USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 914 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 21 THR OG1 : rot -145:sc= 0.239 USER MOD Set 1.2: A 96 ASN : amide:sc= 0.766 K(o=2.1,f=-0.74) USER MOD Set 1.3: A 98 GLN : amide:sc= 1.05 K(o=2.1,f=-0.48) USER MOD Set 2.1: A 84 ASN : amide:sc= 1.42 K(o=2.4,f=-2.3) USER MOD Set 2.2: A 87 LYS NZ :NH3+ 177:sc= 0.952 (180deg=0) USER MOD Set 3.1: A 42 CYS SG : rot -130:sc= -0.17 USER MOD Set 3.2: A 62 CYS SG : rot -159:sc= -0.0518 USER MOD Single : A 3 GLN : amide:sc= 0.811 K(o=0.81,f=0) USER MOD Single : A 6 SER OG : rot -29:sc= 0.449 USER MOD Single : A 7 GLN : amide:sc= 0.491 X(o=0.49,f=0) USER MOD Single : A 8 HIS :FLIP no HD1:sc= -0.22 F(o=-0.94,f=-0.22) USER MOD Single : A 11 TYR OH : rot 30:sc= -0.0116 USER MOD Single : A 14 GLN : amide:sc= 0.0856 X(o=0.086,f=-0.21) USER MOD Single : A 16 LYS NZ :NH3+ 176:sc= -0.687 (180deg=-0.715) USER MOD Single : A 17 GLN : amide:sc= -0.0633 X(o=-0.063,f=-0.37) USER MOD Single : A 20 LYS NZ :NH3+ -117:sc= 0.13 (180deg=-0.236) USER MOD Single : A 25 LYS NZ :NH3+ -178:sc= 0.587 (180deg=0.585) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -172:sc= -0.0038 (180deg=-0.111) USER MOD Single : A 39 LYS NZ :NH3+ 179:sc= 0.77 (180deg=0.749) USER MOD Single : A 41 THR OG1 : rot 81:sc= 0.534 USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 50 THR OG1 : rot 71:sc= 0.402 USER MOD Single : A 54 LYS NZ :NH3+ -104:sc= 1.14 (180deg=-0.419) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc=-0.00324 USER MOD Single : A 68 ASN : amide:sc= -0.56 X(o=-0.56,f=-0.08) USER MOD Single : A 69 THR OG1 : rot 77:sc= 1.1 USER MOD Single : A 74 LYS NZ :NH3+ -166:sc= 0.487 (180deg=0.332) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -146:sc= 0.865 (180deg=0.288) USER MOD Single : A 93 LYS NZ :NH3+ -106:sc= 1.19 (180deg=0.0107) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= 0.445 K(o=0.45,f=-4.7!) USER MOD Single : A 106 THR OG1 : rot 66:sc= 1.19 USER MOD Single : A 111 LYS NZ :NH3+ -140:sc= 0.926 (180deg=0.102) USER MOD ----------------------------------------------------------------- ATOM 43 N GLY A 2 0.821 0.894 1.865 1.00 25.00 N ATOM 44 CA GLY A 2 0.435 1.563 3.103 1.00 25.00 C ATOM 45 C GLY A 2 -0.055 2.965 2.820 1.00 25.00 C ATOM 46 O GLY A 2 -1.010 3.450 3.420 1.00 25.00 O ATOM 0 HA2 GLY A 2 -0.348 0.992 3.602 1.00 25.00 H new ATOM 0 HA3 GLY A 2 1.286 1.600 3.783 1.00 25.00 H new ATOM 50 N GLN A 3 0.587 3.615 1.864 1.00 25.00 N ATOM 51 CA GLN A 3 0.231 4.982 1.510 1.00 25.00 C ATOM 52 C GLN A 3 -1.171 5.067 0.905 1.00 25.00 C ATOM 53 O GLN A 3 -1.901 6.018 1.170 1.00 25.00 O ATOM 54 CB GLN A 3 1.264 5.554 0.537 1.00 25.00 C ATOM 55 CG GLN A 3 2.675 5.611 1.129 1.00 25.00 C ATOM 56 CD GLN A 3 3.656 6.325 0.225 1.00 25.00 C ATOM 57 OE1 GLN A 3 3.473 7.482 -0.106 1.00 25.00 O ATOM 58 NE2 GLN A 3 4.700 5.646 -0.166 1.00 25.00 N ATOM 0 H GLN A 3 1.355 3.222 1.320 1.00 25.00 H new ATOM 0 HA GLN A 3 0.228 5.573 2.426 1.00 25.00 H new ATOM 0 HB2 GLN A 3 1.279 4.946 -0.367 1.00 25.00 H new ATOM 0 HB3 GLN A 3 0.959 6.558 0.241 1.00 25.00 H new ATOM 0 HG2 GLN A 3 2.640 6.117 2.094 1.00 25.00 H new ATOM 0 HG3 GLN A 3 3.029 4.597 1.314 1.00 25.00 H new ATOM 0 HE21 GLN A 3 4.820 4.678 0.132 1.00 25.00 H new ATOM 0 HE22 GLN A 3 5.396 6.084 -0.769 1.00 25.00 H new ATOM 67 N GLU A 4 -1.564 4.075 0.117 1.00 25.00 N ATOM 68 CA GLU A 4 -2.891 4.091 -0.503 1.00 25.00 C ATOM 69 C GLU A 4 -3.959 3.716 0.526 1.00 25.00 C ATOM 70 O GLU A 4 -5.080 4.199 0.469 1.00 25.00 O ATOM 71 CB GLU A 4 -2.931 3.164 -1.733 1.00 25.00 C ATOM 72 CG GLU A 4 -3.542 1.784 -1.507 1.00 25.00 C ATOM 73 CD GLU A 4 -3.310 0.862 -2.682 1.00 25.00 C ATOM 74 OE1 GLU A 4 -2.220 0.256 -2.755 1.00 25.00 O ATOM 75 OE2 GLU A 4 -4.219 0.734 -3.530 1.00 25.00 O ATOM 0 H GLU A 4 -0.996 3.258 -0.108 1.00 25.00 H new ATOM 0 HA GLU A 4 -3.105 5.101 -0.853 1.00 25.00 H new ATOM 0 HB2 GLU A 4 -3.492 3.664 -2.523 1.00 25.00 H new ATOM 0 HB3 GLU A 4 -1.913 3.034 -2.099 1.00 25.00 H new ATOM 0 HG2 GLU A 4 -3.113 1.341 -0.608 1.00 25.00 H new ATOM 0 HG3 GLU A 4 -4.613 1.886 -1.332 1.00 25.00 H new ATOM 82 N LEU A 5 -3.596 2.905 1.511 1.00 25.00 N ATOM 83 CA LEU A 5 -4.528 2.505 2.560 1.00 25.00 C ATOM 84 C LEU A 5 -4.959 3.697 3.408 1.00 25.00 C ATOM 85 O LEU A 5 -6.110 3.783 3.816 1.00 25.00 O ATOM 86 CB LEU A 5 -3.881 1.427 3.430 1.00 25.00 C ATOM 87 CG LEU A 5 -4.360 -0.008 3.160 1.00 25.00 C ATOM 88 CD1 LEU A 5 -4.250 -0.424 1.722 1.00 25.00 C ATOM 89 CD2 LEU A 5 -3.571 -0.983 4.027 1.00 25.00 C ATOM 0 H LEU A 5 -2.661 2.510 1.607 1.00 25.00 H new ATOM 0 HA LEU A 5 -5.426 2.101 2.092 1.00 25.00 H new ATOM 0 HB2 LEU A 5 -2.801 1.466 3.285 1.00 25.00 H new ATOM 0 HB3 LEU A 5 -4.071 1.665 4.477 1.00 25.00 H new ATOM 0 HG LEU A 5 -5.420 -0.028 3.411 1.00 25.00 H new ATOM 0 HD11 LEU A 5 -4.607 -1.448 1.611 1.00 25.00 H new ATOM 0 HD12 LEU A 5 -4.855 0.240 1.104 1.00 25.00 H new ATOM 0 HD13 LEU A 5 -3.209 -0.366 1.405 1.00 25.00 H new ATOM 0 HD21 LEU A 5 -3.912 -2.000 3.834 1.00 25.00 H new ATOM 0 HD22 LEU A 5 -2.510 -0.905 3.789 1.00 25.00 H new ATOM 0 HD23 LEU A 5 -3.726 -0.742 5.079 1.00 25.00 H new ATOM 101 N SER A 6 -4.064 4.657 3.605 1.00 25.00 N ATOM 102 CA SER A 6 -4.408 5.896 4.315 1.00 25.00 C ATOM 103 C SER A 6 -5.266 6.849 3.474 1.00 25.00 C ATOM 104 O SER A 6 -5.679 7.900 3.963 1.00 25.00 O ATOM 105 CB SER A 6 -3.135 6.635 4.743 1.00 25.00 C ATOM 106 OG SER A 6 -3.446 7.700 5.630 1.00 25.00 O ATOM 0 H SER A 6 -3.096 4.608 3.287 1.00 25.00 H new ATOM 0 HA SER A 6 -4.992 5.595 5.185 1.00 25.00 H new ATOM 0 HB2 SER A 6 -2.451 5.939 5.228 1.00 25.00 H new ATOM 0 HB3 SER A 6 -2.622 7.025 3.864 1.00 25.00 H new ATOM 0 HG SER A 6 -4.343 8.041 5.430 1.00 25.00 H new ATOM 112 N GLN A 7 -5.520 6.492 2.222 1.00 25.00 N ATOM 113 CA GLN A 7 -6.343 7.308 1.320 1.00 25.00 C ATOM 114 C GLN A 7 -7.609 6.545 0.917 1.00 25.00 C ATOM 115 O GLN A 7 -8.553 7.117 0.386 1.00 25.00 O ATOM 116 CB GLN A 7 -5.536 7.671 0.071 1.00 25.00 C ATOM 117 CG GLN A 7 -4.292 8.501 0.371 1.00 25.00 C ATOM 118 CD GLN A 7 -3.470 8.768 -0.866 1.00 25.00 C ATOM 119 OE1 GLN A 7 -3.810 9.605 -1.681 1.00 25.00 O ATOM 120 NE2 GLN A 7 -2.379 8.064 -1.004 1.00 25.00 N ATOM 0 H GLN A 7 -5.166 5.634 1.798 1.00 25.00 H new ATOM 0 HA GLN A 7 -6.635 8.221 1.840 1.00 25.00 H new ATOM 0 HB2 GLN A 7 -5.238 6.755 -0.438 1.00 25.00 H new ATOM 0 HB3 GLN A 7 -6.175 8.224 -0.617 1.00 25.00 H new ATOM 0 HG2 GLN A 7 -4.590 9.449 0.818 1.00 25.00 H new ATOM 0 HG3 GLN A 7 -3.679 7.980 1.107 1.00 25.00 H new ATOM 0 HE21 GLN A 7 -2.127 7.371 -0.299 1.00 25.00 H new ATOM 0 HE22 GLN A 7 -1.779 8.207 -1.816 1.00 25.00 H new ATOM 129 N HIS A 8 -7.626 5.249 1.192 1.00 25.00 N ATOM 130 CA HIS A 8 -8.777 4.399 0.885 1.00 25.00 C ATOM 131 C HIS A 8 -9.807 4.657 1.963 1.00 25.00 C ATOM 132 O HIS A 8 -9.685 4.126 3.054 1.00 25.00 O ATOM 133 CB HIS A 8 -8.346 2.925 0.891 1.00 25.00 C ATOM 134 CG HIS A 8 -9.363 1.986 0.311 1.00 25.00 C ATOM 135 ND1 HIS A 8 -10.277 1.160 0.894 1.00 25.00 N flip ATOM 136 CD2 HIS A 8 -9.515 1.769 -1.062 1.00 25.00 C flip ATOM 137 CE1 HIS A 8 -10.934 0.483 -0.086 1.00 25.00 C flip ATOM 138 NE2 HIS A 8 -10.467 0.859 -1.248 1.00 25.00 N flip ATOM 0 H HIS A 8 -6.849 4.755 1.632 1.00 25.00 H new ATOM 0 HA HIS A 8 -9.188 4.621 -0.100 1.00 25.00 H new ATOM 0 HB2 HIS A 8 -7.416 2.827 0.331 1.00 25.00 H new ATOM 0 HB3 HIS A 8 -8.133 2.624 1.917 1.00 25.00 H new ATOM 0 HD2 HIS A 8 -8.952 2.259 -1.843 1.00 25.00 H new ATOM 0 HE1 HIS A 8 -11.715 -0.247 0.070 1.00 25.00 H new ATOM 0 HE2 HIS A 8 -10.783 0.510 -2.153 1.00 25.00 H new ATOM 146 N GLU A 9 -10.786 5.501 1.680 1.00 25.00 N ATOM 147 CA GLU A 9 -11.752 5.947 2.691 1.00 25.00 C ATOM 148 C GLU A 9 -12.334 4.815 3.547 1.00 25.00 C ATOM 149 O GLU A 9 -12.359 4.927 4.766 1.00 25.00 O ATOM 150 CB GLU A 9 -12.865 6.773 2.026 1.00 25.00 C ATOM 151 CG GLU A 9 -13.683 6.018 0.969 1.00 25.00 C ATOM 152 CD GLU A 9 -14.652 6.917 0.215 1.00 25.00 C ATOM 153 OE1 GLU A 9 -14.645 8.146 0.437 1.00 25.00 O ATOM 154 OE2 GLU A 9 -15.389 6.382 -0.642 1.00 25.00 O ATOM 0 H GLU A 9 -10.940 5.898 0.753 1.00 25.00 H new ATOM 0 HA GLU A 9 -11.199 6.574 3.391 1.00 25.00 H new ATOM 0 HB2 GLU A 9 -13.542 7.133 2.800 1.00 25.00 H new ATOM 0 HB3 GLU A 9 -12.418 7.651 1.560 1.00 25.00 H new ATOM 0 HG2 GLU A 9 -13.003 5.549 