 C ATOM 199 NZ LYS A 14 -36.127 -15.008 -10.863 1.00 0.00 N ATOM 0 H LYS A 14 -36.429 -16.587 -4.427 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.677 -17.738 -7.110 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -35.314 -15.131 -5.541 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.358 -15.459 -6.972 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -37.025 -16.102 -7.721 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -37.169 -14.630 -6.782 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -35.790 -13.387 -8.255 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -34.966 -14.813 -8.855 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -37.752 -15.184 -9.481 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -37.365 -13.534 -9.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -36.738 -15.091 -11.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -35.354 -14.342 -11.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -35.729 -15.940 -10.631 1.00 0.00 H new ATOM 213 N LYS A 15 -33.115 -17.858 -6.587 1.00 0.00 N ATOM 214 CA LYS A 15 -31.791 -18.393 -6.163 1.00 0.00 C ATOM 215 C LYS A 15 -30.712 -17.319 -6.314 1.00 0.00 C ATOM 216 O LYS A 15 -30.512 -16.770 -7.380 1.00 0.00 O ATOM 217 CB LYS A 15 -31.518 -19.564 -7.107 1.00 0.00 C ATOM 218 CG LYS A 15 -31.237 -20.826 -6.290 1.00 0.00 C ATOM 219 CD LYS A 15 -32.344 -21.853 -6.538 1.00 0.00 C ATOM 220 CE LYS A 15 -33.522 -21.573 -5.603 1.00 0.00 C ATOM 221 NZ LYS A 15 -33.214 -22.336 -4.360 1.00 0.00 N ATOM 0 H LYS A 15 -33.188 -17.611 -7.574 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.786 -18.701 -5.118 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -32.375 -19.725 -7.761 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -30.667 -19.337 -7.748 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -30.270 -21.244 -6.568 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -31.185 -20.581 -5.229 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -32.672 -21.806 -7.577 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -31.964 -22.861 -6.369 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -33.619 -20.507 -5.398 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -34.463 -21.900 -6.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -34.062 -22.378 -3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -32.918 -23.301 -4.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -32.447 -21.862 -3.843 1.00 0.00 H new ATOM 235 N VAL A 16 -30.015 -17.014 -5.253 1.00 0.00 N ATOM 236 CA VAL A 16 -28.949 -15.975 -5.335 1.00 0.00 C ATOM 237 C VAL A 16 -27.609 -16.559 -4.880 1.00 0.00 C ATOM 238 O VAL A 16 -27.537 -17.290 -3.911 1.00 0.00 O ATOM 239 CB VAL A 16 -29.403 -14.868 -4.385 1.00 0.00 C ATOM 240 CG1 VAL A 16 -28.441 -13.683 -4.483 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.812 -14.412 -4.772 1.00 0.00 C ATOM 0 H VAL A 16 -30.138 -17.439 -4.334 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.806 -15.606 -6.351 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.409 -15.247 -3.363 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -28.766 -12.894 -3.805 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -27.437 -14.006 -4.209 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -28.434 -13.303 -5.505 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -31.138 -13.622 -4.095 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -30.804 -14.034 -5.794 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.499 -15.255 -4.703 1.00 0.00 H new ATOM 251 N ILE A 17 -26.547 -16.244 -5.569 1.00 0.00 N ATOM 252 CA ILE A 17 -25.215 -16.785 -5.174 1.00 0.00 C ATOM 253 C ILE A 17 -24.249 -15.639 -4.863 1.00 0.00 C ATOM 254 O ILE A 17 -23.684 -15.030 -5.750 1.00 0.00 O ATOM 255 CB ILE A 17 -24.734 -17.578 -6.389 1.00 0.00 C ATOM 256 CG1 ILE A 17 -25.567 -18.855 -6.523 1.00 0.00 C ATOM 257 CG2 ILE A 17 -23.261 -17.950 -6.207 1.00 0.00 C ATOM 258 CD1 ILE A 17 -25.227 -19.550 -7.842 1.00 0.00 C ATOM 0 H ILE A 17 -26.543 -15.636 -6.388 1.00 0.00 H new ATOM 0 HA ILE A 17 -25.270 -17.404 -4.279 1.00 0.00 H new ATOM 0 HB ILE A 17 -24.847 -16.971 -7.287 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -25.366 -19.523 -5.685 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -26.629 -18.614 -6.490 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -22.919 -18.515 -7.074 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -22.666 -17.042 -6.108 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -23.147 -18.558 -5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -25.820 -20.459 -7.938 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -25.451 -18.882 -8.674 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -24.167 -19.805 -7.856 1.00 0.00 H new ATOM 270 N LEU A 18 -24.055 -15.339 -3.608 1.00 0.00 N ATOM 271 CA LEU A 18 -23.125 -14.233 -3.239 1.00 0.00 C ATOM 272 C LEU A 18 -21.672 -14.678 -3.427 1.00 0.00 C ATOM 273 O LEU A 18 -21.209 -15.608 -2.796 1.00 0.00 O ATOM 274 CB LEU A 18 -23.412 -13.949 -1.764 1.00 0.00 C ATOM 275 CG LEU A 18 -24.736 -13.193 -1.639 1.00 0.00 C ATOM 276 CD1 LEU A 18 -24.945 -12.766 -0.186 1.00 0.00 C ATOM 277 CD2 LEU A 18 -24.699 -11.951 -2.534 1.00 0.00 C ATOM 0 H LEU A 18 -24.500 -15.812 -2.821 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.269 -13.349 -3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -23.460 -14.884 -1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -22.603 -13.361 -1.332 1.00 0.00 H new ATOM 0 HG LEU A 18 -25.555 -13.842 -1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -25.888 -12.227 -0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -24.970 -13.649 0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -24.126 -12.117 0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -25.642 -11.411 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.879 -11.303 -2.223 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.549 -12.254 -3.570 1.00 0.00 H new ATOM 289 N ASP A 19 -20.949 -14.020 -4.292 1.00 0.00 N ATOM 290 CA ASP A 19 -19.526 -14.403 -4.522 1.00 0.00 C ATOM 291 C ASP A 19 -18.727 -14.285 -3.222 1.00 0.00 C ATOM 292 O ASP A 19 -19.276 -14.046 -2.164 1.00 0.00 O ATOM 293 CB ASP A 19 -19.013 -13.406 -5.560 1.00 0.00 C ATOM 294 CG ASP A 19 -19.369 -13.898 -6.964 1.00 0.00 C ATOM 295 OD1 ASP A 19 -20.539 -13.857 -7.305 1.00 0.00 O ATOM 296 OD2 ASP A 19 -18.465 -14.308 -7.673 1.00 0.00 O ATOM 0 H ASP A 19 -21.282 -13.234 -4.850 1.00 0.00 H new ATOM 0 HA ASP A 19 -19.425 -15.434 -4.861 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -19.454 -12.424 -5.385 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -17.933 -13.292 -5.467 1.00 0.00 H new ATOM 301 N GLU A 20 -17.435 -14.451 -3.294 1.00 0.00 N ATOM 302 CA GLU A 20 -16.600 -14.349 -2.063 1.00 0.00 C ATOM 303 C GLU A 20 -16.707 -12.943 -1.463 1.00 0.00 C ATOM 304 O GLU A 20 -16.310 -12.706 -0.339 1.00 0.00 O ATOM 305 CB GLU A 20 -15.171 -14.623 -2.532 1.00 0.00 C ATOM 306 CG GLU A 20 -14.535 -15.691 -1.639 1.00 0.00 C ATOM 307 CD GLU A 20 -13.108 -15.968 -2.113 1.00 0.00 C ATOM 308 OE1 GLU A 20 -12.714 -15.392 -3.113 1.00 0.00 O ATOM 309 OE2 GLU A 20 -12.432 -16.752 -1.466 1.00 0.00 O ATOM 0 H GLU A 20 -16.921 -14.653 -4.152 1.00 0.00 H new ATOM 0 HA GLU A 20 -16.918 -15.048 -1.290 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.176 -14.957 -3.569 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.583 -13.706 -2.495 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.526 -15.355 -0.602 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -15.125 -16.607 -1.673 1.00 0.00 H new ATOM 316 N ASP A 21 -17.240 -12.010 -2.203 1.00 0.00 N ATOM 317 CA ASP A 21 -17.370 -10.623 -1.674 1.00 0.00 C ATOM 318 C ASP A 21 -18.844 -10.213 -1.613 1.00 0.00 C ATOM 319 O ASP A 21 -19.207 -9.112 -1.975 1.00 0.00 O ATOM 320 CB ASP A 21 -16.609 -9.745 -2.668 1.00 0.00 C ATOM 321 CG ASP A 21 -15.761 -8.726 -1.906 1.00 0.00 C ATOM 322 OD1 ASP A 21 -16.159 -8.351 -0.815 1.00 0.00 O ATOM 323 OD2 ASP A 21 -14.728 -8.336 -2.426 1.00 0.00 O ATOM 0 H ASP A 21 -17.591 -12.148 -3.151 1.00 0.00 H new ATOM 0 HA ASP A 21 -16.974 -10.530 -0.663 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -15.972 -10.363 -3.301 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -17.310 -9.231 -3.326 1.00 0.00 H new ATOM 328 N CYS A 22 -19.695 -11.091 -1.157 1.00 0.00 N ATOM 329 CA CYS A 22 -21.144 -10.750 -1.073 1.00 0.00 C ATOM 330 C CYS A 22 -21.594 -10.022 -2.343 1.00 0.00 C ATOM 331 O CYS A 22 -22.441 -9.152 -2.303 1.00 0.00 O ATOM 332 CB CYS A 22 -21.264 -9.831 0.143 1.00 0.00 C ATOM 333 SG CYS A 22 -20.509 -10.631 1.580 1.00 0.00 S ATOM 0 H CYS A 22 -19.450 -12.029 -0.839 1.00 0.00 H new ATOM 0 HA CYS A 22 -21.771 -11.637 -0.979 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -20.772 -8.879 -0.057 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -22.313 -9.612 0.345 1.00 0.00 H new ATOM 338 N PHE A 23 -21.034 -10.371 -3.469 1.00 0.00 N ATOM 339 CA PHE A 23 -21.433 -9.698 -4.738 1.00 0.00 C ATOM 340 C PHE A 23 -22.360 -10.608 -5.548 1.00 0.00 C ATOM 341 O PHE A 23 -21.971 -11.671 -5.990 1.00 0.00 O ATOM 342 CB PHE A 23 -20.122 -9.460 -5.489 1.00 0.00 C ATOM 343 CG PHE A 23 -19.942 -7.979 -5.723 1.00 0.00 C ATOM 344 CD1 PHE A 23 -20.765 -7.309 -6.637 1.00 0.00 C ATOM 345 CD2 PHE A 23 -18.950 -7.276 -5.026 1.00 0.00 C ATOM 346 CE1 PHE A 23 -20.596 -5.935 -6.853 1.00 0.00 C ATOM 347 CE2 PHE A 23 -18.782 -5.902 -5.243 1.00 0.00 C ATOM 348 CZ PHE A 23 -19.606 -5.231 -6.156 1.00 0.00 C ATOM 0 H PHE A 23 -20.319 -11.092 -3.565 1.00 0.00 H new ATOM 0 HA PHE A 23 -21.975 -8.769 -4.562 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -19.284 -9.853 -4.914 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -20.133 -9.991 -6.441 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -21.529 -7.851 -7.175 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -18.315 -7.793 -4.322 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -21.230 -5.418 -7.558 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -18.017 -5.360 -4.706 1.00 0.00 H new ATOM 0 HZ PHE A 23 -19.478 -4.172 -6.322 1.00 0.00 H new ATOM 358 N MET A 24 -23.584 -10.200 -5.746 1.00 0.00 N ATOM 359 CA MET A 24 -24.537 -11.043 -6.527 1.00 0.00 C ATOM 360 C MET A 24 -23.838 -11.643 -7.749 1.00 0.00 C ATOM 361 O MET A 24 -23.079 -10.982 -8.430 1.00 0.00 O ATOM 362 CB MET A 24 -25.649 -10.088 -6.960 1.00 0.00 C ATOM 363 CG MET A 24 -26.489 -10.746 -8.056 1.00 0.00 C ATOM 364 SD MET A 24 -28.056 -9.857 -8.231 1.00 0.00 S ATOM 365 CE MET A 24 -29.149 -11.287 -8.048 1.00 0.00 C ATOM 0 H MET A 24 -23.966 -9.319 -5.401 1.00 0.00 H new ATOM 0 HA MET A 24 -24.922 -11.878 -5.942 1.00 0.00 H new ATOM 0 HB2 MET A 24 -26.279 -9.835 -6.107 1.00 0.00 H new ATOM 0 HB3 MET A 24 -25.220 -9.156 -7.327 1.00 0.00 H new ATOM 0 HG2 MET A 24 -25.946 -10.736 -9.001 1.00 0.00 H new ATOM 0 HG3 MET A 24 -26.677 -11.790 -7.807 1.00 0.00 H new ATOM 0 HE1 MET A 24 -29.851 -11.318 -8.882 1.00 0.00 H new ATOM 0 HE2 MET A 24 -28.555 -12.201 -8.040 1.00 0.00 H new ATOM 0 HE3 MET A 24 -29.701 -11.205 -7.112 1.00 0.00 H new ATOM 375 N GLN A 25 -24.086 -12.893 -8.032 1.00 0.00 N ATOM 376 CA GLN A 25 -23.435 -13.535 -9.209 1.00 0.00 C ATOM 377 C GLN A 25 -24.468 -13.787 -10.311 1.00 0.00 C ATOM 378 O GLN A 25 -24.246 -14.565 -11.217 1.00 0.00 O ATOM 379 CB GLN A 25 -22.880 -14.858 -8.679 1.00 0.00 C ATOM 380 CG GLN A 25 -21.672 -15.279 -9.518 1.00 0.00 C ATOM 381 CD GLN A 25 -21.937 -16.650 -10.142 1.00 0.00 C