USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 940 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 101 LYS NZ :NH3+ -171:sc= 0.945 (180deg=0.89) USER MOD Set 1.2: A 105 HIS : no HE2:sc=-0.00277 X(o=0.94,f=0.72) USER MOD Set 2.1: A 76 CYS SG : rot -44:sc= 0.557 USER MOD Set 2.2: A 77 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 56 LYS NZ :NH3+ -154:sc= -0.767 (180deg=-1.12) USER MOD Set 3.2: A 62 TYR OH : rot 141:sc= -2.22 USER MOD Single : A 8 ASN : amide:sc= 0.791 K(o=0.79,f=-4.5!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.00331 USER MOD Single : A 21 THR OG1 : rot 86:sc= 0.919 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -33:sc= -0.502 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.161 K(o=-0.16,f=-2.2!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 111:sc= 0.625 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 151:sc= -0.155 (180deg=-0.637) USER MOD Single : A 60 HIS : no HD1:sc= -2.06! K(o=-2.1!,f=-1.5) USER MOD Single : A 61 ASN : amide:sc= -0.234 X(o=-0.23,f=-0.71) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.219 K(o=-0.22,f=-2.4!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= -0.0904 X(o=-0.09,f=0.0073) USER MOD Single : A 98 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 68:sc= 0.0317 USER MOD Single : A 103 THR OG1 : rot 72:sc= 1.29 USER MOD Single : A 117 ASN : amide:sc= -1.21 K(o=-1.2,f=-5.5!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 CYS SG : rot -66:sc= -0.721 USER MOD Single : A 124 LYS NZ :NH3+ -117:sc= 0.0283 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 1.186 18.631 3.836 1.00 0.00 N ATOM 60 CA GLY A 7 2.016 17.550 4.334 1.00 0.00 C ATOM 61 C GLY A 7 1.385 16.829 5.509 1.00 0.00 C ATOM 62 O GLY A 7 1.357 15.600 5.550 1.00 0.00 O ATOM 0 HA2 GLY A 7 2.200 16.837 3.530 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.985 17.949 4.634 1.00 0.00 H new ATOM 66 N ASN A 8 0.879 17.597 6.470 1.00 0.00 N ATOM 67 CA ASN A 8 0.248 17.024 7.653 1.00 0.00 C ATOM 68 C ASN A 8 -0.999 16.229 7.273 1.00 0.00 C ATOM 69 O ASN A 8 -1.259 15.160 7.825 1.00 0.00 O ATOM 70 CB ASN A 8 -0.120 18.128 8.645 1.00 0.00 C ATOM 71 CG ASN A 8 -0.576 19.399 7.954 1.00 0.00 C ATOM 72 OD1 ASN A 8 0.168 19.996 7.176 1.00 0.00 O ATOM 73 ND2 ASN A 8 -1.804 19.818 8.236 1.00 0.00 N ATOM 0 H ASN A 8 0.894 18.617 6.452 1.00 0.00 H new ATOM 0 HA ASN A 8 0.961 16.346 8.123 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -0.912 17.772 9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 8 0.742 18.349 9.274 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -2.166 20.667 7.801 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -2.386 19.291 8.887 1.00 0.00 H new ATOM 80 N THR A 9 -1.767 16.760 6.327 1.00 0.00 N ATOM 81 CA THR A 9 -2.986 16.102 5.873 1.00 0.00 C ATOM 82 C THR A 9 -2.714 14.656 5.476 1.00 0.00 C ATOM 83 O THR A 9 -3.451 13.746 5.861 1.00 0.00 O ATOM 84 CB THR A 9 -3.612 16.842 4.677 1.00 0.00 C ATOM 85 OG1 THR A 9 -3.657 18.249 4.940 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.016 16.329 4.397 1.00 0.00 C ATOM 0 H THR A 9 -1.566 17.644 5.860 1.00 0.00 H new ATOM 0 HA THR A 9 -3.686 16.121 6.708 1.00 0.00 H new ATOM 0 HB THR A 9 -2.993 16.656 3.800 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.055 18.712 4.174 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.437 16.867 3.548 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.975 15.264 4.168 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.643 16.488 5.274 1.00 0.00 H new ATOM 94 N LEU A 10 -1.653 14.448 4.704 1.00 0.00 N ATOM 95 CA LEU A 10 -1.284 13.110 4.254 1.00 0.00 C ATOM 96 C LEU A 10 -0.706 12.290 5.403 1.00 0.00 C ATOM 97 O LEU A 10 -1.035 11.115 5.567 1.00 0.00 O ATOM 98 CB LEU A 10 -0.269 13.196 3.113 1.00 0.00 C ATOM 99 CG LEU A 10 -0.852 13.266 1.701 1.00 0.00 C ATOM 100 CD1 LEU A 10 -1.086 14.711 1.290 1.00 0.00 C ATOM 101 CD2 LEU A 10 0.069 12.570 0.709 1.00 0.00 C ATOM 0 H LEU A 10 -1.033 15.189 4.377 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.185 12.613 3.894 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.353 14.077 3.272 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.387 12.328 3.171 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.812 12.750 1.700 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.501 14.740 0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.785 15.178 1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.140 15.252 1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.361 12.629 -0.291 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.044 13.057 0.714 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.185 11.524 0.992 1.00 0.00 H new ATOM 113 N ARG A 11 0.155 12.918 6.197 1.00 0.00 N ATOM 114 CA ARG A 11 0.778 12.247 7.331 1.00 0.00 C ATOM 115 C ARG A 11 -0.188 11.256 7.974 1.00 0.00 C ATOM 116 O ARG A 11 0.107 10.066 8.078 1.00 0.00 O ATOM 117 CB ARG A 11 1.238 13.273 8.369 1.00 0.00 C ATOM 118 CG ARG A 11 2.054 12.671 9.501 1.00 0.00 C ATOM 119 CD ARG A 11 2.169 13.630 10.676 1.00 0.00 C ATOM 120 NE ARG A 11 0.861 14.068 11.155 1.00 0.00 N ATOM 121 CZ ARG A 11 0.677 15.153 11.898 1.00 0.00 C ATOM 122 NH1 ARG A 11 1.711 15.907 12.245 1.00 0.00 N ATOM 123 NH2 ARG A 11 -0.544 15.487 12.296 1.00 0.00 N ATOM 0 H ARG A 11 0.437 13.891 6.076 1.00 0.00 H new ATOM 0 HA ARG A 11 1.645 11.698 6.964 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.833 14.039 7.871 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.363 13.771 8.788 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.589 11.742 9.832 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.050 12.417 9.138 1.00 0.00 H new ATOM 0 HD2 ARG A 11 2.709 13.144 11.489 1.00 0.00 H new ATOM 0 HD3 ARG A 11 2.756 14.499 10.378 1.00 0.00 H new ATOM 0 HE ARG A 11 0.044 13.510 10.905 1.00 0.00 H new ATOM 0 HH11 ARG A 11 2.651 15.654 11.941 1.00 0.00 H new ATOM 0 HH12 ARG A 11 1.566 16.740 12.816 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -1.342 14.910 12.031 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -0.684 16.321 12.867 1.00 0.00 H new ATOM 137 N GLU A 12 -1.342 11.757 8.404 1.00 0.00 N ATOM 138 CA GLU A 12 -2.350 10.915 9.038 1.00 0.00 C ATOM 139 C GLU A 12 -2.698 9.722 8.152 1.00 0.00 C ATOM 140 O GLU A 12 -2.727 8.580 8.612 1.00 0.00 O ATOM 141 CB GLU A 12 -3.611 11.728 9.337 1.00 0.00 C ATOM 142 CG GLU A 12 -3.565 12.455 10.670 1.00 0.00 C ATOM 143 CD GLU A 12 -4.926 12.964 11.104 1.00 0.00 C ATOM 144 OE1 GLU A 12 -5.679 12.186 11.726 1.00 0.00 O ATOM 145 OE2 GLU A 12 -5.238 14.140 10.822 1.00 0.00 O ATOM 0 H GLU A 12 -1.602 12.740 8.325 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.937 10.541 9.975 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.761 12.457 8.540 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.474 11.062 9.326 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -3.172 11.783 11.433 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.873 13.294 10.598 1.00 0.00 H new ATOM 152 N LEU A 13 -2.964 9.996 6.879 1.00 0.00 N ATOM 153 CA LEU A 13 -3.311 8.947 5.927 1.00 0.00 C ATOM 154 C LEU A 13 -2.209 7.895 5.850 1.00 0.00 C ATOM 155 O LEU A 13 -2.464 6.702 6.014 1.00 0.00 O ATOM 156 CB LEU A 13 -3.556 9.548 4.542 1.00 0.00 C ATOM 157 CG LEU A 13 -4.134 8.600 3.492 1.00 0.00 C ATOM 158 CD1 LEU A 13 -5.642 8.481 3.652 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.781 9.077 2.091 1.00 0.00 C ATOM 0 H LEU A 13 -2.946 10.936 6.483 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.225 8.464 6.273 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.234 10.395 4.650 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.611 9.942 4.166 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.695 7.614 3.640 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.036 7.802 2.896 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -5.873 8.093 4.644 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.099 9.463 3.531 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.201 8.390 1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.192 10.074 1.932 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.697 9.109 1.980 1.00 0.00 H new ATOM 171 N ARG A 14 -0.984 8.346 5.601 1.00 0.00 N ATOM 172 CA ARG A 14 0.157 7.444 5.503 1.00 0.00 C ATOM 173 C ARG A 14 0.135 6.416 6.630 1.00 0.00 C ATOM 174 O ARG A 14 0.122 5.209 6.384 1.00 0.00 O ATOM 175 CB ARG A 14 1.465 8.236 5.546 1.00 0.00 C ATOM 176 CG ARG A 14 2.704 7.375 5.364 1.00 0.00 C ATOM 177 CD ARG A 14 3.920 8.000 6.031 1.00 0.00 C ATOM 178 NE ARG A 14 4.978 7.021 6.267 1.00 0.00 N ATOM 179 CZ ARG A 14 6.148 7.323 6.819 1.00 0.00 C ATOM 180 NH1 ARG A 14 6.408 8.569 7.190 1.00 0.00 N ATOM 181 NH2 ARG A 14 7.061 6.377 7.001 1.00 0.00 N ATOM 0 H ARG A 14 -0.756 9.331 5.463 1.00 0.00 H new ATOM 0 HA ARG A 14 0.091 6.916 4.552 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.444 8.998 4.767 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.533 8.758 6.500 1.00 0.00 H new ATOM 0 HG2 ARG A 14 2.526 6.385 5.784 1.00 0.00 H new ATOM 0 HG3 ARG A 14 2.901 7.239 4.301 1.00 0.00 H new ATOM 0 HD2 ARG A 14 4.304 8.805 5.404 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.623 8.449 6.979 1.00 0.00 H new ATOM 0 HE ARG A 14 4.809 6.053 5.993 1.00 0.00 H new ATOM 0 HH11 ARG A 14 5.709 9.299 7.052 1.00 0.00 H new ATOM 0 HH12 ARG A 14 7.307 8.798 7.614 1.00 0.00 H new ATOM 0 HH21 ARG A 14 6.865 5.417 6.717 1.00 0.00 H new ATOM 0 HH22 ARG A 14 7.959 6.610 7.425 1.00 0.00 H new ATOM 195 N LEU A 15 0.132 6.901 7.867 1.00 0.00 N ATOM 196 CA LEU A 15 0.112 6.024 9.032 1.00 0.00 C ATOM 197 C LEU A 15 -1.137 5.148 9.034 1.00 0.00 C ATOM 198 O LEU A 15 -1.060 3.940 9.254 1.00 0.00 O ATOM 199 CB LEU A 15 0.171 6.851 10.318 1.00 0.00 C ATOM 200 CG LEU A 15 1.463 7.634 10.554 1.00 0.00 C ATOM 201 CD1 LEU A 15 1.229 8.765 11.543 1.00 0.00 C ATOM 202 CD2 LEU A 15 2.565 6.709 11.049 1.00 0.00 C ATOM 0 H LEU A 15 0.143 7.897 8.089 1.00 0.00 H new ATOM 0 HA LEU A 15 0.987 5.376 8.983 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.661 7.555 10.312 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.016 6.182 11.164 1.00 0.00 H new ATOM 0 HG LEU A 15 1.780 8.068 9.606 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.160 9.311 11.698 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.472 9.443 11.148 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.887 8.353 12.493 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.477 7.284 11.211 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.257 6.245 11.986 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.752 5.935 10.305 1.00 0.00 H new ATOM 214 N PHE A 16 -2.286 5.766 8.786 1.00 0.00 N ATOM 215 CA PHE A 16 -3.552 5.043 8.757 1.00 0.00 C ATOM 216 C PHE A 16 -3.493 3.881 7.771 1.00 0.00 C ATOM 217 O PHE A 16 -3.517 2.714 8.166 1.00 0.00 O ATOM 218 CB PHE A 16 -4.696 5.988 8.381 1.00 0.00 C ATOM 219 CG PHE A 16 -5.975 5.277 8.045 1.00 0.00 C ATOM 220 CD1 PHE A 16 -6.807 4.808 9.049 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.346 5.078 6.725 1.00 0.00 C ATOM 222 CE1 PHE A 16 -7.984 4.152 8.742 1.00 0.00 C ATOM 223 CE2 PHE A 16 -7.523 4.424 6.412 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.343 3.961 7.422 1.00 0.00 C ATOM 0 H PHE A 16 -2.367 6.766 8.602 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.734 4.642 9.754 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.877 6.673 9.209 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.391 6.593 7.527 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.533 4.957 10.083 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.708 5.438 5.931 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.623 3.789 9.534 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -7.801 4.275 5.379 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.263 3.450 7.180 1.00 0.00 H new ATOM 234 N LEU A 17 -3.415 4.207 6.485 1.00 0.00 N ATOM 235 CA LEU A 17 -3.352 3.191 5.440 1.00 0.00 C ATOM 236 C LEU A 17 -2.482 2.016 5.875 1.00 0.00 C ATOM 237 O LEU A 17 -2.960 0.888 5.996 1.00 0.00 O ATOM 238 CB LEU A 17 -2.805 3.796 4.146 1.00 0.00 C ATOM 239 CG LEU A 17 -3.566 5.001 3.594 1.00 0.00 C ATOM 240 CD1 LEU A 17 -2.819 5.611 2.418 1.00 0.00 C ATOM 241 CD2 LEU A 17 -4.975 4.600 3.182 1.00 0.00 C ATOM 0 H LEU A 17 -3.394 5.167 6.141 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.363 2.824 5.262 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.770 4.092 4.316 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.792 3.019 3.382 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.639 5.751 4.381 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.376 6.468 2.038 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.831 5.936 2.744 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.714 4.867 1.628 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.502 5.471 2.791 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.924 3.831 2.411 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.510 4.210 4.048 1.00 0.00 H new ATOM 253 N ARG A 18 -1.202 2.290 6.108 1.00 0.00 N ATOM 254 CA ARG A 18 -0.265 1.256 6.530 1.00 0.00 C ATOM 255 C ARG A 18 -0.883 0.367 7.606 1.00 0.00 C ATOM 256 O ARG A 18 -0.767 -0.857 7.557 1.00 0.00 O ATOM 257 CB ARG A 18 1.024 1.889 7.056 1.00 0.00 C ATOM 258 CG ARG A 18 2.231 0.969 6.979 1.00 0.00 C ATOM 259 CD ARG A 18 3.519 1.710 7.303 1.00 0.00 C ATOM 260 NE ARG A 18 4.601 0.797 7.659 1.00 0.00 N ATOM 261 CZ ARG A 18 4.735 0.248 8.861 1.00 0.00 C ATOM 262 NH1 ARG A 18 3.858 0.518 9.818 1.00 0.00 N ATOM 263 NH2 ARG A 18 5.747 -0.574 9.108 1.00 0.00 N ATOM 0 H ARG A 18 -0.791 3.218 6.012 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.031 0.638 5.663 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.232 2.795 6.487 1.00 0.00 H new ATOM 0 HB3 ARG A 18 0.874 2.191 8.093 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.102 0.140 7.675 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.299 0.539 5.980 1.00 0.00 H new ATOM 0 HD2 ARG A 18 3.819 2.309 6.443 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.342 2.401 8.127 1.00 0.00 H new ATOM 0 HE ARG A 18 5.293 0.568 6.945 1.00 0.00 H new ATOM 0 HH11 ARG A 18 3.078 1.149 9.632 1.00 0.00 H new ATOM 0 HH12 ARG A 18 3.963 0.095 10.740 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.423 -0.785 8.374 1.00 0.00 H new ATOM 0 HH22 ARG A 18 5.849 -0.995 10.032 1.00 0.00 H new ATOM 277 N ASP A 19 -1.540 0.993 8.577 1.00 0.00 N ATOM 278 CA ASP A 19 -2.178 