0.258 1.00 25.00 H new ATOM 0 HG3 GLU A 9 -14.241 5.217 1.453 1.00 25.00 H new ATOM 161 N ARG A 10 -12.697 3.693 2.938 1.00 25.00 N ATOM 162 CA ARG A 10 -13.244 2.564 3.697 1.00 25.00 C ATOM 163 C ARG A 10 -12.235 1.940 4.657 1.00 25.00 C ATOM 164 O ARG A 10 -12.599 1.484 5.741 1.00 25.00 O ATOM 165 CB ARG A 10 -13.788 1.498 2.753 1.00 25.00 C ATOM 166 CG ARG A 10 -15.024 1.919 1.989 1.00 25.00 C ATOM 167 CD ARG A 10 -15.583 0.723 1.237 1.00 25.00 C ATOM 168 NE ARG A 10 -16.799 1.064 0.486 1.00 25.00 N ATOM 169 CZ ARG A 10 -17.522 0.206 -0.226 1.00 25.00 C ATOM 170 NH1 ARG A 10 -17.199 -1.063 -0.337 1.00 25.00 N ATOM 171 NH2 ARG A 10 -18.589 0.634 -0.839 1.00 25.00 N ATOM 0 H ARG A 10 -12.626 3.536 1.933 1.00 25.00 H new ATOM 0 HA ARG A 10 -14.054 2.968 4.304 1.00 25.00 H new ATOM 0 HB2 ARG A 10 -13.009 1.228 2.041 1.00 25.00 H new ATOM 0 HB3 ARG A 10 -14.018 0.602 3.329 1.00 25.00 H new ATOM 0 HG2 ARG A 10 -15.773 2.313 2.676 1.00 25.00 H new ATOM 0 HG3 ARG A 10 -14.779 2.719 1.291 1.00 25.00 H new ATOM 0 HD2 ARG A 10 -14.828 0.341 0.550 1.00 25.00 H new ATOM 0 HD3 ARG A 10 -15.805 -0.077 1.943 1.00 25.00 H new ATOM 0 HE ARG A 10 -17.112 2.034 0.513 1.00 25.00 H new ATOM 0 HH11 ARG A 10 -16.367 -1.421 0.133 1.00 25.00 H new ATOM 0 HH12 ARG A 10 -17.780 -1.690 -0.893 1.00 25.00 H new ATOM 0 HH21 ARG A 10 -18.859 1.615 -0.768 1.00 25.00 H new ATOM 0 HH22 ARG A 10 -19.155 -0.012 -1.390 1.00 25.00 H new ATOM 185 N TYR A 11 -10.962 1.927 4.294 1.00 25.00 N ATOM 186 CA TYR A 11 -9.949 1.390 5.179 1.00 25.00 C ATOM 187 C TYR A 11 -9.746 2.378 6.318 1.00 25.00 C ATOM 188 O TYR A 11 -9.665 2.005 7.489 1.00 25.00 O ATOM 189 CB TYR A 11 -8.648 1.187 4.411 1.00 25.00 C ATOM 190 CG TYR A 11 -7.675 0.336 5.161 1.00 25.00 C ATOM 191 CD1 TYR A 11 -7.799 -1.063 5.148 1.00 25.00 C ATOM 192 CD2 TYR A 11 -6.625 0.914 5.899 1.00 25.00 C ATOM 193 CE1 TYR A 11 -6.905 -1.871 5.866 1.00 25.00 C ATOM 194 CE2 TYR A 11 -5.719 0.097 6.616 1.00 25.00 C ATOM 195 CZ TYR A 11 -5.878 -1.288 6.599 1.00 25.00 C ATOM 196 OH TYR A 11 -5.016 -2.072 7.308 1.00 25.00 O ATOM 0 H TYR A 11 -10.612 2.278 3.403 1.00 25.00 H new ATOM 0 HA TYR A 11 -10.262 0.425 5.577 1.00 25.00 H new ATOM 0 HB2 TYR A 11 -8.865 0.725 3.448 1.00 25.00 H new ATOM 0 HB3 TYR A 11 -8.195 2.157 4.204 1.00 25.00 H new ATOM 0 HD1 TYR A 11 -8.593 -1.523 4.578 1.00 25.00 H new ATOM 0 HD2 TYR A 11 -6.510 1.988 5.918 1.00 25.00 H new ATOM 0 HE1 TYR A 11 -7.015 -2.945 5.849 1.00 25.00 H new ATOM 0 HE2 TYR A 11 -4.909 0.544 7.173 1.00 25.00 H new ATOM 0 HH TYR A 11 -4.923 -2.940 6.864 1.00 25.00 H new ATOM 206 N VAL A 12 -9.712 3.653 5.957 1.00 25.00 N ATOM 207 CA VAL A 12 -9.553 4.746 6.916 1.00 25.00 C ATOM 208 C VAL A 12 -10.727 4.780 7.911 1.00 25.00 C ATOM 209 O VAL A 12 -10.540 5.139 9.069 1.00 25.00 O ATOM 210 CB VAL A 12 -9.408 6.116 6.159 1.00 25.00 C ATOM 211 CG1 VAL A 12 -9.257 7.294 7.125 1.00 25.00 C ATOM 212 CG2 VAL A 12 -8.174 6.092 5.253 1.00 25.00 C ATOM 0 H VAL A 12 -9.794 3.963 4.989 1.00 25.00 H new ATOM 0 HA VAL A 12 -8.642 4.575 7.490 1.00 25.00 H new ATOM 0 HB VAL A 12 -10.319 6.248 5.575 1.00 25.00 H new ATOM 0 HG11 VAL A 12 -9.160 8.220 6.558 1.00 25.00 H new ATOM 0 HG12 VAL A 12 -10.136 7.353 7.767 1.00 25.00 H new ATOM 0 HG13 VAL A 12 -8.368 7.150 7.739 1.00 25.00 H new ATOM 0 HG21 VAL A 12 -8.085 7.047 4.734 1.00 25.00 H new ATOM 0 HG22 VAL A 12 -7.283 5.922 5.857 1.00 25.00 H new ATOM 0 HG23 VAL A 12 -8.275 5.290 4.522 1.00 25.00 H new ATOM 222 N GLU A 13 -11.917 4.369 7.493 1.00 25.00 N ATOM 223 CA GLU A 13 -13.075 4.292 8.396 1.00 25.00 C ATOM 224 C GLU A 13 -12.811 3.334 9.554 1.00 25.00 C ATOM 225 O GLU A 13 -12.947 3.711 10.718 1.00 25.00 O ATOM 226 CB GLU A 13 -14.323 3.839 7.636 1.00 25.00 C ATOM 227 CG GLU A 13 -14.963 4.934 6.791 1.00 25.00 C ATOM 228 CD GLU A 13 -15.656 4.378 5.551 1.00 25.00 C ATOM 229 OE1 GLU A 13 -16.223 3.268 5.625 1.00 25.00 O ATOM 230 OE2 GLU A 13 -15.574 5.023 4.487 1.00 25.00 O ATOM 0 H GLU A 13 -12.113 4.082 6.534 1.00 25.00 H new ATOM 0 HA GLU A 13 -13.241 5.291 8.799 1.00 25.00 H new ATOM 0 HB2 GLU A 13 -14.059 3.002 6.989 1.00 25.00 H new ATOM 0 HB3 GLU A 13 -15.058 3.469 8.351 1.00 25.00 H new ATOM 0 HG2 GLU A 13 -15.688 5.480 7.396 1.00 25.00 H new ATOM 0 HG3 GLU A 13 -14.198 5.649 6.487 1.00 25.00 H new ATOM 237 N GLN A 14 -12.397 2.115 9.246 1.00 25.00 N ATOM 238 CA GLN A 14 -12.130 1.122 10.289 1.00 25.00 C ATOM 239 C GLN A 14 -10.897 1.487 11.103 1.00 25.00 C ATOM 240 O GLN A 14 -10.878 1.376 12.335 1.00 25.00 O ATOM 241 CB GLN A 14 -11.922 -0.255 9.656 1.00 25.00 C ATOM 242 CG GLN A 14 -13.181 -0.820 9.017 1.00 25.00 C ATOM 243 CD GLN A 14 -14.314 -0.981 10.018 1.00 25.00 C ATOM 244 OE1 GLN A 14 -15.369 -0.406 9.862 1.00 25.00 O ATOM 245 NE2 GLN A 14 -14.088 -1.752 11.052 1.00 25.00 N ATOM 0 H GLN A 14 -12.238 1.786 8.294 1.00 25.00 H new ATOM 0 HA GLN A 14 -12.992 1.102 10.956 1.00 25.00 H new ATOM 0 HB2 GLN A 14 -11.139 -0.185 8.901 1.00 25.00 H new ATOM 0 HB3 GLN A 14 -11.568 -0.948 10.419 1.00 25.00 H new ATOM 0 HG2 GLN A 14 -13.503 -0.162 8.210 1.00 25.00 H new ATOM 0 HG3 GLN A 14 -12.955 -1.787 8.568 1.00 25.00 H new ATOM 0 HE21 GLN A 14 -13.188 -2.221 11.151 1.00 25.00 H new ATOM 0 HE22 GLN A 14 -14.812 -1.884 11.758 1.00 25.00 H new ATOM 254 N LEU A 15 -9.858 1.939 10.421 1.00 25.00 N ATOM 255 CA LEU A 15 -8.615 2.294 11.090 1.00 25.00 C ATOM 256 C LEU A 15 -8.769 3.508 11.997 1.00 25.00 C ATOM 257 O LEU A 15 -7.983 3.686 12.921 1.00 25.00 O ATOM 258 CB LEU A 15 -7.482 2.498 10.096 1.00 25.00 C ATOM 259 CG LEU A 15 -6.243 1.646 10.412 1.00 25.00 C ATOM 260 CD1 LEU A 15 -6.506 0.147 10.196 1.00 25.00 C ATOM 261 CD2 LEU A 15 -5.095 2.110 9.542 1.00 25.00 C ATOM 0 H LEU A 15 -9.849 2.069 9.409 1.00 25.00 H new ATOM 0 HA LEU A 15 -8.356 1.448 11.727 1.00 25.00 H new ATOM 0 HB2 LEU A 15 -7.837 2.255 9.094 1.00 25.00 H new ATOM 0 HB3 LEU A 15 -7.199 3.551 10.087 1.00 25.00 H new ATOM 0 HG LEU A 15 -5.993 1.776 11.465 1.00 25.00 H new ATOM 0 HD11 LEU A 15 -5.604 -0.418 10.431 1.00 25.00 H new ATOM 0 HD12 LEU A 15 -7.318 -0.178 10.847 1.00 25.00 H new ATOM 0 HD13 LEU A 15 -6.783 -0.028 9.156 1.00 25.00 H new ATOM 0 HD21 LEU A 15 -4.210 1.512 9.758 1.00 25.00 H new ATOM 0 HD22 LEU A 15 -5.364 1.994 8.492 1.00 25.00 H new ATOM 0 HD23 LEU A 15 -4.883 3.159 9.748 1.00 25.00 H new ATOM 273 N LYS A 16 -9.764 4.350 11.734 1.00 25.00 N ATOM 274 CA LYS A 16 -10.033 5.524 12.578 1.00 25.00 C ATOM 275 C LYS A 16 -10.168 5.095 14.030 1.00 25.00 C ATOM 276 O LYS A 16 -9.716 5.801 14.939 1.00 25.00 O ATOM 277 CB LYS A 16 -11.335 6.214 12.147 1.00 25.00 C ATOM 278 CG LYS A 16 -11.259 7.738 12.106 1.00 25.00 C ATOM 279 CD LYS A 16 -10.659 8.256 10.790 1.00 25.00 C ATOM 280 CE LYS A 16 -11.741 8.731 9.797 1.00 25.00 C ATOM 281 NZ LYS A 16 -12.600 7.614 9.267 1.00 25.00 N ATOM 0 H LYS A 16 -10.401 4.247 10.944 1.00 25.00 H new ATOM 0 HA LYS A 16 -9.201 6.220 12.467 1.00 25.00 H new ATOM 0 HB2 LYS A 16 -11.614 5.850 11.158 1.00 25.00 H new ATOM 0 HB3 LYS A 16 -12.131 5.921 12.832 1.00 25.00 H new ATOM 0 HG2 LYS A 16 -12.259 8.153 12.235 1.00 25.00 H new ATOM 0 HG3 LYS A 16 -10.656 8.092 12.942 1.00 25.00 H new ATOM 0 HD2 LYS A 16 -9.979 9.080 11.004 1.00 25.00 H new ATOM 0 HD3 LYS A 16 -10.067 7.466 10.328 1.00 25.00 H new ATOM 0 HE2 LYS A 16 -12.378 9.466 10.289 1.00 25.00 H new ATOM 0 HE3 LYS A 16 -11.259 9.236 8.960 1.00 25.00 H new ATOM 0 HZ1 LYS A 16 -13.347 8.008 8.660 1.00 25.00 H new ATOM 0 HZ2 LYS A 16 -12.014 6.958 8.712 1.00 25.00 H new ATOM 0 HZ3 LYS A 16 -13.034 7.103 10.062 1.00 25.00 H new ATOM 295 N GLN A 17 -10.759 3.924 14.231 1.00 25.00 N ATOM 296 CA GLN A 17 -10.895 3.351 15.560 1.00 25.00 C ATOM 297 C GLN A 17 -9.610 2.640 15.958 1.00 25.00 C ATOM 298 O GLN A 17 -9.108 2.858 17.047 1.00 25.00 O ATOM 299 CB GLN A 17 -12.064 2.358 15.599 1.00 25.00 C ATOM 300 CG GLN A 17 -13.431 2.980 15.284 1.00 25.00 C ATOM 301 CD GLN A 17 -13.862 4.006 16.317 1.00 25.00 C ATOM 302 OE1 GLN A 17 -13.406 5.143 16.313 1.00 25.00 O ATOM 303 NE2 GLN A 17 -14.736 3.610 17.204 1.00 25.00 N ATOM 0 H GLN A 17 -11.153 3.351 13.485 1.00 25.00 H new ATOM 0 HA GLN A 17 -11.093 4.159 16.264 1.00 25.00 H new ATOM 0 HB2 GLN A 17 -11.869 1.557 14.886 1.00 25.00 H new ATOM 0 HB3 GLN A 17 -12.105 1.901 16.588 1.00 25.00 H new ATOM 0 HG2 GLN A 17 -13.393 3.453 14.303 