ATOM 382 OE1 GLN A 25 -22.777 -16.784 -11.009 1.00 0.00 O ATOM 383 NE2 GLN A 25 -21.249 -17.682 -9.735 1.00 0.00 N ATOM 0 H GLN A 25 -24.711 -13.497 -7.499 1.00 0.00 H new ATOM 0 HA GLN A 25 -22.654 -12.911 -9.643 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -22.590 -14.750 -7.634 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -23.650 -15.629 -8.718 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -21.484 -14.542 -10.299 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -20.779 -15.318 -8.895 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -20.544 -17.570 -9.007 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -21.417 -18.601 -10.145 1.00 0.00 H new ATOM 392 N ASN A 26 -25.597 -13.136 -10.239 1.00 0.00 N ATOM 393 CA ASN A 26 -26.644 -13.340 -11.282 1.00 0.00 C ATOM 394 C ASN A 26 -27.027 -12.000 -11.917 1.00 0.00 C ATOM 395 O ASN A 26 -28.133 -11.527 -11.748 1.00 0.00 O ATOM 396 CB ASN A 26 -27.835 -13.940 -10.536 1.00 0.00 C ATOM 397 CG ASN A 26 -28.782 -14.605 -11.537 1.00 0.00 C ATOM 398 OD1 ASN A 26 -28.608 -14.479 -12.732 1.00 0.00 O ATOM 399 ND2 ASN A 26 -29.784 -15.316 -11.095 1.00 0.00 N ATOM 0 H ASN A 26 -25.840 -12.472 -9.504 1.00 0.00 H new ATOM 0 HA ASN A 26 -26.302 -13.987 -12.090 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -27.489 -14.671 -9.805 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -28.361 -13.162 -9.983 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -30.420 -15.765 -11.754 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -29.930 -15.422 -10.091 1.00 0.00 H new ATOM 406 N PRO A 27 -26.092 -11.435 -12.630 1.00 0.00 N ATOM 407 CA PRO A 27 -26.327 -10.135 -13.303 1.00 0.00 C ATOM 408 C PRO A 27 -27.245 -10.318 -14.516 1.00 0.00 C ATOM 409 O PRO A 27 -27.662 -9.365 -15.141 1.00 0.00 O ATOM 410 CB PRO A 27 -24.931 -9.701 -13.740 1.00 0.00 C ATOM 411 CG PRO A 27 -24.147 -10.970 -13.855 1.00 0.00 C ATOM 412 CD PRO A 27 -24.740 -11.950 -12.875 1.00 0.00 C ATOM 0 HA PRO A 27 -26.815 -9.402 -12.660 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -24.963 -9.170 -14.691 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -24.482 -9.025 -13.012 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -24.198 -11.363 -14.870 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.094 -10.793 -13.634 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -24.766 -12.959 -13.286 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -24.158 -11.996 -11.955 1.00 0.00 H new ATOM 420 N GLU A 28 -27.561 -11.540 -14.852 1.00 0.00 N ATOM 421 CA GLU A 28 -28.452 -11.784 -16.023 1.00 0.00 C ATOM 422 C GLU A 28 -29.909 -11.497 -15.649 1.00 0.00 C ATOM 423 O GLU A 28 -30.692 -11.052 -16.465 1.00 0.00 O ATOM 424 CB GLU A 28 -28.266 -13.264 -16.358 1.00 0.00 C ATOM 425 CG GLU A 28 -28.088 -13.428 -17.869 1.00 0.00 C ATOM 426 CD GLU A 28 -26.797 -14.199 -18.151 1.00 0.00 C ATOM 427 OE1 GLU A 28 -25.928 -14.194 -17.294 1.00 0.00 O ATOM 428 OE2 GLU A 28 -26.700 -14.782 -19.219 1.00 0.00 O ATOM 0 H GLU A 28 -27.241 -12.378 -14.367 1.00 0.00 H new ATOM 0 HA GLU A 28 -28.210 -11.140 -16.868 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -27.396 -13.660 -15.834 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -29.130 -13.836 -16.019 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -28.941 -13.960 -18.291 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -28.053 -12.450 -18.350 1.00 0.00 H new ATOM 435 N ASP A 29 -30.277 -11.747 -14.422 1.00 0.00 N ATOM 436 CA ASP A 29 -31.683 -11.488 -13.999 1.00 0.00 C ATOM 437 C ASP A 29 -31.783 -10.128 -13.300 1.00 0.00 C ATOM 438 O ASP A 29 -32.160 -9.139 -13.897 1.00 0.00 O ATOM 439 CB ASP A 29 -32.020 -12.618 -13.027 1.00 0.00 C ATOM 440 CG ASP A 29 -32.550 -13.823 -13.807 1.00 0.00 C ATOM 441 OD1 ASP A 29 -33.751 -13.888 -14.012 1.00 0.00 O ATOM 442 OD2 ASP A 29 -31.747 -14.660 -14.185 1.00 0.00 O ATOM 0 H ASP A 29 -29.666 -12.119 -13.695 1.00 0.00 H new ATOM 0 HA ASP A 29 -32.370 -11.461 -14.845 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -31.133 -12.900 -12.460 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -32.765 -12.282 -12.306 1.00 0.00 H new ATOM 447 N TRP A 30 -31.451 -10.073 -12.040 1.00 0.00 N ATOM 448 CA TRP A 30 -31.527 -8.777 -11.304 1.00 0.00 C ATOM 449 C TRP A 30 -32.959 -8.238 -11.331 1.00 0.00 C ATOM 450 O TRP A 30 -33.521 -7.990 -12.379 1.00 0.00 O ATOM 451 CB TRP A 30 -30.586 -7.837 -12.059 1.00 0.00 C ATOM 452 CG TRP A 30 -30.413 -6.574 -11.279 1.00 0.00 C ATOM 453 CD1 TRP A 30 -29.360 -6.294 -10.477 1.00 0.00 C ATOM 454 CD2 TRP A 30 -31.298 -5.419 -11.211 1.00 0.00 C ATOM 455 NE1 TRP A 30 -29.542 -5.041 -9.921 1.00 0.00 N ATOM 456 CE2 TRP A 30 -30.722 -4.461 -10.342 1.00 0.00 C ATOM 457 CE3 TRP A 30 -32.533 -5.111 -11.814 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -31.349 -3.241 -10.081 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -33.167 -3.884 -11.553 1.00 0.00 C ATOM 460 CH2 TRP A 30 -32.576 -2.952 -10.688 1.00 0.00 C ATOM 0 H TRP A 30 -31.130 -10.868 -11.487 1.00 0.00 H new ATOM 0 HA TRP A 30 -31.246 -8.880 -10.256 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -29.620 -8.318 -12.212 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -30.991 -7.615 -13.046 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -28.515 -6.943 -10.300 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -28.885 -4.599 -9.278 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -32.996 -5.823 -12.482 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -30.890 -2.525 -9.415 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -34.114 -3.658 -12.021 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -33.068 -2.011 -10.490 1.00 0.00 H new ATOM 471 N ASP A 31 -33.554 -8.053 -10.183 1.00 0.00 N ATOM 472 CA ASP A 31 -34.949 -7.529 -10.142 1.00 0.00 C ATOM 473 C ASP A 31 -35.074 -6.443 -9.069 1.00 0.00 C ATOM 474 O ASP A 31 -34.128 -6.134 -8.372 1.00 0.00 O ATOM 475 CB ASP A 31 -35.815 -8.738 -9.784 1.00 0.00 C ATOM 476 CG ASP A 31 -36.998 -8.822 -10.749 1.00 0.00 C ATOM 477 OD1 ASP A 31 -37.753 -7.866 -10.815 1.00 0.00 O ATOM 478 OD2 ASP A 31 -37.131 -9.842 -11.405 1.00 0.00 O ATOM 0 H ASP A 31 -33.134 -8.242 -9.273 1.00 0.00 H new ATOM 0 HA ASP A 31 -35.249 -7.078 -11.088 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -35.223 -9.652 -9.838 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -36.174 -8.651 -8.759 1.00 0.00 H new ATOM 483 N GLU A 32 -36.234 -5.862 -8.932 1.00 0.00 N ATOM 484 CA GLU A 32 -36.416 -4.797 -7.903 1.00 0.00 C ATOM 485 C GLU A 32 -36.265 -5.386 -6.498 1.00 0.00 C ATOM 486 O GLU A 32 -35.359 -5.043 -5.765 1.00 0.00 O ATOM 487 CB GLU A 32 -37.839 -4.278 -8.118 1.00 0.00 C ATOM 488 CG GLU A 32 -38.225 -3.355 -6.962 1.00 0.00 C ATOM 489 CD GLU A 32 -39.387 -3.972 -6.181 1.00 0.00 C ATOM 490 OE1 GLU A 32 -40.387 -4.295 -6.802 1.00 0.00 O ATOM 491 OE2 GLU A 32 -39.258 -4.112 -4.976 1.00 0.00 O ATOM 0 H GLU A 32 -37.063 -6.077 -9.486 1.00 0.00 H new ATOM 0 HA GLU A 32 -35.674 -4.003 -7.995 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -37.902 -3.740 -9.064 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -38.537 -5.113 -8.179 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -37.370 -3.203 -6.303 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -38.510 -2.375 -7.345 1.00 0.00 H new ATOM 498 N LYS A 33 -37.146 -6.271 -6.119 1.00 0.00 N ATOM 499 CA LYS A 33 -37.053 -6.882 -4.761 1.00 0.00 C ATOM 500 C LYS A 33 -35.618 -7.342 -4.486 1.00 0.00 C ATOM 501 O LYS A 33 -35.171 -7.372 -3.357 1.00 0.00 O ATOM 502 CB LYS A 33 -38.001 -8.081 -4.802 1.00 0.00 C ATOM 503 CG LYS A 33 -38.652 -8.264 -3.429 1.00 0.00 C ATOM 504 CD LYS A 33 -37.886 -9.326 -2.637 1.00 0.00 C ATOM 505 CE LYS A 33 -37.713 -8.859 -1.191 1.00 0.00 C ATOM 506 NZ LYS A 33 -38.988 -9.226 -0.514 1.00 0.00 N ATOM 0 H LYS A 33 -37.926 -6.598 -6.690 1.00 0.00 H new ATOM 0 HA LYS A 33 -37.318 -6.179 -3.972 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -38.767 -7.927 -5.562 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -37.454 -8.982 -5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -38.651 -7.319 -2.886 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -39.694 -8.563 -3.546 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -38.425 -10.273 -2.662 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -36.911 -9.502 -3.092 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -36.860 -9.346 -0.718 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -37.534 -7.785 -1.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -38.947 -8.937 0.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -39.781 -8.742 -0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -39.128 -10.255 -0.571 1.00 0.00 H new ATOM 520 N VAL A 34 -34.895 -7.704 -5.510 1.00 0.00 N ATOM 521 CA VAL A 34 -33.491 -8.163 -5.306 1.00 0.00 C ATOM 522 C VAL A 34 -32.605 -6.990 -4.875 1.00 0.00 C ATOM 523 O VAL A 34 -32.050 -6.984 -3.795 1.00 0.00 O ATOM 524 CB VAL A 34 -33.048 -8.696 -6.670 1.00 0.00 C ATOM 525 CG1 VAL A 34 -31.601 -9.181 -6.585 1.00 0.00 C ATOM 526 CG2 VAL A 34 -33.953 -9.861 -7.077 1.00 0.00 C ATOM 0 H VAL A 34 -35.215 -7.702 -6.479 1.00 0.00 H new ATOM 0 HA VAL A 34 -33.414 -8.920 -4.526 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.120 -7.901 -7.412 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -31.287 -9.560 -7.557 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -30.956 -8.352 -6.293 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -31.527 -9.977 -5.844 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.640 -10.243 -8.049 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -33.880 -10.655 -6.334 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -34.985 -9.516 -7.138 1.00 0.00 H new ATOM 536 N ALA A 35 -32.468 -5.998 -5.712 1.00 0.00 N ATOM 537 CA ALA A 35 -31.616 -4.828 -5.351 1.00 0.00 C ATOM 538 C ALA A 35 -31.976 -4.321 -3.951 1.00 0.00 C ATOM 539 O ALA A 35 -31.115 -3.997 -3.157 1.00 0.00 O ATOM 540 CB ALA A 35 -31.936 -3.766 -6.403 1.00 0.00 C ATOM 0 H ALA A 35 -32.909 -5.947 -6.630 1.00 0.00 H new ATOM 0 HA ALA A 35 -30.556 -5.080 -5.334 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -31.347 -2.870 -6.207 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -31.693 -4.150 -7.394 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -32.997 -3.519 -6.360 1.00 0.00 H new ATOM 546 N GLU A 36 -33.242 -4.246 -3.643 1.00 0.00 N ATOM 547 CA GLU A 36 -33.655 -3.757 -2.295 1.00 0.00 C ATOM 548 C GLU A 36 -33.194 -4.733 -1.208 1.00 0.00 C ATOM 549 O GLU A 36 -32.826 -4.335 -0.121 1.00 0.00 O ATOM 550 CB GLU A 36 -35.182 -3.695 -2.350 1.00 0.00 C ATOM 551 CG GLU A 36 -35.742 -3.585 -0.929 1.00 0.00 C ATOM 552 CD GLU A 36 -36.328 -4.933 -0.506 1.00 0.00 C ATOM 553 OE1 GLU A 36 -37.355 -5.307 -1.050 1.00 0.00 O ATOM 554 OE2 GLU A 36 -35.743 -5.568 0.355 1.00 0.00 O ATOM 0 H GLU A 36 -34.008 -4.502 -4.265 1.00 0.00 H new ATOM 0 HA GLU A 36 -33.214 -2.789 -2.055 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -35.500 -2.839 -2.945 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -35.575 -4.586 -2.839 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -34.954 -3.286 -0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -36.511 -2.813 -0.888 1.00 0.00 H new ATOM 561 N TRP A 37 -33.215 -6.007 -1.492 1.00 0.00 N ATOM 562 CA TRP A 37 -32.782 -7.005 -0.473 1.00 0.00 C ATOM 563 C TRP A 37 -31.291 -6.838 -0.160 1.00 0.00 C ATOM 564 O TRP A 37 -30.877 -6.899 0.980 1.00 0.00 O ATOM 565 CB TRP A 37 -33.045 -8.366 -1.117 1.00 0.00 C ATOM 566 CG TRP A 37 -32.432 -9.442 -0.279 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.025 -10.031 0.785 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.123 -10.067 -0.416 1.00 0.00 C ATOM 569 NE1 TRP A 37 -32.163 -10.977 1.311 1.00 0.00 N ATOM 570 CE2 TRP A 37 -30.979 -11.037 0.605 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.057 -9.888 -1.319 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -29.817 -11.802 0.726 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -28.887 -10.657 -1.200 1.00 0.00 C ATOM 574 CH2 TRP A 37 -28.768 -11.612 -0.180 1.00 0.00 C ATOM 0 H TRP A 37 -33.513 -6.400 -2.385 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.316 -6.888 0.470 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.118 -8.533 -1.214 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -32.626 -8.391 -2.123 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -34.010 -9.800 1.162 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -32.377 -11.559 2.121 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -30.139 -9.155 -2.