0.260 9.664 1.00 0.00 C ATOM 279 C ASP A 19 -3.193 -0.741 9.123 1.00 0.00 C ATOM 280 O ASP A 19 -3.257 -1.884 9.576 1.00 0.00 O ATOM 281 CB ASP A 19 -2.863 1.229 10.628 1.00 0.00 C ATOM 282 CG ASP A 19 -3.312 0.552 11.909 1.00 0.00 C ATOM 283 OD1 ASP A 19 -2.525 -0.239 12.468 1.00 0.00 O ATOM 284 OD2 ASP A 19 -4.450 0.814 12.351 1.00 0.00 O ATOM 0 H ASP A 19 -1.644 2.006 8.633 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.405 -0.289 10.201 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -2.177 2.041 10.871 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.726 1.677 10.136 1.00 0.00 H new ATOM 289 N VAL A 20 -3.987 -0.304 8.151 1.00 0.00 N ATOM 290 CA VAL A 20 -5.000 -1.162 7.547 1.00 0.00 C ATOM 291 C VAL A 20 -4.375 -2.423 6.962 1.00 0.00 C ATOM 292 O VAL A 20 -4.625 -3.532 7.436 1.00 0.00 O ATOM 293 CB VAL A 20 -5.773 -0.423 6.438 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.880 -1.304 5.881 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.338 0.887 6.966 1.00 0.00 C ATOM 0 H VAL A 20 -3.949 0.639 7.765 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.694 -1.439 8.341 1.00 0.00 H new ATOM 0 HB VAL A 20 -5.081 -0.194 5.627 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.415 -0.765 5.099 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.446 -2.213 5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.573 -1.566 6.680 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.881 1.396 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -7.016 0.683 7.795 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.522 1.522 7.312 1.00 0.00 H new ATOM 305 N THR A 21 -3.559 -2.247 5.927 1.00 0.00 N ATOM 306 CA THR A 21 -2.897 -3.370 5.276 1.00 0.00 C ATOM 307 C THR A 21 -2.123 -4.212 6.283 1.00 0.00 C ATOM 308 O THR A 21 -2.286 -5.431 6.347 1.00 0.00 O ATOM 309 CB THR A 21 -1.932 -2.892 4.174 1.00 0.00 C ATOM 310 OG1 THR A 21 -2.672 -2.496 3.014 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.947 -3.991 3.804 1.00 0.00 C ATOM 0 H THR A 21 -3.341 -1.337 5.522 1.00 0.00 H new ATOM 0 HA THR A 21 -3.680 -3.979 4.824 1.00 0.00 H new ATOM 0 HB THR A 21 -1.372 -2.038 4.556 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.947 -1.560 3.105 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.276 -3.631 3.024 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.366 -4.270 4.683 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.493 -4.861 3.439 1.00 0.00 H new ATOM 319 N LYS A 22 -1.279 -3.555 7.072 1.00 0.00 N ATOM 320 CA LYS A 22 -0.480 -4.242 8.079 1.00 0.00 C ATOM 321 C LYS A 22 -1.312 -5.289 8.813 1.00 0.00 C ATOM 322 O LYS A 22 -0.981 -6.475 8.804 1.00 0.00 O ATOM 323 CB LYS A 22 0.091 -3.235 9.081 1.00 0.00 C ATOM 324 CG LYS A 22 1.116 -3.834 10.028 1.00 0.00 C ATOM 325 CD LYS A 22 1.732 -2.774 10.925 1.00 0.00 C ATOM 326 CE LYS A 22 0.923 -2.581 12.199 1.00 0.00 C ATOM 327 NZ LYS A 22 1.623 -1.698 13.173 1.00 0.00 N ATOM 0 H LYS A 22 -1.131 -2.547 7.033 1.00 0.00 H new ATOM 0 HA LYS A 22 0.342 -4.747 7.572 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.551 -2.412 8.534 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.727 -2.812 9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.642 -4.600 10.641 1.00 0.00 H new ATOM 0 HG3 LYS A 22 1.900 -4.326 9.453 1.00 0.00 H new ATOM 0 HD2 LYS A 22 2.752 -3.061 11.181 1.00 0.00 H new ATOM 0 HD3 LYS A 22 1.792 -1.829 10.385 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -0.047 -2.151 11.951 1.00 0.00 H new ATOM 0 HE3 LYS A 22 0.734 -3.551 12.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 1.039 -1.592 14.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.538 -2.121 13.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 1.781 -0.764 12.744 1.00 0.00 H new ATOM 341 N ARG A 23 -2.392 -4.843 9.445 1.00 0.00 N ATOM 342 CA ARG A 23 -3.271 -5.742 10.183 1.00 0.00 C ATOM 343 C ARG A 23 -3.436 -7.068 9.445 1.00 0.00 C ATOM 344 O ARG A 23 -3.451 -8.135 10.060 1.00 0.00 O ATOM 345 CB ARG A 23 -4.639 -5.091 10.395 1.00 0.00 C ATOM 346 CG ARG A 23 -5.374 -5.606 11.622 1.00 0.00 C ATOM 347 CD ARG A 23 -4.839 -4.975 12.898 1.00 0.00 C ATOM 348 NE ARG A 23 -5.316 -3.606 13.073 1.00 0.00 N ATOM 349 CZ ARG A 23 -4.835 -2.771 13.988 1.00 0.00 C ATOM 350 NH1 ARG A 23 -3.869 -3.165 14.806 1.00 0.00 N ATOM 351 NH2 ARG A 23 -5.320 -1.540 14.085 1.00 0.00 N ATOM 0 H ARG A 23 -2.680 -3.865 9.461 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.816 -5.940 11.153 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -4.509 -4.013 10.486 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -5.255 -5.265 9.513 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -6.438 -5.391 11.527 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -5.272 -6.690 11.680 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -5.142 -5.577 13.755 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -3.749 -4.979 12.875 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.059 -3.272 12.459 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -3.494 -4.111 14.734 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -3.501 -2.522 15.508 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -6.063 -1.234 13.457 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -4.950 -0.900 14.788 1.00 0.00 H new ATOM 365 N LEU A 24 -3.560 -6.993 8.125 1.00 0.00 N ATOM 366 CA LEU A 24 -3.724 -8.186 7.302 1.00 0.00 C ATOM 367 C LEU A 24 -2.470 -9.054 7.345 1.00 0.00 C ATOM 368 O LEU A 24 -2.501 -10.184 7.830 1.00 0.00 O ATOM 369 CB LEU A 24 -4.039 -7.795 5.858 1.00 0.00 C ATOM 370 CG LEU A 24 -5.284 -6.932 5.652 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.247 -6.257 4.290 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.545 -7.770 5.800 1.00 0.00 C ATOM 0 H LEU A 24 -3.550 -6.118 7.601 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.557 -8.763 7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.180 -7.261 5.452 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.153 -8.707 5.272 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.295 -6.157 6.418 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.141 -5.647 4.162 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.363 -5.623 4.222 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.210 -7.016 3.509 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.421 -7.139 5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.541 -8.568 5.057 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.578 -8.205 6.799 1.00 0.00 H new ATOM 384 N ALA A 25 -1.367 -8.515 6.835 1.00 0.00 N ATOM 385 CA ALA A 25 -0.102 -9.238 6.818 1.00 0.00 C ATOM 386 C ALA A 25 0.144 -9.945 8.146 1.00 0.00 C ATOM 387 O ALA A 25 0.255 -11.171 8.199 1.00 0.00 O ATOM 388 CB ALA A 25 1.045 -8.288 6.504 1.00 0.00 C ATOM 0 H ALA A 25 -1.325 -7.580 6.428 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.156 -9.996 6.037 1.00 0.00 H new ATOM 0 HB1 ALA A 25 1.984 -8.842 6.495 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.883 -7.832 5.527 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.091 -7.509 7.265 1.00 0.00 H new ATOM 394 N THR A 26 0.230 -9.166 9.220 1.00 0.00 N ATOM 395 CA THR A 26 0.464 -9.717 10.548 1.00 0.00 C ATOM 396 C THR A 26 -0.240 -11.058 10.719 1.00 0.00 C ATOM 397 O THR A 26 0.397 -12.075 10.991 1.00 0.00 O ATOM 398 CB THR A 26 -0.016 -8.753 11.650 1.00 0.00 C ATOM 399 OG1 THR A 26 -1.375 -8.373 11.409 1.00 0.00 O ATOM 400 CG2 THR A 26 0.862 -7.512 11.703 1.00 0.00 C ATOM 0 H THR A 26 0.141 -8.150 9.195 1.00 0.00 H new ATOM 0 HA THR A 26 1.540 -9.860 10.645 1.00 0.00 H new ATOM 0 HB THR A 26 0.052 -9.268 12.608 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.538 -8.336 10.443 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.504 -6.846 12.488 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.891 -7.803 11.915 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.821 -6.996 10.744 1.00 0.00 H new ATOM 408 N ASP A 27 -1.559 -11.052 10.559 1.00 0.00 N ATOM 409 CA ASP A 27 -2.351 -12.269 10.694 1.00 0.00 C ATOM 410 C ASP A 27 -1.746 -13.405 9.875 1.00 0.00 C ATOM 411 O ASP A 27 -1.003 -13.170 8.921 1.00 0.00 O ATOM 412 CB ASP A 27 -3.793 -12.017 10.251 1.00 0.00 C ATOM 413 CG ASP A 27 -4.750 -13.073 10.766 1.00 0.00 C ATOM 414 OD1 ASP A 27 -4.433 -13.712 11.790 1.00 0.00 O ATOM 415 OD2 ASP A 27 -5.817 -13.262 10.144 1.00 0.00 O ATOM 0 H ASP A 27 -2.102 -10.218 10.336 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.347 -12.560 11.744 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -4.113 -11.037 10.606 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -3.836 -11.992 9.162 1.00 0.00 H new ATOM 420 N LYS A 28 -2.068 -14.637 10.253 1.00 0.00 N ATOM 421 CA LYS A 28 -1.557 -15.811 9.555 1.00 0.00 C ATOM 422 C LYS A 28 -2.486 -16.213 8.414 1.00 0.00 C ATOM 423 O LYS A 28 -2.149 -17.073 7.600 1.00 0.00 O ATOM 424 CB LYS A 28 -1.394 -16.979 10.530 1.00 0.00 C ATOM 425 CG LYS A 28 -2.692 -17.401 11.196 1.00 0.00 C ATOM 426 CD LYS A 28 -2.545 -18.735 11.908 1.00 0.00 C ATOM 427 CE LYS A 28 -3.882 -19.236 12.434 1.00 0.00 C ATOM 428 NZ LYS A 28 -4.207 -18.655 13.766 1.00 0.00 N ATOM 0 H LYS A 28 -2.681 -14.849 11.040 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.583 -15.558 9.135 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.976 -17.832 9.995 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.674 -16.701 11.300 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.000 -16.638 11.911 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.480 -17.472 10.446 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.124 -19.470 11.222 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.843 -18.632 12.735 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.670 -18.981 11.725 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.859 -20.323 12.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -5.125 -19.021 14.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -3.469 -18.919 14.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -4.254 -17.619 13.691 1.00 0.00 H new ATOM 442 N ARG A 29 -3.656 -15.584 8.361 1.00 0.00 N ATOM 443 CA ARG A 29 -4.634 -15.877 7.319 1.00 0.00 C ATOM 444 C ARG A 29 -4.326 -15.089 6.049 1.00 0.00 C ATOM 445 O ARG A 29 -4.419 -15.618 4.941 1.00 0.00 O ATOM 446 CB ARG A 29 -6.045 -15.547 7.808 1.00 0.00 C ATOM 447 CG ARG A 29 -6.516 -16.431 8.951 1.00 0.00 C ATOM 448 CD ARG A 29 -6.695 -17.873 8.503 1.00 0.00 C ATOM 449 NE ARG A 29 -7.149 -18.732 9.593 1.00 0.00 N ATOM 450 CZ ARG A 29 -8.377 -18.690 10.099 1.00 0.00 C ATOM 451 NH1 ARG A 29 -9.268 -17.836 9.616 1.00 0.00 N ATOM 452 NH2 ARG A 29 -8.715 -19.504 11.091 1.00 0.00 N ATOM 0 H ARG A 29 -3.950 -14.869 9.027 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.577 -16.941 7.089 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -6.075 -14.506 8.129 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.741 -15.644 6.975 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -5.794 -16.389 9.766 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -7.460 -16.050 9.342 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.416 -17.912 7.686 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -5.750 -18.251 8.113 1.00 0.00 H new ATOM 0 HE ARG A 29 -6.488 -19.401 9.988 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -9.012 -17.209 8.854 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -10.210 -17.806 10.007 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -8.032 -20.162 11.466 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -9.658 -19.471 11.479 1.00 0.00 H new ATOM 466 N PHE A 30 -3.961 -13.823 6.218 1.00 0.00 N ATOM 467 CA PHE A 30 -3.642 -12.962 5.085 1.00 0.00 C ATOM 468 C PHE A 30 -2.132 -12.812 4.924 1.00 0.00 C ATOM 469 O PHE A 30 -1.643 -11.767 4.496 1.00 0.00 O ATOM 470 CB PHE A 30 -4.286 -11.585 5.266 1.00 0.00 C ATOM 471 CG PHE A 30 -5.750 -11.647 5.598 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.655 -12.188 4.699 1.00 0.00 C ATOM 473 CD2 PHE A 30 -6.220 -11.164 6.808 1.00 0.00 C ATOM 474 CE1 PHE A 30 -8.002 -12.247 5.001 1.00 0.00 C ATOM 475 CE2 PHE A 30 -7.566 -11.220 7.116 1.00 0.00 C ATOM 476 CZ PHE A 30 -8.459 -11.761 6.211 1.00 0.00 C ATOM 0 H PHE A 30 -3.879 -13.370 7.128 1.00 0.00 H new ATOM 0 HA PHE A 30 -4.042 -13.427 4.184 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.764 -11.050 6.059 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.153 -11.007 4.351 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -6.303 -12.568 3.751 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.527 -10.739 7.519 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.697 -12.672 4.292 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.920 -10.841 8.063 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.512 -11.804 6.449 1.00 0.00 H new ATOM 486 N ASN A 31 -1.399 -13.865 5.271 1.00 0.00 N ATOM 487 CA ASN A 31 0.056 -13.851 5.166 1.00 0.00 C ATOM 488 C ASN A 31 0.510 -14.415 3.823 1.00 0.00 C ATOM 489 O ASN A 31 1.405 -13.867 3.180 1.00 0.00 O ATOM 490 CB ASN A 31 0.677 -14.659 6.307 1.00 0.00 C ATOM 491 CG ASN A 31 2.063 -14.167 6.676 1.00 0.00 C ATOM 492 OD1 ASN A 31 2.515 -13.129 6.192 1.00 0.00 O ATOM 493 ND2 ASN A 31 2.746 -14.912 7.537 1.00 0.00 N ATOM 0 H ASN A 31 -1.788 -14.738 5.627 1.00 0.00 H new ATOM 0 HA ASN A 31 0.391 -12.816 5.237 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.030 -14.603 7.182 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.732 -15.708 6.017 1.00 0.00 H new ATOM 0 HD21 ASN A 31 3.684 -14.631 7.822 1.00 0.00 H new ATOM 0 HD22 ASN A 31 2.332 -15.765 7.913 1.00 0.00 H new ATOM 500 N ILE A 32 -0.114 -15.511 3.406 1.00 0.00 N ATOM 501 CA ILE A 32 0.225 -16.148 2.139 1.00 0.00 C ATOM 502 C ILE A 32 0.292 -15.124 1.011 1.00 0.00 C ATOM 503 O ILE A 32 1.006 -15.317 0.026 1.00 0.00 O ATOM 504 CB ILE A 32 -0.796 -17.239 1.767 1.00 0.00 C ATOM 505 CG1 ILE A 32 -2.175 -16.619 1.531 1.00 0.00 C ATOM 506 CG2 ILE A 32 -0.865 -18.296 2.859 1.00 0.00 C ATOM 507 CD1 ILE A 32 -3.098 -17.492 0.710 1.00 0.00 C ATOM 0 H ILE A 32 -0.857 -15.977 3.927 1.00 0.00 H new ATOM 0 HA ILE A 32 1.205 -16.608 2.268 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.471 -17.719 0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.642 -16.415 2.494 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.052 -15.660 1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.591 -19.060 2.581 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.116 -18.756 2.983 