1.00 25.00 H new ATOM 0 HG3 GLN A 17 -14.180 2.190 15.228 1.00 25.00 H new ATOM 0 HE21 GLN A 17 -15.094 2.655 17.176 1.00 25.00 H new ATOM 0 HE22 GLN A 17 -15.060 4.256 17.924 1.00 25.00 H new ATOM 312 N ALA A 18 -9.070 1.811 15.073 1.00 25.00 N ATOM 313 CA ALA A 18 -7.877 1.015 15.386 1.00 25.00 C ATOM 314 C ALA A 18 -6.666 1.849 15.847 1.00 25.00 C ATOM 315 O ALA A 18 -5.944 1.446 16.757 1.00 25.00 O ATOM 316 CB ALA A 18 -7.501 0.151 14.180 1.00 25.00 C ATOM 0 H ALA A 18 -9.435 1.668 14.131 1.00 25.00 H new ATOM 0 HA ALA A 18 -8.142 0.387 16.236 1.00 25.00 H new ATOM 0 HB1 ALA A 18 -6.615 -0.438 14.417 1.00 25.00 H new ATOM 0 HB2 ALA A 18 -8.328 -0.517 13.939 1.00 25.00 H new ATOM 0 HB3 ALA A 18 -7.292 0.792 13.324 1.00 25.00 H new ATOM 322 N LEU A 19 -6.461 3.015 15.243 1.00 25.00 N ATOM 323 CA LEU A 19 -5.358 3.901 15.643 1.00 25.00 C ATOM 324 C LEU A 19 -5.535 4.315 17.111 1.00 25.00 C ATOM 325 O LEU A 19 -4.568 4.407 17.858 1.00 25.00 O ATOM 326 CB LEU A 19 -5.325 5.177 14.766 1.00 25.00 C ATOM 327 CG LEU A 19 -4.344 5.303 13.570 1.00 25.00 C ATOM 328 CD1 LEU A 19 -2.890 5.231 14.011 1.00 25.00 C ATOM 329 CD2 LEU A 19 -4.594 4.284 12.487 1.00 25.00 C ATOM 0 H LEU A 19 -7.036 3.372 14.480 1.00 25.00 H new ATOM 0 HA LEU A 19 -4.423 3.357 15.513 1.00 25.00 H new ATOM 0 HB2 LEU A 19 -6.331 5.317 14.369 1.00 25.00 H new ATOM 0 HB3 LEU A 19 -5.125 6.016 15.432 1.00 25.00 H new ATOM 0 HG LEU A 19 -4.538 6.290 13.150 1.00 25.00 H new ATOM 0 HD11 LEU A 19 -2.241 5.324 13.140 1.00 25.00 H new ATOM 0 HD12 LEU A 19 -2.681 6.043 14.708 1.00 25.00 H new ATOM 0 HD13 LEU A 19 -2.705 4.275 14.501 1.00 25.00 H new ATOM 0 HD21 LEU A 19 -3.875 4.426 11.680 1.00 25.00 H new ATOM 0 HD22 LEU A 19 -4.484 3.281 12.899 1.00 25.00 H new ATOM 0 HD23 LEU A 19 -5.605 4.407 12.098 1.00 25.00 H new ATOM 341 N LYS A 20 -6.773 4.584 17.511 1.00 25.00 N ATOM 342 CA LYS A 20 -7.065 5.054 18.871 1.00 25.00 C ATOM 343 C LYS A 20 -7.200 3.955 19.915 1.00 25.00 C ATOM 344 O LYS A 20 -6.829 4.159 21.061 1.00 25.00 O ATOM 345 CB LYS A 20 -8.361 5.862 18.888 1.00 25.00 C ATOM 346 CG LYS A 20 -8.305 7.127 18.063 1.00 25.00 C ATOM 347 CD LYS A 20 -9.579 7.938 18.265 1.00 25.00 C ATOM 348 CE LYS A 20 -9.582 9.186 17.400 1.00 25.00 C ATOM 349 NZ LYS A 20 -9.677 8.812 15.950 1.00 25.00 N ATOM 0 H LYS A 20 -7.595 4.486 16.916 1.00 25.00 H new ATOM 0 HA LYS A 20 -6.198 5.657 19.140 1.00 25.00 H new ATOM 0 HB2 LYS A 20 -9.173 5.235 18.520 1.00 25.00 H new ATOM 0 HB3 LYS A 20 -8.602 6.122 19.919 1.00 25.00 H new ATOM 0 HG2 LYS A 20 -7.437 7.720 18.351 1.00 25.00 H new ATOM 0 HG3 LYS A 20 -8.186 6.878 17.008 1.00 25.00 H new ATOM 0 HD2 LYS A 20 -10.446 7.323 18.023 1.00 25.00 H new ATOM 0 HD3 LYS A 20 -9.671 8.220 19.314 1.00 25.00 H new ATOM 0 HE2 LYS A 20 -10.422 9.825 17.674 1.00 25.00 H new ATOM 0 HE3 LYS A 20 -8.673 9.761 17.576 1.00 25.00 H new ATOM 0 HZ1 LYS A 20 -8.818 9.124 15.454 1.00 25.00 H new ATOM 0 HZ2 LYS A 20 -9.771 7.780 15.863 1.00 25.00 H new ATOM 0 HZ3 LYS A 20 -10.508 9.272 15.527 1.00 25.00 H new ATOM 363 N THR A 21 -7.765 2.815 19.544 1.00 25.00 N ATOM 364 CA THR A 21 -8.047 1.746 20.513 1.00 25.00 C ATOM 365 C THR A 21 -6.779 1.138 21.088 1.00 25.00 C ATOM 366 O THR A 21 -6.802 0.551 22.161 1.00 25.00 O ATOM 367 CB THR A 21 -8.878 0.610 19.881 1.00 25.00 C ATOM 368 OG1 THR A 21 -8.297 0.234 18.633 1.00 25.00 O ATOM 369 CG2 THR A 21 -10.306 1.047 19.616 1.00 25.00 C ATOM 0 H THR A 21 -8.039 2.599 18.585 1.00 25.00 H new ATOM 0 HA THR A 21 -8.613 2.221 21.314 1.00 25.00 H new ATOM 0 HB THR A 21 -8.883 -0.224 20.582 1.00 25.00 H new ATOM 0 HG1 THR A 21 -9.006 -0.021 18.006 1.00 25.00 H new ATOM 0 HG21 THR A 21 -10.862 0.222 19.171 1.00 25.00 H new ATOM 0 HG22 THR A 21 -10.778 1.338 20.555 1.00 25.00 H new ATOM 0 HG23 THR A 21 -10.306 1.896 18.932 1.00 25.00 H new ATOM 377 N ARG A 22 -5.655 1.321 20.408 1.00 25.00 N ATOM 378 CA ARG A 22 -4.375 0.843 20.921 1.00 25.00 C ATOM 379 C ARG A 22 -3.900 1.722 22.088 1.00 25.00 C ATOM 380 O ARG A 22 -3.020 1.341 22.845 1.00 25.00 O ATOM 381 CB ARG A 22 -3.345 0.826 19.779 1.00 25.00 C ATOM 382 CG ARG A 22 -2.056 0.066 20.092 1.00 25.00 C ATOM 383 CD ARG A 22 -2.292 -1.421 20.278 1.00 25.00 C ATOM 384 NE ARG A 22 -1.053 -2.103 20.674 1.00 25.00 N ATOM 385 CZ ARG A 22 -0.945 -3.399 20.940 1.00 25.00 C ATOM 386 NH1 ARG A 22 -1.968 -4.211 20.883 1.00 25.00 N ATOM 387 NH2 ARG A 22 0.216 -3.883 21.261 1.00 25.00 N ATOM 0 H ARG A 22 -5.602 1.794 19.506 1.00 25.00 H new ATOM 0 HA ARG A 22 -4.491 -0.171 21.303 1.00 25.00 H new ATOM 0 HB2 ARG A 22 -3.808 0.382 18.898 1.00 25.00 H new ATOM 0 HB3 ARG A 22 -3.091 1.854 19.522 1.00 25.00 H new ATOM 0 HG2 ARG A 22 -1.342 0.219 19.283 1.00 25.00 H new ATOM 0 HG3 ARG A 22 -1.606 0.476 20.996 1.00 25.00 H new ATOM 0 HD2 ARG A 22 -3.058 -1.580 21.037 1.00 25.00 H new ATOM 0 HD3 ARG A 22 -2.669 -1.852 19.351 1.00 25.00 H new ATOM 0 HE ARG A 22 -0.209 -1.536 20.751 1.00 25.00 H new ATOM 0 HH11 ARG A 22 -2.889 -3.854 20.627 1.00 25.00 H new ATOM 0 HH12 ARG A 22 -1.845 -5.201 21.094 1.00 25.00 H new ATOM 0 HH21 ARG A 22 1.030 -3.269 21.306 1.00 25.00 H new ATOM 0 HH22 ARG A 22 0.315 -4.877 21.468 1.00 25.00 H new ATOM 401 N GLY A 23 -4.478 2.910 22.212 1.00 25.00 N ATOM 402 CA GLY A 23 -4.122 3.826 23.287 1.00 25.00 C ATOM 403 C GLY A 23 -2.863 4.619 22.997 1.00 25.00 C ATOM 404 O GLY A 23 -2.469 5.502 23.770 1.00 25.00 O ATOM 0 H GLY A 23 -5.197 3.262 21.580 1.00 25.00 H new ATOM 0 HA2 GLY A 23 -4.948 4.516 23.457 1.00 25.00 H new ATOM 0 HA3 GLY A 23 -3.984 3.260 24.208 1.00 25.00 H new ATOM 408 N VAL A 24 -2.226 4.308 21.879 1.00 25.00 N ATOM 409 CA VAL A 24 -0.988 4.961 21.469 1.00 25.00 C ATOM 410 C VAL A 24 -1.365 6.178 20.638 1.00 25.00 C ATOM 411 O VAL A 24 -2.208 6.101 19.752 1.00 25.00 O ATOM 412 CB VAL A 24 -0.094 3.989 20.645 1.00 25.00 C ATOM 413 CG1 VAL A 24 1.231 4.656 20.255 1.00 25.00 C ATOM 414 CG2 VAL A 24 0.202 2.724 21.466 1.00 25.00 C ATOM 0 H VAL A 24 -2.552 3.594 21.227 1.00 25.00 H new ATOM 0 HA VAL A 24 -0.412 5.261 22.345 1.00 25.00 H new ATOM 0 HB VAL A 24 -0.635 3.724 19.737 1.00 25.00 H new ATOM 0 HG11 VAL A 24 1.836 3.955 19.680 1.00 25.00 H new ATOM 0 HG12 VAL A 24 1.029 5.541 19.651 1.00 25.00 H new ATOM 0 HG13 VAL A 24 1.771 4.947 21.156 1.00 25.00 H new ATOM 0 HG21 VAL A 24 0.828 2.049 20.882 1.00 25.00 H new ATOM 0 HG22 VAL A 24 0.722 2.999 22.383 1.00 25.00 H new ATOM 0 HG23 VAL A 24 -0.734 2.225 21.716 1.00 25.00 H new ATOM 424 N LYS A 25 -0.780 7.318 20.962 1.00 25.00 N ATOM 425 CA LYS A 25 -1.129 8.576 20.310 1.00 25.00 C ATOM 426 C LYS A 25 -0.260 8.756 19.070 1.00 25.00 C ATOM 427 O LYS A 25 0.773 9.406 19.124 1.00 25.00 O ATOM 428 CB LYS A 25 -0.950 9.759 21.281 1.00 25.00 C ATOM 429 CG LYS A 25 -2.002 9.822 22.421 1.00 25.00 C ATOM 430 CD LYS A 25 -1.671 8.902 23.612 1.00 25.00 C ATOM 431 CE LYS A 25 -2.800 8.879 24.636 1.00 25.00 C ATOM 432 NZ LYS A 25 -2.555 7.802 25.663 1.00 25.00 N ATOM 0 H LYS A 25 -0.057 7.402 21.676 1.00 25.00 H new ATOM 0 HA LYS A 25 -2.177 8.549 20.011 1.00 25.00 H new ATOM 0 HB2 LYS A 25 0.044 9.701 21.724 1.00 25.00 H new ATOM 0 HB3 LYS A 25 -0.992 10.688 20.713 1.00 25.00 H new ATOM 0 HG2 LYS A 25 -2.081 10.849 22.776 1.00 25.00 H new ATOM 0 HG3 LYS A 25 -2.978 9.548 22.020 1.00 25.00 H new ATOM 0 HD2 LYS A 25 -1.487 7.890 23.250 1.00 25.00 H new ATOM 0 HD3 LYS A 25 -0.752 9.242 24.090 1.00 25.00 H new ATOM 0 HE2 LYS A 25 -2.874 9.849 25.127 1.00 25.00 H new ATOM 0 HE3 LYS A 25 -3.751 8.703 24.134 1.00 25.00 H new ATOM 0 HZ1 LYS A 25 -3.349 7.775 26.334 1.00 25.00 H new ATOM 0 HZ2 LYS A 25 -2.473 6.881 25.187 1.00 25.00 H new ATOM 0 HZ3 LYS A 25 -1.674 8.006 26.177 1.00 25.00 H new ATOM 446 N VAL A 26 -0.686 8.159 17.966 1.00 25.00 N ATOM 447 CA VAL A 26 0.038 8.244 16.693 1.00 25.00 C ATOM 448 C VAL A 26 -0.912 8.612 15.559 1.00 25.00 C ATOM 449 O VAL A 26 -2.130 8.430 15.653 1.00 25.00 O ATOM 450 CB VAL A 26 0.754 6.903 16.336 1.00 25.00 C ATOM 451 CG1 VAL A 26 2.091 6.801 17.073 1.00 25.00 C ATOM 452 CG2 VAL A 26 -0.135 5.688 16.671 1.00 25.00 C ATOM 0 H VAL A 26 -1.540 7.602 17.921 1.00 25.00 H new ATOM 0 HA VAL A 26 0.794 9.020 16.813 1.00 25.00 H new ATOM 0 HB VAL A 26 0.941 6.898 15.262 1.00 25.00 H new ATOM 0 HG11 VAL A 26 2.578 5.861 16.814 1.00 25.00 H new ATOM 0 HG12 VAL A 26 2.731 7.634 16.782 1.00 25.00 H