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -29.729 -12.535 1.514 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -28.075 -10.512 -1.898 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -27.867 -12.201 -0.094 1.00 0.00 H new ATOM 585 N LEU A 38 -30.483 -6.631 -1.164 1.00 0.00 N ATOM 586 CA LEU A 38 -29.021 -6.466 -0.922 1.00 0.00 C ATOM 587 C LEU A 38 -28.752 -5.177 -0.138 1.00 0.00 C ATOM 588 O LEU A 38 -28.142 -5.193 0.912 1.00 0.00 O ATOM 589 CB LEU A 38 -28.397 -6.385 -2.316 1.00 0.00 C ATOM 590 CG LEU A 38 -27.121 -7.227 -2.352 1.00 0.00 C ATOM 591 CD1 LEU A 38 -26.454 -7.085 -3.722 1.00 0.00 C ATOM 592 CD2 LEU A 38 -26.160 -6.742 -1.265 1.00 0.00 C ATOM 0 H LEU A 38 -30.771 -6.569 -2.140 1.00 0.00 H new ATOM 0 HA LEU A 38 -28.606 -7.285 -0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -29.104 -6.744 -3.064 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -28.169 -5.349 -2.565 1.00 0.00 H new ATOM 0 HG LEU A 38 -27.371 -8.273 -2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -25.544 -7.685 -3.748 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -27.138 -7.430 -4.497 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -26.204 -6.039 -3.898 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -25.250 -7.342 -1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -25.910 -5.696 -1.441 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -26.634 -6.843 -0.289 1.00 0.00 H new ATOM 604 N ALA A 39 -29.200 -4.060 -0.644 1.00 0.00 N ATOM 605 CA ALA A 39 -28.965 -2.772 0.070 1.00 0.00 C ATOM 606 C ALA A 39 -29.489 -2.853 1.506 1.00 0.00 C ATOM 607 O ALA A 39 -28.959 -2.230 2.406 1.00 0.00 O ATOM 608 CB ALA A 39 -29.749 -1.730 -0.729 1.00 0.00 C ATOM 0 H ALA A 39 -29.718 -3.983 -1.519 1.00 0.00 H new ATOM 0 HA ALA A 39 -27.905 -2.526 0.136 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -29.628 -0.750 -0.267 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -29.374 -1.698 -1.752 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -30.805 -1.998 -0.739 1.00 0.00 H new ATOM 614 N ARG A 40 -30.527 -3.611 1.731 1.00 0.00 N ATOM 615 CA ARG A 40 -31.083 -3.726 3.110 1.00 0.00 C ATOM 616 C ARG A 40 -30.174 -4.599 3.981 1.00 0.00 C ATOM 617 O ARG A 40 -30.000 -4.349 5.157 1.00 0.00 O ATOM 618 CB ARG A 40 -32.451 -4.388 2.934 1.00 0.00 C ATOM 619 CG ARG A 40 -33.115 -4.560 4.301 1.00 0.00 C ATOM 620 CD ARG A 40 -32.701 -5.905 4.905 1.00 0.00 C ATOM 621 NE ARG A 40 -32.513 -5.631 6.357 1.00 0.00 N ATOM 622 CZ ARG A 40 -33.299 -6.192 7.234 1.00 0.00 C ATOM 623 NH1 ARG A 40 -34.568 -5.888 7.264 1.00 0.00 N ATOM 624 NH2 ARG A 40 -32.816 -7.058 8.084 1.00 0.00 N ATOM 0 H ARG A 40 -31.015 -4.156 1.020 1.00 0.00 H new ATOM 0 HA ARG A 40 -31.158 -2.757 3.603 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -33.081 -3.778 2.286 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.338 -5.357 2.448 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -32.822 -3.746 4.964 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -34.199 -4.514 4.199 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -33.466 -6.664 4.742 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -31.782 -6.276 4.451 1.00 0.00 H new ATOM 0 HE ARG A 40 -31.770 -5.005 6.666 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -34.946 -5.211 6.601 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -35.182 -6.327 7.950 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -31.824 -7.296 8.062 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -33.430 -7.497 8.770 1.00 0.00 H new ATOM 638 N GLU A 41 -29.596 -5.622 3.414 1.00 0.00 N ATOM 639 CA GLU A 41 -28.703 -6.510 4.213 1.00 0.00 C ATOM 640 C GLU A 41 -27.383 -5.798 4.523 1.00 0.00 C ATOM 641 O GLU A 41 -26.730 -6.084 5.507 1.00 0.00 O ATOM 642 CB GLU A 41 -28.461 -7.729 3.323 1.00 0.00 C ATOM 643 CG GLU A 41 -29.652 -8.684 3.432 1.00 0.00 C ATOM 644 CD GLU A 41 -29.162 -10.064 3.873 1.00 0.00 C ATOM 645 OE1 GLU A 41 -28.167 -10.120 4.577 1.00 0.00 O ATOM 646 OE2 GLU A 41 -29.791 -11.042 3.501 1.00 0.00 O ATOM 0 H GLU A 41 -29.703 -5.882 2.433 1.00 0.00 H new ATOM 0 HA GLU A 41 -29.144 -6.785 5.171 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -28.326 -7.416 2.288 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -27.545 -8.237 3.625 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -30.377 -8.298 4.149 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -30.162 -8.757 2.471 1.00 0.00 H new ATOM 653 N LEU A 42 -26.983 -4.875 3.691 1.00 0.00 N ATOM 654 CA LEU A 42 -25.704 -4.149 3.941 1.00 0.00 C ATOM 655 C LEU A 42 -25.919 -3.029 4.962 1.00 0.00 C ATOM 656 O LEU A 42 -25.118 -2.829 5.855 1.00 0.00 O ATOM 657 CB LEU A 42 -25.307 -3.567 2.584 1.00 0.00 C ATOM 658 CG LEU A 42 -24.293 -4.492 1.910 1.00 0.00 C ATOM 659 CD1 LEU A 42 -24.912 -5.877 1.716 1.00 0.00 C ATOM 660 CD2 LEU A 42 -23.905 -3.913 0.546 1.00 0.00 C ATOM 0 H LEU A 42 -27.486 -4.592 2.850 1.00 0.00 H new ATOM 0 HA LEU A 42 -24.932 -4.803 4.347 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -26.188 -3.454 1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -24.879 -2.573 2.714 1.00 0.00 H new ATOM 0 HG LEU A 42 -23.406 -4.576 2.538 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -24.188 -6.535 1.235 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -25.190 -6.290 2.685 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -25.799 -5.794 1.089 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -23.182 -4.571 0.064 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.794 -3.829 -0.080 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -23.463 -2.926 0.682 1.00 0.00 H new ATOM 672 N GLU A 43 -26.993 -2.299 4.840 1.00 0.00 N ATOM 673 CA GLU A 43 -27.255 -1.192 5.806 1.00 0.00 C ATOM 674 C GLU A 43 -28.442 -1.546 6.707 1.00 0.00 C ATOM 675 O GLU A 43 -28.275 -2.025 7.810 1.00 0.00 O ATOM 676 CB GLU A 43 -27.583 0.022 4.938 1.00 0.00 C ATOM 677 CG GLU A 43 -26.306 0.822 4.674 1.00 0.00 C ATOM 678 CD GLU A 43 -25.572 0.229 3.471 1.00 0.00 C ATOM 679 OE1 GLU A 43 -24.804 -0.697 3.668 1.00 0.00 O ATOM 680 OE2 GLU A 43 -25.791 0.712 2.371 1.00 0.00 O ATOM 0 H GLU A 43 -27.700 -2.420 4.115 1.00 0.00 H new ATOM 0 HA GLU A 43 -26.404 -1.006 6.461 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -28.024 -0.301 3.995 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.321 0.650 5.437 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -26.552 1.867 4.485 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.662 0.800 5.553 1.00 0.00 H new ATOM 687 N GLY A 44 -29.638 -1.315 6.242 1.00 0.00 N ATOM 688 CA GLY A 44 -30.835 -1.637 7.070 1.00 0.00 C ATOM 689 C GLY A 44 -32.046 -0.877 6.531 1.00 0.00 C ATOM 690 O GLY A 44 -32.873 -0.393 7.280 1.00 0.00 O ATOM 0 H GLY A 44 -29.839 -0.917 5.325 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -31.027 -2.710 7.050 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.655 -1.365 8.110 1.00 0.00 H new ATOM 694 N ILE A 45 -32.158 -0.765 5.236 1.00 0.00 N ATOM 695 CA ILE A 45 -33.316 -0.034 4.645 1.00 0.00 C ATOM 696 C ILE A 45 -34.584 -0.889 4.732 1.00 0.00 C ATOM 697 O ILE A 45 -34.910 -1.625 3.822 1.00 0.00 O ATOM 698 CB ILE A 45 -32.928 0.205 3.187 1.00 0.00 C ATOM 699 CG1 ILE A 45 -31.736 1.163 3.129 1.00 0.00 C ATOM 700 CG2 ILE A 45 -34.113 0.818 2.438 1.00 0.00 C ATOM 701 CD1 ILE A 45 -31.111 1.117 1.734 1.00 0.00 C ATOM 0 H ILE A 45 -31.497 -1.148 4.560 1.00 0.00 H new ATOM 0 HA ILE A 45 -33.528 0.898 5.169 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.656 -0.743 2.722 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -32.060 2.178 3.361 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -30.996 0.885 3.880 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -33.837 0.989 1.398 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -34.962 0.136 2.481 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -34.385 1.766 2.901 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -30.262 1.799 1.693 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -30.772 0.103 1.520 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -31.853 1.416 0.993 1.00 0.00 H new ATOM 713 N GLN A 46 -35.302 -0.794 5.817 1.00 0.00 N ATOM 714 CA GLN A 46 -36.549 -1.599 5.958 1.00 0.00 C ATOM 715 C GLN A 46 -37.374 -1.522 4.671 1.00 0.00 C ATOM 716 O GLN A 46 -38.085 -2.443 4.320 1.00 0.00 O ATOM 717 CB GLN A 46 -37.307 -0.956 7.119 1.00 0.00 C ATOM 718 CG GLN A 46 -37.798 -2.044 8.076 1.00 0.00 C ATOM 719 CD GLN A 46 -38.918 -1.484 8.956 1.00 0.00 C ATOM 720 OE1 GLN A 46 -39.893 -0.957 8.457 1.00 0.00 O ATOM 721 NE2 GLN A 46 -38.819 -1.576 10.254 1.00 0.00 N ATOM 0 H GLN A 46 -35.080 -0.194 6.612 1.00 0.00 H new ATOM 0 HA GLN A 46 -36.342 -2.653 6.141 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -36.658 -0.258 7.648 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -38.153 -0.381 6.741 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -38.160 -2.903 7.511 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -36.974 -2.395 8.697 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -38.001 -2.018 10.673 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -39.560 -1.206 10.849 1.00 0.00 H new ATOM 730 N LYS A 47 -37.283 -0.429 3.964 1.00 0.00 N ATOM 731 CA LYS A 47 -38.059 -0.290 2.698 1.00 0.00 C ATOM 732 C LYS A 47 -37.366 0.701 1.760 1.00 0.00 C ATOM 733 O LYS A 47 -37.002 1.792 2.151 1.00 0.00 O ATOM 734 CB LYS A 47 -39.425 0.246 3.131 1.00 0.00 C ATOM 735 CG LYS A 47 -40.449 -0.889 3.111 1.00 0.00 C ATOM 736 CD LYS A 47 -41.622 -0.502 2.208 1.00 0.00 C ATOM 737 CE LYS A 47 -42.640 -1.645 2.177 1.00 0.00 C ATOM 738 NZ LYS A 47 -43.958 -0.992 2.412 1.00 0.00 N ATOM 0 H LYS A 47 -36.704 0.375 4.208 1.00 0.00 H new ATOM 0 HA LYS A 47 -38.143 -1.233 2.157 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.359 0.673 4.132 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -39.741 1.047 2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -39.984 -1.806 2.749 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -40.805 -1.090 4.121 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -42.093 0.409 2.576 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -41.265 -0.291 1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -42.622 -2.164 1.219 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -42.424 -2.387 2.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -44.708 -1.712 2.