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.169 -17.831 3.797 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -4.057 -16.989 0.583 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.652 -17.675 -0.267 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.252 -18.442 1.222 1.00 0.00 H new ATOM 519 N PHE A 33 -0.453 -14.035 1.162 1.00 0.00 N ATOM 520 CA PHE A 33 -0.477 -12.979 0.157 1.00 0.00 C ATOM 521 C PHE A 33 0.774 -12.111 0.249 1.00 0.00 C ATOM 522 O PHE A 33 1.361 -11.738 -0.767 1.00 0.00 O ATOM 523 CB PHE A 33 -1.727 -12.113 0.326 1.00 0.00 C ATOM 524 CG PHE A 33 -3.010 -12.862 0.106 1.00 0.00 C ATOM 525 CD1 PHE A 33 -3.511 -13.045 -1.173 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.716 -13.383 1.178 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.691 -13.734 -1.379 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.896 -14.074 0.979 1.00 0.00 C ATOM 529 CZ PHE A 33 -5.385 -14.248 -0.301 1.00 0.00 C ATOM 0 H PHE A 33 -1.049 -13.860 1.971 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.499 -13.449 -0.826 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.732 -11.688 1.330 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.678 -11.279 -0.374 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.973 -12.644 -2.019 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.340 -13.248 2.181 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.070 -13.870 -2.381 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -5.435 -14.478 1.823 1.00 0.00 H new ATOM 0 HZ PHE A 33 -6.309 -14.785 -0.459 1.00 0.00 H new ATOM 539 N SER A 34 1.175 -11.791 1.475 1.00 0.00 N ATOM 540 CA SER A 34 2.354 -10.962 1.702 1.00 0.00 C ATOM 541 C SER A 34 3.436 -11.264 0.671 1.00 0.00 C ATOM 542 O SER A 34 4.080 -10.356 0.145 1.00 0.00 O ATOM 543 CB SER A 34 2.900 -11.191 3.113 1.00 0.00 C ATOM 544 OG SER A 34 3.863 -10.208 3.452 1.00 0.00 O ATOM 0 H SER A 34 0.701 -12.093 2.326 1.00 0.00 H new ATOM 0 HA SER A 34 2.059 -9.918 1.599 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.081 -11.166 3.832 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.349 -12.182 3.176 1.00 0.00 H new ATOM 0 HG SER A 34 4.196 -10.375 4.359 1.00 0.00 H new ATOM 550 N LYS A 35 3.632 -12.547 0.386 1.00 0.00 N ATOM 551 CA LYS A 35 4.635 -12.971 -0.584 1.00 0.00 C ATOM 552 C LYS A 35 4.019 -13.134 -1.969 1.00 0.00 C ATOM 553 O LYS A 35 2.811 -13.324 -2.119 1.00 0.00 O ATOM 554 CB LYS A 35 5.276 -14.289 -0.141 1.00 0.00 C ATOM 555 CG LYS A 35 6.330 -14.119 0.940 1.00 0.00 C ATOM 556 CD LYS A 35 5.699 -13.888 2.303 1.00 0.00 C ATOM 557 CE LYS A 35 5.126 -15.175 2.877 1.00 0.00 C ATOM 558 NZ LYS A 35 6.157 -15.962 3.610 1.00 0.00 N ATOM 0 H LYS A 35 3.109 -13.312 0.813 1.00 0.00 H new ATOM 0 HA LYS A 35 5.403 -12.199 -0.636 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.497 -14.958 0.225 1.00 0.00 H new ATOM 0 HB3 LYS A 35 5.730 -14.772 -1.007 1.00 0.00 H new ATOM 0 HG2 LYS A 35 6.962 -15.007 0.976 1.00 0.00 H new ATOM 0 HG3 LYS A 35 6.976 -13.278 0.690 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.445 -13.484 2.987 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.908 -13.143 2.218 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.303 -14.937 3.551 1.00 0.00 H new ATOM 0 HE3 LYS A 35 4.713 -15.780 2.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.728 -16.831 3.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.930 -16.211 2.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 6.534 -15.394 4.396 1.00 0.00 H new ATOM 572 N PRO A 36 4.865 -13.060 -3.007 1.00 0.00 N ATOM 573 CA PRO A 36 4.425 -13.199 -4.399 1.00 0.00 C ATOM 574 C PRO A 36 3.989 -14.622 -4.730 1.00 0.00 C ATOM 575 O PRO A 36 4.808 -15.462 -5.102 1.00 0.00 O ATOM 576 CB PRO A 36 5.671 -12.821 -5.204 1.00 0.00 C ATOM 577 CG PRO A 36 6.814 -13.114 -4.294 1.00 0.00 C ATOM 578 CD PRO A 36 6.317 -12.836 -2.902 1.00 0.00 C ATOM 0 HA PRO A 36 3.556 -12.578 -4.616 1.00 0.00 H new ATOM 0 HB2 PRO A 36 5.739 -13.401 -6.124 1.00 0.00 H new ATOM 0 HB3 PRO A 36 5.653 -11.770 -5.491 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.136 -14.150 -4.394 1.00 0.00 H new ATOM 0 HG3 PRO A 36 7.674 -12.488 -4.534 1.00 0.00 H new ATOM 0 HD2 PRO A 36 6.775 -13.503 -2.171 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.545 -11.817 -2.590 1.00 0.00 H new ATOM 586 N VAL A 37 2.694 -14.886 -4.592 1.00 0.00 N ATOM 587 CA VAL A 37 2.148 -16.208 -4.878 1.00 0.00 C ATOM 588 C VAL A 37 2.079 -16.461 -6.380 1.00 0.00 C ATOM 589 O VAL A 37 1.435 -15.714 -7.116 1.00 0.00 O ATOM 590 CB VAL A 37 0.741 -16.377 -4.275 1.00 0.00 C ATOM 591 CG1 VAL A 37 0.775 -16.154 -2.771 1.00 0.00 C ATOM 592 CG2 VAL A 37 -0.241 -15.427 -4.942 1.00 0.00 C ATOM 0 H VAL A 37 2.003 -14.202 -4.284 1.00 0.00 H new ATOM 0 HA VAL A 37 2.821 -16.934 -4.421 1.00 0.00 H new ATOM 0 HB VAL A 37 0.405 -17.398 -4.459 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.228 -16.277 -2.362 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.446 -16.879 -2.311 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.131 -15.145 -2.561 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.230 -15.560 -4.504 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.088 -14.399 -4.791 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.286 -15.641 -6.010 1.00 0.00 H new ATOM 602 N SER A 38 2.748 -17.519 -6.828 1.00 0.00 N ATOM 603 CA SER A 38 2.765 -17.869 -8.244 1.00 0.00 C ATOM 604 C SER A 38 3.442 -19.219 -8.461 1.00 0.00 C ATOM 605 O SER A 38 4.024 -19.789 -7.539 1.00 0.00 O ATOM 606 CB SER A 38 3.488 -16.787 -9.049 1.00 0.00 C ATOM 607 OG SER A 38 4.813 -16.603 -8.581 1.00 0.00 O ATOM 0 H SER A 38 3.285 -18.148 -6.231 1.00 0.00 H new ATOM 0 HA SER A 38 1.733 -17.940 -8.589 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.506 -17.065 -10.103 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.940 -15.848 -8.976 1.00 0.00 H new ATOM 0 HG SER A 38 5.446 -16.925 -9.256 1.00 0.00 H new ATOM 613 N ASP A 39 3.360 -19.723 -9.687 1.00 0.00 N ATOM 614 CA ASP A 39 3.965 -21.006 -10.028 1.00 0.00 C ATOM 615 C ASP A 39 5.418 -20.825 -10.457 1.00 0.00 C ATOM 616 O ASP A 39 6.296 -21.584 -10.046 1.00 0.00 O ATOM 617 CB ASP A 39 3.172 -21.687 -11.144 1.00 0.00 C ATOM 618 CG ASP A 39 1.684 -21.729 -10.855 1.00 0.00 C ATOM 619 OD1 ASP A 39 1.299 -22.283 -9.804 1.00 0.00 O ATOM 620 OD2 ASP A 39 0.905 -21.206 -11.679 1.00 0.00 O ATOM 0 H ASP A 39 2.881 -19.263 -10.461 1.00 0.00 H new ATOM 0 HA ASP A 39 3.943 -21.638 -9.140 1.00 0.00 H new ATOM 0 HB2 ASP A 39 3.342 -21.158 -12.082 1.00 0.00 H new ATOM 0 HB3 ASP A 39 3.541 -22.703 -11.280 1.00 0.00 H new ATOM 625 N TYR A 40 5.663 -19.815 -11.285 1.00 0.00 N ATOM 626 CA TYR A 40 7.009 -19.537 -11.772 1.00 0.00 C ATOM 627 C TYR A 40 7.541 -18.233 -11.186 1.00 0.00 C ATOM 628 O TYR A 40 6.824 -17.512 -10.491 1.00 0.00 O ATOM 629 CB TYR A 40 7.015 -19.463 -13.300 1.00 0.00 C ATOM 630 CG TYR A 40 8.337 -19.859 -13.920 1.00 0.00 C ATOM 631 CD1 TYR A 40 8.752 -21.184 -13.931 1.00 0.00 C ATOM 632 CD2 TYR A 40 9.169 -18.907 -14.495 1.00 0.00 C ATOM 633 CE1 TYR A 40 9.958 -21.550 -14.495 1.00 0.00 C ATOM 634 CE2 TYR A 40 10.377 -19.264 -15.064 1.00 0.00 C ATOM 635 CZ TYR A 40 10.767 -20.586 -15.061 1.00 0.00 C ATOM 636 OH TYR A 40 11.969 -20.947 -15.625 1.00 0.00 O ATOM 0 H TYR A 40 4.948 -19.176 -11.632 1.00 0.00 H new ATOM 0 HA TYR A 40 7.660 -20.350 -11.452 1.00 0.00 H new ATOM 0 HB2 TYR A 40 6.231 -20.112 -13.690 1.00 0.00 H new ATOM 0 HB3 TYR A 40 6.769 -18.447 -13.607 1.00 0.00 H new ATOM 0 HD1 TYR A 40 8.121 -21.941 -13.491 1.00 0.00 H new ATOM 0 HD2 TYR A 40 8.867 -17.870 -14.498 1.00 0.00 H new ATOM 0 HE1 TYR A 40 10.266 -22.585 -14.493 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.012 -18.511 -15.508 1.00 0.00 H new ATOM 0 HH TYR A 40 12.416 -20.150 -15.980 1.00 0.00 H new ATOM 646 N LEU A 41 8.804 -17.936 -11.472 1.00 0.00 N ATOM 647 CA LEU A 41 9.435 -16.718 -10.974 1.00 0.00 C ATOM 648 C LEU A 41 9.475 -15.644 -12.057 1.00 0.00 C ATOM 649 O LEU A 41 9.419 -15.948 -13.248 1.00 0.00 O ATOM 650 CB LEU A 41 10.854 -17.018 -10.486 1.00 0.00 C ATOM 651 CG LEU A 41 11.883 -17.338 -11.570 1.00 0.00 C ATOM 652 CD1 LEU A 41 13.293 -17.077 -11.062 1.00 0.00 C ATOM 653 CD2 LEU A 41 11.740 -18.781 -12.033 1.00 0.00 C ATOM 0 H LEU A 41 9.411 -18.521 -12.046 1.00 0.00 H new ATOM 0 HA LEU A 41 8.841 -16.346 -10.139 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.210 -16.159 -9.917 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.809 -17.861 -9.796 1.00 0.00 H new ATOM 0 HG LEU A 41 11.699 -16.684 -12.422 1.00 0.00 H new ATOM 0 HD11 LEU A 41 14.012 -17.310 -11.847 1.00 0.00 H new ATOM 0 HD12 LEU A 41 13.390 -16.028 -10.781 1.00 0.00 H new ATOM 0 HD13 LEU A 41 13.489 -17.705 -10.193 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.481 -18.991 -12.805 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.897 -19.451 -11.188 1.00 0.00 H new ATOM 0 HD23 LEU A 41 10.740 -18.936 -12.438 1.00 0.00 H new ATOM 665 N GLU A 42 9.572 -14.388 -11.633 1.00 0.00 N ATOM 666 CA GLU A 42 9.620 -13.269 -12.568 1.00 0.00 C ATOM 667 C GLU A 42 8.683 -13.506 -13.749 1.00 0.00 C ATOM 668 O GLU A 42 8.955 -13.072 -14.868 1.00 0.00 O ATOM 669 CB GLU A 42 11.050 -13.058 -13.071 1.00 0.00 C ATOM 670 CG GLU A 42 11.513 -14.121 -14.052 1.00 0.00 C ATOM 671 CD GLU A 42 12.614 -13.627 -14.971 1.00 0.00 C ATOM 672 OE1 GLU A 42 13.759 -13.472 -14.496 1.00 0.00 O ATOM 673 OE2 GLU A 42 12.330 -13.397 -16.165 1.00 0.00 O ATOM 0 H GLU A 42 9.619 -14.120 -10.650 1.00 0.00 H new ATOM 0 HA GLU A 42 9.292 -12.373 -12.041 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.118 -12.081 -13.549 1.00 0.00 H new ATOM 0 HB3 GLU A 42 11.728 -13.043 -12.218 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.869 -14.990 -13.499 1.00 0.00 H new ATOM 0 HG3 GLU A 42 10.665 -14.451 -14.652 1.00 0.00 H new ATOM 680 N VAL A 43 7.578 -14.198 -13.490 1.00 0.00 N ATOM 681 CA VAL A 43 6.600 -14.493 -14.530 1.00 0.00 C ATOM 682 C VAL A 43 5.340 -13.652 -14.354 1.00 0.00 C ATOM 683 O VAL A 43 4.331 -13.881 -15.021 1.00 0.00 O ATOM 684 CB VAL A 43 6.213 -15.984 -14.530 1.00 0.00 C ATOM 685 CG1 VAL A 43 5.208 -16.275 -13.426 1.00 0.00 C ATOM 686 CG2 VAL A 43 5.658 -16.389 -15.887 1.00 0.00 C ATOM 0 H VAL A 43 7.338 -14.565 -12.569 1.00 0.00 H new ATOM 0 HA VAL A 43 7.068 -14.247 -15.483 1.00 0.00 H new ATOM 0 HB VAL A 43 7.109 -16.574 -14.338 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.947 -17.333 -13.442 1.00 0.00 H new ATOM 0 HG12 VAL A 43 5.646 -16.024 -12.460 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.310 -15.677 -13.584 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.390 -17.445 -15.870 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.773 -15.793 -16.111 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.413 -16.219 -16.654 1.00 0.00 H new ATOM 696 N ILE A 44 5.407 -12.678 -13.453 1.00 0.00 N ATOM 697 CA ILE A 44 4.273 -11.801 -13.191 1.00 0.00 C ATOM 698 C ILE A 44 4.471 -10.436 -13.840 1.00 0.00 C ATOM 699 O ILE A 44 5.420 -9.718 -13.524 1.00 0.00 O ATOM 700 CB ILE A 44 4.046 -11.611 -11.680 1.00 0.00 C ATOM 701 CG1 ILE A 44 3.747 -12.955 -11.013 1.00 0.00 C ATOM 702 CG2 ILE A 44 2.911 -10.627 -11.434 1.00 0.00 C ATOM 703 CD1 ILE A 44 4.983 -13.673 -10.519 1.00 0.00 C ATOM 0 H ILE A 44 6.235 -12.476 -12.892 1.00 0.00 H new ATOM 0 HA ILE A 44 3.396 -12.282 -13.624 1.00 0.00 H new ATOM 0 HB ILE A 44 4.956 -11.203 -11.240 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.071 -12.792 -10.173 1.00 0.00 H new ATOM 0 HG13 ILE A 44 3.224 -13.596 -11.723 1.00 0.00 H new ATOM 0 HG21 ILE A 44 2.763 -10.503 -10.361 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.161 -9.664 -11.879 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.995 -11.008 -11.885 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.695 -14.618 -10.058 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.651 -13.868 -11.358 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.495 -13.052 -9.784 1.00 0.00 H new ATOM 715 N LYS A 45 3.568 -10.082 -14.749 1.00 0.00 N ATOM 716 CA LYS A 45 3.641 -8.801 -15.441 1.00 0.00 C ATOM 717 C LYS A 45 3.506 -7.643 -14.458 1.00 0.00 C ATOM 718 O LYS A 45 4.381 -6.781 -14.379 1.00 0.00 O ATOM 719 CB LYS A 45 2.544 -8.711 -16.505 1.00 0.00 C ATOM 720 CG LYS A 45 2.887 -9.437 -17.795 1.00 0.00 C ATOM 721 CD LYS A 45 3.712 -8.562 -18.725 1.00 0.00 C ATOM 722 CE LYS A 45 5.194 -8.634 -18.389 1.00 0.00 C ATOM 723 NZ LYS A 45 6.046 -8.431 -19.593 1.00 0.00 N ATOM 0 H LYS A 45 2.777 -10.665 -15.023 1.00 0.00 H new ATOM 0 HA LYS A 45 4.615 -8.732 -15.924 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.621 -9.125 -16.099 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.351 -7.662 -16.729 1.00 0.00 H new ATOM 0 HG2 LYS A 45 3.440 -10.348 -17.565 1.00 0.00 H new ATOM 0 HG3 LYS A 45 1.969 -9.740 -18.298 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.556 -8.877 -19.757 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.371 -7.529 -18.652 1.00 0.00 H new ATOM 0 HE2 LYS A 45 5.434 -7.877 -17.642 1.00 0.00 H new ATOM 0 HE3 LYS A 45 5.419 -9.603 -17.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 7.049 -8.487 -19.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.835 -9.168 -20.