new ATOM 0 HG13 VAL A 26 1.917 6.835 18.148 1.00 25.00 H new ATOM 0 HG21 VAL A 26 0.391 4.769 16.411 1.00 25.00 H new ATOM 0 HG22 VAL A 26 -0.363 5.687 17.737 1.00 25.00 H new ATOM 0 HG23 VAL A 26 -1.063 5.748 16.102 1.00 25.00 H new ATOM 462 N LYS A 27 -0.344 9.159 14.497 1.00 25.00 N ATOM 463 CA LYS A 27 -1.096 9.594 13.323 1.00 25.00 C ATOM 464 C LYS A 27 -1.167 8.434 12.335 1.00 25.00 C ATOM 465 O LYS A 27 -0.340 7.534 12.367 1.00 25.00 O ATOM 466 CB LYS A 27 -0.350 10.796 12.714 1.00 25.00 C ATOM 467 CG LYS A 27 -1.132 11.660 11.725 1.00 25.00 C ATOM 468 CD LYS A 27 -0.291 12.893 11.362 1.00 25.00 C ATOM 469 CE LYS A 27 -1.053 13.902 10.496 1.00 25.00 C ATOM 470 NZ LYS A 27 -1.241 13.437 9.075 1.00 25.00 N ATOM 0 H LYS A 27 0.661 9.317 14.421 1.00 25.00 H new ATOM 0 HA LYS A 27 -2.113 9.891 13.578 1.00 25.00 H new ATOM 0 HB2 LYS A 27 -0.011 11.435 13.530 1.00 25.00 H new ATOM 0 HB3 LYS A 27 0.541 10.423 12.209 1.00 25.00 H new ATOM 0 HG2 LYS A 27 -1.366 11.087 10.828 1.00 25.00 H new ATOM 0 HG3 LYS A 27 -2.081 11.968 12.163 1.00 25.00 H new ATOM 0 HD2 LYS A 27 0.039 13.384 12.278 1.00 25.00 H new ATOM 0 HD3 LYS A 27 0.606 12.572 10.832 1.00 25.00 H new ATOM 0 HE2 LYS A 27 -2.029 14.091 10.942 1.00 25.00 H new ATOM 0 HE3 LYS A 27 -0.515 14.850 10.494 1.00 25.00 H new ATOM 0 HZ1 LYS A 27 -1.762 14.160 8.539 1.00 25.00 H new ATOM 0 HZ2 LYS A 27 -0.312 13.282 8.635 1.00 25.00 H new ATOM 0 HZ3 LYS A 27 -1.779 12.547 9.069 1.00 25.00 H new ATOM 484 N PHE A 28 -2.105 8.498 11.401 1.00 25.00 N ATOM 485 CA PHE A 28 -2.185 7.505 10.324 1.00 25.00 C ATOM 486 C PHE A 28 -0.889 7.470 9.538 1.00 25.00 C ATOM 487 O PHE A 28 -0.443 6.416 9.126 1.00 25.00 O ATOM 488 CB PHE A 28 -3.290 7.891 9.337 1.00 25.00 C ATOM 489 CG PHE A 28 -4.631 7.313 9.655 1.00 25.00 C ATOM 490 CD1 PHE A 28 -5.382 7.767 10.758 1.00 25.00 C ATOM 491 CD2 PHE A 28 -5.173 6.321 8.821 1.00 25.00 C ATOM 492 CE1 PHE A 28 -6.667 7.232 11.022 1.00 25.00 C ATOM 493 CE2 PHE A 28 -6.445 5.788 9.071 1.00 25.00 C ATOM 494 CZ PHE A 28 -7.198 6.245 10.170 1.00 25.00 C ATOM 0 H PHE A 28 -2.822 9.222 11.362 1.00 25.00 H new ATOM 0 HA PHE A 28 -2.386 6.537 10.783 1.00 25.00 H new ATOM 0 HB2 PHE A 28 -3.373 8.977 9.310 1.00 25.00 H new ATOM 0 HB3 PHE A 28 -2.997 7.569 8.338 1.00 25.00 H new ATOM 0 HD1 PHE A 28 -4.975 8.528 11.407 1.00 25.00 H new ATOM 0 HD2 PHE A 28 -4.602 5.964 7.976 1.00 25.00 H new ATOM 0 HE1 PHE A 28 -7.236 7.579 11.872 1.00 25.00 H new ATOM 0 HE2 PHE A 28 -6.848 5.026 8.420 1.00 25.00 H new ATOM 0 HZ PHE A 28 -8.181 5.839 10.359 1.00 25.00 H new ATOM 504 N ALA A 29 -0.288 8.634 9.339 1.00 25.00 N ATOM 505 CA ALA A 29 0.949 8.734 8.580 1.00 25.00 C ATOM 506 C ALA A 29 2.030 7.881 9.231 1.00 25.00 C ATOM 507 O ALA A 29 2.801 7.217 8.555 1.00 25.00 O ATOM 508 CB ALA A 29 1.402 10.194 8.526 1.00 25.00 C ATOM 0 H ALA A 29 -0.638 9.524 9.694 1.00 25.00 H new ATOM 0 HA ALA A 29 0.776 8.373 7.566 1.00 25.00 H new ATOM 0 HB1 ALA A 29 2.329 10.267 7.957 1.00 25.00 H new ATOM 0 HB2 ALA A 29 0.632 10.796 8.044 1.00 25.00 H new ATOM 0 HB3 ALA A 29 1.568 10.561 9.539 1.00 25.00 H new ATOM 514 N ASP A 30 2.074 7.927 10.552 1.00 25.00 N ATOM 515 CA ASP A 30 3.113 7.259 11.314 1.00 25.00 C ATOM 516 C ASP A 30 2.925 5.761 11.186 1.00 25.00 C ATOM 517 O ASP A 30 3.883 5.010 11.064 1.00 25.00 O ATOM 518 CB ASP A 30 3.025 7.635 12.801 1.00 25.00 C ATOM 519 CG ASP A 30 2.944 9.140 13.039 1.00 25.00 C ATOM 520 OD1 ASP A 30 3.271 9.945 12.140 1.00 25.00 O ATOM 521 OD2 ASP A 30 2.415 9.509 14.109 1.00 25.00 O ATOM 0 H ASP A 30 1.393 8.427 11.124 1.00 25.00 H new ATOM 0 HA ASP A 30 4.084 7.566 10.926 1.00 25.00 H new ATOM 0 HB2 ASP A 30 2.148 7.157 13.238 1.00 25.00 H new ATOM 0 HB3 ASP A 30 3.897 7.238 13.321 1.00 25.00 H new ATOM 526 N LEU A 31 1.672 5.326 11.234 1.00 25.00 N ATOM 527 CA LEU A 31 1.371 3.902 11.195 1.00 25.00 C ATOM 528 C LEU A 31 1.510 3.299 9.804 1.00 25.00 C ATOM 529 O LEU A 31 2.211 2.306 9.607 1.00 25.00 O ATOM 530 CB LEU A 31 -0.041 3.634 11.724 1.00 25.00 C ATOM 531 CG LEU A 31 -0.436 2.144 11.739 1.00 25.00 C ATOM 532 CD1 LEU A 31 0.571 1.291 12.513 1.00 25.00 C ATOM 533 CD2 LEU A 31 -1.810 1.982 12.345 1.00 25.00 C ATOM 0 H LEU A 31 0.855 5.933 11.299 1.00 25.00 H new ATOM 0 HA LEU A 31 2.110 3.420 11.836 1.00 25.00 H new ATOM 0 HB2 LEU A 31 -0.119 4.030 12.737 1.00 25.00 H new ATOM 0 HB3 LEU A 31 -0.757 4.182 11.112 1.00 25.00 H new ATOM 0 HG LEU A 31 -0.441 1.797 10.706 1.00 25.00 H new ATOM 0 HD11 LEU A 31 0.253 0.249 12.497 1.00 25.00 H new ATOM 0 HD12 LEU A 31 1.554 1.377 12.049 1.00 25.00 H new ATOM 0 HD13 LEU A 31 0.625 1.638 13.545 1.00 25.00 H new ATOM 0 HD21 LEU A 31 -2.082 0.927 12.352 1.00 25.00 H new ATOM 0 HD22 LEU A 31 -1.804 2.362 13.366 1.00 25.00 H new ATOM 0 HD23 LEU A 31 -2.536 2.540 11.754 1.00 25.00 H new ATOM 545 N LEU A 32 0.824 3.883 8.837 1.00 25.00 N ATOM 546 CA LEU A 32 0.811 3.341 7.475 1.00 25.00 C ATOM 547 C LEU A 32 2.180 3.407 6.810 1.00 25.00 C ATOM 548 O LEU A 32 2.461 2.643 5.891 1.00 25.00 O ATOM 549 CB LEU A 32 -0.235 4.035 6.602 1.00 25.00 C ATOM 550 CG LEU A 32 -1.698 3.550 6.718 1.00 25.00 C ATOM 551 CD1 LEU A 32 -1.850 2.040 6.544 1.00 25.00 C ATOM 552 CD2 LEU A 32 -2.310 3.958 8.035 1.00 25.00 C ATOM 0 H LEU A 32 0.268 4.729 8.961 1.00 25.00 H new ATOM 0 HA LEU A 32 0.540 2.290 7.570 1.00 25.00 H new ATOM 0 HB2 LEU A 32 -0.214 5.100 6.835 1.00 25.00 H new ATOM 0 HB3 LEU A 32 0.072 3.930 5.562 1.00 25.00 H new ATOM 0 HG LEU A 32 -2.227 4.035 5.898 1.00 25.00 H new ATOM 0 HD11 LEU A 32 -2.901 1.767 6.637 1.00 25.00 H new ATOM 0 HD12 LEU A 32 -1.485 1.749 5.559 1.00 25.00 H new ATOM 0 HD13 LEU A 32 -1.272 1.525 7.312 1.00 25.00 H new ATOM 0 HD21 LEU A 32 -3.339 3.601 8.084 1.00 25.00 H new ATOM 0 HD22 LEU A 32 -1.736 3.523 8.853 1.00 25.00 H new ATOM 0 HD23 LEU A 32 -2.298 5.045 8.121 1.00 25.00 H new ATOM 564 N LYS A 33 3.056 4.261 7.314 1.00 25.00 N ATOM 565 CA LYS A 33 4.456 4.275 6.861 1.00 25.00 C ATOM 566 C LYS A 33 5.062 2.874 6.983 1.00 25.00 C ATOM 567 O LYS A 33 5.792 2.421 6.108 1.00 25.00 O ATOM 568 CB LYS A 33 5.271 5.255 7.713 1.00 25.00 C ATOM 569 CG LYS A 33 6.744 5.319 7.349 1.00 25.00 C ATOM 570 CD LYS A 33 7.485 6.282 8.268 1.00 25.00 C ATOM 571 CE LYS A 33 8.948 6.433 7.850 1.00 25.00 C ATOM 572 NZ LYS A 33 9.689 5.122 7.906 1.00 25.00 N ATOM 0 H LYS A 33 2.835 4.952 8.031 1.00 25.00 H new ATOM 0 HA LYS A 33 4.483 4.590 5.818 1.00 25.00 H new ATOM 0 HB2 LYS A 33 4.840 6.251 7.614 1.00 25.00 H new ATOM 0 HB3 LYS A 33 5.179 4.971 8.761 1.00 25.00 H new ATOM 0 HG2 LYS A 33 7.186 4.325 7.423 1.00 25.00 H new ATOM 0 HG3 LYS A 33 6.854 5.640 6.313 1.00 25.00 H new ATOM 0 HD2 LYS A 33 6.996 7.256 8.248 1.00 25.00 H new ATOM 0 HD3 LYS A 33 7.433 5.921 9.295 1.00 25.00 H new ATOM 0 HE2 LYS A 33 8.996 6.834 6.838 1.00 25.00 H new ATOM 0 HE3 LYS A 33 9.439 7.155 8.502 1.00 25.00 H new ATOM 0 HZ1 LYS A 33 10.703 5.289 7.748 1.00 25.00 H new ATOM 0 HZ2 LYS A 33 9.552 4.685 8.840 1.00 25.00 H new ATOM 0 HZ3 LYS A 33 9.324 4.485 7.169 1.00 25.00 H new ATOM 586 N PHE A 34 4.748 2.185 8.066 1.00 25.00 N ATOM 587 CA PHE A 34 5.285 0.850 8.310 1.00 25.00 C ATOM 588 C PHE A 34 4.541 -0.220 7.520 1.00 25.00 C ATOM 589 O PHE A 34 5.113 -1.247 7.181 1.00 25.00 O ATOM 590 CB PHE A 34 5.278 0.562 9.807 1.00 25.00 C ATOM 591 CG PHE A 34 6.353 1.310 10.543 1.00 25.00 C ATOM 592 CD1 PHE A 34 6.128 2.625 10.982 1.00 25.00 C ATOM 593 CD2 PHE A 34 7.614 0.724 10.761 1.00 25.00 C ATOM 594 CE1 PHE A 34 7.143 3.358 11.635 1.00 25.00 C ATOM 595 CE2 PHE A 34 8.643 1.447 11.414 1.00 25.00 C ATOM 596 CZ PHE A 34 8.403 2.769 11.852 1.00 25.00 C ATOM 0 H PHE A 34 4.122 2.526 8.795 1.00 25.00 H new ATOM 0 HA PHE A 34 6.315 0.822 7.955 1.00 25.00 H new ATOM 0 HB2 PHE A 34 4.306 0.830 10.220 1.00 25.00 H new ATOM 0 HB3 PHE A 34 5.409 -0.508 9.968 1.00 25.00 H new ATOM 0 HD1 PHE A 34 5.164 3.083 10.818 1.00 25.00 H new ATOM 0 HD2 PHE A 34 7.799 -0.286 10.427 1.00 25.00 H new ATOM 0 HE1 PHE A 34 6.953 4.368 11.967 1.00 25.00 H new ATOM 0 HE2 PHE A 34 9.608 0.989 11.576 1.00 25.00 H new ATOM 0 HZ PHE A 34 9.183 3.325 12.351 1.00 25.00 H new ATOM 606 N PHE A 35 3.300 0.052 7.146 1.00 25.00 N ATOM 607 CA PHE A 35 2.560 -0.857 6.267 1.00 25.00 C ATOM 608 C PHE A 35 3.220 -0.824 4.883 1.00 25.00 C ATOM 609 O PHE A 35 3.242 -1.818 4.176 1.00 25.00 O ATOM 610 