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -43.948 -0.512 3.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -44.139 -0.296 1.661 1.00 0.00 H new ATOM 752 N MET A 48 -37.180 0.330 0.522 1.00 0.00 N ATOM 753 CA MET A 48 -36.510 1.251 -0.440 1.00 0.00 C ATOM 754 C MET A 48 -37.281 2.571 -0.532 1.00 0.00 C ATOM 755 O MET A 48 -38.483 2.587 -0.713 1.00 0.00 O ATOM 756 CB MET A 48 -36.540 0.517 -1.781 1.00 0.00 C ATOM 757 CG MET A 48 -35.169 -0.106 -2.054 1.00 0.00 C ATOM 758 SD MET A 48 -33.921 1.202 -2.147 1.00 0.00 S ATOM 759 CE MET A 48 -33.377 0.875 -3.842 1.00 0.00 C ATOM 0 H MET A 48 -37.463 -0.571 0.136 1.00 0.00 H new ATOM 0 HA MET A 48 -35.493 1.498 -0.135 1.00 0.00 H new ATOM 0 HB2 MET A 48 -37.307 -0.258 -1.766 1.00 0.00 H new ATOM 0 HB3 MET A 48 -36.802 1.210 -2.581 1.00 0.00 H new ATOM 0 HG2 MET A 48 -34.914 -0.811 -1.263 1.00 0.00 H new ATOM 0 HG3 MET A 48 -35.192 -0.668 -2.987 1.00 0.00 H new ATOM 0 HE1 MET A 48 -32.406 1.341 -4.009 1.00 0.00 H new ATOM 0 HE2 MET A 48 -33.294 -0.201 -3.996 1.00 0.00 H new ATOM 0 HE3 MET A 48 -34.103 1.287 -4.543 1.00 0.00 H new ATOM 769 N THR A 49 -36.600 3.678 -0.410 1.00 0.00 N ATOM 770 CA THR A 49 -37.298 4.994 -0.490 1.00 0.00 C ATOM 771 C THR A 49 -37.409 5.446 -1.949 1.00 0.00 C ATOM 772 O THR A 49 -36.686 4.987 -2.810 1.00 0.00 O ATOM 773 CB THR A 49 -36.418 5.959 0.307 1.00 0.00 C ATOM 774 OG1 THR A 49 -37.132 7.165 0.541 1.00 0.00 O ATOM 775 CG2 THR A 49 -35.144 6.263 -0.481 1.00 0.00 C ATOM 0 H THR A 49 -35.593 3.729 -0.259 1.00 0.00 H new ATOM 0 HA THR A 49 -38.313 4.948 -0.095 1.00 0.00 H new ATOM 0 HB THR A 49 -36.151 5.503 1.260 1.00 0.00 H new ATOM 0 HG1 THR A 49 -36.570 7.784 1.053 1.00 0.00 H new ATOM 0 HG21 THR A 49 -34.519 6.951 0.089 1.00 0.00 H new ATOM 0 HG22 THR A 49 -34.597 5.337 -0.659 1.00 0.00 H new ATOM 0 HG23 THR A 49 -35.407 6.718 -1.436 1.00 0.00 H new ATOM 783 N GLU A 50 -38.314 6.342 -2.233 1.00 0.00 N ATOM 784 CA GLU A 50 -38.477 6.823 -3.635 1.00 0.00 C ATOM 785 C GLU A 50 -37.162 7.413 -4.155 1.00 0.00 C ATOM 786 O GLU A 50 -36.788 7.211 -5.293 1.00 0.00 O ATOM 787 CB GLU A 50 -39.555 7.905 -3.558 1.00 0.00 C ATOM 788 CG GLU A 50 -40.806 7.436 -4.305 1.00 0.00 C ATOM 789 CD GLU A 50 -41.601 8.653 -4.782 1.00 0.00 C ATOM 790 OE1 GLU A 50 -41.330 9.122 -5.876 1.00 0.00 O ATOM 791 OE2 GLU A 50 -42.468 9.095 -4.047 1.00 0.00 O ATOM 0 H GLU A 50 -38.949 6.763 -1.554 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.752 6.018 -4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -39.799 8.117 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -39.185 8.833 -3.994 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -40.524 6.816 -5.156 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -41.423 6.819 -3.652 1.00 0.00 H new ATOM 798 N GLU A 51 -36.462 8.145 -3.332 1.00 0.00 N ATOM 799 CA GLU A 51 -35.175 8.749 -3.782 1.00 0.00 C ATOM 800 C GLU A 51 -34.210 7.659 -4.257 1.00 0.00 C ATOM 801 O GLU A 51 -33.469 7.843 -5.204 1.00 0.00 O ATOM 802 CB GLU A 51 -34.618 9.458 -2.547 1.00 0.00 C ATOM 803 CG GLU A 51 -35.530 10.630 -2.179 1.00 0.00 C ATOM 804 CD GLU A 51 -35.276 11.038 -0.726 1.00 0.00 C ATOM 805 OE1 GLU A 51 -35.227 10.156 0.116 1.00 0.00 O ATOM 806 OE2 GLU A 51 -35.136 12.224 -0.481 1.00 0.00 O ATOM 0 H GLU A 51 -36.725 8.351 -2.368 1.00 0.00 H new ATOM 0 HA GLU A 51 -35.313 9.433 -4.619 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.550 8.760 -1.713 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.608 9.817 -2.745 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -35.342 11.474 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -36.574 10.347 -2.311 1.00 0.00 H new ATOM 813 N HIS A 52 -34.209 6.527 -3.609 1.00 0.00 N ATOM 814 CA HIS A 52 -33.288 5.430 -4.026 1.00 0.00 C ATOM 815 C HIS A 52 -33.636 4.953 -5.438 1.00 0.00 C ATOM 816 O HIS A 52 -32.854 5.087 -6.359 1.00 0.00 O ATOM 817 CB HIS A 52 -33.523 4.309 -3.013 1.00 0.00 C ATOM 818 CG HIS A 52 -32.526 4.426 -1.893 1.00 0.00 C ATOM 819 ND1 HIS A 52 -32.767 3.895 -0.620 1.00 0.00 N ATOM 820 CD2 HIS A 52 -31.278 5.007 -1.829 1.00 0.00 C ATOM 821 CE1 HIS A 52 -31.689 4.164 0.145 1.00 0.00 C ATOM 822 NE2 HIS A 52 -30.782 4.829 -0.553 1.00 0.00 N ATOM 0 H HIS A 52 -34.805 6.313 -2.809 1.00 0.00 H new ATOM 0 HA HIS A 52 -32.247 5.753 -4.046 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.537 4.368 -2.618 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.426 3.339 -3.500 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -30.774 5.515 -2.638 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -31.581 3.877 1.181 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -29.878 5.152 -0.209 1.00 0.00 H new ATOM 830 N TRP A 53 -34.801 4.395 -5.615 1.00 0.00 N ATOM 831 CA TRP A 53 -35.198 3.904 -6.967 1.00 0.00 C ATOM 832 C TRP A 53 -35.079 5.027 -8.002 1.00 0.00 C ATOM 833 O TRP A 53 -34.881 4.782 -9.175 1.00 0.00 O ATOM 834 CB TRP A 53 -36.653 3.461 -6.815 1.00 0.00 C ATOM 835 CG TRP A 53 -36.692 2.073 -6.258 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.481 1.666 -5.237 1.00 0.00 C ATOM 837 CD2 TRP A 53 -35.923 0.906 -6.672 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.246 0.325 -4.997 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.294 -0.190 -5.856 1.00 0.00 C ATOM 840 CE3 TRP A 53 -34.950 0.695 -7.668 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -35.718 -1.451 -6.023 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.368 -0.573 -7.837 1.00 0.00 C ATOM 843 CH2 TRP A 53 -34.752 -1.643 -7.016 1.00 0.00 C ATOM 0 H TRP A 53 -35.497 4.257 -4.882 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.559 3.092 -7.314 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -37.186 4.145 -6.155 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -37.157 3.492 -7.781 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.180 2.287 -4.697 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -37.718 -0.218 -4.274 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.649 1.513 -8.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.017 -2.273 -5.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -33.622 -0.724 -8.603 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -34.302 -2.615 -7.150 1.00 0.00 H new ATOM 854 N LYS A 54 -35.198 6.257 -7.581 1.00 0.00 N ATOM 855 CA LYS A 54 -35.090 7.388 -8.548 1.00 0.00 C ATOM 856 C LYS A 54 -33.663 7.480 -9.096 1.00 0.00 C ATOM 857 O LYS A 54 -33.418 7.243 -10.264 1.00 0.00 O ATOM 858 CB LYS A 54 -35.433 8.637 -7.736 1.00 0.00 C ATOM 859 CG LYS A 54 -35.908 9.746 -8.679 1.00 0.00 C ATOM 860 CD LYS A 54 -37.131 9.262 -9.461 1.00 0.00 C ATOM 861 CE LYS A 54 -37.996 10.463 -9.849 1.00 0.00 C ATOM 862 NZ LYS A 54 -38.976 9.928 -10.836 1.00 0.00 N ATOM 0 H LYS A 54 -35.365 6.528 -6.612 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.752 7.264 -9.405 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -36.210 8.407 -7.007 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -34.559 8.971 -7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -36.158 10.640 -8.109 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -35.108 10.020 -9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -36.815 8.724 -10.355 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -37.710 8.564 -8.856 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -38.501 10.883 -8.979 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -37.393 11.260 -10.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -39.698 10.650 -11.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -38.482 9.681 -11.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -39.433 9.079 -10.446 1.00 0.00 H new ATOM 876 N LEU A 55 -32.719 7.823 -8.264 1.00 0.00 N ATOM 877 CA LEU A 55 -31.309 7.930 -8.739 1.00 0.00 C ATOM 878 C LEU A 55 -30.909 6.655 -9.486 1.00 0.00 C ATOM 879 O LEU A 55 -30.325 6.703 -10.550 1.00 0.00 O ATOM 880 CB LEU A 55 -30.473 8.094 -7.470 1.00 0.00 C ATOM 881 CG LEU A 55 -28.992 8.174 -7.840 1.00 0.00 C ATOM 882 CD1 LEU A 55 -28.496 9.609 -7.649 1.00 0.00 C ATOM 883 CD2 LEU A 55 -28.190 7.234 -6.939 1.00 0.00 C ATOM 0 H LEU A 55 -32.862 8.034 -7.276 1.00 0.00 H new ATOM 0 HA LEU A 55 -31.166 8.762 -9.429 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -30.775 8.996 -6.937 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -30.646 7.254 -6.797 1.00 0.00 H new ATOM 0 HG LEU A 55 -28.861 7.879 -8.881 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -27.440 9.667 -7.913 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -29.068 10.280 -8.290 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -28.627 9.904 -6.608 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -27.134 7.291 -7.202 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -28.321 7.529 -5.898 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -28.543 6.212 -7.074 1.00 0.00 H new ATOM 895 N VAL A 56 -31.221 5.512 -8.935 1.00 0.00 N ATOM 896 CA VAL A 56 -30.862 4.235 -9.614 1.00 0.00 C ATOM 897 C VAL A 56 -31.410 4.225 -11.043 1.00 0.00 C ATOM 898 O VAL A 56 -30.710 3.912 -11.986 1.00 0.00 O ATOM 899 CB VAL A 56 -31.525 3.142 -8.776 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.573 1.839 -9.575 1.00 0.00 C ATOM 901 CG2 VAL A 56 -30.718 2.923 -7.494 1.00 0.00 C ATOM 0 H VAL A 56 -31.708 5.409 -8.045 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.784 4.094 -9.687 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.540 3.448 -8.521 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -32.046 1.062 -8.975 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -32.148 1.993 -10.488 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.559 1.532 -9.832 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -31.190 2.144 -6.896 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.703 2.619 -7.750 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -30.685 3.850 -6.922 1.00 0.00 H new ATOM 911 N LYS A 57 -32.659 4.567 -11.212 1.00 0.00 N ATOM 912 CA LYS A 57 -33.249 4.579 -12.580 1.00 0.00 C ATOM 913 C LYS A 57 -32.408 5.458 -13.508 1.00 0.00 C ATOM 914 O LYS A 57 -32.111 5.092 -14.627 1.00 0.00 O ATOM 915 CB LYS A 57 -34.649 5.170 -12.404 1.00 0.00 C ATOM 916 CG LYS A 57 -35.584 4.596 -13.471 1.00 0.00 C ATOM 917 CD LYS A 57 -36.274 5.741 -14.215 1.00 0.00 C ATOM 918 CE LYS A 57 -37.179 6.508 -13.247 1.00 0.00 C ATOM 919 NZ LYS A 57 -37.253 7.888 -13.802 1.00 0.00 N ATOM 0 H LYS A 57 -33.295 4.838 -10.462 1.00 0.00 H new ATOM 0 HA LYS A 57 -33.281 3.585 -13.025 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -35.030 4.939 -11.409 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -34.610 6.256 -12.486 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -35.019 3.981 -14.172 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -36.328 3.949 -13.007 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -35.529 6.412 -14.642 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.862 5.348 -15.045 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -38.168 6.053 -13.186 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -36.767 6.510 -12.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -37.857 8.475 -13.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -36.298 8.298 -13.