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 5.850 -7.496 -20.003 1.00 0.00 H new ATOM 737 N GLU A 46 2.407 -7.630 -13.711 1.00 0.00 N ATOM 738 CA GLU A 46 2.160 -6.577 -12.733 1.00 0.00 C ATOM 739 C GLU A 46 2.170 -7.139 -11.315 1.00 0.00 C ATOM 740 O GLU A 46 1.126 -7.383 -10.709 1.00 0.00 O ATOM 741 CB GLU A 46 0.820 -5.894 -13.014 1.00 0.00 C ATOM 742 CG GLU A 46 0.678 -5.396 -14.443 1.00 0.00 C ATOM 743 CD GLU A 46 0.247 -6.490 -15.401 1.00 0.00 C ATOM 744 OE1 GLU A 46 -0.299 -7.509 -14.930 1.00 0.00 O ATOM 745 OE2 GLU A 46 0.457 -6.326 -16.621 1.00 0.00 O ATOM 0 H GLU A 46 1.673 -8.337 -13.764 1.00 0.00 H new ATOM 0 HA GLU A 46 2.959 -5.841 -12.819 1.00 0.00 H new ATOM 0 HB2 GLU A 46 0.013 -6.595 -12.801 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.700 -5.053 -12.331 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.051 -4.586 -14.471 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.629 -4.981 -14.776 1.00 0.00 H new ATOM 752 N PRO A 47 3.377 -7.351 -10.771 1.00 0.00 N ATOM 753 CA PRO A 47 3.553 -7.887 -9.418 1.00 0.00 C ATOM 754 C PRO A 47 3.135 -6.892 -8.341 1.00 0.00 C ATOM 755 O PRO A 47 3.370 -5.690 -8.468 1.00 0.00 O ATOM 756 CB PRO A 47 5.057 -8.161 -9.337 1.00 0.00 C ATOM 757 CG PRO A 47 5.666 -7.224 -10.322 1.00 0.00 C ATOM 758 CD PRO A 47 4.664 -7.084 -11.435 1.00 0.00 C ATOM 0 HA PRO A 47 2.935 -8.768 -9.246 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.439 -7.982 -8.332 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.284 -9.198 -9.584 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.877 -6.258 -9.863 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.613 -7.613 -10.696 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.690 -6.087 -11.876 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.856 -7.794 -12.240 1.00 0.00 H new ATOM 766 N MET A 48 2.514 -7.399 -7.282 1.00 0.00 N ATOM 767 CA MET A 48 2.064 -6.553 -6.182 1.00 0.00 C ATOM 768 C MET A 48 1.647 -7.397 -4.982 1.00 0.00 C ATOM 769 O MET A 48 1.198 -8.533 -5.136 1.00 0.00 O ATOM 770 CB MET A 48 0.896 -5.673 -6.632 1.00 0.00 C ATOM 771 CG MET A 48 0.535 -4.585 -5.633 1.00 0.00 C ATOM 772 SD MET A 48 1.914 -3.477 -5.285 1.00 0.00 S ATOM 773 CE MET A 48 1.665 -2.222 -6.538 1.00 0.00 C ATOM 0 H MET A 48 2.311 -8.391 -7.162 1.00 0.00 H new ATOM 0 HA MET A 48 2.896 -5.915 -5.883 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.147 -5.210 -7.586 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.023 -6.302 -6.803 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.303 -4.005 -6.020 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.201 -5.047 -4.704 1.00 0.00 H new ATOM 0 HE1 MET A 48 2.442 -1.463 -6.452 1.00 0.00 H new ATOM 0 HE2 MET A 48 1.713 -2.680 -7.526 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.688 -1.758 -6.400 1.00 0.00 H new ATOM 783 N ASP A 49 1.799 -6.836 -3.788 1.00 0.00 N ATOM 784 CA ASP A 49 1.438 -7.537 -2.561 1.00 0.00 C ATOM 785 C ASP A 49 1.597 -6.627 -1.348 1.00 0.00 C ATOM 786 O ASP A 49 2.106 -5.510 -1.458 1.00 0.00 O ATOM 787 CB ASP A 49 2.299 -8.789 -2.392 1.00 0.00 C ATOM 788 CG ASP A 49 3.782 -8.491 -2.497 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.286 -7.693 -1.679 1.00 0.00 O ATOM 790 OD2 ASP A 49 4.438 -9.055 -3.397 1.00 0.00 O ATOM 0 H ASP A 49 2.170 -5.897 -3.643 1.00 0.00 H new ATOM 0 HA ASP A 49 0.392 -7.833 -2.635 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.090 -9.242 -1.423 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.024 -9.521 -3.152 1.00 0.00 H new ATOM 795 N LEU A 50 1.159 -7.110 -0.191 1.00 0.00 N ATOM 796 CA LEU A 50 1.252 -6.339 1.045 1.00 0.00 C ATOM 797 C LEU A 50 2.649 -5.752 1.216 1.00 0.00 C ATOM 798 O LEU A 50 2.834 -4.537 1.157 1.00 0.00 O ATOM 799 CB LEU A 50 0.905 -7.221 2.246 1.00 0.00 C ATOM 800 CG LEU A 50 -0.430 -7.962 2.172 1.00 0.00 C ATOM 801 CD1 LEU A 50 -0.598 -8.881 3.371 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.585 -6.973 2.090 1.00 0.00 C ATOM 0 H LEU A 50 0.736 -8.032 -0.082 1.00 0.00 H new ATOM 0 HA LEU A 50 0.538 -5.517 0.987 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.699 -7.957 2.372 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.902 -6.598 3.140 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.435 -8.572 1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.554 -9.400 3.301 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.211 -9.611 3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.572 -8.292 4.288 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.528 -7.518 2.038 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.582 -6.336 2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.473 -6.356 1.199 1.00 0.00 H new ATOM 814 N SER A 51 3.630 -6.624 1.428 1.00 0.00 N ATOM 815 CA SER A 51 5.010 -6.192 1.609 1.00 0.00 C ATOM 816 C SER A 51 5.310 -4.960 0.761 1.00 0.00 C ATOM 817 O SER A 51 5.650 -3.898 1.285 1.00 0.00 O ATOM 818 CB SER A 51 5.973 -7.323 1.244 1.00 0.00 C ATOM 819 OG SER A 51 7.213 -7.174 1.914 1.00 0.00 O ATOM 0 H SER A 51 3.494 -7.634 1.479 1.00 0.00 H new ATOM 0 HA SER A 51 5.148 -5.931 2.658 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.528 -8.283 1.506 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.137 -7.331 0.166 1.00 0.00 H new ATOM 0 HG SER A 51 7.810 -7.910 1.665 1.00 0.00 H new ATOM 825 N THR A 52 5.182 -5.109 -0.554 1.00 0.00 N ATOM 826 CA THR A 52 5.440 -4.010 -1.476 1.00 0.00 C ATOM 827 C THR A 52 4.559 -2.807 -1.157 1.00 0.00 C ATOM 828 O THR A 52 4.998 -1.661 -1.254 1.00 0.00 O ATOM 829 CB THR A 52 5.200 -4.435 -2.937 1.00 0.00 C ATOM 830 OG1 THR A 52 6.351 -5.119 -3.444 1.00 0.00 O ATOM 831 CG2 THR A 52 4.897 -3.226 -3.809 1.00 0.00 C ATOM 0 H THR A 52 4.901 -5.980 -1.004 1.00 0.00 H new ATOM 0 HA THR A 52 6.487 -3.733 -1.353 1.00 0.00 H new ATOM 0 HB THR A 52 4.341 -5.105 -2.961 1.00 0.00 H new ATOM 0 HG1 THR A 52 6.189 -5.387 -4.373 1.00 0.00 H new ATOM 0 HG21 THR A 52 4.731 -3.551 -4.836 1.00 0.00 H new ATOM 0 HG22 THR A 52 4.003 -2.725 -3.438 1.00 0.00 H new ATOM 0 HG23 THR A 52 5.739 -2.535 -3.778 1.00 0.00 H new ATOM 839 N VAL A 53 3.314 -3.074 -0.776 1.00 0.00 N ATOM 840 CA VAL A 53 2.372 -2.013 -0.442 1.00 0.00 C ATOM 841 C VAL A 53 2.857 -1.207 0.759 1.00 0.00 C ATOM 842 O VAL A 53 2.887 0.023 0.721 1.00 0.00 O ATOM 843 CB VAL A 53 0.974 -2.580 -0.135 1.00 0.00 C ATOM 844 CG1 VAL A 53 0.057 -1.486 0.390 1.00 0.00 C ATOM 845 CG2 VAL A 53 0.381 -3.234 -1.374 1.00 0.00 C ATOM 0 H VAL A 53 2.934 -4.017 -0.691 1.00 0.00 H new ATOM 0 HA VAL A 53 2.308 -1.360 -1.313 1.00 0.00 H new ATOM 0 HB VAL A 53 1.072 -3.341 0.639 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.926 -1.906 0.601 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.477 -1.067 1.305 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.037 -0.700 -0.359 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.607 -3.629 -1.139 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.296 -2.495 -2.170 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.029 -4.047 -1.702 1.00 0.00 H new ATOM 855 N ILE A 54 3.235 -1.909 1.822 1.00 0.00 N ATOM 856 CA ILE A 54 3.720 -1.258 3.033 1.00 0.00 C ATOM 857 C ILE A 54 4.844 -0.277 2.718 1.00 0.00 C ATOM 858 O ILE A 54 4.928 0.800 3.310 1.00 0.00 O ATOM 859 CB ILE A 54 4.225 -2.287 4.061 1.00 0.00 C ATOM 860 CG1 ILE A 54 3.045 -2.990 4.735 1.00 0.00 C ATOM 861 CG2 ILE A 54 5.108 -1.610 5.098 1.00 0.00 C ATOM 862 CD1 ILE A 54 2.596 -4.242 4.015 1.00 0.00 C ATOM 0 H ILE A 54 3.215 -2.928 1.869 1.00 0.00 H new ATOM 0 HA ILE A 54 2.876 -0.715 3.459 1.00 0.00 H new ATOM 0 HB ILE A 54 4.820 -3.037 3.540 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.322 -3.248 5.757 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.207 -2.296 4.797 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.457 -2.350 5.818 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.965 -1.152 4.603 1.00 0.00 H new ATOM 0 HG23 ILE A 54 4.536 -0.841 5.617 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.757 -4.687 4.549 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.287 -3.988 3.001 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.420 -4.954 3.976 1.00 0.00 H new ATOM 874 N THR A 55 5.706 -0.654 1.779 1.00 0.00 N ATOM 875 CA THR A 55 6.825 0.192 1.384 1.00 0.00 C ATOM 876 C THR A 55 6.336 1.522 0.822 1.00 0.00 C ATOM 877 O THR A 55 6.536 2.575 1.428 1.00 0.00 O ATOM 878 CB THR A 55 7.710 -0.502 0.332 1.00 0.00 C ATOM 879 OG1 THR A 55 8.504 -1.519 0.953 1.00 0.00 O ATOM 880 CG2 THR A 55 8.617 0.503 -0.361 1.00 0.00 C ATOM 0 H THR A 55 5.650 -1.541 1.278 1.00 0.00 H new ATOM 0 HA THR A 55 7.416 0.374 2.282 1.00 0.00 H new ATOM 0 HB THR A 55 7.059 -0.955 -0.415 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.062 -1.956 0.277 1.00 0.00 H new ATOM 0 HG21 THR A 55 9.232 -0.011 -1.099 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.009 1.259 -0.858 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.260 0.982 0.377 1.00 0.00 H new ATOM 888 N LYS A 56 5.693 1.468 -0.340 1.00 0.00 N ATOM 889 CA LYS A 56 5.174 2.669 -0.984 1.00 0.00 C ATOM 890 C LYS A 56 4.698 3.680 0.054 1.00 0.00 C ATOM 891 O LYS A 56 5.152 4.825 0.072 1.00 0.00 O ATOM 892 CB LYS A 56 4.022 2.309 -1.926 1.00 0.00 C ATOM 893 CG LYS A 56 4.478 1.912 -3.319 1.00 0.00 C ATOM 894 CD LYS A 56 3.379 1.189 -4.080 1.00 0.00 C ATOM 895 CE LYS A 56 2.432 2.169 -4.757 1.00 0.00 C ATOM 896 NZ LYS A 56 1.328 2.590 -3.850 1.00 0.00 N ATOM 0 H LYS A 56 5.519 0.605 -0.855 1.00 0.00 H new ATOM 0 HA LYS A 56 5.981 3.120 -1.561 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.451 1.488 -1.492 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.347 3.161 -2.003 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.780 2.802 -3.872 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.355 1.269 -3.246 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.824 0.535 -4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.818 0.554 -3.395 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.990 3.047 -5.082 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.012 1.709 -5.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 0.502 2.871 -4.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 1.068 1.798 -3.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.642 3.395 -3.272 1.00 0.00 H new ATOM 910 N ILE A 57 3.784 3.251 0.917 1.00 0.00 N ATOM 911 CA ILE A 57 3.250 4.119 1.959 1.00 0.00 C ATOM 912 C ILE A 57 4.366 4.883 2.663 1.00 0.00 C ATOM 913 O ILE A 57 4.349 6.113 2.723 1.00 0.00 O ATOM 914 CB ILE A 57 2.453 3.318 3.006 1.00 0.00 C ATOM 915 CG1 ILE A 57 1.297 2.572 2.336 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.933 4.242 4.097 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.891 1.309 3.063 1.00 0.00 C ATOM 0 H ILE A 57 3.397 2.307 0.915 1.00 0.00 H new ATOM 0 HA ILE A 57 2.581 4.826 1.468 1.00 0.00 H new ATOM 0 HB ILE A 57 3.117 2.585 3.464 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.436 3.237 2.271 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.582 2.318 1.315 1.00 0.00 H new ATOM 0 HG21 ILE A 57 1.372 3.661 4.829 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.773 4.732 4.589 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.281 4.996 3.655 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.067 0.833 2.532 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.739 0.625 3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.574 1.558 4.076 1.00 0.00 H new ATOM 929 N ASP A 58 5.337 4.147 3.194 1.00 0.00 N ATOM 930 CA ASP A 58 6.464 4.755 3.891 1.00 0.00 C ATOM 931 C ASP A 58 7.087 5.866 3.052 1.00 0.00 C ATOM 932 O ASP A 58 7.427 6.931 3.566 1.00 0.00 O ATOM 933 CB ASP A 58 7.517 3.697 4.223 1.00 0.00 C ATOM 934 CG ASP A 58 8.370 4.082 5.415 1.00 0.00 C ATOM 935 OD1 ASP A 58 8.940 5.194 5.403 1.00 0.00 O ATOM 936 OD2 ASP A 58 8.466 3.273 6.361 1.00 0.00 O ATOM 0 H ASP A 58 5.366 3.128 3.155 1.00 0.00 H new ATOM 0 HA ASP A 58 6.093 5.190 4.819 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.022 2.747 4.426 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.159 3.543 3.356 1.00 0.00 H new ATOM 941 N LYS A 59 7.236 5.609 1.757 1.00 0.00 N ATOM 942 CA LYS A 59 7.818 6.586 0.844 1.00 0.00 C ATOM 943 C LYS A 59 6.768 7.591 0.381 1.00 0.00 C ATOM 944 O LYS A 59 6.760 8.005 -0.778 1.00 0.00 O ATOM 945 CB LYS A 59 8.433 5.881 -0.366 1.00 0.00 C ATOM 946 CG LYS A 59 9.888 5.492 -0.170 1.00 0.00 C ATOM 947 CD LYS A 59 10.101 4.778 1.155 1.00 0.00 C ATOM 948 CE LYS A 59 9.688 3.317 1.072 1.00 0.00 C ATOM 949 NZ LYS A 59 10.354 2.492 2.118 1.00 0.00 N ATOM 0 H LYS A 59 6.961 4.731 1.316 1.00 0.00 H new ATOM 0 HA LYS A 59 8.600 7.125 1.379 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.853 4.985 -0.587 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.354 6.534 -1.235 1.00 0.00 H new ATOM 0 HG2 LYS A 59 10.206 4.846 -0.988 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.512 6.385 -0.208 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.151 4.845 1.441 1.00 0.00 H new ATOM 0 HD3 LYS A 59 9.525 5.276 1.935 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.606 3.239 1.182 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.938 2.924 0.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.743 1.688 2.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 11.262 2.138 1.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 10.522 3.073 2.964 1.00 0.00 H new ATOM 963 N HIS A 60 5.885 7.981 1.295 1.00 0.00 N ATOM 964 CA HIS A 60 4.832 8.940 0.980 1.00 0.00 C ATOM 965 C HIS A 60 4.342 8.758 -0.453 1.00 0.00 C ATOM 966 O HIS A 60 4.233 9.722 -1.209 1.00 0.00 O ATOM 967 CB HIS A 60 5.338 10.369 1.180 1.00 0.00 C ATOM 968 CG HIS A 60 5.184 10.868 2.584 1.00 0.00 C ATOM 969 ND1 HIS A 60 4.827 12.165 2.887 1.00 0.00 N ATOM 970 CD2 HIS A 60 5.338 10.235 3.770 1.00 0.00 C ATOM 971 CE1 HIS A 60 4.770 12.309 4.199 1.00 0.00 C ATOM 972 NE2 HIS A 60 5.076 11.152 4.758 1.00 0.00 N ATOM 0 H HIS A 60 5.878 7.648 2.259 1.00 0.00 H new ATOM 0 HA HIS A 60 3.997 8.760 1.657 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.390 10.416 0.900 1.00 0.00 H new ATOM 0 HB3 HIS A 60 4.799 11.034 0.506 1.00 0.00 H new ATOM 0 HD2 HIS A 60 5.615 9.201 3.913 1.00 0.00 H new ATOM 0 HE1 HIS A 60 4.516 13.218 4.725 1.00 0.00 H new ATOM 0 HE2 HIS A 60 5.112 10.969 5.761 1.00 0.00 H new ATOM 981 N ASN A 61 4.049 7.514 -0.819 1.00 0.00 N ATOM 982 CA ASN A 61 3.571 7.205 -2.162 1.00 0.00 C ATOM 983 C ASN A 61 2.080 7.501 -2.291 1.00 0.00 C ATOM 984 O ASN A 61 1.652 8.191 -3.217 1.00 0.00 O ATOM 985 CB ASN A 61 3.842 5.737 -2.497 1.00 0.00 C ATOM 986 CG ASN A 61 3.997 5.502 -3.987 1.00 0.00 C ATOM 987 OD1 ASN A 61 3.014 5.466 -4.727 1.00 0.00 O ATOM 988 ND2 ASN A 61 5.238 5.342 -4.434 1.00 0.00 N ATOM 0 H ASN A 61 4.134 6.704 -0.205 1.00 0.00 H new ATOM 0 HA ASN A 61 4.111 7.837 -2.867 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.747 5.412 -1.985 1.00 0.00 H new ATOM 0 HB3 ASN A 61 3.024 5.124 -2.119 1.00 0.00 H new ATOM 0 HD21 ASN A 61 5.406 5.182 -5.427 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.023 5.380 -3.784 1.00 0.00 H new ATOM 995 N TYR A 62 1.296 6.977 -1.357 1.00 0.00 N ATOM 996 CA TYR A 62 -0.148 7.183 -1.366 1.00 0.00 C ATOM 997 C TYR A 62 -0.498 8.599 -0.918 1.00 0.00 C ATOM 998 O TYR A 62 0.217 9.205 -0.120 1.00 0.00 O ATOM 999 CB TYR A 62 -0.836 6.163 -0.458 1.00 0.00 C ATOM 1000 CG TYR A 62 -0.935 4.782 -1.065 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.687 4.558 -2.212 1.00 0.00 C ATOM 1002 CD2 TYR A 62 -0.277 3.701 -0.492 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.781 3.297 -2.769 1.00 0.00 C ATOM 1004 CE2 TYR A 62 -0.364 2.437 -1.043 1.00 0.00 C ATOM 1005 CZ TYR A 62 -1.117 2.241 -2.182 1.00 0.00 C ATOM 1006 OH TYR A 62 -1.207 0.984 -2.735 1.00 0.00 O ATOM 0 H TYR A 62 1.635 6.406 -0.583 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.503 7.046 -2.387 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.289 6.099 0.483 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.838 6.519 -0.220 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.207 5.383 -2.676 1.00 0.00 H new ATOM 0 HD2 TYR A 62 0.313 3.851 0.400 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.371 3.139 -3.659 1.00 0.00 H new ATOM 0 HE2 TYR A 62 0.154 1.608 -0.585 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.336 0.538 -2.677 1.00 0.00 H new ATOM 1016 N LEU A 63 -1.606 9.119 -1.436 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.054 10.463 -1.089 1.00 0.00 C ATOM 1018 C LEU A 63 -3.495 10.444 -0.589 1.00 0.00 C ATOM 1019 O LEU A 63 -3.881 11.251 0.258 1.00 0.00 O ATOM 1020 CB LEU A 63 -1.935 11.390 -2.300 1.00 0.00 C ATOM 1021 CG LEU A 63 -3.150 11.444 -3.226 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -4.149 12.480 -2.736 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -2.719 11.749 -4.654 1.00 0.00 C ATOM 0 H LEU A 63 -2.210 8.631 -2.097 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.416 10.837 -0.289 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.732 12.399 -1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.070 11.080 -2.886 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.635 10.468 -3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.007 12.504 -3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.482 12.218 -1.732 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.675 13.462 -2.717 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.597 11.784 -5.299 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.209 12.712 -4.682 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.042 10.970 -5.004 1.00 0.00 H new ATOM 1035 N THR A 64 -4.287 9.517 -1.117 1.00 0.00 N ATOM 1036 CA THR A 64 -5.685 9.392 -0.724 1.00 0.00 C ATOM 1037 C THR A 64 -6.018 7.959 -0.323 1.00 0.00 C ATOM 1038 O THR A 64 -5.389 7.011 -0.794 1.00 0.00 O ATOM 1039 CB THR A 64 -6.629 9.827 -1.860 1.00 0.00 C ATOM 1040 OG1 THR A 64 -6.041 9.523 -3.130 1.00 0.00 O ATOM 1041 CG2 THR A 64 -6.926 11.317 -1.776 1.00 0.00 C ATOM 0 H THR A 64 -3.984 8.841 -1.818 1.00 0.00 H new ATOM 0 HA THR A 64 -5.832 10.050 0.133 1.00 0.00 H new ATOM 0 HB THR A 64 -7.565 9.279 -1.754 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.649 9.801 -3.847 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.595 11.601 -2.589 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.401 11.540 -0.821 1.00 0.00 H new ATOM 0 HG23 THR A 64 -5.996 11.879 -1.859 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.010 7.808 0.548 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.427 6.490 1.009 1.00 0.00 C ATOM 1051 C ALA A 65 -8.071 5.692 -0.119 1.00 0.00 C ATOM 1052 O ALA A 65 -8.053 4.460 -0.112 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.389 6.621 2.181 1.00 0.00 C ATOM 0 H ALA A 65 -7.540 8.582 0.948 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.539 5.951 1.340 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -8.692 5.629 2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -7.896 7.145 3.000 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.269 7.183 1.868 1.00 0.00 H new ATOM 1059 N LYS A 66 -8.641 6.400 -1.088 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.291 5.758 -2.225 1.00 0.00 C ATOM 1061 C LYS A 66 -8.274 5.015 -3.085 1.00 0.00 C ATOM 1062 O LYS A 66 -8.388 3.807 -3.293 1.00 0.00 O ATOM 1063 CB LYS A 66 -10.028 6.799 -3.071 1.00 0.00 C ATOM 1064 CG LYS A 66 -10.977 6.192 -4.090 1.00 0.00 C ATOM 1065 CD LYS A 66 -11.188 7.119 -5.276 1.00 0.00 C ATOM 1066 CE LYS A 66 -12.234 6.569 -6.233 1.00 0.00 C ATOM 1067 NZ LYS A 66 -12.837 7.642 -7.072 1.00 0.00 N ATOM 0 H LYS A 66 -8.666 7.419 -1.109 1.00 0.00 H new ATOM 0 HA LYS A 66 -10.011 5.036 -1.840 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.591 7.459 -2.411 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.296 7.417 -3.591 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -10.578 5.239 -4.438 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.936 5.982 -3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -11.499 8.101 -4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.245 7.255 -5.805 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.777 5.818 -6.877 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -13.018 6.068 -5.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.545 7.227 -7.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -13.295 8.346 -6.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.093 8.103 -7.633 1.00 0.00 H new ATOM 1081 N ASP A 67 -7.281 5.744 -3.581 1.00 0.00 N ATOM 1082 CA ASP A 67 -6.242 5.153 -4.417 1.00 0.00 C ATOM 1083 C ASP A 67 -5.678 3.891 -3.772 1.00 0.00 C ATOM 1084 O ASP A 67 -5.306 2.942 -4.462 1.00 0.00 O ATOM 1085 CB ASP A 67 -5.118 6.162 -4.660 1.00 0.00 C ATOM 1086 CG ASP A 67 -5.365 7.020 -5.885 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -6.545 7.276 -6.202 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -4.378 7.436 -6.526 1.00 0.00 O ATOM 0 H ASP A 67 -7.173 6.745 -3.419 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.690 4.882 -5.373 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.015 6.804 -3.785 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.174 5.629 -4.778 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.619 3.887 -2.444 1.00 0.00 N ATOM 1094 CA PHE A 68 -5.099 2.742 -1.706 1.00 0.00 C ATOM 1095 C PHE A 68 -5.958 1.504 -1.946 1.00 0.00 C ATOM 1096 O PHE A 68 -5.455 0.454 -2.349 1.00 0.00 O ATOM 1097 CB PHE A 68 -5.044 3.055 -0.209 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.952 1.832 0.657 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -6.087 1.098 0.964 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -3.732 1.415 1.163 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -6.005 -0.028 1.761 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -3.644 0.289 1.961 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.782 -0.434 2.259 1.00 0.00 C ATOM 0 H PHE A 68 -5.925 4.663 -1.857 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.090 2.538 -2.065 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.184 3.696 -0.011 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.933 3.621 0.069 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.046 1.409 0.576 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.839 1.976 0.932 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.897 -0.591 1.995 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -2.687 -0.024 2.351 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.716 -1.315 2.880 1.00 0.00 H new ATOM 1113 N LEU A 69 -7.256 1.635 -1.696 1.00 0.00 N ATOM 1114 CA LEU A 69 -8.187 0.527 -1.884 1.00 0.00 C ATOM 1115 C LEU A 69 -7.987 -0.126 -3.249 1.00 0.00 C ATOM 1116 O LEU A 69 -8.059 -1.347 -3.381 1.00 0.00 O ATOM 1117 CB LEU A 69 -9.629 1.018 -1.747 1.00 0.00 C ATOM 1118 CG LEU A 69 -10.218 0.982 -0.337 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -11.518 1.769 -0.281 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -10.443 -0.455 0.111 1.00 0.00 C ATOM 0 H LEU A 69 -7.688 2.497 -1.363 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.989 -0.217 -1.113 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.679 2.043 -2.114 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.261 0.415 -2.399 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.506 1.447 0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.922 1.732 0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.328 2.806 -0.558 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -12.237 1.334 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.863 -0.461 1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.135 -0.946 -0.574 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.493 -0.989 0.111 1.00 0.00 H new ATOM 1132 N LYS A 70 -7.735 0.697 -4.261 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.522 0.201 -5.615 1.00 0.00 C ATOM 1134 C LYS A 70 -6.343 -0.766 -5.661 1.00 0.00 C ATOM 1135 O LYS A 70 -6.378 -1.769 -6.375 1.00 0.00 O ATOM 1136 CB LYS A 70 -7.275 1.368 -6.575 1.00 0.00 C ATOM 1137 CG LYS A 70 -8.525 2.172 -6.889 1.00 0.00 C ATOM 1138 CD LYS A 70 -8.194 3.436 -7.665 1.00 0.00 C ATOM 1139 CE LYS A 70 -8.076 3.160 -9.156 1.00 0.00 C ATOM 1140 NZ LYS A 70 -9.403 3.189 -9.832 1.00 0.00 N ATOM 0 H LYS A 70 -7.673 1.711 -4.169 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.420 -0.333 -5.925 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.526 2.031 -6.142 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.859 0.981 -7.505 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.217 1.560 -7.467 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.032 2.436 -5.961 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.968 4.183 -7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.258 3.856 -7.296 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.420 3.902 -9.612 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.611 2.186 -9.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -9.280 2.996 -10.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.021 2.464 -9.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -9.836 4.127 -9.708 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.303 -0.460 -4.894 1.00 0.00 N ATOM 1155 CA ASP A 71 -4.114 -1.305 -4.845 1.00 0.00 C ATOM 1156 C ASP A 71 -4.440 -2.666 -4.239 1.00 0.00 C ATOM 1157 O ASP A 71 -4.039 -3.703 -4.767 1.00 0.00 O ATOM 1158 CB ASP A 71 -3.011 -0.622 -4.036 1.00 0.00 C ATOM 1159 CG ASP A 71 -1.925 -1.589 -3.607 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -2.252 -2.588 -2.932 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -0.748 -1.348 -3.948 1.00 0.00 O ATOM 0 H ASP A 71 -5.258 0.366 -4.298 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.763 -1.457 -5.866 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.568 0.176 -4.632 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.448 -0.156 -3.153 1.00 0.00 H new ATOM 1166 N ILE A 72 -5.166 -2.654 -3.126 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.545 -3.887 -2.448 1.00 0.00 C ATOM 1168 C ILE A 72 -6.321 -4.811 -3.380 1.00 0.00 C ATOM 1169 O ILE A 72 -6.264 -6.034 -3.249 1.00 0.00 O ATOM 1170 CB ILE A 72 -6.398 -3.603 -1.198 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.641 -2.687 -0.234 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.779 -4.906 -0.510 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -4.156 -2.967 -0.176 1.00 0.00 C ATOM 0 H ILE A 72 -5.503 -1.804 -2.675 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.620 -4.376 -2.143 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.312 -3.097 -1.507 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.796 -1.650 -0.533 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.063 -2.797 0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.382 -4.689 0.372 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.353 -5.527 -1.198 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.875 -5.437 -0.210 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.684 -2.281 0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.992 -3.993 0.153 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.721 -2.829 -1.166 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.045 -4.219 -4.324 1.00 0.00 N ATOM 1186 CA ASP A 73 -7.831 -4.988 -5.281 1.00 0.00 C ATOM 1187 C ASP A 73 -6.924 -5.710 -6.273 1.00 0.00 C ATOM 1188 O ASP A 73 -7.278 -6.766 -6.799 1.00 0.00 O ATOM 1189 CB ASP A 73 -8.800 -4.073 -6.030 1.00 0.00 C ATOM 1190 CG ASP A 73 -9.395 -4.738 -7.256 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -8.739 -4.718 -8.319 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -10.515 -5.280 -7.152 1.00 0.00 O ATOM 0 H ASP A 73 -7.104 -3.208 -4.447 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.402 -5.734 -4.728 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.603 -3.772 -5.358 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.278 -3.164 -6.330 1.00 0.00 H new ATOM 1197 N LEU A 74 -5.754 -5.134 -6.524 1.00 0.00 N ATOM 1198 CA LEU A 74 -4.796 -5.722 -7.454 1.00 0.00 C ATOM 1199 C LEU A 74 -4.134 -6.955 -6.847 1.00 0.00 C ATOM 1200 O LEU A 74 -3.514 -7.750 -7.554 1.00 0.00 O ATOM 1201 CB LEU A 74 -3.730 -4.694 -7.837 1.00 0.00 C ATOM 1202 CG LEU A 74 -2.855 -5.050 -9.039 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -3.712 -5.523 -10.202 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -2.004 -3.858 -9.451 1.00 0.00 C ATOM 0 H LEU A 74 -5.446 -4.261 -6.097 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.337 -6.026 -8.350 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.226 -3.745 -8.042 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.082 -4.535 -6.975 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.189 -5.864 -8.751 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.072 -5.772 -11.048 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.277 -6.406 -9.902 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.403 -4.731 -10.490 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -1.388 -4.130 -10.308 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.652 -3.024 -9.720 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.362 -3.565 -8.620 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.273 -7.109 -5.535 1.00 0.00 N ATOM 1217 CA ILE A 75 -3.691 -8.247 -4.834 1.00 0.00 C ATOM 1218 C ILE A 75 -4.556 -9.492 -4.995 1.00 0.00 C ATOM 1219 O ILE A 75 -4.077 -10.542 -5.425 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.510 -7.951 -3.333 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.451 -6.866 -3.129 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -3.128 -9.220 -2.586 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -2.404 -6.326 -1.717 1.00 0.00 C ATOM 0 H ILE A 75 -4.783 -6.460 -4.936 1.00 0.00 H new ATOM 0 HA ILE A 75 -2.713 -8.427 -5.281 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.456 -7.588 -2.932 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.473 -7.271 -3.387 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.647 -6.044 -3.817 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -3.004 -8.995 -1.527 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.914 -9.965 -2.709 