CB PHE A 35 1.087 -0.441 6.138 1.00 25.00 C ATOM 611 CG PHE A 35 0.217 -0.854 7.305 1.00 25.00 C ATOM 612 CD1 PHE A 35 0.579 -0.574 8.641 1.00 25.00 C ATOM 613 CD2 PHE A 35 -0.999 -1.518 7.063 1.00 25.00 C ATOM 614 CE1 PHE A 35 -0.257 -0.969 9.710 1.00 25.00 C ATOM 615 CE2 PHE A 35 -1.836 -1.913 8.132 1.00 25.00 C ATOM 616 CZ PHE A 35 -1.464 -1.638 9.453 1.00 25.00 C ATOM 0 H PHE A 35 2.784 0.884 7.431 1.00 25.00 H new ATOM 0 HA PHE A 35 2.586 -1.860 6.692 1.00 25.00 H new ATOM 0 HB2 PHE A 35 1.036 0.642 6.028 1.00 25.00 H new ATOM 0 HB3 PHE A 35 0.678 -0.874 5.225 1.00 25.00 H new ATOM 0 HD1 PHE A 35 1.503 -0.054 8.848 1.00 25.00 H new ATOM 0 HD2 PHE A 35 -1.298 -1.729 6.047 1.00 25.00 H new ATOM 0 HE1 PHE A 35 0.034 -0.755 10.728 1.00 25.00 H new ATOM 0 HE2 PHE A 35 -2.764 -2.428 7.929 1.00 25.00 H new ATOM 0 HZ PHE A 35 -2.102 -1.939 10.270 1.00 25.00 H new ATOM 626 N ASP A 36 3.789 0.315 4.513 1.00 25.00 N ATOM 627 CA ASP A 36 4.471 0.435 3.222 1.00 25.00 C ATOM 628 C ASP A 36 5.893 -0.131 3.284 1.00 25.00 C ATOM 629 O ASP A 36 6.461 -0.522 2.271 1.00 25.00 O ATOM 630 CB ASP A 36 4.515 1.897 2.772 1.00 25.00 C ATOM 631 CG ASP A 36 4.366 2.041 1.267 1.00 25.00 C ATOM 632 OD1 ASP A 36 3.479 1.370 0.701 1.00 25.00 O ATOM 633 OD2 ASP A 36 5.069 2.863 0.651 1.00 25.00 O ATOM 0 H ASP A 36 3.795 1.164 5.079 1.00 25.00 H new ATOM 0 HA ASP A 36 3.903 -0.147 2.497 1.00 25.00 H new ATOM 0 HB2 ASP A 36 3.719 2.452 3.269 1.00 25.00 H new ATOM 0 HB3 ASP A 36 5.459 2.343 3.086 1.00 25.00 H new ATOM 638 N PHE A 37 6.447 -0.224 4.486 1.00 25.00 N ATOM 639 CA PHE A 37 7.777 -0.815 4.687 1.00 25.00 C ATOM 640 C PHE A 37 7.730 -2.321 4.401 1.00 25.00 C ATOM 641 O PHE A 37 8.711 -2.916 3.943 1.00 25.00 O ATOM 642 CB PHE A 37 8.249 -0.548 6.122 1.00 25.00 C ATOM 643 CG PHE A 37 9.677 -0.952 6.383 1.00 25.00 C ATOM 644 CD1 PHE A 37 10.742 -0.249 5.787 1.00 25.00 C ATOM 645 CD2 PHE A 37 9.967 -2.032 7.238 1.00 25.00 C ATOM 646 CE1 PHE A 37 12.090 -0.622 6.041 1.00 25.00 C ATOM 647 CE2 PHE A 37 11.310 -2.414 7.500 1.00 25.00 C ATOM 648 CZ PHE A 37 12.371 -1.706 6.898 1.00 25.00 C ATOM 0 H PHE A 37 6.000 0.101 5.343 1.00 25.00 H new ATOM 0 HA PHE A 37 8.486 -0.357 3.997 1.00 25.00 H new ATOM 0 HB2 PHE A 37 8.138 0.514 6.338 1.00 25.00 H new ATOM 0 HB3 PHE A 37 7.598 -1.084 6.813 1.00 25.00 H new ATOM 0 HD1 PHE A 37 10.532 0.582 5.130 1.00 25.00 H new ATOM 0 HD2 PHE A 37 9.158 -2.577 7.701 1.00 25.00 H new ATOM 0 HE1 PHE A 37 12.898 -0.076 5.578 1.00 25.00 H new ATOM 0 HE2 PHE A 37 11.518 -3.244 8.158 1.00 25.00 H new ATOM 0 HZ PHE A 37 13.394 -1.993 7.093 1.00 25.00 H new ATOM 658 N VAL A 38 6.553 -2.912 4.584 1.00 25.00 N ATOM 659 CA VAL A 38 6.328 -4.316 4.227 1.00 25.00 C ATOM 660 C VAL A 38 6.551 -4.480 2.755 1.00 25.00 C ATOM 661 O VAL A 38 7.149 -5.439 2.303 1.00 25.00 O ATOM 662 CB VAL A 38 4.844 -4.750 4.455 1.00 25.00 C ATOM 663 CG1 VAL A 38 4.606 -6.224 4.041 1.00 25.00 C ATOM 664 CG2 VAL A 38 4.451 -4.541 5.865 1.00 25.00 C ATOM 0 H VAL A 38 5.737 -2.443 4.978 1.00 25.00 H new ATOM 0 HA VAL A 38 7.002 -4.910 4.845 1.00 25.00 H new ATOM 0 HB VAL A 38 4.220 -4.123 3.818 1.00 25.00 H new ATOM 0 HG11 VAL A 38 3.563 -6.487 4.215 1.00 25.00 H new ATOM 0 HG12 VAL A 38 4.840 -6.347 2.984 1.00 25.00 H new ATOM 0 HG13 VAL A 38 5.248 -6.876 4.633 1.00 25.00 H new ATOM 0 HG21 VAL A 38 3.415 -4.849 6.003 1.00 25.00 H new ATOM 0 HG22 VAL A 38 5.096 -5.134 6.514 1.00 25.00 H new ATOM 0 HG23 VAL A 38 4.553 -3.486 6.118 1.00 25.00 H new ATOM 674 N LYS A 39 5.988 -3.552 2.002 1.00 25.00 N ATOM 675 CA LYS A 39 5.897 -3.693 0.567 1.00 25.00 C ATOM 676 C LYS A 39 7.267 -3.767 -0.098 1.00 25.00 C ATOM 677 O LYS A 39 7.475 -4.550 -1.013 1.00 25.00 O ATOM 678 CB LYS A 39 5.117 -2.501 0.013 1.00 25.00 C ATOM 679 CG LYS A 39 4.821 -2.540 -1.485 1.00 25.00 C ATOM 680 CD LYS A 39 4.162 -1.229 -1.919 1.00 25.00 C ATOM 681 CE LYS A 39 5.173 -0.069 -1.985 1.00 25.00 C ATOM 682 NZ LYS A 39 4.476 1.259 -2.022 1.00 25.00 N ATOM 0 H LYS A 39 5.586 -2.689 2.367 1.00 25.00 H new ATOM 0 HA LYS A 39 5.387 -4.631 0.347 1.00 25.00 H new ATOM 0 HB2 LYS A 39 4.171 -2.429 0.550 1.00 25.00 H new ATOM 0 HB3 LYS A 39 5.677 -1.591 0.230 1.00 25.00 H new ATOM 0 HG2 LYS A 39 5.744 -2.695 -2.043 1.00 25.00 H new ATOM 0 HG3 LYS A 39 4.165 -3.380 -1.713 1.00 25.00 H new ATOM 0 HD2 LYS A 39 3.699 -1.362 -2.897 1.00 25.00 H new ATOM 0 HD3 LYS A 39 3.365 -0.976 -1.221 1.00 25.00 H new ATOM 0 HE2 LYS A 39 5.835 -0.111 -1.120 1.00 25.00 H new ATOM 0 HE3 LYS A 39 5.799 -0.179 -2.871 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 5.183 2.021 -2.049 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 3.876 1.313 -2.870 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 3.885 1.365 -1.173 1.00 25.00 H new ATOM 696 N ASP A 40 8.190 -2.929 0.348 1.00 25.00 N ATOM 697 CA ASP A 40 9.516 -2.864 -0.274 1.00 25.00 C ATOM 698 C ASP A 40 10.380 -4.074 0.088 1.00 25.00 C ATOM 699 O ASP A 40 11.139 -4.581 -0.736 1.00 25.00 O ATOM 700 CB ASP A 40 10.233 -1.581 0.152 1.00 25.00 C ATOM 701 CG ASP A 40 11.405 -1.240 -0.758 1.00 25.00 C ATOM 702 OD1 ASP A 40 11.166 -0.964 -1.954 1.00 25.00 O ATOM 703 OD2 ASP A 40 12.558 -1.176 -0.276 1.00 25.00 O ATOM 0 H ASP A 40 8.054 -2.288 1.130 1.00 25.00 H new ATOM 0 HA ASP A 40 9.368 -2.868 -1.354 1.00 25.00 H new ATOM 0 HB2 ASP A 40 9.523 -0.754 0.150 1.00 25.00 H new ATOM 0 HB3 ASP A 40 10.592 -1.691 1.175 1.00 25.00 H new ATOM 708 N THR A 41 10.254 -4.543 1.324 1.00 25.00 N ATOM 709 CA THR A 41 11.043 -5.689 1.789 1.00 25.00 C ATOM 710 C THR A 41 10.439 -7.002 1.282 1.00 25.00 C ATOM 711 O THR A 41 11.148 -7.942 0.931 1.00 25.00 O ATOM 712 CB THR A 41 11.102 -5.732 3.340 1.00 25.00 C ATOM 713 OG1 THR A 41 11.294 -4.406 3.845 1.00 25.00 O ATOM 714 CG2 THR A 41 12.264 -6.589 3.818 1.00 25.00 C ATOM 0 H THR A 41 9.619 -4.154 2.021 1.00 25.00 H new ATOM 0 HA THR A 41 12.052 -5.572 1.393 1.00 25.00 H new ATOM 0 HB THR A 41 10.166 -6.157 3.701 1.00 25.00 H new ATOM 0 HG1 THR A 41 10.434 -3.936 3.866 1.00 25.00 H new ATOM 0 HG21 THR A 41 12.282 -6.602 4.908 1.00 25.00 H new ATOM 0 HG22 THR A 41 12.144 -7.606 3.445 1.00 25.00 H new ATOM 0 HG23 THR A 41 13.200 -6.174 3.444 1.00 25.00 H new ATOM 722 N CYS A 42 9.116 -7.046 1.246 1.00 25.00 N ATOM 723 CA CYS A 42 8.366 -8.218 0.813 1.00 25.00 C ATOM 724 C CYS A 42 7.416 -7.855 -0.331 1.00 25.00 C ATOM 725 O CYS A 42 6.212 -7.715 -0.114 1.00 25.00 O ATOM 726 CB CYS A 42 7.537 -8.761 1.981 1.00 25.00 C ATOM 727 SG CYS A 42 8.519 -9.282 3.386 1.00 25.00 S ATOM 0 H CYS A 42 8.525 -6.261 1.519 1.00 25.00 H new ATOM 0 HA CYS A 42 9.076 -8.971 0.471 1.00 25.00 H new ATOM 0 HB2 CYS A 42 6.836 -7.992 2.305 1.00 25.00 H new ATOM 0 HB3 CYS A 42 6.944 -9.606 1.631 1.00 25.00 H new ATOM 0 HG CYS A 42 8.156 -10.476 3.750 1.00 25.00 H new ATOM 733 N PRO A 43 7.929 -7.741 -1.568 1.00 25.00 N ATOM 734 CA PRO A 43 7.039 -7.380 -2.683 1.00 25.00 C ATOM 735 C PRO A 43 6.103 -8.523 -3.057 1.00 25.00 C ATOM 736 O PRO A 43 5.098 -8.338 -3.733 1.00 25.00 O ATOM 737 CB PRO A 43 8.021 -7.064 -3.811 1.00 25.00 C ATOM 738 CG PRO A 43 9.190 -7.941 -3.531 1.00 25.00 C ATOM 739 CD PRO A 43 9.317 -7.942 -2.025 1.00 25.00 C ATOM 0 HA PRO A 43 6.373 -6.550 -2.446 1.00 25.00 H new ATOM 0 HB2 PRO A 43 7.588 -7.277 -4.788 1.00 25.00 H new ATOM 0 HB3 PRO A 43 8.303 -6.011 -3.810 1.00 25.00 H new ATOM 0 HG2 PRO A 43 9.030 -8.948 -3.916 1.00 25.00 H new ATOM 0 HG3 PRO A 43 10.094 -7.559 -4.004 1.00 25.00 H new ATOM 0 HD2 PRO A 43 9.730 -8.881 -1.657 1.00 25.00 H new ATOM 0 HD3 PRO A 43 9.975 -7.146 -1.676 1.00 25.00 H new ATOM 747 N TRP A 44 6.432 -9.706 -2.566 1.00 25.00 N ATOM 748 CA TRP A 44 5.628 -10.897 -2.770 1.00 25.00 C ATOM 749 C TRP A 44 4.502 -11.001 -1.739 1.00 25.00 C ATOM 750 O TRP A 44 3.573 -11.760 -1.929 1.00 25.00 O ATOM 751 CB TRP A 44 6.538 -12.117 -2.679 1.00 25.00 C ATOM 752 CG TRP A 44 7.613 -11.929 -1.651 1.00 25.00 C ATOM 753 CD1 TRP A 44 7.455 -11.863 -0.315 1.00 25.00 C ATOM 754 CD2 TRP A 44 9.025 -11.747 -1.879 1.00 25.00 C ATOM 755 NE1 TRP A 44 8.641 -11.668 0.330 1.00 25.00 N ATOM 756 CE2 TRP A 44 9.638 -11.584 -0.601 1.00 25.00 C ATOM 757 CE3 TRP A 44 9.835 -11.695 -3.032 1.00 25.00 C ATOM 758 CZ2 TRP A 44 11.019 -11.362 -0.447 1.00 25.00 C ATOM 759 CZ3 TRP A 44 11.232 -11.480 -2.882 1.00 25.00 C ATOM 760 CH2 TRP A 44 11.805 -11.312 -1.585 1.00 25.00 C ATOM 0 H TRP A 44 7.272 -9.867 -2.010 1.00 25.00 H new ATOM 0 HA TRP A 44 5.161 -10.844 -3.753 1.00 25.00 H new ATOM 0 HB2 TRP A 44 5.944 -12.996 -2.429 1.00 25.00 H new ATOM 0 HB3 TRP A 44 6.993 -12.306 -3.651 1.00 25.00 H new ATOM 0 HD1 TRP A 44 6.503 -11.954 0.186 1.00 25.00 H new ATOM 0 HE1 TRP A 44 8.764 -11.597 1.340 1.00 25.00 H new ATOM 0 HE3 TRP A 44 9.401 -11.817 -4.013 1.00 25.00 H new ATOM 0 HZ2 TRP A 44 11.454 -11.234 0.533 1.00 25.00 H new ATOM 0 HZ3 TRP A 44 11.865 -11.443 -3.756 1.00 25.00 H new ATOM 0 HH2 TRP A 44 12.868 -11.143 -1.491 1.00 25.00 H new ATOM 771 N PHE A 45 4.550 -10.233 -0.657 1.00 25.00 N ATOM 772 CA PHE A 45 3.470 -10.304 0.334 1.00 25.00 C ATOM 773 C PHE A 45 2.143 -9.761 -0.218 1.00 25.00 C ATOM 774 O PHE A 45 1.125 -10.444 -0.130 1.00 25.00 O ATOM 775 CB PHE A 45 3.826 -9.589 1.639 1.00 25.00 C ATOM 776 CG PHE A 45 2.766 -9.737 2.698 1.00 25.00 C ATOM 777 CD1 PHE A 45 2.769 -10.851 3.556 1.00 25.00 C ATOM 778 CD2 PHE A 45 1.736 -8.786 2.822 1.00 25.00 C ATOM 779 CE1 PHE A 45 1.756 -11.012 4.532 1.00 25.00 C ATOM 780 CE2 PHE A 45 0.715 -8.951 3.790 1.00 25.00 C ATOM 781 CZ PHE A 45 0.728 -10.063 4.644 1.00 25.00 C ATOM 0 H PHE A 45 5.297 -9.572 -0.442 1.00 25.00 H new ATOM 0 HA PHE A 45 3.342 -11.364 0.555 1.00 25.00 H new ATOM 0 HB2 PHE A 45 4.768 -9.984 2.018 1.00 25.00 H new ATOM 0 HB3 PHE A 45 3.983 -8.530 1.435 1.00 25.00 H new ATOM 0 HD1 PHE A 45 3.551 -11.591 3.470 1.00 25.00 H new ATOM 0 HD2 PHE A 45 1.724 -7.923 2.173 1.00 25.00 H new ATOM 0 HE1 PHE A 45 1.774 -11.867 5.192 1.00 25.00 H new ATOM 0 HE2 PHE A 45 -0.075 -8.219 3.870 1.00 25.00 H new ATOM 0 HZ PHE A 45 -0.049 -10.189 5.384 1.00 25.00 H new ATOM 791 N PRO A 46 2.131 -8.550 -0.831 1.00 25.00 N ATOM 792 CA PRO A 46 0.814 -8.196 -1.373 1.00 25.00 C ATOM 793 C PRO A 46 0.399 -9.066 -2.561 1.00 25.00 C ATOM 794 O PRO A 46 -0.778 -9.192 -2.857 1.00 25.00 O ATOM 795 CB PRO A 46 1.000 -6.734 -1.792 1.00 25.00 C ATOM 796 CG PRO A 46 2.427 -6.626 -2.124 1.00 25.00 C ATOM 797 CD PRO A 46 3.110 -7.472 -1.089 1.00 25.00 C ATOM 0 HA PRO A 46 0.016 -8.350 -0.647 1.00 25.00 H new ATOM 0 HB2 PRO A 46 0.373 -6.483 -2.648 1.00 25.00 H new ATOM 0 HB3 PRO A 46 0.727 -6.052 -0.986 1.00 25.00 H new ATOM 0 HG2 PRO A 46 2.630 -6.988 -3.132 1.00 25.00 H new ATOM 0 HG3 PRO A 46 2.769 -5.592 -2.082 1.00 25.00 H new ATOM 0 HD2 PRO A 46 4.057 -7.868 -1.454 1.00 25.00 H new ATOM 0 HD3 PRO A 46 3.330 -6.903 -0.185 1.00 25.00 H new ATOM 805 N GLN A 47 1.373 -9.702 -3.199 1.00 25.00 N ATOM 806 CA GLN A 47 1.124 -10.602 -4.321 1.00 25.00 C ATOM 807 C GLN A 47 0.414 -11.886 -3.866 1.00 25.00 C ATOM 808 O GLN A 47 -0.333 -12.488 -4.626 1.00 25.00 O ATOM 809 CB GLN A 47 2.463 -10.935 -4.982 1.00 25.00 C ATOM 810 CG GLN A 47 2.362 -11.615 -6.325 1.00 25.00 C ATOM 811 CD GLN A 47 3.716 -11.738 -6.988 1.00 25.00 C ATOM 812 OE1 GLN A 47 4.712 -12.053 -6.350 1.00 25.00 O ATOM 813 NE2 GLN A 47 3.765 -11.464 -8.260 1.00 25.00 N ATOM 0 H GLN A 47 2.359 -9.609 -2.954 1.00 25.00 H new ATOM 0 HA GLN A 47 0.465 -10.109 -5.035 1.00 25.00 H new ATOM 0 HB2 GLN A 47 3.031 -10.012 -5.101 1.00 25.00 H new ATOM 0 HB3 GLN A 47 3.033 -11.576 -4.309 1.00 25.00 H new ATOM 0 HG2 GLN A 47 1.926 -12.606 -6.200 1.00 25.00 H new ATOM 0 HG3 GLN A 47 1.690 -11.050 -6.970 1.00 25.00 H new ATOM 0 HE21 GLN A 47 2.914 -11.205 -8.759 1.00 25.00 H new ATOM 0 HE22 GLN A 47 4.654 -11.508 -8.757 1.00 25.00 H new ATOM 822 N GLU A 48 0.608 -12.276 -2.610 1.00 25.00 N ATOM 823 CA GLU A 48 -0.093 -13.440 -2.051 1.00 25.00 C ATOM 824 C GLU A 48 -1.584 -13.123 -1.870 1.00 25.00 C ATOM 825 O GLU A 48 -2.411 -14.031 -1.762 1.00 25.00 O ATOM 826 CB GLU A 48 0.510 -13.852 -0.698 1.00 25.00 C ATOM 827 CG GLU A 48 1.879 -14.549 -0.806 1.00 25.00 C ATOM 828 CD GLU A 48 2.439 -14.986 0.553 1.00 25.00 C ATOM 829 OE1 GLU A 48 1.699 -14.928 1.557 1.00 25.00 O ATOM 830 OE2 GLU A 48 3.597 -15.456 0.607 1.00 25.00 O ATOM 0 H GLU A 48 1.240 -11.810 -1.959 1.00 25.00 H new ATOM 0 HA GLU A 48 0.023 -14.268 -2.751 1.00 25.00 H new ATOM 0 HB2 GLU A 48 0.614 -12.965 -0.074 1.00 25.00 H new ATOM 0 HB3 GLU A 48 -0.186 -14.519 -0.190 1.00 25.00 H new ATOM 0 HG2 GLU A 48 1.786 -15.422 -1.452 1.00 25.00 H new ATOM 0 HG3 GLU A 48 2.588 -13.873 -1.284 1.00 25.00 H new ATOM 837 N GLY A 49 -1.916 -11.835 -1.844 1.00 25.00 N ATOM 838 CA GLY A 49 -3.305 -11.388 -1.799 1.00 25.00 C ATOM 839 C GLY A 49 -4.118 -11.840 -0.602 1.00 25.00 C ATOM 840 O GLY A 49 -5.339 -11.797 -0.641 1.00 25.00 O ATOM 0 H GLY A 49 -1.235 -11.076 -1.853 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -3.315 -10.298 -1.827 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -3.805 -11.735 -2.703 1.00 25.00 H new ATOM 844 N THR A 50 -3.459 -12.314 0.443 1.00 25.00 N ATOM 845 CA THR A 50 -4.150 -12.889 1.593 1.00 25.00 C ATOM 846 C THR A 50 -3.550 -12.360 2.885 1.00 25.00 C ATOM 847 O THR A 50 -2.326 -12.313 3.031 1.00 25.00 O ATOM 848 CB THR A 50 -4.011 -14.424 1.575 1.00 25.00 C ATOM 849 OG1 THR A 50 -4.432 -14.934 0.307 1.00 25.00 O ATOM 850 CG2 THR A 50 -4.853 -15.085 2.665 1.00 25.00 C ATOM 0 H THR A 50 -2.442 -12.313 0.521 1.00 25.00 H new ATOM 0 HA THR A 50 -5.202 -12.610 1.537 1.00 25.00 H new ATOM 0 HB THR A 50 -2.961 -14.656 1.756 1.00 25.00 H new ATOM 0 HG1 THR A 50 -3.771 -14.696 -0.377 1.00 25.00 H new ATOM 0 HG21 THR A 50 -4.726 -16.167 2.617 1.00 25.00 H new ATOM 0 HG22 THR A 50 -4.531 -14.725 3.642 1.00 25.00 H new ATOM 0 HG23 THR A 50 -5.903 -14.836 2.515 1.00 25.00 H new ATOM 858 N ILE A 51 -4.397 -11.981 3.830 1.00 25.00 N ATOM 859 CA ILE A 51 -3.935 -11.470 5.114 1.00 25.00 C ATOM 860 C ILE A 51 -4.199 -12.516 6.177 1.00 25.00 C ATOM 861 O ILE A 51 -5.332 -12.840 6.521 1.00 25.00 O ATOM 862 CB ILE A 51 -4.623 -10.148 5.491 1.00 25.00 C ATOM 863 CG1 ILE A 51 -4.418 -9.089 4.401 1.00 25.00 C ATOM 864 CG2 ILE A 51 -4.095 -9.606 6.849 1.00 25.00 C ATOM 865 CD1 ILE A 51 -2.978 -8.696 4.078 1.00 25.00 C ATOM 0 H ILE A 51 -5.412 -12.017 3.732 1.00 25.00 H new ATOM 0 HA ILE A 51 -2.867 -11.264 5.039 1.00 25.00 H new ATOM 0 HB ILE A 51 -5.689 -10.355 5.586 1.00 25.00 H new ATOM 0 HG12 ILE A 51 -4.884 -9.452 3.485 1.00 25.00 H new ATOM 0 HG13 ILE A 51 -4.956 -8.189 4.698 1.00 25.00 H new ATOM 0 HG21 ILE A 51 -4.600 -8.670 7.089 1.00 25.00 H new ATOM 0 HG22 ILE A 51 -4.292 -10.336 7.634 1.00 25.00 H new ATOM 0 HG23 ILE A 51 -3.022 -9.431 6.778 1.00 25.00 H new ATOM 0 HD11 ILE A 51 -2.975 -7.941 3.292 1.00 25.00 H new ATOM 0 HD12 ILE A 51 -2.502 -8.292 4.971 1.00 25.00 H new ATOM 0 HD13 ILE A 51 -2.428 -9.574 3.740 1.00 25.00 H new ATOM 877 N ASP A 52 -3.112 -13.058 6.680 1.00 25.00 N ATOM 878 CA ASP A 52 -3.148 -14.119 7.680 1.00 25.00 C ATOM 879 C ASP A 52 -1.894 -13.996 8.488 1.00 25.00 C ATOM 880 O ASP A 52 -0.878 -13.501 8.011 1.00 25.00 O ATOM 881 CB ASP A 52 -3.157 -15.480 7.002 1.00 25.00 C ATOM 882 CG ASP A 52 -3.295 -16.640 7.972 1.00 25.00 C ATOM 883 OD1 ASP A 52 -3.757 -16.478 9.120 1.00 25.00 O ATOM 884 OD2 ASP A 52 -2.840 -17.732 7.594 1.00 25.00 O ATOM 0 H ASP A 52 -2.169 -12.778 6.410 1.00 25.00 H new ATOM 0 HA ASP A 52 -4.042 -14.030 8.297 1.00 25.00 H new ATOM 0 HB2 ASP A 52 -3.979 -15.515 6.287 1.00 25.00 H new ATOM 0 HB3 ASP A 52 -2.235 -15.600 6.434 1.00 25.00 H new ATOM 889 N ILE A 53 -1.953 -14.479 9.706 1.00 25.00 N ATOM 890 CA ILE A 53 -0.835 -14.400 10.613 1.00 25.00 C ATOM 891 C ILE A 53 0.305 -15.289 10.156 1.00 25.00 C ATOM 892 O ILE A 53 1.464 -14.967 10.356 1.00 25.00 O ATOM 893 CB ILE A 53 -1.317 -14.750 12.033 1.00 25.00 C ATOM 894 CG1 ILE A 53 -0.270 -14.369 13.095 1.00 25.00 C ATOM 895 CG2 ILE A 53 -1.692 -16.245 12.184 1.00 25.00 C ATOM 896 CD1 ILE A 53 0.139 -12.908 13.113 1.00 25.00 C ATOM 0 H ILE A 53 -2.777 -14.937 10.095 1.00 25.00 H new ATOM 0 HA ILE A 53 -0.441 -13.384 10.623 1.00 25.00 H new ATOM 0 HB ILE A 53 -2.220 -14.161 12.195 1.00 25.00 H new ATOM 0 HG12 ILE A 53 -0.663 -14.631 14.078 1.00 25.00 H new ATOM 0 HG13 ILE A 53 0.621 -14.976 12.936 1.00 25.00 H new ATOM 0 HG21 ILE A 53 -2.025 -16.435 13.204 1.00 25.00 H new ATOM 0 HG22 ILE A 53 -2.495 -16.491 11.489 1.00 25.00 H new ATOM 0 HG23 ILE A 53 -0.821 -16.863 11.965 1.00 25.00 H new ATOM 0 HD11 ILE A 53 0.879 -12.747 13.897 1.00 25.00 H new ATOM 0 HD12 ILE A 53 0.568 -12.638 12.148 1.00 25.00 H new ATOM 0 HD13 ILE A 53 -0.736 -12.288 