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -37.656 7.856 -14.760 1.00 0.00 H new ATOM 933 N TYR A 58 -32.022 6.618 -13.051 1.00 0.00 N ATOM 934 CA TYR A 58 -31.200 7.520 -13.907 1.00 0.00 C ATOM 935 C TYR A 58 -29.922 6.804 -14.358 1.00 0.00 C ATOM 936 O TYR A 58 -29.662 6.662 -15.536 1.00 0.00 O ATOM 937 CB TYR A 58 -30.858 8.713 -13.014 1.00 0.00 C ATOM 938 CG TYR A 58 -30.466 9.890 -13.875 1.00 0.00 C ATOM 939 CD1 TYR A 58 -29.324 9.816 -14.682 1.00 0.00 C ATOM 940 CD2 TYR A 58 -31.245 11.056 -13.865 1.00 0.00 C ATOM 941 CE1 TYR A 58 -28.960 10.909 -15.482 1.00 0.00 C ATOM 942 CE2 TYR A 58 -30.880 12.147 -14.664 1.00 0.00 C ATOM 943 CZ TYR A 58 -29.738 12.074 -15.472 1.00 0.00 C ATOM 944 OH TYR A 58 -29.380 13.150 -16.260 1.00 0.00 O ATOM 0 H TYR A 58 -32.240 6.980 -12.123 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.729 7.825 -14.810 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.715 8.973 -12.392 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -30.042 8.454 -12.340 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -28.724 8.918 -14.688 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -32.125 11.113 -13.242 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -28.080 10.853 -16.106 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -31.480 13.045 -14.657 1.00 0.00 H new ATOM 0 HH TYR A 58 -30.026 13.876 -16.136 1.00 0.00 H new ATOM 954 N LEU A 59 -29.124 6.353 -13.428 1.00 0.00 N ATOM 955 CA LEU A 59 -27.864 5.647 -13.804 1.00 0.00 C ATOM 956 C LEU A 59 -28.160 4.525 -14.804 1.00 0.00 C ATOM 957 O LEU A 59 -27.361 4.228 -15.670 1.00 0.00 O ATOM 958 CB LEU A 59 -27.331 5.067 -12.493 1.00 0.00 C ATOM 959 CG LEU A 59 -26.253 5.991 -11.925 1.00 0.00 C ATOM 960 CD1 LEU A 59 -25.875 5.532 -10.516 1.00 0.00 C ATOM 961 CD2 LEU A 59 -25.014 5.942 -12.824 1.00 0.00 C ATOM 0 H LEU A 59 -29.289 6.442 -12.425 1.00 0.00 H new ATOM 0 HA LEU A 59 -27.145 6.314 -14.280 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -28.144 4.956 -11.776 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -26.919 4.073 -12.664 1.00 0.00 H new ATOM 0 HG LEU A 59 -26.636 7.011 -11.885 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -25.107 6.191 -10.112 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -26.755 5.565 -9.874 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -25.493 4.512 -10.556 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -24.245 6.600 -12.420 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -24.634 4.921 -12.864 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -25.280 6.269 -13.829 1.00 0.00 H new ATOM 973 N ARG A 60 -29.299 3.900 -14.690 1.00 0.00 N ATOM 974 CA ARG A 60 -29.643 2.795 -15.633 1.00 0.00 C ATOM 975 C ARG A 60 -29.504 3.269 -17.083 1.00 0.00 C ATOM 976 O ARG A 60 -28.790 2.683 -17.872 1.00 0.00 O ATOM 977 CB ARG A 60 -31.098 2.448 -15.320 1.00 0.00 C ATOM 978 CG ARG A 60 -31.268 0.928 -15.305 1.00 0.00 C ATOM 979 CD ARG A 60 -32.752 0.581 -15.166 1.00 0.00 C ATOM 980 NE ARG A 60 -33.257 0.488 -16.565 1.00 0.00 N ATOM 981 CZ ARG A 60 -34.341 1.126 -16.910 1.00 0.00 C ATOM 982 NH1 ARG A 60 -35.362 1.167 -16.098 1.00 0.00 N ATOM 983 NH2 ARG A 60 -34.405 1.724 -18.069 1.00 0.00 N ATOM 0 H ARG A 60 -30.007 4.105 -13.985 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.983 1.935 -15.518 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -31.383 2.866 -14.355 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.757 2.891 -16.066 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -30.868 0.498 -16.223 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -30.704 0.497 -14.478 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -32.889 -0.360 -14.633 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -33.286 1.347 -14.603 1.00 0.00 H new ATOM 0 HE ARG A 60 -32.755 -0.074 -17.252 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -35.313 0.700 -15.193 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -36.209 1.666 -16.369 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -33.607 1.692 -18.704 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -35.253 2.223 -18.339 1.00 0.00 H new ATOM 997 N GLU A 61 -30.188 4.321 -17.441 1.00 0.00 N ATOM 998 CA GLU A 61 -30.100 4.828 -18.841 1.00 0.00 C ATOM 999 C GLU A 61 -28.639 4.894 -19.296 1.00 0.00 C ATOM 1000 O GLU A 61 -28.322 4.621 -20.436 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.710 6.229 -18.794 1.00 0.00 C ATOM 1002 CG GLU A 61 -32.195 6.129 -18.438 1.00 0.00 C ATOM 1003 CD GLU A 61 -33.039 6.357 -19.694 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -32.491 6.830 -20.675 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -34.220 6.053 -19.652 1.00 0.00 O ATOM 0 H GLU A 61 -30.804 4.852 -16.825 1.00 0.00 H new ATOM 0 HA GLU A 61 -30.620 4.179 -19.546 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -30.189 6.839 -18.056 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.589 6.722 -19.758 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -32.413 5.149 -18.014 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -32.448 6.868 -17.678 1.00 0.00 H new ATOM 1012 N TYR A 62 -27.748 5.258 -18.416 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.310 5.343 -18.804 1.00 0.00 C ATOM 1014 C TYR A 62 -25.724 3.942 -18.996 1.00 0.00 C ATOM 1015 O TYR A 62 -24.910 3.714 -19.868 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.626 6.054 -17.635 1.00 0.00 C ATOM 1017 CG TYR A 62 -24.931 7.295 -18.139 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -23.897 7.186 -19.079 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -25.320 8.556 -17.670 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -23.252 8.338 -19.548 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -24.676 9.709 -18.139 1.00 0.00 C ATOM 1022 CZ TYR A 62 -23.641 9.599 -19.078 1.00 0.00 C ATOM 1023 OH TYR A 62 -23.006 10.735 -19.540 1.00 0.00 O ATOM 0 H TYR A 62 -27.952 5.500 -17.446 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.170 5.874 -19.745 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.362 6.319 -16.876 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -24.905 5.387 -17.161 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -23.597 6.214 -19.442 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -26.117 8.640 -16.946 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -22.455 8.254 -20.272 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -24.977 10.681 -17.777 1.00 0.00 H new ATOM 0 HH TYR A 62 -23.398 11.525 -19.114 1.00 0.00 H new ATOM 1033 N TRP A 63 -26.130 3.001 -18.189 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.592 1.616 -18.327 1.00 0.00 C ATOM 1035 C TRP A 63 -26.126 0.960 -19.604 1.00 0.00 C ATOM 1036 O TRP A 63 -25.762 -0.150 -19.939 1.00 0.00 O ATOM 1037 CB TRP A 63 -26.098 0.870 -17.091 1.00 0.00 C ATOM 1038 CG TRP A 63 -25.385 -0.439 -16.975 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -24.139 -0.603 -16.476 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -25.853 -1.765 -17.356 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -23.811 -1.947 -16.525 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -24.835 -2.703 -17.060 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -27.050 -2.241 -17.925 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -24.999 -4.066 -17.318 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -27.218 -3.612 -18.186 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -26.195 -4.522 -17.884 1.00 0.00 C ATOM 0 H TRP A 63 -26.810 3.130 -17.440 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.504 1.603 -18.397 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.929 1.469 -16.196 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -27.173 0.706 -17.166 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -23.504 0.186 -16.101 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -22.922 -2.332 -16.205 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -27.844 -1.548 -18.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -24.208 -4.763 -17.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -28.140 -3.966 -18.622 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -26.330 -5.574 -18.088 1.00 0.00 H new ATOM 1057 N GLU A 64 -26.985 1.634 -20.318 1.00 0.00 N ATOM 1058 CA GLU A 64 -27.538 1.042 -21.571 1.00 0.00 C ATOM 1059 C GLU A 64 -26.973 1.763 -22.798 1.00 0.00 C ATOM 1060 O GLU A 64 -26.898 1.208 -23.876 1.00 0.00 O ATOM 1061 CB GLU A 64 -29.049 1.250 -21.474 1.00 0.00 C ATOM 1062 CG GLU A 64 -29.756 -0.106 -21.513 1.00 0.00 C ATOM 1063 CD GLU A 64 -30.593 -0.284 -20.245 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -30.100 0.056 -19.181 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -31.712 -0.758 -20.358 1.00 0.00 O ATOM 0 H GLU A 64 -27.328 2.567 -20.090 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.277 -0.011 -21.678 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.296 1.774 -20.551 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -29.394 1.875 -22.297 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -30.394 -0.170 -22.394 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.022 -0.908 -21.592 1.00 0.00 H new ATOM 1072 N THR A 65 -26.574 2.997 -22.644 1.00 0.00 N ATOM 1073 CA THR A 65 -26.016 3.750 -23.805 1.00 0.00 C ATOM 1074 C THR A 65 -24.507 3.518 -23.910 1.00 0.00 C ATOM 1075 O THR A 65 -24.030 2.871 -24.821 1.00 0.00 O ATOM 1076 CB THR A 65 -26.317 5.220 -23.506 1.00 0.00 C ATOM 1077 OG1 THR A 65 -27.653 5.342 -23.038 1.00 0.00 O ATOM 1078 CG2 THR A 65 -26.143 6.048 -24.780 1.00 0.00 C ATOM 0 H THR A 65 -26.610 3.516 -21.766 1.00 0.00 H new ATOM 0 HA THR A 65 -26.451 3.431 -24.752 1.00 0.00 H new ATOM 0 HB THR A 65 -25.629 5.584 -22.743 1.00 0.00 H new ATOM 0 HG1 THR A 65 -27.679 5.165 -22.074 1.00 0.00 H new ATOM 0 HG21 THR A 65 -26.358 7.095 -24.566 1.00 0.00 H new ATOM 0 HG22 THR A 65 -25.118 5.954 -25.138 1.00 0.00 H new ATOM 0 HG23 THR A 65 -26.829 5.686 -25.546 1.00 0.00 H new ATOM 1086 N PHE A 66 -23.749 4.043 -22.985 1.00 0.00 N ATOM 1087 CA PHE A 66 -22.272 3.850 -23.033 1.00 0.00 C ATOM 1088 C PHE A 66 -21.871 2.641 -22.184 1.00 0.00 C ATOM 1089 O PHE A 66 -21.086 1.811 -22.600 1.00 0.00 O ATOM 1090 CB PHE A 66 -21.685 5.134 -22.447 1.00 0.00 C ATOM 1091 CG PHE A 66 -21.102 5.976 -23.557 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -20.260 5.391 -24.512 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -21.404 7.343 -23.632 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -19.718 6.173 -25.541 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -20.863 8.124 -24.663 1.00 0.00 C ATOM 1096 CZ PHE A 66 -20.020 7.538 -25.617 1.00 0.00 C ATOM 0 H PHE A 66 -24.089 4.597 -22.199 1.00 0.00 H new ATOM 0 HA PHE A 66 -21.912 3.663 -24.045 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -22.459 5.693 -21.921 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -20.913 4.893 -21.716 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -20.029 4.338 -24.455 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -22.053 7.794 -22.896 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -19.067 5.722 -26.276 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -21.096 9.177 -24.722 1.00 0.00 H new ATOM 0 HZ PHE A 66 -19.603 8.140 -26.411 1.00 0.00 H new ATOM 1106 N GLY A 67 -22.403 2.534 -20.998 1.00 0.00 N ATOM 1107 CA GLY A 67 -22.052 1.380 -20.124 1.00 0.00 C ATOM 1108 C GLY A 67 -20.823 1.730 -19.284 1.00 0.00 C ATOM 1109 O GLY A 67 -19.755 1.181 -19.471 1.00 0.00 O ATOM 0 H GLY A 67 -23.066 3.197 -20.596 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -22.892 1.134 -19.474 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -21.851 0.498 -20.732 1.00 0.00 H new ATOM 1113 N THR A 68 -20.963 2.639 -18.359 1.00 0.00 N ATOM 1114 CA THR A 68 -19.800 