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.192 -9.610 -2.986 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.631 -5.561 -1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -3.370 -5.890 -1.462 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.177 -7.137 -1.025 1.00 0.00 H new ATOM 1235 N CYS A 76 -5.833 -9.367 -4.648 1.00 0.00 N ATOM 1236 CA CYS A 76 -6.766 -10.483 -4.755 1.00 0.00 C ATOM 1237 C CYS A 76 -6.868 -10.971 -6.196 1.00 0.00 C ATOM 1238 O CYS A 76 -7.160 -12.140 -6.447 1.00 0.00 O ATOM 1239 CB CYS A 76 -8.148 -10.069 -4.246 1.00 0.00 C ATOM 1240 SG CYS A 76 -9.100 -9.075 -5.418 1.00 0.00 S ATOM 0 H CYS A 76 -6.245 -8.505 -4.291 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.389 -11.300 -4.140 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.717 -10.966 -4.001 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.029 -9.505 -3.321 1.00 0.00 H new ATOM 0 HG CYS A 76 -8.331 -8.167 -5.941 1.00 0.00 H new ATOM 1246 N SER A 77 -6.625 -10.067 -7.140 1.00 0.00 N ATOM 1247 CA SER A 77 -6.694 -10.405 -8.557 1.00 0.00 C ATOM 1248 C SER A 77 -5.405 -11.077 -9.019 1.00 0.00 C ATOM 1249 O SER A 77 -5.426 -12.186 -9.551 1.00 0.00 O ATOM 1250 CB SER A 77 -6.954 -9.148 -9.390 1.00 0.00 C ATOM 1251 OG SER A 77 -8.323 -8.785 -9.351 1.00 0.00 O ATOM 0 H SER A 77 -6.379 -9.096 -6.949 1.00 0.00 H new ATOM 0 HA SER A 77 -7.518 -11.104 -8.699 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.346 -8.326 -9.013 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.650 -9.322 -10.422 1.00 0.00 H new ATOM 0 HG SER A 77 -8.463 -7.978 -9.889 1.00 0.00 H new ATOM 1257 N ASN A 78 -4.282 -10.396 -8.812 1.00 0.00 N ATOM 1258 CA ASN A 78 -2.982 -10.926 -9.207 1.00 0.00 C ATOM 1259 C ASN A 78 -2.881 -12.413 -8.885 1.00 0.00 C ATOM 1260 O ASN A 78 -2.422 -13.207 -9.707 1.00 0.00 O ATOM 1261 CB ASN A 78 -1.861 -10.162 -8.500 1.00 0.00 C ATOM 1262 CG ASN A 78 -1.431 -8.926 -9.266 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -1.992 -8.605 -10.314 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -0.431 -8.225 -8.745 1.00 0.00 N ATOM 0 H ASN A 78 -4.246 -9.476 -8.373 1.00 0.00 H new ATOM 0 HA ASN A 78 -2.877 -10.798 -10.284 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.195 -9.871 -7.504 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.003 -10.821 -8.368 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.099 -7.383 -9.216 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.005 -8.528 -7.874 1.00 0.00 H new ATOM 1271 N ALA A 79 -3.313 -12.785 -7.685 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.273 -14.177 -7.255 1.00 0.00 C ATOM 1273 C ALA A 79 -4.196 -15.041 -8.108 1.00 0.00 C ATOM 1274 O ALA A 79 -3.740 -15.927 -8.831 1.00 0.00 O ATOM 1275 CB ALA A 79 -3.652 -14.287 -5.786 1.00 0.00 C ATOM 0 H ALA A 79 -3.695 -12.141 -6.993 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.254 -14.542 -7.384 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.618 -15.332 -5.479 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.950 -13.709 -5.185 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.660 -13.899 -5.640 1.00 0.00 H new ATOM 1281 N LEU A 80 -5.495 -14.778 -8.018 1.00 0.00 N ATOM 1282 CA LEU A 80 -6.483 -15.532 -8.781 1.00 0.00 C ATOM 1283 C LEU A 80 -6.008 -15.759 -10.213 1.00 0.00 C ATOM 1284 O LEU A 80 -6.390 -16.736 -10.855 1.00 0.00 O ATOM 1285 CB LEU A 80 -7.824 -14.795 -8.787 1.00 0.00 C ATOM 1286 CG LEU A 80 -8.681 -14.951 -7.530 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -9.770 -13.890 -7.493 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -9.288 -16.345 -7.469 1.00 0.00 C ATOM 0 H LEU A 80 -5.889 -14.048 -7.424 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.611 -16.503 -8.302 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.632 -13.733 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.403 -15.142 -9.643 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.042 -14.817 -6.657 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.370 -14.016 -6.592 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.314 -12.900 -7.490 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.408 -13.992 -8.371 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.895 -16.439 -6.568 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.914 -16.508 -8.346 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.491 -17.088 -7.448 1.00 0.00 H new ATOM 1300 N GLU A 81 -5.172 -14.850 -10.704 1.00 0.00 N ATOM 1301 CA GLU A 81 -4.644 -14.952 -12.059 1.00 0.00 C ATOM 1302 C GLU A 81 -3.622 -16.081 -12.161 1.00 0.00 C ATOM 1303 O GLU A 81 -3.747 -16.973 -13.000 1.00 0.00 O ATOM 1304 CB GLU A 81 -4.003 -13.629 -12.482 1.00 0.00 C ATOM 1305 CG GLU A 81 -4.069 -13.371 -13.978 1.00 0.00 C ATOM 1306 CD GLU A 81 -3.426 -12.056 -14.373 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -3.489 -11.100 -13.572 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -2.859 -11.983 -15.483 1.00 0.00 O ATOM 0 H GLU A 81 -4.846 -14.035 -10.184 1.00 0.00 H new ATOM 0 HA GLU A 81 -5.474 -15.175 -12.729 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -4.499 -12.811 -11.959 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -2.960 -13.623 -12.167 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.574 -14.186 -14.505 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.111 -13.372 -14.297 1.00 0.00 H new ATOM 1315 N TYR A 82 -2.610 -16.033 -11.302 1.00 0.00 N ATOM 1316 CA TYR A 82 -1.563 -17.048 -11.297 1.00 0.00 C ATOM 1317 C TYR A 82 -1.823 -18.092 -10.214 1.00 0.00 C ATOM 1318 O TYR A 82 -0.913 -18.485 -9.485 1.00 0.00 O ATOM 1319 CB TYR A 82 -0.195 -16.400 -11.079 1.00 0.00 C ATOM 1320 CG TYR A 82 0.133 -15.324 -12.088 1.00 0.00 C ATOM 1321 CD1 TYR A 82 0.599 -15.651 -13.356 1.00 0.00 C ATOM 1322 CD2 TYR A 82 -0.025 -13.979 -11.775 1.00 0.00 C ATOM 1323 CE1 TYR A 82 0.900 -14.670 -14.281 1.00 0.00 C ATOM 1324 CE2 TYR A 82 0.272 -12.992 -12.695 1.00 0.00 C ATOM 1325 CZ TYR A 82 0.735 -13.342 -13.946 1.00 0.00 C ATOM 1326 OH TYR A 82 1.033 -12.363 -14.865 1.00 0.00 O ATOM 0 H TYR A 82 -2.492 -15.302 -10.600 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.570 -17.546 -12.267 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.161 -15.970 -10.078 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.574 -17.172 -11.120 1.00 0.00 H new ATOM 0 HD1 TYR A 82 0.728 -16.690 -13.623 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -0.386 -13.701 -10.796 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.263 -14.941 -15.261 1.00 0.00 H new ATOM 0 HE2 TYR A 82 0.142 -11.952 -12.436 1.00 0.00 H new ATOM 0 HH TYR A 82 0.861 -11.482 -14.472 1.00 0.00 H new ATOM 1431 N ASP A 90 -5.970 -25.540 -3.156 1.00 0.00 N ATOM 1432 CA ASP A 90 -6.170 -24.262 -3.829 1.00 0.00 C ATOM 1433 C ASP A 90 -7.514 -23.650 -3.444 1.00 0.00 C ATOM 1434 O ASP A 90 -7.625 -22.439 -3.253 1.00 0.00 O ATOM 1435 CB ASP A 90 -6.094 -24.442 -5.346 1.00 0.00 C ATOM 1436 CG ASP A 90 -6.835 -23.353 -6.096 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -8.060 -23.494 -6.291 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -6.189 -22.358 -6.488 1.00 0.00 O ATOM 0 HA ASP A 90 -5.377 -23.584 -3.511 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -5.049 -24.447 -5.656 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -6.511 -25.413 -5.615 1.00 0.00 H new ATOM 1443 N LYS A 91 -8.533 -24.495 -3.332 1.00 0.00 N ATOM 1444 CA LYS A 91 -9.870 -24.039 -2.970 1.00 0.00 C ATOM 1445 C LYS A 91 -9.804 -22.959 -1.895 1.00 0.00 C ATOM 1446 O LYS A 91 -10.435 -21.909 -2.017 1.00 0.00 O ATOM 1447 CB LYS A 91 -10.716 -25.215 -2.476 1.00 0.00 C ATOM 1448 CG LYS A 91 -10.954 -26.279 -3.533 1.00 0.00 C ATOM 1449 CD LYS A 91 -12.059 -25.875 -4.493 1.00 0.00 C ATOM 1450 CE LYS A 91 -12.279 -26.929 -5.567 1.00 0.00 C ATOM 1451 NZ LYS A 91 -13.626 -26.813 -6.191 1.00 0.00 N ATOM 0 H LYS A 91 -8.458 -25.500 -3.487 1.00 0.00 H new ATOM 0 HA LYS A 91 -10.335 -23.613 -3.859 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.223 -25.671 -1.618 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.678 -24.839 -2.128 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.033 -26.452 -4.090 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.217 -27.220 -3.050 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -12.985 -25.720 -3.939 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.805 -24.924 -4.962 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.513 -26.829 -6.336 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.165 -27.921 -5.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.737 -27.549 -6.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -14.358 -26.933 -5.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.726 -25.875 -6.630 1.00 0.00 H new ATOM 1465 N ILE A 92 -9.035 -23.224 -0.844 1.00 0.00 N ATOM 1466 CA ILE A 92 -8.885 -22.273 0.251 1.00 0.00 C ATOM 1467 C ILE A 92 -8.410 -20.917 -0.260 1.00 0.00 C ATOM 1468 O ILE A 92 -9.134 -19.924 -0.181 1.00 0.00 O ATOM 1469 CB ILE A 92 -7.892 -22.786 1.310 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -8.378 -24.114 1.895 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -7.711 -21.752 2.411 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -7.871 -24.380 3.295 1.00 0.00 C ATOM 0 H ILE A 92 -8.507 -24.089 -0.728 1.00 0.00 H new ATOM 0 HA ILE A 92 -9.868 -22.162 0.710 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.927 -22.952 0.831 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.468 -24.120 1.905 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -8.061 -24.927 1.242 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -7.006 -22.129 3.152 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -7.326 -20.827 1.982 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -8.671 -21.558 2.889 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -8.255 -25.338 3.645 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -6.781 -24.407 3.288 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.210 -23.587 3.962 1.00 0.00 H new ATOM 1484 N ILE A 93 -7.190 -20.883 -0.785 1.00 0.00 N ATOM 1485 CA ILE A 93 -6.619 -19.650 -1.312 1.00 0.00 C ATOM 1486 C ILE A 93 -7.681 -18.807 -2.011 1.00 0.00 C ATOM 1487 O ILE A 93 -7.937 -17.667 -1.624 1.00 0.00 O ATOM 1488 CB ILE A 93 -5.474 -19.937 -2.301 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -4.270 -20.526 -1.565 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -5.081 -18.665 -3.039 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -3.181 -21.025 -2.489 1.00 0.00 C ATOM 0 H ILE A 93 -6.578 -21.696 -0.857 1.00 0.00 H new ATOM 0 HA ILE A 93 -6.222 -19.097 -0.461 1.00 0.00 H new ATOM 0 HB ILE A 93 -5.820 -20.667 -3.033 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -3.853 -19.768 -0.902 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -4.607 -21.350 -0.936 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -4.271 -18.883 -3.734 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -5.940 -18.284 -3.591 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -4.750 -17.915 -2.321 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.359 -21.429 -1.898 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -3.582 -21.806 -3.135 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -2.817 -20.200 -3.101 1.00 0.00 H new ATOM 1503 N ARG A 94 -8.297 -19.378 -3.041 1.00 0.00 N ATOM 1504 CA ARG A 94 -9.333 -18.680 -3.794 1.00 0.00 C ATOM 1505 C ARG A 94 -10.296 -17.960 -2.854 1.00 0.00 C ATOM 1506 O ARG A 94 -10.611 -16.786 -3.051 1.00 0.00 O ATOM 1507 CB ARG A 94 -10.103 -19.664 -4.676 1.00 0.00 C ATOM 1508 CG ARG A 94 -9.349 -20.076 -5.930 1.00 0.00 C ATOM 1509 CD ARG A 94 -10.302 -20.427 -7.062 1.00 0.00 C ATOM 1510 NE ARG A 94 -11.123 -21.593 -6.745 1.00 0.00 N ATOM 1511 CZ ARG A 94 -12.075 -22.061 -7.544 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -12.324 -21.466 -8.703 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -12.780 -23.126 -7.186 1.00 0.00 N ATOM 0 H ARG A 94 -8.097 -20.321 -3.373 1.00 0.00 H new ATOM 0 HA ARG A 94 -8.849 -17.938 -4.428 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -10.337 -20.555 -4.093 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -11.053 -19.214 -4.965 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -8.692 -19.265 -6.244 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -8.713 -20.933 -5.709 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.948 -19.574 -7.269 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -9.731 -20.622 -7.970 1.00 0.00 H new ATOM 0 HE ARG A 94 -10.956 -22.074 -5.861 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -11.784 -20.647 -8.982 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.056 -21.827 -9.315 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -12.591 -23.587 -6.296 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -13.511 -23.484 -7.801 1.00 0.00 H new ATOM 1527 N HIS A 95 -10.762 -18.672 -1.833 1.00 0.00 N ATOM 1528 CA HIS A 95 -11.690 -18.102 -0.863 1.00 0.00 C ATOM 1529 C HIS A 95 -11.017 -17.000 -0.051 1.00 0.00 C ATOM 1530 O HIS A 95 -11.643 -15.996 0.289 1.00 0.00 O ATOM 1531 CB HIS A 95 -12.217 -19.191 0.072 1.00 0.00 C ATOM 1532 CG HIS A 95 -13.406 -19.922 -0.471 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -14.699 -19.655 -0.075 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -13.492 -20.916 -1.386 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -15.529 -20.454 -0.721 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -14.822 -21.229 -1.523 1.00 0.00 N ATOM 0 H HIS A 95 -10.512 -19.645 -1.656 1.00 0.00 H new ATOM 0 HA HIS A 95 -12.527 -17.667 -1.410 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -11.419 -19.907 0.269 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -12.483 -18.740 1.028 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -12.668 -21.377 -1.910 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -16.603 -20.471 -0.612 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -15.202 -21.944 -2.143 1.00 0.00 H new ATOM 1545 N ARG A 96 -9.739 -17.194 0.257 1.00 0.00 N ATOM 1546 CA ARG A 96 -8.982 -16.218 1.031 1.00 0.00 C ATOM 1547 C ARG A 96 -8.931 -14.874 0.310 1.00 0.00 C ATOM 1548 O ARG A 96 -9.184 -13.828 0.907 1.00 0.00 O ATOM 1549 CB ARG A 96 -7.562 -16.726 1.284 1.00 0.00 C ATOM 1550 CG ARG A 96 -7.510 -18.007 2.101 1.00 0.00 C ATOM 1551 CD ARG A 96 -7.729 -17.734 3.580 1.00 0.00 C ATOM 1552 NE ARG A 96 -7.354 -18.877 4.409 1.00 0.00 N ATOM 1553 CZ ARG A 96 -6.109 -19.121 