13.307 1.00 25.00 H new ATOM 908 N LYS A 54 -0.017 -16.380 9.476 1.00 25.00 N ATOM 909 CA LYS A 54 1.007 -17.299 8.985 1.00 25.00 C ATOM 910 C LYS A 54 1.848 -16.598 7.930 1.00 25.00 C ATOM 911 O LYS A 54 3.047 -16.809 7.835 1.00 25.00 O ATOM 912 CB LYS A 54 0.352 -18.552 8.397 1.00 25.00 C ATOM 913 CG LYS A 54 -0.590 -19.264 9.377 1.00 25.00 C ATOM 914 CD LYS A 54 -1.322 -20.421 8.694 1.00 25.00 C ATOM 915 CE LYS A 54 -2.593 -20.822 9.459 1.00 25.00 C ATOM 916 NZ LYS A 54 -3.644 -19.730 9.411 1.00 25.00 N ATOM 0 H LYS A 54 -0.974 -16.652 9.251 1.00 25.00 H new ATOM 0 HA LYS A 54 1.649 -17.602 9.812 1.00 25.00 H new ATOM 0 HB2 LYS A 54 -0.207 -18.275 7.503 1.00 25.00 H new ATOM 0 HB3 LYS A 54 1.131 -19.247 8.083 1.00 25.00 H new ATOM 0 HG2 LYS A 54 -0.020 -19.641 10.226 1.00 25.00 H new ATOM 0 HG3 LYS A 54 -1.316 -18.552 9.771 1.00 25.00 H new ATOM 0 HD2 LYS A 54 -1.586 -20.134 7.676 1.00 25.00 H new ATOM 0 HD3 LYS A 54 -0.655 -21.280 8.621 1.00 25.00 H new ATOM 0 HE2 LYS A 54 -3.001 -21.739 9.032 1.00 25.00 H new ATOM 0 HE3 LYS A 54 -2.340 -21.038 10.497 1.00 25.00 H new ATOM 0 HZ1 LYS A 54 -3.672 -19.234 10.325 1.00 25.00 H new ATOM 0 HZ2 LYS A 54 -3.408 -19.053 8.657 1.00 25.00 H new ATOM 0 HZ3 LYS A 54 -4.575 -20.152 9.218 1.00 25.00 H new ATOM 930 N ARG A 55 1.207 -15.727 7.163 1.00 25.00 N ATOM 931 CA ARG A 55 1.888 -14.978 6.112 1.00 25.00 C ATOM 932 C ARG A 55 2.566 -13.748 6.698 1.00 25.00 C ATOM 933 O ARG A 55 3.666 -13.396 6.313 1.00 25.00 O ATOM 934 CB ARG A 55 0.875 -14.578 5.038 1.00 25.00 C ATOM 935 CG ARG A 55 0.179 -15.781 4.402 1.00 25.00 C ATOM 936 CD ARG A 55 -0.913 -15.334 3.461 1.00 25.00 C ATOM 937 NE ARG A 55 -1.675 -16.471 2.915 1.00 25.00 N ATOM 938 CZ ARG A 55 -1.372 -17.144 1.809 1.00 25.00 C ATOM 939 NH1 ARG A 55 -0.306 -16.894 1.099 1.00 25.00 N ATOM 940 NH2 ARG A 55 -2.174 -18.088 1.404 1.00 25.00 N ATOM 0 H ARG A 55 0.212 -15.520 7.248 1.00 25.00 H new ATOM 0 HA ARG A 55 2.657 -15.604 5.659 1.00 25.00 H new ATOM 0 HB2 ARG A 55 0.125 -13.922 5.479 1.00 25.00 H new ATOM 0 HB3 ARG A 55 1.383 -14.006 4.262 1.00 25.00 H new ATOM 0 HG2 ARG A 55 0.908 -16.384 3.860 1.00 25.00 H new ATOM 0 HG3 ARG A 55 -0.243 -16.416 5.181 1.00 25.00 H new ATOM 0 HD2 ARG A 55 -1.592 -14.663 3.987 1.00 25.00 H new ATOM 0 HD3 ARG A 55 -0.474 -14.765 2.641 1.00 25.00 H new ATOM 0 HE ARG A 55 -2.505 -16.767 3.429 1.00 25.00 H new ATOM 0 HH11 ARG A 55 0.336 -16.155 1.386 1.00 25.00 H new ATOM 0 HH12 ARG A 55 -0.115 -17.437 0.257 1.00 25.00 H new ATOM 0 HH21 ARG A 55 -3.019 -18.301 1.933 1.00 25.00 H new ATOM 0 HH22 ARG A 55 -1.956 -18.614 0.558 1.00 25.00 H new ATOM 954 N TRP A 56 1.921 -13.121 7.670 1.00 25.00 N ATOM 955 CA TRP A 56 2.482 -11.947 8.338 1.00 25.00 C ATOM 956 C TRP A 56 3.762 -12.294 9.094 1.00 25.00 C ATOM 957 O TRP A 56 4.669 -11.475 9.199 1.00 25.00 O ATOM 958 CB TRP A 56 1.450 -11.358 9.297 1.00 25.00 C ATOM 959 CG TRP A 56 1.868 -10.042 9.873 1.00 25.00 C ATOM 960 CD1 TRP A 56 2.172 -9.772 11.164 1.00 25.00 C ATOM 961 CD2 TRP A 56 2.041 -8.795 9.171 1.00 25.00 C ATOM 962 NE1 TRP A 56 2.510 -8.463 11.340 1.00 25.00 N ATOM 963 CE2 TRP A 56 2.446 -7.824 10.135 1.00 25.00 C ATOM 964 CE3 TRP A 56 1.906 -8.398 7.826 1.00 25.00 C ATOM 965 CZ2 TRP A 56 2.720 -6.488 9.792 1.00 25.00 C ATOM 966 CZ3 TRP A 56 2.181 -7.054 7.475 1.00 25.00 C ATOM 967 CH2 TRP A 56 2.580 -6.111 8.470 1.00 25.00 C ATOM 0 H TRP A 56 1.005 -13.404 8.018 1.00 25.00 H new ATOM 0 HA TRP A 56 2.735 -11.210 7.576 1.00 25.00 H new ATOM 0 HB2 TRP A 56 0.504 -11.233 8.771 1.00 25.00 H new ATOM 0 HB3 TRP A 56 1.273 -12.063 10.109 1.00 25.00 H new ATOM 0 HD1 TRP A 56 2.150 -10.504 11.958 1.00 25.00 H new ATOM 0 HE1 TRP A 56 2.769 -8.031 12.227 1.00 25.00 H new ATOM 0 HE3 TRP A 56 1.597 -9.108 7.073 1.00 25.00 H new ATOM 0 HZ2 TRP A 56 3.031 -5.776 10.542 1.00 25.00 H new ATOM 0 HZ3 TRP A 56 2.088 -6.740 6.446 1.00 25.00 H new ATOM 0 HH2 TRP A 56 2.775 -5.088 8.185 1.00 25.00 H new ATOM 978 N ARG A 57 3.860 -13.525 9.577 1.00 25.00 N ATOM 979 CA ARG A 57 5.079 -13.992 10.245 1.00 25.00 C ATOM 980 C ARG A 57 6.263 -13.935 9.290 1.00 25.00 C ATOM 981 O ARG A 57 7.303 -13.406 9.649 1.00 25.00 O ATOM 982 CB ARG A 57 4.872 -15.390 10.818 1.00 25.00 C ATOM 983 CG ARG A 57 4.107 -15.339 12.143 1.00 25.00 C ATOM 984 CD ARG A 57 3.335 -16.616 12.411 1.00 25.00 C ATOM 985 NE ARG A 57 2.545 -16.505 13.654 1.00 25.00 N ATOM 986 CZ ARG A 57 1.770 -17.456 14.167 1.00 25.00 C ATOM 987 NH1 ARG A 57 1.685 -18.650 13.633 1.00 25.00 N ATOM 988 NH2 ARG A 57 1.058 -17.198 15.230 1.00 25.00 N ATOM 0 H ARG A 57 3.116 -14.220 9.522 1.00 25.00 H new ATOM 0 HA ARG A 57 5.303 -13.329 11.081 1.00 25.00 H new ATOM 0 HB2 ARG A 57 4.323 -16.002 10.102 1.00 25.00 H new ATOM 0 HB3 ARG A 57 5.839 -15.869 10.972 1.00 25.00 H new ATOM 0 HG2 ARG A 57 4.809 -15.163 12.959 1.00 25.00 H new ATOM 0 HG3 ARG A 57 3.417 -14.496 12.129 1.00 25.00 H new ATOM 0 HD2 ARG A 57 2.672 -16.827 11.572 1.00 25.00 H new ATOM 0 HD3 ARG A 57 4.027 -17.454 12.489 1.00 25.00 H new ATOM 0 HE ARG A 57 2.599 -15.623 14.163 1.00 25.00 H new ATOM 0 HH11 ARG A 57 2.224 -18.874 12.797 1.00 25.00 H new ATOM 0 HH12 ARG A 57 1.080 -19.355 14.054 1.00 25.00 H new ATOM 0 HH21 ARG A 57 1.099 -16.274 15.659 1.00 25.00 H new ATOM 0 HH22 ARG A 57 0.460 -17.921 15.631 1.00 25.00 H new ATOM 1002 N ARG A 58 6.053 -14.346 8.045 1.00 25.00 N ATOM 1003 CA ARG A 58 7.102 -14.251 7.010 1.00 25.00 C ATOM 1004 C ARG A 58 7.643 -12.836 6.825 1.00 25.00 C ATOM 1005 O ARG A 58 8.794 -12.658 6.470 1.00 25.00 O ATOM 1006 CB ARG A 58 6.594 -14.721 5.645 1.00 25.00 C ATOM 1007 CG ARG A 58 6.055 -16.140 5.611 1.00 25.00 C ATOM 1008 CD ARG A 58 5.791 -16.560 4.168 1.00 25.00 C ATOM 1009 NE ARG A 58 7.054 -16.732 3.426 1.00 25.00 N ATOM 1010 CZ ARG A 58 7.189 -16.682 2.104 1.00 25.00 C ATOM 1011 NH1 ARG A 58 6.191 -16.448 1.291 1.00 25.00 N ATOM 1012 NH2 ARG A 58 8.373 -16.864 1.588 1.00 25.00 N ATOM 0 H ARG A 58 5.174 -14.748 7.719 1.00 25.00 H new ATOM 0 HA ARG A 58 7.901 -14.897 7.373 1.00 25.00 H new ATOM 0 HB2 ARG A 58 5.808 -14.042 5.314 1.00 25.00 H new ATOM 0 HB3 ARG A 58 7.408 -14.641 4.925 1.00 25.00 H new ATOM 0 HG2 ARG A 58 6.770 -16.821 6.072 1.00 25.00 H new ATOM 0 HG3 ARG A 58 5.135 -16.203 6.192 1.00 25.00 H new ATOM 0 HD2 ARG A 58 5.228 -17.493 4.155 1.00 25.00 H new ATOM 0 HD3 ARG A 58 5.175 -15.809 3.674 1.00 25.00 H new ATOM 0 HE ARG A 58 7.897 -16.904 3.974 1.00 25.00 H new ATOM 0 HH11 ARG A 58 5.255 -16.293 1.664 1.00 25.00 H new ATOM 0 HH12 ARG A 58 6.349 -16.420 0.284 1.00 25.00 H new ATOM 0 HH21 ARG A 58 9.173 -17.041 2.196 1.00 25.00 H new ATOM 0 HH22 ARG A 58 8.499 -16.830 0.576 1.00 25.00 H new ATOM 1026 N VAL A 59 6.810 -11.829 7.042 1.00 25.00 N ATOM 1027 CA VAL A 59 7.238 -10.436 6.877 1.00 25.00 C ATOM 1028 C VAL A 59 8.246 -10.083 7.957 1.00 25.00 C ATOM 1029 O VAL A 59 9.253 -9.424 7.705 1.00 25.00 O ATOM 1030 CB VAL A 59 6.032 -9.462 6.982 1.00 25.00 C ATOM 1031 CG1 VAL A 59 6.472 -8.020 6.798 1.00 25.00 C ATOM 1032 CG2 VAL A 59 4.986 -9.821 5.950 1.00 25.00 C ATOM 0 H VAL A 59 5.838 -11.943 7.331 1.00 25.00 H new ATOM 0 HA VAL A 59 7.687 -10.336 5.889 1.00 25.00 H new ATOM 0 HB VAL A 59 5.603 -9.560 7.979 1.00 25.00 H new ATOM 0 HG11 VAL A 59 5.606 -7.363 6.877 1.00 25.00 H new ATOM 0 HG12 VAL A 59 7.197 -7.760 7.569 1.00 25.00 H new ATOM 0 HG13 VAL A 59 6.929 -7.902 5.816 1.00 25.00 H new ATOM 0 HG21 VAL A 59 4.144 -9.133 6.031 1.00 25.00 H new ATOM 0 HG22 VAL A 59 5.419 -9.749 4.952 1.00 25.00 H new ATOM 0 HG23 VAL A 59 4.640 -10.840 6.122 1.00 25.00 H new ATOM 1042 N GLY A 60 7.980 -10.547 9.165 1.00 25.00 N ATOM 1043 CA GLY A 60 8.873 -10.276 10.272 1.00 25.00 C ATOM 1044 C GLY A 60 10.143 -11.078 10.138 1.00 25.00 C ATOM 1045 O GLY A 60 11.225 -10.588 10.448 1.00 25.00 O ATOM 0 H GLY A 60 7.161 -11.107 9.401 1.00 25.00 H new ATOM 0 HA2 GLY A 60 9.110 -9.212 10.303 1.00 25.00 H new ATOM 0 HA3 GLY A 60 8.380 -10.521 11.213 1.00 25.00 H new ATOM 1049 N ASP A 61 10.017 -12.288 9.616 1.00 25.00 N ATOM 1050 CA ASP A 61 11.172 -13.146 9.359 1.00 25.00 C ATOM 1051 C ASP A 61 12.070 -12.446 8.337 1.00 25.00 C ATOM 1052 O ASP A 61 13.287 -12.451 8.454 1.00 25.00 O ATOM 1053 CB ASP A 61 10.728 -14.511 8.804 1.00 25.00 C ATOM 1054 CG ASP A 61 9.812 -15.275 9.760 1.00 25.00 C ATOM 1055 OD1 ASP A 61 9.944 -15.123 10.993 