3.024 -17.508 1.00 0.00 C ATOM 1115 C THR A 68 -20.280 3.491 -16.131 1.00 0.00 C ATOM 1116 O THR A 68 -21.430 3.839 -15.949 1.00 0.00 O ATOM 1117 CB THR A 68 -19.125 4.173 -18.258 1.00 0.00 C ATOM 1118 OG1 THR A 68 -18.808 3.752 -19.578 1.00 0.00 O ATOM 1119 CG2 THR A 68 -17.844 4.579 -17.528 1.00 0.00 C ATOM 0 H THR A 68 -21.832 3.132 -18.155 1.00 0.00 H new ATOM 0 HA THR A 68 -19.119 2.190 -17.339 1.00 0.00 H new ATOM 0 HB THR A 68 -19.801 5.027 -18.301 1.00 0.00 H new ATOM 0 HG1 THR A 68 -18.377 4.487 -20.061 1.00 0.00 H new ATOM 0 HG21 THR A 68 -17.364 5.398 -18.064 1.00 0.00 H new ATOM 0 HG22 THR A 68 -18.089 4.901 -16.516 1.00 0.00 H new ATOM 0 HG23 THR A 68 -17.165 3.727 -17.483 1.00 0.00 H new ATOM 1127 N CYS A 69 -19.408 3.501 -15.160 1.00 0.00 N ATOM 1128 CA CYS A 69 -19.815 3.946 -13.795 1.00 0.00 C ATOM 1129 C CYS A 69 -19.150 5.284 -13.458 1.00 0.00 C ATOM 1130 O CYS A 69 -18.115 5.320 -12.822 1.00 0.00 O ATOM 1131 CB CYS A 69 -19.317 2.848 -12.856 1.00 0.00 C ATOM 1132 SG CYS A 69 -20.623 1.617 -12.619 1.00 0.00 S ATOM 0 H CYS A 69 -18.432 3.221 -15.252 1.00 0.00 H new ATOM 0 HA CYS A 69 -20.891 4.095 -13.711 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -18.428 2.375 -13.272 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -19.030 3.278 -11.897 1.00 0.00 H new ATOM 1137 N PRO A 70 -19.774 6.341 -13.900 1.00 0.00 N ATOM 1138 CA PRO A 70 -19.242 7.702 -13.647 1.00 0.00 C ATOM 1139 C PRO A 70 -19.456 8.097 -12.183 1.00 0.00 C ATOM 1140 O PRO A 70 -20.120 7.402 -11.442 1.00 0.00 O ATOM 1141 CB PRO A 70 -20.070 8.587 -14.574 1.00 0.00 C ATOM 1142 CG PRO A 70 -21.345 7.835 -14.794 1.00 0.00 C ATOM 1143 CD PRO A 70 -21.023 6.368 -14.669 1.00 0.00 C ATOM 0 HA PRO A 70 -18.171 7.784 -13.830 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -20.260 9.561 -14.124 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -19.551 8.767 -15.515 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -22.096 8.128 -14.061 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -21.757 8.056 -15.778 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -21.819 5.827 -14.156 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -20.900 5.902 -15.647 1.00 0.00 H new ATOM 1151 N PRO A 71 -18.879 9.210 -11.818 1.00 0.00 N ATOM 1152 CA PRO A 71 -19.003 9.714 -10.429 1.00 0.00 C ATOM 1153 C PRO A 71 -20.411 10.263 -10.182 1.00 0.00 C ATOM 1154 O PRO A 71 -21.338 9.969 -10.911 1.00 0.00 O ATOM 1155 CB PRO A 71 -17.964 10.831 -10.361 1.00 0.00 C ATOM 1156 CG PRO A 71 -17.788 11.284 -11.775 1.00 0.00 C ATOM 1157 CD PRO A 71 -18.065 10.095 -12.659 1.00 0.00 C ATOM 0 HA PRO A 71 -18.843 8.942 -9.677 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -18.304 11.648 -9.725 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -17.024 10.471 -9.942 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -18.470 12.102 -12.005 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -16.777 11.657 -11.937 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -18.597 10.386 -13.564 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -17.142 9.608 -12.974 1.00 0.00 H new ATOM 1165 N ILE A 72 -20.579 11.055 -9.160 1.00 0.00 N ATOM 1166 CA ILE A 72 -21.927 11.622 -8.868 1.00 0.00 C ATOM 1167 C ILE A 72 -21.881 13.152 -8.926 1.00 0.00 C ATOM 1168 O ILE A 72 -22.842 13.823 -8.608 1.00 0.00 O ATOM 1169 CB ILE A 72 -22.255 11.149 -7.452 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -23.700 11.524 -7.112 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -21.308 11.821 -6.456 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -24.521 10.251 -6.900 1.00 0.00 C ATOM 0 H ILE A 72 -19.841 11.335 -8.513 1.00 0.00 H new ATOM 0 HA ILE A 72 -22.677 11.300 -9.590 1.00 0.00 H new ATOM 0 HB ILE A 72 -22.135 10.067 -7.394 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -23.725 12.140 -6.213 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -24.132 12.118 -7.917 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -21.542 11.483 -5.446 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -20.279 11.556 -6.697 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -21.427 12.903 -6.514 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -25.550 10.518 -6.658 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -24.506 9.652 -7.811 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -24.093 9.674 -6.080 1.00 0.00 H new ATOM 1184 N LYS A 73 -20.771 13.706 -9.330 1.00 0.00 N ATOM 1185 CA LYS A 73 -20.663 15.192 -9.408 1.00 0.00 C ATOM 1186 C LYS A 73 -21.473 15.719 -10.595 1.00 0.00 C ATOM 1187 O LYS A 73 -22.070 16.776 -10.532 1.00 0.00 O ATOM 1188 CB LYS A 73 -19.173 15.470 -9.609 1.00 0.00 C ATOM 1189 CG LYS A 73 -18.750 16.648 -8.729 1.00 0.00 C ATOM 1190 CD LYS A 73 -17.229 16.638 -8.559 1.00 0.00 C ATOM 1191 CE LYS A 73 -16.870 17.087 -7.141 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.384 18.487 -7.294 1.00 0.00 N ATOM 0 H LYS A 73 -19.934 13.195 -9.610 1.00 0.00 H new ATOM 0 HA LYS A 73 -21.052 15.682 -8.516 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -18.590 14.585 -9.355 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -18.972 15.694 -10.657 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.070 17.587 -9.181 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -19.236 16.581 -7.756 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -16.838 15.637 -8.745 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -16.767 17.301 -9.290 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.736 17.039 -6.480 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -16.102 16.447 -6.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -16.118 18.866 -6.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -15.556 18.500 -7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -17.139 19.074 -7.703 1.00 0.00 H new ATOM 1206 N MET A 74 -21.499 14.991 -11.678 1.00 0.00 N ATOM 1207 CA MET A 74 -22.271 15.452 -12.868 1.00 0.00 C ATOM 1208 C MET A 74 -23.756 15.120 -12.696 1.00 0.00 C ATOM 1209 O MET A 74 -24.606 15.673 -13.364 1.00 0.00 O ATOM 1210 CB MET A 74 -21.681 14.677 -14.047 1.00 0.00 C ATOM 1211 CG MET A 74 -21.135 15.660 -15.083 1.00 0.00 C ATOM 1212 SD MET A 74 -19.701 14.929 -15.911 1.00 0.00 S ATOM 1213 CE MET A 74 -18.510 16.224 -15.488 1.00 0.00 C ATOM 0 H MET A 74 -21.020 14.098 -11.791 1.00 0.00 H new ATOM 0 HA MET A 74 -22.202 16.530 -13.013 1.00 0.00 H new ATOM 0 HB2 MET A 74 -20.885 14.018 -13.701 1.00 0.00 H new ATOM 0 HB3 MET A 74 -22.445 14.044 -14.498 1.00 0.00 H new ATOM 0 HG2 MET A 74 -21.907 15.901 -15.814 1.00 0.00 H new ATOM 0 HG3 MET A 74 -20.852 16.595 -14.599 1.00 0.00 H new ATOM 0 HE1 MET A 74 -17.536 15.973 -15.907 1.00 0.00 H new ATOM 0 HE2 MET A 74 -18.847 17.176 -15.898 1.00 0.00 H new ATOM 0 HE3 MET A 74 -18.429 16.304 -14.404 1.00 0.00 H new ATOM 1223 N VAL A 75 -24.071 14.220 -11.806 1.00 0.00 N ATOM 1224 CA VAL A 75 -25.501 13.853 -11.593 1.00 0.00 C ATOM 1225 C VAL A 75 -26.226 14.969 -10.835 1.00 0.00 C ATOM 1226 O VAL A 75 -27.312 15.375 -11.200 1.00 0.00 O ATOM 1227 CB VAL A 75 -25.461 12.574 -10.756 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -26.888 12.110 -10.462 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -24.720 11.483 -11.532 1.00 0.00 C ATOM 0 H VAL A 75 -23.402 13.723 -11.218 1.00 0.00 H new ATOM 0 HA VAL A 75 -26.035 13.709 -12.532 1.00 0.00 H new ATOM 0 HB VAL A 75 -24.943 12.770 -9.817 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -26.858 11.198 -9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -27.417 12.887 -9.911 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -27.407 11.913 -11.400 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -24.690 10.570 -10.937 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -25.239 11.288 -12.471 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -23.702 11.813 -11.742 1.00 0.00 H new ATOM 1239 N THR A 76 -25.635 15.467 -9.784 1.00 0.00 N ATOM 1240 CA THR A 76 -26.292 16.556 -9.007 1.00 0.00 C ATOM 1241 C THR A 76 -26.478 17.795 -9.888 1.00 0.00 C ATOM 1242 O THR A 76 -27.370 18.592 -9.673 1.00 0.00 O ATOM 1243 CB THR A 76 -25.333 16.856 -7.854 1.00 0.00 C ATOM 1244 OG1 THR A 76 -25.421 15.819 -6.886 1.00 0.00 O ATOM 1245 CG2 THR A 76 -25.706 18.191 -7.211 1.00 0.00 C ATOM 0 H THR A 76 -24.727 15.167 -9.430 1.00 0.00 H new ATOM 0 HA THR A 76 -27.281 16.269 -8.649 1.00 0.00 H new ATOM 0 HB THR A 76 -24.313 16.913 -8.234 1.00 0.00 H new ATOM 0 HG1 THR A 76 -26.146 16.019 -6.258 1.00 0.00 H new ATOM 0 HG21 THR A 76 -25.022 18.403 -6.390 1.00 0.00 H new ATOM 0 HG22 THR A 76 -25.637 18.985 -7.955 1.00 0.00 H new ATOM 0 HG23 THR A 76 -26.726 18.139 -6.829 1.00 0.00 H new ATOM 1253 N LYS A 77 -25.643 17.962 -10.878 1.00 0.00 N ATOM 1254 CA LYS A 77 -25.774 19.148 -11.771 1.00 0.00 C ATOM 1255 C LYS A 77 -27.106 19.101 -12.523 1.00 0.00 C ATOM 1256 O LYS A 77 -27.663 20.119 -12.883 1.00 0.00 O ATOM 1257 CB LYS A 77 -24.602 19.042 -12.748 1.00 0.00 C ATOM 1258 CG LYS A 77 -24.567 20.283 -13.641 1.00 0.00 C ATOM 1259 CD LYS A 77 -24.334 19.863 -15.093 1.00 0.00 C ATOM 1260 CE LYS A 77 -23.968 21.092 -15.928 1.00 0.00 C ATOM 1261 NZ LYS A 77 -24.701 20.916 -17.212 1.00 0.00 N ATOM 0 H LYS A 77 -24.877 17.329 -11.106 1.00 0.00 H new ATOM 0 HA LYS A 77 -25.757 20.086 -11.215 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -23.665 18.950 -12.199 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -24.704 18.145 -13.358 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -25.505 20.831 -13.556 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -23.774 20.956 -13.315 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -23.535 19.124 -15.145 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -25.231 19.391 -15.495 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -24.265 22.013 -15.427 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -22.892 21.152 -16.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -24.500 21.721 -17.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -24.392 20.035 -17.