4.805 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -5.126 -18.305 4.451 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -5.847 -20.181 5.558 1.00 0.00 N ATOM 0 H ARG A 96 -9.206 -18.019 -0.018 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.487 -16.080 1.987 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.070 -16.896 0.326 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -6.995 -15.952 1.801 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -8.271 -18.700 1.741 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -6.544 -18.492 1.959 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -7.145 -16.863 3.878 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -8.777 -17.490 3.752 1.00 0.00 H new ATOM 0 HE ARG A 96 -8.088 -19.523 4.700 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.324 -17.488 3.874 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -4.171 -18.494 4.756 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.601 -20.810 5.834 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -4.891 -20.367 5.861 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.602 -14.911 -0.977 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.520 -13.697 -1.780 1.00 0.00 C ATOM 1571 C ALA A 97 -9.754 -12.824 -1.583 1.00 0.00 C ATOM 1572 O ALA A 97 -9.652 -11.600 -1.489 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.348 -14.047 -3.251 1.00 0.00 C ATOM 0 H ALA A 97 -8.388 -15.769 -1.486 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.650 -13.130 -1.449 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -8.288 -13.131 -3.838 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.432 -14.623 -3.383 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -9.200 -14.638 -3.586 1.00 0.00 H new ATOM 1579 N CYS A 98 -10.919 -13.459 -1.522 1.00 0.00 N ATOM 1580 CA CYS A 98 -12.174 -12.739 -1.337 1.00 0.00 C ATOM 1581 C CYS A 98 -12.265 -12.157 0.069 1.00 0.00 C ATOM 1582 O CYS A 98 -12.836 -11.085 0.274 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.362 -13.668 -1.595 1.00 0.00 C ATOM 1584 SG CYS A 98 -14.910 -12.805 -1.954 1.00 0.00 S ATOM 0 H CYS A 98 -11.021 -14.471 -1.598 1.00 0.00 H new ATOM 0 HA CYS A 98 -12.202 -11.918 -2.053 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.122 -14.324 -2.432 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -13.508 -14.305 -0.723 1.00 0.00 H new ATOM 0 HG CYS A 98 -15.854 -13.675 -2.160 1.00 0.00 H new ATOM 1590 N THR A 99 -11.700 -12.871 1.038 1.00 0.00 N ATOM 1591 CA THR A 99 -11.719 -12.427 2.426 1.00 0.00 C ATOM 1592 C THR A 99 -10.799 -11.229 2.633 1.00 0.00 C ATOM 1593 O THR A 99 -11.007 -10.422 3.540 1.00 0.00 O ATOM 1594 CB THR A 99 -11.297 -13.557 3.383 1.00 0.00 C ATOM 1595 OG1 THR A 99 -12.180 -14.675 3.242 1.00 0.00 O ATOM 1596 CG2 THR A 99 -11.307 -13.075 4.826 1.00 0.00 C ATOM 0 H THR A 99 -11.223 -13.760 0.886 1.00 0.00 H new ATOM 0 HA THR A 99 -12.745 -12.136 2.651 1.00 0.00 H new ATOM 0 HB THR A 99 -10.283 -13.862 3.125 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.055 -15.081 2.359 1.00 0.00 H new ATOM 0 HG21 THR A 99 -11.006 -13.890 5.484 1.00 0.00 H new ATOM 0 HG22 THR A 99 -10.611 -12.243 4.937 1.00 0.00 H new ATOM 0 HG23 THR A 99 -12.311 -12.746 5.093 1.00 0.00 H new ATOM 1604 N LEU A 100 -9.780 -11.119 1.787 1.00 0.00 N ATOM 1605 CA LEU A 100 -8.827 -10.019 1.877 1.00 0.00 C ATOM 1606 C LEU A 100 -9.443 -8.721 1.364 1.00 0.00 C ATOM 1607 O LEU A 100 -9.156 -7.639 1.876 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.563 -10.346 1.080 1.00 0.00 C ATOM 1609 CG LEU A 100 -6.500 -9.248 1.026 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -5.754 -9.162 2.348 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -5.531 -9.501 -0.120 1.00 0.00 C ATOM 0 H LEU A 100 -9.593 -11.778 1.031 1.00 0.00 H new ATOM 0 HA LEU A 100 -8.563 -9.885 2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.110 -11.241 1.506 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.855 -10.592 0.059 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.998 -8.294 0.851 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.002 -8.375 2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.458 -8.934 3.149 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.267 -10.115 2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.781 -8.710 -0.144 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.039 -10.463 0.025 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.078 -9.511 -1.063 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.293 -8.837 0.349 1.00 0.00 N ATOM 1624 CA LYS A 101 -10.954 -7.674 -0.233 1.00 0.00 C ATOM 1625 C LYS A 101 -12.000 -7.108 0.722 1.00 0.00 C ATOM 1626 O LYS A 101 -11.986 -5.919 1.039 1.00 0.00 O ATOM 1627 CB LYS A 101 -11.612 -8.048 -1.563 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.975 -6.849 -2.420 1.00 0.00 C ATOM 1629 CD LYS A 101 -12.083 -7.225 -3.889 1.00 0.00 C ATOM 1630 CE LYS A 101 -13.088 -6.346 -4.617 1.00 0.00 C ATOM 1631 NZ LYS A 101 -12.486 -5.054 -5.047 1.00 0.00 N ATOM 0 H LYS A 101 -10.541 -9.725 -0.088 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.198 -6.909 -0.411 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.936 -8.694 -2.124 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.513 -8.627 -1.363 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -12.923 -6.431 -2.080 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -11.221 -6.071 -2.297 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.106 -7.131 -4.362 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -12.381 -8.270 -3.977 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.470 -6.877 -5.489 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.939 -6.151 -3.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -13.233 -4.423 -5.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -12.010 -4.606 -4.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -11.793 -5.228 -5.803 1.00 0.00 H new ATOM 1645 N ASP A 102 -12.904 -7.968 1.179 1.00 0.00 N ATOM 1646 CA ASP A 102 -13.956 -7.553 2.101 1.00 0.00 C ATOM 1647 C ASP A 102 -13.360 -6.950 3.369 1.00 0.00 C ATOM 1648 O ASP A 102 -13.698 -5.831 3.756 1.00 0.00 O ATOM 1649 CB ASP A 102 -14.849 -8.743 2.457 1.00 0.00 C ATOM 1650 CG ASP A 102 -15.813 -9.098 1.342 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -15.403 -9.825 0.413 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -16.976 -8.648 1.398 1.00 0.00 O ATOM 0 H ASP A 102 -12.930 -8.956 0.926 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.559 -6.791 1.607 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -14.224 -9.607 2.682 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -15.413 -8.513 3.361 1.00 0.00 H new ATOM 1657 N THR A 103 -12.472 -7.700 4.014 1.00 0.00 N ATOM 1658 CA THR A 103 -11.831 -7.241 5.240 1.00 0.00 C ATOM 1659 C THR A 103 -11.309 -5.817 5.088 1.00 0.00 C ATOM 1660 O THR A 103 -11.606 -4.946 5.906 1.00 0.00 O ATOM 1661 CB THR A 103 -10.664 -8.162 5.643 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.151 -9.482 5.910 1.00 0.00 O ATOM 1663 CG2 THR A 103 -9.947 -7.622 6.871 1.00 0.00 C ATOM 0 H THR A 103 -12.180 -8.628 3.708 1.00 0.00 H new ATOM 0 HA THR A 103 -12.591 -7.266 6.021 1.00 0.00 H new ATOM 0 HB THR A 103 -9.956 -8.197 4.815 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.406 -9.913 5.068 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.127 -8.289 7.136 1.00 0.00 H new ATOM 0 HG22 THR A 103 -9.552 -6.630 6.654 1.00 0.00 H new ATOM 0 HG23 THR A 103 -10.648 -7.560 7.703 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.532 -5.585 4.035 1.00 0.00 N ATOM 1672 CA ALA A 104 -9.972 -4.265 3.774 1.00 0.00 C ATOM 1673 C ALA A 104 -11.073 -3.222 3.621 1.00 0.00 C ATOM 1674 O ALA A 104 -11.172 -2.287 4.417 1.00 0.00 O ATOM 1675 CB ALA A 104 -9.098 -4.299 2.529 1.00 0.00 C ATOM 0 H ALA A 104 -10.276 -6.295 3.349 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.357 -3.983 4.629 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.686 -3.306 2.346 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.283 -5.008 2.676 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.697 -4.607 1.672 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.900 -3.387 2.593 1.00 0.00 N ATOM 1682 CA HIS A 105 -12.995 -2.458 2.337 1.00 0.00 C ATOM 1683 C HIS A 105 -13.726 -2.108 3.630 1.00 0.00 C ATOM 1684 O HIS A 105 -14.155 -0.972 3.823 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.976 -3.059 1.330 1.00 0.00 C ATOM 1686 CG HIS A 105 -13.614 -2.783 -0.097 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -14.090 -1.695 -0.798 1.00 0.00 N ATOM 1688 CD2 HIS A 105 -12.815 -3.461 -0.955 1.00 0.00 C ATOM 1689 CE1 HIS A 105 -13.602 -1.716 -2.025 1.00 0.00 C ATOM 1690 NE2 HIS A 105 -12.825 -2.777 -2.146 1.00 0.00 N ATOM 0 H HIS A 105 -11.833 -4.155 1.925 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.572 -1.543 1.921 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -14.025 -4.137 1.482 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.973 -2.664 1.526 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -14.721 -0.985 -0.427 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -12.272 -4.370 -0.742 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -13.804 -0.989 -2.798 1.00 0.00 H new ATOM 1699 N ALA A 106 -13.863 -3.094 4.511 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.540 -2.890 5.785 1.00 0.00 C ATOM 1701 C ALA A 106 -13.775 -1.904 6.662 1.00 0.00 C ATOM 1702 O ALA A 106 -14.291 -0.842 7.014 1.00 0.00 O ATOM 1703 CB ALA A 106 -14.715 -4.217 6.509 1.00 0.00 C ATOM 0 H ALA A 106 -13.514 -4.041 4.365 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.524 -2.467 5.581 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -15.222 -4.049 7.459 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.311 -4.891 5.894 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -13.737 -4.663 6.693 1.00 0.00 H new ATOM 1709 N ILE A 107 -12.544 -2.262 7.011 1.00 0.00 N ATOM 1710 CA ILE A 107 -11.709 -1.408 7.846 1.00 0.00 C ATOM 1711 C ILE A 107 -11.745 0.038 7.363 1.00 0.00 C ATOM 1712 O ILE A 107 -11.848 0.968 8.163 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.248 -1.895 7.866 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.174 -3.334 8.381 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -9.394 -0.974 8.725 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -8.826 -3.985 8.164 1.00 0.00 C ATOM 0 H ILE A 107 -12.103 -3.137 6.729 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.115 -1.461 8.856 1.00 0.00 H new ATOM 0 HB ILE A 107 -9.859 -1.873 6.848 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.405 -3.342 9.446 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -10.940 -3.929 7.884 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.364 -1.331 8.729 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.426 0.036 8.318 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.779 -0.966 9.745 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -8.847 -5.003 8.553 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -8.601 -4.009 7.098 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.058 -3.413 8.684 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.660 0.219 6.049 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.686 1.552 5.459 1.00 0.00 C ATOM 1730 C ILE A 108 -12.971 2.289 5.822 1.00 0.00 C ATOM 1731 O ILE A 108 -12.936 3.435 6.269 1.00 0.00 O ATOM 1732 CB ILE A 108 -11.558 1.491 3.926 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -10.305 0.707 3.528 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -11.518 2.895 3.341 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -9.014 1.406 3.893 1.00 0.00 C ATOM 0 H ILE A 108 -11.573 -0.540 5.373 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.832 2.094 5.866 1.00 0.00 H new ATOM 0 HB ILE A 108 -12.430 0.976 3.524 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.329 -0.270 4.011 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.322 0.532 2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -11.427 2.835 2.256 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.436 3.423 3.600 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.662 3.434 3.747 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.168 0.793 3.582 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.968 2.371 3.389 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.975 1.557 4.972 1.00 0.00 H new ATOM 1747 N ALA A 109 -14.104 1.623 5.627 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.400 2.213 5.936 1.00 0.00 C ATOM 1749 C ALA A 109 -15.676 2.175 7.436 1.00 0.00 C ATOM 1750 O ALA A 109 -16.566 2.867 7.930 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.504 1.491 5.177 1.00 0.00 C ATOM 0 H ALA A 109 -14.150 0.674 5.256 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.381 3.257 5.622 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.466 1.943 5.418 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -16.323 1.573 4.105 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.515 0.439 5.464 1.00 0.00 H new ATOM 1757 N ALA A 110 -14.907 1.364 8.154 1.00 0.00 N ATOM 1758 CA ALA A 110 -15.068 1.238 9.597 1.00 0.00 C ATOM 1759 C ALA A 110 -14.310 2.338 10.332 1.00 0.00 C ATOM 1760 O ALA A 110 -14.665 2.707 11.451 1.00 0.00 O ATOM 1761 CB ALA A 110 -14.598 -0.132 10.063 1.00 0.00 C ATOM 0 H ALA A 110 -14.166 0.784 7.760 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.127 1.345 9.830 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.724 -0.212 11.143 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -15.187 -0.906 9.571 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.546 -0.261 9.810 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.265 2.857 9.696 1.00 0.00 N ATOM 1768 CA GLU A 111 -12.457 3.915 10.292 1.00 0.00 C ATOM 1769 C GLU A 111 -12.577 5.208 9.491 1.00 0.00 C ATOM 1770 O GLU A 111 -12.988 6.242 10.018 1.00 0.00 O ATOM 1771 CB GLU A 111 -10.991 3.484 10.369 1.00 0.00 C ATOM 1772 CG GLU A 111 -10.738 2.360 11.361 1.00 0.00 C ATOM 1773 CD GLU A 111 -10.363 2.871 12.738 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -9.647 3.891 12.817 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -10.784 2.251 13.737 1.00 0.00 O ATOM 0 H GLU A 111 -12.958 2.563 8.769 1.00 0.00 H new ATOM 0 HA GLU A 111 -12.829 4.097 11.300 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.662 3.165 9.380 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.382 