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -25.723 20.869 -17.025 1.00 0.00 H new ATOM 1275 N GLU A 78 -27.621 17.926 -12.763 1.00 0.00 N ATOM 1276 CA GLU A 78 -28.917 17.817 -13.494 1.00 0.00 C ATOM 1277 C GLU A 78 -30.084 17.820 -12.502 1.00 0.00 C ATOM 1278 O GLU A 78 -30.750 18.820 -12.314 1.00 0.00 O ATOM 1279 CB GLU A 78 -28.845 16.480 -14.233 1.00 0.00 C ATOM 1280 CG GLU A 78 -28.985 16.720 -15.738 1.00 0.00 C ATOM 1281 CD GLU A 78 -30.376 17.281 -16.037 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -31.210 17.251 -15.147 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -30.585 17.732 -17.151 1.00 0.00 O ATOM 0 H GLU A 78 -27.202 17.038 -12.486 1.00 0.00 H new ATOM 0 HA GLU A 78 -29.078 18.651 -14.177 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -27.898 15.985 -14.020 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -29.637 15.817 -13.885 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -28.219 17.417 -16.079 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -28.833 15.788 -16.282 1.00 0.00 H new ATOM 1290 N THR A 79 -30.339 16.710 -11.865 1.00 0.00 N ATOM 1291 CA THR A 79 -31.463 16.652 -10.887 1.00 0.00 C ATOM 1292 C THR A 79 -31.318 17.767 -9.848 1.00 0.00 C ATOM 1293 O THR A 79 -32.289 18.236 -9.287 1.00 0.00 O ATOM 1294 CB THR A 79 -31.338 15.280 -10.222 1.00 0.00 C ATOM 1295 OG1 THR A 79 -29.964 14.970 -10.034 1.00 0.00 O ATOM 1296 CG2 THR A 79 -31.987 14.219 -11.111 1.00 0.00 C ATOM 0 H THR A 79 -29.818 15.841 -11.979 1.00 0.00 H new ATOM 0 HA THR A 79 -32.434 16.787 -11.364 1.00 0.00 H new ATOM 0 HB THR A 79 -31.842 15.297 -9.256 1.00 0.00 H new ATOM 0 HG1 THR A 79 -29.882 14.092 -9.607 1.00 0.00 H new ATOM 0 HG21 THR A 79 -31.897 13.242 -10.636 1.00 0.00 H new ATOM 0 HG22 THR A 79 -33.041 14.458 -11.253 1.00 0.00 H new ATOM 0 HG23 THR A 79 -31.486 14.199 -12.079 1.00 0.00 H new ATOM 1304 N GLY A 80 -30.113 18.194 -9.586 1.00 0.00 N ATOM 1305 CA GLY A 80 -29.906 19.278 -8.585 1.00 0.00 C ATOM 1306 C GLY A 80 -30.013 18.697 -7.173 1.00 0.00 C ATOM 1307 O GLY A 80 -29.955 19.413 -6.192 1.00 0.00 O ATOM 0 H GLY A 80 -29.262 17.839 -10.022 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -28.928 19.737 -8.728 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -30.650 20.063 -8.724 1.00 0.00 H new ATOM 1311 N PHE A 81 -30.168 17.406 -7.059 1.00 0.00 N ATOM 1312 CA PHE A 81 -30.278 16.785 -5.709 1.00 0.00 C ATOM 1313 C PHE A 81 -29.034 17.109 -4.877 1.00 0.00 C ATOM 1314 O PHE A 81 -27.919 17.024 -5.353 1.00 0.00 O ATOM 1315 CB PHE A 81 -30.372 15.281 -5.970 1.00 0.00 C ATOM 1316 CG PHE A 81 -31.798 14.823 -5.778 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -32.476 15.124 -4.589 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -32.444 14.098 -6.789 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -33.800 14.699 -4.411 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -33.767 13.674 -6.611 1.00 0.00 C ATOM 1321 CZ PHE A 81 -34.445 13.975 -5.421 1.00 0.00 C ATOM 0 H PHE A 81 -30.223 16.755 -7.842 1.00 0.00 H new ATOM 0 HA PHE A 81 -31.139 17.156 -5.152 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -30.040 15.056 -6.984 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -29.711 14.742 -5.291 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -31.979 15.683 -3.810 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -31.921 13.866 -7.705 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -34.323 14.930 -3.495 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -34.265 13.115 -7.390 1.00 0.00 H new ATOM 0 HZ PHE A 81 -35.465 13.648 -5.284 1.00 0.00 H new ATOM 1331 N SER A 82 -29.215 17.478 -3.639 1.00 0.00 N ATOM 1332 CA SER A 82 -28.041 17.806 -2.780 1.00 0.00 C ATOM 1333 C SER A 82 -27.183 16.557 -2.560 1.00 0.00 C ATOM 1334 O SER A 82 -27.691 15.469 -2.375 1.00 0.00 O ATOM 1335 CB SER A 82 -28.639 18.285 -1.459 1.00 0.00 C ATOM 1336 OG SER A 82 -28.072 19.542 -1.116 1.00 0.00 O ATOM 0 H SER A 82 -30.124 17.567 -3.185 1.00 0.00 H new ATOM 0 HA SER A 82 -27.396 18.559 -3.232 1.00 0.00 H new ATOM 0 HB2 SER A 82 -29.722 18.373 -1.547 1.00 0.00 H new ATOM 0 HB3 SER A 82 -28.442 17.557 -0.672 1.00 0.00 H new ATOM 0 HG SER A 82 -28.455 19.853 -0.269 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.887 16.704 -2.578 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.999 15.525 -2.370 1.00 0.00 C ATOM 1344 C LEU A 83 -25.202 14.951 -0.965 1.00 0.00 C ATOM 1345 O LEU A 83 -25.043 13.768 -0.739 1.00 0.00 O ATOM 1346 CB LEU A 83 -23.578 16.064 -2.531 1.00 0.00 C ATOM 1347 CG LEU A 83 -22.573 14.972 -2.164 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -21.818 14.527 -3.418 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -21.578 15.519 -1.138 1.00 0.00 C ATOM 0 H LEU A 83 -25.404 17.590 -2.728 1.00 0.00 H new ATOM 0 HA LEU A 83 -25.210 14.720 -3.074 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.416 16.391 -3.558 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.434 16.935 -1.892 1.00 0.00 H new ATOM 0 HG LEU A 83 -23.104 14.120 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -21.102 13.749 -3.155 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.526 14.137 -4.149 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -21.288 15.378 -3.845 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -20.861 14.741 -0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -21.049 16.372 -1.563 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -22.115 15.834 -0.243 1.00 0.00 H new ATOM 1361 N GLU A 84 -25.554 15.781 -0.020 1.00 0.00 N ATOM 1362 CA GLU A 84 -25.766 15.280 1.369 1.00 0.00 C ATOM 1363 C GLU A 84 -26.851 14.200 1.379 1.00 0.00 C ATOM 1364 O GLU A 84 -26.655 13.114 1.889 1.00 0.00 O ATOM 1365 CB GLU A 84 -26.220 16.503 2.167 1.00 0.00 C ATOM 1366 CG GLU A 84 -25.217 16.782 3.288 1.00 0.00 C ATOM 1367 CD GLU A 84 -25.968 16.996 4.604 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -27.117 16.594 4.679 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -25.380 17.555 5.515 1.00 0.00 O ATOM 0 H GLU A 84 -25.704 16.782 -0.149 1.00 0.00 H new ATOM 0 HA GLU A 84 -24.866 14.832 1.789 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -26.299 17.370 1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -27.211 16.330 2.586 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -24.523 15.947 3.385 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -24.624 17.664 3.048 1.00 0.00 H new ATOM 1376 N LYS A 85 -27.993 14.487 0.816 1.00 0.00 N ATOM 1377 CA LYS A 85 -29.085 13.473 0.792 1.00 0.00 C ATOM 1378 C LYS A 85 -28.537 12.127 0.313 1.00 0.00 C ATOM 1379 O LYS A 85 -28.917 11.082 0.801 1.00 0.00 O ATOM 1380 CB LYS A 85 -30.113 14.019 -0.198 1.00 0.00 C ATOM 1381 CG LYS A 85 -31.378 14.432 0.557 1.00 0.00 C ATOM 1382 CD LYS A 85 -31.365 15.946 0.784 1.00 0.00 C ATOM 1383 CE LYS A 85 -32.014 16.648 -0.411 1.00 0.00 C ATOM 1384 NZ LYS A 85 -33.477 16.584 -0.146 1.00 0.00 N ATOM 0 H LYS A 85 -28.217 15.378 0.373 1.00 0.00 H new ATOM 0 HA LYS A 85 -29.521 13.308 1.777 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -29.700 14.874 -0.733 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -30.353 13.262 -0.944 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -32.263 14.146 -0.011 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -31.431 13.911 1.513 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -31.903 16.192 1.700 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -30.341 16.296 0.913 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -31.673 17.680 -0.496 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -31.760 16.150 -1.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -33.994 16.588 -1.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -33.698 15.711 0.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -33.763 17.408 0.421 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.640 12.147 -0.635 1.00 0.00 N ATOM 1399 CA ILE A 86 -27.062 10.869 -1.140 1.00 0.00 C ATOM 1400 C ILE A 86 -26.096 10.289 -0.103 1.00 0.00 C ATOM 1401 O ILE A 86 -25.991 9.091 0.060 1.00 0.00 O ATOM 1402 CB ILE A 86 -26.317 11.249 -2.420 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -27.327 11.460 -3.551 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -25.352 10.126 -2.805 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -26.595 11.912 -4.814 1.00 0.00 C ATOM 0 H ILE A 86 -27.283 12.992 -1.081 1.00 0.00 H new ATOM 0 HA ILE A 86 -27.823 10.111 -1.326 1.00 0.00 H new ATOM 0 HB ILE A 86 -25.755 12.168 -2.253 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.870 10.535 -3.745 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -28.065 12.207 -3.259 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -24.822 10.399 -3.718 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -24.633 9.972 -2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -25.912 9.206 -2.972 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -27.315 12.062 -5.618 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -26.072 12.848 -4.616 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -25.875 11.149 -5.110 1.00 0.00 H new ATOM 1417 N TYR A 87 -25.395 11.134 0.603 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.442 10.634 1.634 1.00 0.00 C ATOM 1419 C TYR A 87 -25.197 9.850 2.710 1.00 0.00 C ATOM 1420 O TYR A 87 -24.686 8.907 3.279 1.00 0.00 O ATOM 1421 CB TYR A 87 -23.811 11.892 2.233 1.00 0.00 C ATOM 1422 CG TYR A 87 -22.374 12.000 1.783 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -21.536 10.879 1.838 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -21.879 13.222 1.309 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -20.202 10.980 1.420 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -20.544 13.323 0.891 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.706 12.202 0.947 1.00 0.00 C ATOM 1428 OH TYR A 87 -18.393 12.301 0.536 1.00 0.00 O ATOM 0 H TYR A 87 -25.441 12.149 0.510 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.693 9.962 1.215 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -24.368 12.775 1.920 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -23.860 11.853 3.321 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -21.918 9.937 2.203 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -22.525 14.086 1.265 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -19.556 10.115 1.463 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -20.162 14.265 0.526 1.00 0.00 H new ATOM 0 HH TYR A 87 -18.212 13.216 0.236 1.00 0.00 H new ATOM 1438 N GLN A 88 -26.410 10.237 2.994 1.00 0.00 N ATOM 1439 CA GLN A 88 -27.200 9.515 4.034 1.00 0.00 C ATOM 1440 C GLN A 88 -27.865 8.276 3.427 1.00 0.00 C ATOM 1441 O GLN A 88 -27.792 7.192 3.969 1.00 0.00 O ATOM 1442 CB GLN A 88 -28.256 10.520 4.498 1.00 0.00 C ATOM 1443 CG GLN A 88 -28.915 10.013 5.782 1.00 0.00 C ATOM 1444 CD GLN A 88 -30.242 10.744 5.998 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -31.291 10.130 6.009 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -30.242 12.037 6.170 1.00 0.00 N ATOM 0 H GLN A 88 -26.889 11.021 2.552 1.00 0.00 H new ATOM 0 HA GLN A 88 -26.578 9.168 4.859 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -27.796 11.492 4.673 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -29.008 10.658 3.721 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -29.086 8.939 5.716 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -28.254 10.179 6.633 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -29.362 12.553 6.161 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -31.122 12.532 6.314 1.00 0.00 H new ATOM 1455 N LEU A 89 -28.513 8.430 2.304 1.00 0.00 N ATOM 1456 CA LEU A 89 -29.181 7.261 1.662 1.00 0.00 C ATOM 1457 C LEU A 89 -28.160 6.154 1.386 1.00 0.00 C ATOM 1458 O LEU A 89 -28.487 4.984 1.366 1.00 0.00 O ATOM 1459 CB LEU A 89 -29.750 7.801 0.350 1.00 0.00 C ATOM 1460 CG LEU A 89 -30.824 8.849 0.651 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -31.124 9.650 -0.617 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -32.099 8.150 1.125 1.00 0.00 C ATOM 0 H LEU A 89 -28.609 9.314 1.804 1.00 0.00 H new ATOM 0 HA LEU A 89 -29.955 6.829 2.296 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -28.954 8.243 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -30.176 6.987 -0.236 1.00 0.00 H new ATOM 0 HG LEU A 89 -30.467 9.522 1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -31.889 10.397 -0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -30.216 10.148 -0.956 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -31.482 8.977 -1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -32.864 8.896 1.340 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -32.456 7.477 0.345 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -31.886 7.578 2.028 1.00 0.00 H new ATOM 1474 N PHE A 90 -26.924 6.517 1.175 1.00 0.00 N ATOM 1475 CA PHE A 90 -25.880 5.488 0.900 1.00 0.00 C ATOM 1476 C PHE A 90 -24.680 5.699 1.825 1.00 0.00 C ATOM 1477 O