4.345 10.645 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.632 1.741 11.438 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.939 1.721 10.985 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.215 5.142 8.214 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.280 6.307 7.339 1.00 0.00 C ATOM 1784 C LEU A 112 -13.611 7.035 7.501 1.00 0.00 C ATOM 1785 O LEU A 112 -14.654 6.409 7.685 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.091 5.885 5.881 1.00 0.00 C ATOM 1787 CG LEU A 112 -11.524 6.951 4.942 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -10.056 7.205 5.249 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -11.702 6.532 3.490 1.00 0.00 C ATOM 0 H LEU A 112 -11.873 4.294 7.762 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.477 6.988 7.621 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.429 5.019 5.857 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -13.055 5.560 5.490 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.074 7.879 5.101 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.669 7.966 4.571 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.954 7.549 6.278 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.492 6.282 5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.293 7.302 2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -11.178 5.592 3.316 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -12.763 6.401 3.277 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.566 8.361 7.427 1.00 0.00 N ATOM 1802 CA ASP A 113 -14.769 9.175 7.563 1.00 0.00 C ATOM 1803 C ASP A 113 -15.030 9.974 6.290 1.00 0.00 C ATOM 1804 O ASP A 113 -14.120 10.262 5.511 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.638 10.122 8.756 1.00 0.00 C ATOM 1806 CG ASP A 113 -15.037 9.465 10.063 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -14.196 8.751 10.649 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -16.190 9.663 10.499 1.00 0.00 O ATOM 0 H ASP A 113 -12.710 8.895 7.274 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.613 8.507 7.731 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.608 10.471 8.828 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.261 11.000 8.589 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.301 10.340 6.070 1.00 0.00 N ATOM 1814 CA PRO A 114 -16.712 11.110 4.893 1.00 0.00 C ATOM 1815 C PRO A 114 -16.202 12.547 4.933 1.00 0.00 C ATOM 1816 O PRO A 114 -16.445 13.327 4.013 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.240 11.082 4.966 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.547 10.884 6.410 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.437 10.030 6.956 1.00 0.00 C ATOM 0 HA PRO A 114 -16.309 10.691 3.971 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.671 12.011 4.593 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.651 10.275 4.360 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.598 11.839 6.933 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.514 10.398 6.540 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.215 10.275 7.995 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -17.693 8.971 6.926 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.495 12.889 6.005 1.00 0.00 N ATOM 1828 CA GLU A 115 -14.952 14.233 6.164 1.00 0.00 C ATOM 1829 C GLU A 115 -13.458 14.256 5.855 1.00 0.00 C ATOM 1830 O GLU A 115 -12.948 15.215 5.275 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.197 14.741 7.587 1.00 0.00 C ATOM 1832 CG GLU A 115 -14.502 13.915 8.656 1.00 0.00 C ATOM 1833 CD GLU A 115 -13.130 14.455 9.011 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -12.854 15.630 8.689 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -12.333 13.704 9.610 1.00 0.00 O ATOM 0 H GLU A 115 -15.285 12.255 6.776 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.462 14.889 5.458 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.856 15.774 7.659 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.269 14.745 7.783 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -15.122 13.892 9.552 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.405 12.886 8.309 1.00 0.00 H new ATOM 1842 N PHE A 116 -12.762 13.194 6.246 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.326 13.093 6.012 1.00 0.00 C ATOM 1844 C PHE A 116 -11.038 12.624 4.588 1.00 0.00 C ATOM 1845 O PHE A 116 -10.034 13.006 3.989 1.00 0.00 O ATOM 1846 CB PHE A 116 -10.691 12.128 7.016 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.191 12.094 6.948 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.449 13.249 7.136 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -8.523 10.907 6.696 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.069 13.221 7.075 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -7.142 10.872 6.634 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.415 12.031 6.823 1.00 0.00 C ATOM 0 H PHE A 116 -13.169 12.391 6.726 1.00 0.00 H new ATOM 0 HA PHE A 116 -10.891 14.084 6.145 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -10.995 12.413 8.023 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.078 11.125 6.838 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -8.955 14.182 7.333 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.087 9.998 6.546 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.503 14.128 7.224 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.633 9.940 6.438 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.336 12.007 6.774 1.00 0.00 H new ATOM 1862 N ASN A 117 -11.928 11.794 4.054 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.770 11.271 2.702 1.00 0.00 C ATOM 1864 C ASN A 117 -11.898 12.387 1.669 1.00 0.00 C ATOM 1865 O ASN A 117 -11.290 12.333 0.600 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.812 10.185 2.427 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.608 9.515 1.082 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -12.021 8.435 0.997 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -13.092 10.153 0.023 1.00 0.00 N ATOM 0 H ASN A 117 -12.766 11.469 4.537 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.773 10.837 2.622 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.766 9.433 3.215 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.809 10.624 2.463 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -12.985 9.750 -0.908 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.571 11.046 0.140 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.694 13.400 1.997 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.901 14.531 1.100 1.00 0.00 C ATOM 1878 C LYS A 118 -11.718 15.492 1.153 1.00 0.00 C ATOM 1879 O LYS A 118 -11.434 16.198 0.185 1.00 0.00 O ATOM 1880 CB LYS A 118 -14.189 15.271 1.469 1.00 0.00 C ATOM 1881 CG LYS A 118 -13.995 16.335 2.536 1.00 0.00 C ATOM 1882 CD LYS A 118 -15.249 16.520 3.373 1.00 0.00 C ATOM 1883 CE LYS A 118 -16.244 17.446 2.691 1.00 0.00 C ATOM 1884 NZ LYS A 118 -16.007 18.873 3.045 1.00 0.00 N ATOM 0 H LYS A 118 -13.206 13.461 2.877 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.988 14.146 0.084 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -14.600 15.737 0.573 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.926 14.548 1.818 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -13.163 16.056 3.182 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -13.729 17.281 2.064 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -15.715 15.551 3.550 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -14.980 16.928 4.347 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -16.172 17.323 1.610 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -17.257 17.164 2.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.706 19.472 2.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -16.100 18.996 4.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -15.049 19.150 2.749 1.00 0.00 H new ATOM 1898 N LEU A 119 -11.029 15.512 2.289 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.874 16.386 2.467 1.00 0.00 C ATOM 1900 C LEU A 119 -8.671 15.864 1.687 1.00 0.00 C ATOM 1901 O LEU A 119 -8.234 16.482 0.715 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.522 16.501 3.951 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.464 17.355 4.800 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -9.843 17.648 6.157 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -10.808 18.649 4.078 1.00 0.00 C ATOM 0 H LEU A 119 -11.250 14.934 3.100 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.133 17.373 2.083 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.492 15.498 4.376 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.516 16.913 4.034 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.386 16.795 4.959 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.528 18.257 6.747 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.650 16.711 6.679 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.906 18.187 6.019 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -11.479 19.244 4.697 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.895 19.213 3.887 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -11.297 18.419 3.131 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.143 14.724 2.116 1.00 0.00 N ATOM 1918 CA CYS A 120 -6.991 14.118 1.457 1.00 0.00 C ATOM 1919 C CYS A 120 -7.096 14.260 -0.058 1.00 0.00 C ATOM 1920 O CYS A 120 -6.145 14.677 -0.718 1.00 0.00 O ATOM 1921 CB CYS A 120 -6.879 12.641 1.837 1.00 0.00 C ATOM 1922 SG CYS A 120 -8.430 11.723 1.698 1.00 0.00 S ATOM 0 H CYS A 120 -8.494 14.200 2.918 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.095 14.640 1.792 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -6.131 12.169 1.200 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -6.516 12.567 2.862 1.00 0.00 H new ATOM 0 HG CYS A 120 -9.282 12.177 2.568 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.257 13.909 -0.602 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.484 13.995 -2.039 1.00 0.00 C ATOM 1930 C GLU A 121 -8.533 15.450 -2.496 1.00 0.00 C ATOM 1931 O GLU A 121 -8.132 15.774 -3.613 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.787 13.286 -2.416 1.00 0.00 C ATOM 1933 CG GLU A 121 -11.035 14.049 -2.006 1.00 0.00 C ATOM 1934 CD GLU A 121 -12.281 13.554 -2.714 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.180 13.183 -3.903 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -13.356 13.536 -2.080 1.00 0.00 O ATOM 0 H GLU A 121 -9.055 13.562 -0.069 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.652 13.502 -2.542 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.806 13.128 -3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -9.803 12.301 -1.949 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.174 13.959 -0.929 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.896 15.108 -2.222 1.00 0.00 H new ATOM 1943 N GLU A 122 -9.029 16.322 -1.623 1.00 0.00 N ATOM 1944 CA GLU A 122 -9.132 17.742 -1.938 1.00 0.00 C ATOM 1945 C GLU A 122 -7.858 18.244 -2.613 1.00 0.00 C ATOM 1946 O GLU A 122 -7.913 18.922 -3.639 1.00 0.00 O ATOM 1947 CB GLU A 122 -9.401 18.550 -0.667 1.00 0.00 C ATOM 1948 CG GLU A 122 -10.180 19.831 -0.914 1.00 0.00 C ATOM 1949 CD GLU A 122 -10.383 20.643 0.351 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -9.374 21.018 0.983 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -11.551 20.903 0.709 1.00 0.00 O ATOM 0 H GLU A 122 -9.365 16.070 -0.694 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.965 17.875 -2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.953 17.929 0.038 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -8.450 18.798 -0.196 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.651 20.437 -1.650 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -11.151 19.584 -1.343 1.00 0.00 H new ATOM 1958 N ILE A 123 -6.714 17.906 -2.029 1.00 0.00 N ATOM 1959 CA ILE A 123 -5.427 18.321 -2.573 1.00 0.00 C ATOM 1960 C ILE A 123 -5.199 17.727 -3.959 1.00 0.00 C ATOM 1961 O ILE A 123 -4.485 18.300 -4.782 1.00 0.00 O ATOM 1962 CB ILE A 123 -4.265 17.906 -1.652 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -4.394 18.593 -0.290 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -2.930 18.244 -2.297 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.806 17.791 0.849 1.00 0.00 C ATOM 0 H ILE A 123 -6.652 17.346 -1.179 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.451 19.408 -2.645 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.310 16.828 -1.500 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.900 19.564 -0.333 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -5.448 18.781 -0.085 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -2.119 17.944 -1.633 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -2.839 17.713 -3.244 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -2.874 19.318 -2.476 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.933 18.338 1.783 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.316 16.830 0.919 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.744 17.625 0.667 1.00 0.00 H new ATOM 1977 N LYS A 124 -5.813 16.576 -4.212 1.00 0.00 N ATOM 1978 CA LYS A 124 -5.681 15.904 -5.499 1.00 0.00 C ATOM 1979 C LYS A 124 -5.941 16.874 -6.648 1.00 0.00 C ATOM 1980 O LYS A 124 -5.191 16.910 -7.622 1.00 0.00 O ATOM 1981 CB LYS A 124 -6.651 14.724 -5.584 1.00 0.00 C ATOM 1982 CG LYS A 124 -6.337 13.759 -6.713 1.00 0.00 C ATOM 1983 CD LYS A 124 -7.027 12.420 -6.510 1.00 0.00 C ATOM 1984 CE LYS A 124 -6.312 11.305 -7.259 1.00 0.00 C ATOM 1985 NZ LYS A 124 -7.244 10.210 -7.645 1.00 0.00 N ATOM 0 H LYS A 124 -6.408 16.089 -3.542 1.00 0.00 H new ATOM 0 HA LYS A 124 -4.660 15.533 -5.584 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -6.634 14.182 -4.639 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -7.664 15.106 -5.715 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -6.653 14.192 -7.662 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -5.259 13.608 -6.775 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -7.059 12.183 -5.446 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.060 12.486 -6.853 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -5.840 11.713 -8.153 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -5.515 10.901 -6.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -6.962 9.330 -7.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -8.212 10.463 -7.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.209 10.072 -8.675 1.00 0.00 H new