PHE A 90 -24.571 6.718 2.478 1.00 0.00 O ATOM 1478 CB PHE A 90 -25.477 5.713 -0.558 1.00 0.00 C ATOM 1479 CG PHE A 90 -26.360 4.886 -1.460 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -26.216 3.492 -1.495 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -27.322 5.511 -2.264 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -27.035 2.725 -2.335 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -28.141 4.744 -3.103 1.00 0.00 C ATOM 1484 CZ PHE A 90 -27.998 3.350 -3.138 1.00 0.00 C ATOM 0 H PHE A 90 -26.592 7.481 1.181 1.00 0.00 H new ATOM 0 HA PHE A 90 -26.242 4.474 1.071 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -25.568 6.769 -0.812 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -24.432 5.439 -0.704 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -25.475 3.009 -0.875 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -27.432 6.585 -2.237 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -26.924 1.651 -2.363 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -28.882 5.227 -3.723 1.00 0.00 H new ATOM 0 HZ PHE A 90 -28.630 2.758 -3.784 1.00 0.00 H new ATOM 1494 N PRO A 91 -23.815 4.724 1.848 1.00 0.00 N ATOM 1495 CA PRO A 91 -22.604 4.801 2.699 1.00 0.00 C ATOM 1496 C PRO A 91 -21.601 5.795 2.105 1.00 0.00 C ATOM 1497 O PRO A 91 -21.890 6.481 1.145 1.00 0.00 O ATOM 1498 CB PRO A 91 -22.049 3.380 2.664 1.00 0.00 C ATOM 1499 CG PRO A 91 -22.567 2.793 1.389 1.00 0.00 C ATOM 1500 CD PRO A 91 -23.881 3.471 1.090 1.00 0.00 C ATOM 0 HA PRO A 91 -22.811 5.145 3.712 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -20.959 3.381 2.684 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -22.383 2.805 3.528 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -21.858 2.951 0.576 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -22.703 1.716 1.488 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -24.001 3.656 0.023 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -24.726 2.859 1.404 1.00 0.00 H new ATOM 1508 N SER A 92 -20.428 5.880 2.669 1.00 0.00 N ATOM 1509 CA SER A 92 -19.414 6.832 2.132 1.00 0.00 C ATOM 1510 C SER A 92 -18.974 6.401 0.731 1.00 0.00 C ATOM 1511 O SER A 92 -18.090 5.582 0.571 1.00 0.00 O ATOM 1512 CB SER A 92 -18.243 6.756 3.110 1.00 0.00 C ATOM 1513 OG SER A 92 -17.717 8.061 3.314 1.00 0.00 O ATOM 0 H SER A 92 -20.128 5.333 3.476 1.00 0.00 H new ATOM 0 HA SER A 92 -19.805 7.846 2.043 1.00 0.00 H new ATOM 0 HB2 SER A 92 -18.573 6.332 4.058 1.00 0.00 H new ATOM 0 HB3 SER A 92 -17.469 6.096 2.718 1.00 0.00 H new ATOM 0 HG SER A 92 -16.966 8.017 3.942 1.00 0.00 H new ATOM 1519 N GLY A 93 -19.584 6.944 -0.287 1.00 0.00 N ATOM 1520 CA GLY A 93 -19.200 6.565 -1.676 1.00 0.00 C ATOM 1521 C GLY A 93 -20.447 6.142 -2.454 1.00 0.00 C ATOM 1522 O GLY A 93 -20.678 4.968 -2.665 1.00 0.00 O ATOM 0 H GLY A 93 -20.332 7.634 -0.217 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.716 7.406 -2.173 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -18.478 5.749 -1.655 1.00 0.00 H new ATOM 1526 N PRO A 94 -21.210 7.120 -2.856 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.451 6.853 -3.624 1.00 0.00 C ATOM 1528 C PRO A 94 -22.113 6.422 -5.053 1.00 0.00 C ATOM 1529 O PRO A 94 -22.970 5.999 -5.804 1.00 0.00 O ATOM 1530 CB PRO A 94 -23.172 8.199 -3.618 1.00 0.00 C ATOM 1531 CG PRO A 94 -22.091 9.217 -3.426 1.00 0.00 C ATOM 1532 CD PRO A 94 -20.992 8.554 -2.636 1.00 0.00 C ATOM 0 HA PRO A 94 -23.054 6.050 -3.200 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -23.708 8.364 -4.553 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.908 8.249 -2.816 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.716 9.567 -4.388 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -22.473 10.090 -2.896 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.007 8.866 -2.984 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -21.052 8.809 -1.578 1.00 0.00 H new ATOM 1540 N ALA A 95 -20.869 6.525 -5.436 1.00 0.00 N ATOM 1541 CA ALA A 95 -20.478 6.122 -6.817 1.00 0.00 C ATOM 1542 C ALA A 95 -20.484 4.596 -6.945 1.00 0.00 C ATOM 1543 O ALA A 95 -21.476 3.999 -7.313 1.00 0.00 O ATOM 1544 CB ALA A 95 -19.063 6.670 -7.003 1.00 0.00 C ATOM 0 H ALA A 95 -20.107 6.871 -4.853 1.00 0.00 H new ATOM 0 HA ALA A 95 -21.166 6.506 -7.570 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -18.702 6.414 -7.999 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -19.075 7.754 -6.888 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -18.402 6.233 -6.254 1.00 0.00 H new ATOM 1550 N HIS A 96 -19.384 3.962 -6.646 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.327 2.476 -6.753 1.00 0.00 C ATOM 1552 C HIS A 96 -20.565 1.849 -6.104 1.00 0.00 C ATOM 1553 O HIS A 96 -21.030 0.805 -6.515 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.063 2.073 -5.993 1.00 0.00 C ATOM 1555 CG HIS A 96 -16.876 2.170 -6.911 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -16.655 1.258 -7.931 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -15.836 3.065 -6.976 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -15.521 1.621 -8.560 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -14.983 2.716 -8.019 1.00 0.00 N ATOM 0 H HIS A 96 -18.522 4.408 -6.332 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.307 2.138 -7.789 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -17.922 2.722 -5.129 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -18.162 1.056 -5.614 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -15.701 3.911 -6.318 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -15.098 1.090 -9.400 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -14.130 3.194 -8.308 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.101 2.478 -5.095 1.00 0.00 N ATOM 1568 CA GLY A 97 -22.307 1.917 -4.423 1.00 0.00 C ATOM 1569 C GLY A 97 -23.483 1.913 -5.401 1.00 0.00 C ATOM 1570 O GLY A 97 -24.016 0.875 -5.740 1.00 0.00 O ATOM 0 H GLY A 97 -20.756 3.356 -4.707 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -22.105 0.903 -4.077 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -22.555 2.510 -3.543 1.00 0.00 H new ATOM 1574 N ALA A 98 -23.889 3.065 -5.860 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.030 3.126 -6.816 1.00 0.00 C ATOM 1576 C ALA A 98 -24.876 2.049 -7.894 1.00 0.00 C ATOM 1577 O ALA A 98 -25.745 1.222 -8.087 1.00 0.00 O ATOM 1578 CB ALA A 98 -24.950 4.520 -7.438 1.00 0.00 C ATOM 0 H ALA A 98 -23.480 3.966 -5.614 1.00 0.00 H new ATOM 0 HA ALA A 98 -25.988 2.951 -6.327 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -25.760 4.645 -8.157 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -25.040 5.273 -6.655 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -23.993 4.637 -7.946 1.00 0.00 H new ATOM 1584 N CYS A 99 -23.775 2.052 -8.596 1.00 0.00 N ATOM 1585 CA CYS A 99 -23.568 1.028 -9.661 1.00 0.00 C ATOM 1586 C CYS A 99 -23.906 -0.367 -9.127 1.00 0.00 C ATOM 1587 O CYS A 99 -24.664 -1.104 -9.725 1.00 0.00 O ATOM 1588 CB CYS A 99 -22.084 1.121 -10.016 1.00 0.00 C ATOM 1589 SG CYS A 99 -21.835 2.441 -11.229 1.00 0.00 S ATOM 0 H CYS A 99 -23.011 2.718 -8.479 1.00 0.00 H new ATOM 0 HA CYS A 99 -24.206 1.199 -10.528 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -21.497 1.321 -9.120 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -21.736 0.171 -10.420 1.00 0.00 H new ATOM 1594 N LYS A 100 -23.350 -0.735 -8.004 1.00 0.00 N ATOM 1595 CA LYS A 100 -23.641 -2.081 -7.434 1.00 0.00 C ATOM 1596 C LYS A 100 -25.153 -2.288 -7.311 1.00 0.00 C ATOM 1597 O LYS A 100 -25.669 -3.352 -7.593 1.00 0.00 O ATOM 1598 CB LYS A 100 -22.986 -2.077 -6.053 1.00 0.00 C ATOM 1599 CG LYS A 100 -22.483 -3.484 -5.720 1.00 0.00 C ATOM 1600 CD LYS A 100 -22.372 -3.639 -4.202 1.00 0.00 C ATOM 1601 CE LYS A 100 -21.611 -2.446 -3.621 1.00 0.00 C ATOM 1602 NZ LYS A 100 -21.364 -2.804 -2.196 1.00 0.00 N ATOM 0 H LYS A 100 -22.707 -0.162 -7.457 1.00 0.00 H new ATOM 0 HA LYS A 100 -23.261 -2.886 -8.063 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -22.157 -1.369 -6.034 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -23.703 -1.748 -5.300 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -23.166 -4.231 -6.124 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -21.512 -3.655 -6.186 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -23.366 -3.701 -3.759 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.856 -4.567 -3.957 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -20.675 -2.277 -4.154 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -22.194 -1.528 -3.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -20.845 -2.033 -1.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -22.273 -2.952 -1.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.801 -3.677 -2.150 1.00 0.00 H new ATOM 1616 N VAL A 101 -25.868 -1.279 -6.893 1.00 0.00 N ATOM 1617 CA VAL A 101 -27.346 -1.420 -6.753 1.00 0.00 C ATOM 1618 C VAL A 101 -27.973 -1.779 -8.103 1.00 0.00 C ATOM 1619 O VAL A 101 -28.717 -2.733 -8.217 1.00 0.00 O ATOM 1620 CB VAL A 101 -27.832 -0.048 -6.283 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -29.355 -0.066 -6.146 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -27.202 0.278 -4.928 1.00 0.00 C ATOM 0 H VAL A 101 -25.493 -0.364 -6.643 1.00 0.00 H new ATOM 0 HA VAL A 101 -27.622 -2.211 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 101 -27.542 0.710 -7.011 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.702 0.912 -5.811 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -29.804 -0.299 -7.111 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -29.646 -0.823 -5.418 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -27.548 1.256 -4.592 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -27.492 -0.480 -4.200 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -26.116 0.291 -5.025 1.00 0.00 H new ATOM 1632 N ALA A 102 -27.678 -1.023 -9.124 1.00 0.00 N ATOM 1633 CA ALA A 102 -28.259 -1.322 -10.465 1.00 0.00 C ATOM 1634 C ALA A 102 -27.788 -2.696 -10.950 1.00 0.00 C ATOM 1635 O ALA A 102 -28.444 -3.343 -11.743 1.00 0.00 O ATOM 1636 CB ALA A 102 -27.727 -0.219 -11.381 1.00 0.00 C ATOM 0 H ALA A 102 -27.061 -0.212 -9.089 1.00 0.00 H new ATOM 0 HA ALA A 102 -29.349 -1.347 -10.448 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -28.110 -0.368 -12.390 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -28.053 0.752 -11.009 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.638 -0.254 -11.398 1.00 0.00 H new ATOM 1642 N GLY A 103 -26.657 -3.147 -10.481 1.00 0.00 N ATOM 1643 CA GLY A 103 -26.147 -4.478 -10.916 1.00 0.00 C ATOM 1644 C GLY A 103 -24.982 -4.286 -11.888 1.00 0.00 C ATOM 1645 O GLY A 103 -25.054 -4.657 -13.042 1.00 0.00 O ATOM 0 H GLY A 103 -26.064 -2.651 -9.815 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -25.821 -5.055 -10.050 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -26.944 -5.046 -11.395 1.00 0.00 H new ATOM 1649 N ALA A 104 -23.905 -3.708 -11.429 1.00 0.00 N ATOM 1650 CA ALA A 104 -22.734 -3.491 -12.327 1.00 0.00 C ATOM 1651 C ALA A 104 -22.038 -4.824 -12.618 1.00 0.00 C ATOM 1652 O ALA A 104 -21.837 -5.627 -11.729 1.00 0.00 O ATOM 1653 CB ALA A 104 -21.804 -2.561 -11.548 1.00 0.00 C ATOM 0 H ALA A 104 -23.785 -3.377 -10.472 1.00 0.00 H new ATOM 0 HA ALA A 104 -23.024 -3.066 -13.288 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -20.915 -2.353 -12.144 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -22.322 -1.627 -11.331 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -21.511 -3.039 -10.613 1.00 0.00 H new