1.00 25.00 O ATOM 1056 OD2 ASP A 61 8.934 -16.021 9.260 1.00 25.00 O ATOM 0 H ASP A 61 9.122 -12.704 9.359 1.00 25.00 H new ATOM 0 HA ASP A 61 11.710 -13.318 10.291 1.00 25.00 H new ATOM 0 HB2 ASP A 61 10.211 -14.361 7.856 1.00 25.00 H new ATOM 0 HB3 ASP A 61 11.610 -15.116 8.594 1.00 25.00 H new ATOM 1061 N CYS A 62 11.451 -11.799 7.358 1.00 25.00 N ATOM 1062 CA CYS A 62 12.178 -11.056 6.328 1.00 25.00 C ATOM 1063 C CYS A 62 12.931 -9.868 6.923 1.00 25.00 C ATOM 1064 O CYS A 62 14.093 -9.629 6.597 1.00 25.00 O ATOM 1065 CB CYS A 62 11.193 -10.544 5.276 1.00 25.00 C ATOM 1066 SG CYS A 62 11.872 -10.488 3.600 1.00 25.00 S ATOM 0 H CYS A 62 10.437 -11.772 7.253 1.00 25.00 H new ATOM 0 HA CYS A 62 12.902 -11.732 5.874 1.00 25.00 H new ATOM 0 HB2 CYS A 62 10.310 -11.183 5.278 1.00 25.00 H new ATOM 0 HB3 CYS A 62 10.864 -9.544 5.557 1.00 25.00 H new ATOM 0 HG CYS A 62 11.175 -9.662 2.877 1.00 25.00 H new ATOM 1072 N PHE A 63 12.280 -9.131 7.816 1.00 25.00 N ATOM 1073 CA PHE A 63 12.941 -8.008 8.478 1.00 25.00 C ATOM 1074 C PHE A 63 14.117 -8.520 9.293 1.00 25.00 C ATOM 1075 O PHE A 63 15.152 -7.879 9.346 1.00 25.00 O ATOM 1076 CB PHE A 63 12.004 -7.269 9.439 1.00 25.00 C ATOM 1077 CG PHE A 63 10.808 -6.608 8.783 1.00 25.00 C ATOM 1078 CD1 PHE A 63 10.876 -6.078 7.477 1.00 25.00 C ATOM 1079 CD2 PHE A 63 9.604 -6.481 9.504 1.00 25.00 C ATOM 1080 CE1 PHE A 63 9.751 -5.437 6.895 1.00 25.00 C ATOM 1081 CE2 PHE A 63 8.481 -5.831 8.936 1.00 25.00 C ATOM 1082 CZ PHE A 63 8.556 -5.312 7.627 1.00 25.00 C ATOM 0 H PHE A 63 11.311 -9.285 8.096 1.00 25.00 H new ATOM 0 HA PHE A 63 13.261 -7.321 7.694 1.00 25.00 H new ATOM 0 HB2 PHE A 63 11.645 -7.975 10.188 1.00 25.00 H new ATOM 0 HB3 PHE A 63 12.577 -6.507 9.968 1.00 25.00 H new ATOM 0 HD1 PHE A 63 11.794 -6.161 6.914 1.00 25.00 H new ATOM 0 HD2 PHE A 63 9.537 -6.885 10.503 1.00 25.00 H new ATOM 0 HE1 PHE A 63 9.812 -5.045 5.890 1.00 25.00 H new ATOM 0 HE2 PHE A 63 7.568 -5.733 9.505 1.00 25.00 H new ATOM 0 HZ PHE A 63 7.700 -4.821 7.188 1.00 25.00 H new ATOM 1092 N GLN A 64 13.948 -9.664 9.941 1.00 25.00 N ATOM 1093 CA GLN A 64 14.997 -10.238 10.780 1.00 25.00 C ATOM 1094 C GLN A 64 16.172 -10.700 9.940 1.00 25.00 C ATOM 1095 O GLN A 64 17.320 -10.523 10.322 1.00 25.00 O ATOM 1096 CB GLN A 64 14.443 -11.423 11.570 1.00 25.00 C ATOM 1097 CG GLN A 64 15.458 -12.065 12.509 1.00 25.00 C ATOM 1098 CD GLN A 64 14.850 -13.184 13.321 1.00 25.00 C ATOM 1099 OE1 GLN A 64 14.129 -12.950 14.277 1.00 25.00 O ATOM 1100 NE2 GLN A 64 15.137 -14.403 12.947 1.00 25.00 N ATOM 0 H GLN A 64 13.092 -10.217 9.903 1.00 25.00 H new ATOM 0 HA GLN A 64 15.341 -9.465 11.467 1.00 25.00 H new ATOM 0 HB2 GLN A 64 13.584 -11.090 12.152 1.00 25.00 H new ATOM 0 HB3 GLN A 64 14.081 -12.177 10.871 1.00 25.00 H new ATOM 0 HG2 GLN A 64 16.295 -12.452 11.928 1.00 25.00 H new ATOM 0 HG3 GLN A 64 15.860 -11.307 13.181 1.00 25.00 H new ATOM 0 HE21 GLN A 64 15.744 -14.560 12.142 1.00 25.00 H new ATOM 0 HE22 GLN A 64 14.754 -15.197 13.460 1.00 25.00 H new ATOM 1109 N ASP A 65 15.889 -11.284 8.790 1.00 25.00 N ATOM 1110 CA ASP A 65 16.939 -11.754 7.899 1.00 25.00 C ATOM 1111 C ASP A 65 17.768 -10.569 7.431 1.00 25.00 C ATOM 1112 O ASP A 65 18.990 -10.559 7.525 1.00 25.00 O ATOM 1113 CB ASP A 65 16.317 -12.461 6.699 1.00 25.00 C ATOM 1114 CG ASP A 65 17.324 -13.291 5.923 1.00 25.00 C ATOM 1115 OD1 ASP A 65 18.452 -13.486 6.421 1.00 25.00 O ATOM 1116 OD2 ASP A 65 16.975 -13.770 4.824 1.00 25.00 O ATOM 0 H ASP A 65 14.941 -11.445 8.449 1.00 25.00 H new ATOM 0 HA ASP A 65 17.581 -12.457 8.429 1.00 25.00 H new ATOM 0 HB2 ASP A 65 15.508 -13.106 7.041 1.00 25.00 H new ATOM 0 HB3 ASP A 65 15.874 -11.719 6.034 1.00 25.00 H new ATOM 1121 N TYR A 66 17.083 -9.522 7.003 1.00 25.00 N ATOM 1122 CA TYR A 66 17.756 -8.307 6.557 1.00 25.00 C ATOM 1123 C TYR A 66 18.532 -7.679 7.720 1.00 25.00 C ATOM 1124 O TYR A 66 19.644 -7.180 7.546 1.00 25.00 O ATOM 1125 CB TYR A 66 16.717 -7.327 6.001 1.00 25.00 C ATOM 1126 CG TYR A 66 17.258 -6.187 5.135 1.00 25.00 C ATOM 1127 CD1 TYR A 66 18.618 -6.122 4.728 1.00 25.00 C ATOM 1128 CD2 TYR A 66 16.387 -5.165 4.700 1.00 25.00 C ATOM 1129 CE1 TYR A 66 19.079 -5.059 3.901 1.00 25.00 C ATOM 1130 CE2 TYR A 66 16.851 -4.107 3.875 1.00 25.00 C ATOM 1131 CZ TYR A 66 18.190 -4.071 3.481 1.00 25.00 C ATOM 1132 OH TYR A 66 18.627 -3.051 2.675 1.00 25.00 O ATOM 0 H TYR A 66 16.065 -9.485 6.954 1.00 25.00 H new ATOM 0 HA TYR A 66 18.468 -8.550 5.768 1.00 25.00 H new ATOM 0 HB2 TYR A 66 15.995 -7.892 5.412 1.00 25.00 H new ATOM 0 HB3 TYR A 66 16.174 -6.892 6.840 1.00 25.00 H new ATOM 0 HD1 TYR A 66 19.309 -6.887 5.049 1.00 25.00 H new ATOM 0 HD2 TYR A 66 15.350 -5.188 5.000 1.00 25.00 H new ATOM 0 HE1 TYR A 66 20.115 -5.018 3.600 1.00 25.00 H new ATOM 0 HE2 TYR A 66 16.171 -3.333 3.553 1.00 25.00 H new ATOM 0 HH TYR A 66 17.880 -2.449 2.475 1.00 25.00 H new ATOM 1142 N PHE A 67 17.965 -7.746 8.917 1.00 25.00 N ATOM 1143 CA PHE A 67 18.617 -7.197 10.109 1.00 25.00 C ATOM 1144 C PHE A 67 19.878 -7.980 10.485 1.00 25.00 C ATOM 1145 O PHE A 67 20.854 -7.399 10.924 1.00 25.00 O ATOM 1146 CB PHE A 67 17.635 -7.206 11.284 1.00 25.00 C ATOM 1147 CG PHE A 67 18.137 -6.496 12.514 1.00 25.00 C ATOM 1148 CD1 PHE A 67 18.951 -7.163 13.451 1.00 25.00 C ATOM 1149 CD2 PHE A 67 17.775 -5.160 12.758 1.00 25.00 C ATOM 1150 CE1 PHE A 67 19.409 -6.500 14.615 1.00 25.00 C ATOM 1151 CE2 PHE A 67 18.215 -4.490 13.923 1.00 25.00 C ATOM 1152 CZ PHE A 67 19.039 -5.159 14.851 1.00 25.00 C ATOM 0 H PHE A 67 17.056 -8.174 9.093 1.00 25.00 H new ATOM 0 HA PHE A 67 18.918 -6.175 9.880 1.00 25.00 H new ATOM 0 HB2 PHE A 67 16.701 -6.742 10.966 1.00 25.00 H new ATOM 0 HB3 PHE A 67 17.405 -8.240 11.543 1.00 25.00 H new ATOM 0 HD1 PHE A 67 19.229 -8.192 13.279 1.00 25.00 H new ATOM 0 HD2 PHE A 67 17.153 -4.638 12.046 1.00 25.00 H new ATOM 0 HE1 PHE A 67 20.040 -7.019 15.321 1.00 25.00 H new ATOM 0 HE2 PHE A 67 17.920 -3.467 14.102 1.00 25.00 H new ATOM 0 HZ PHE A 67 19.385 -4.648 15.737 1.00 25.00 H new ATOM 1162 N ASN A 68 19.877 -9.292 10.309 1.00 25.00 N ATOM 1163 CA ASN A 68 21.060 -10.086 10.651 1.00 25.00 C ATOM 1164 C ASN A 68 22.131 -9.930 9.570 1.00 25.00 C ATOM 1165 O ASN A 68 23.316 -9.865 9.864 1.00 25.00 O ATOM 1166 CB ASN A 68 20.677 -11.562 10.876 1.00 25.00 C ATOM 1167 CG ASN A 68 21.201 -12.489 9.798 1.00 25.00 C ATOM 1168 OD1 ASN A 68 22.328 -12.944 9.853 1.00 25.00 O ATOM 1169 ND2 ASN A 68 20.366 -12.813 8.855 1.00 25.00 N ATOM 0 H ASN A 68 19.091 -9.826 9.940 1.00 25.00 H new ATOM 0 HA ASN A 68 21.479 -9.716 11.587 1.00 25.00 H new ATOM 0 HB2 ASN A 68 21.062 -11.886 11.843 1.00 25.00 H new ATOM 0 HB3 ASN A 68 19.591 -11.645 10.921 1.00 25.00 H new ATOM 0 HD21 ASN A 68 20.648 -13.470 8.128 1.00 25.00 H new ATOM 0 HD22 ASN A 68 19.429 -12.410 8.843 1.00 25.00 H new ATOM 1176 N THR A 69 21.689 -9.811 8.329 1.00 25.00 N ATOM 1177 CA THR A 69 22.595 -9.645 7.191 1.00 25.00 C ATOM 1178 C THR A 69 23.293 -8.281 7.178 1.00 25.00 C ATOM 1179 O THR A 69 24.473 -8.186 6.846 1.00 25.00 O ATOM 1180 CB THR A 69 21.811 -9.802 5.855 1.00 25.00 C ATOM 1181 OG1 THR A 69 21.143 -11.066 5.839 1.00 25.00 O ATOM 1182 CG2 THR A 69 22.733 -9.762 4.645 1.00 25.00 C ATOM 0 H THR A 69 20.701 -9.826 8.077 1.00 25.00 H new ATOM 0 HA THR A 69 23.357 -10.418 7.293 1.00 25.00 H new ATOM 0 HB THR A 69 21.107 -8.972 5.798 1.00 25.00 H new ATOM 0 HG1 THR A 69 20.347 -11.023 6.410 1.00 25.00 H new ATOM 0 HG21 THR A 69 22.144 -9.875 3.735 1.00 25.00 H new ATOM 0 HG22 THR A 69 23.260 -8.808 4.620 1.00 25.00 H new ATOM 0 HG23 THR A 69 23.457 -10.574 4.712 1.00 25.00 H new ATOM 1190 N PHE A 70 22.555 -7.219 7.483 1.00 25.00 N ATOM 1191 CA PHE A 70 23.077 -5.858 7.333 1.00 25.00 C ATOM 1192 C PHE A 70 23.036 -4.984 8.589 1.00 25.00 C ATOM 1193 O PHE A 70 23.411 -3.817 8.554 1.00 25.00 O ATOM 1194 CB PHE A 70 22.293 -5.167 6.226 1.00 25.00 C ATOM 1195 CG PHE A 70 23.160 -4.618 5.127 1.00 25.00 C ATOM 1196 CD1 PHE A 70 23.957 -3.476 5.340 1.00 25.00 C ATOM 1197 CD2 PHE A 70 23.183 -5.240 3.867 1.00 25.00 C ATOM 1198 CE1 PHE A 70 24.772 -2.956 4.307 1.00 25.00 C ATOM 1199 CE2 PHE A 70 23.996 -4.731 2.821 1.00 25.00 C ATOM 1200 CZ PHE A 70 24.791 -3.585 3.044 1.00 25.00 C ATOM 0 H PHE A 70 21.599 -7.269 7.834 1.00 25.00 H new ATOM 0 HA PHE A 70 24.136 -5.971 7.102 1.00 25.00 H new ATOM 0 HB2 PHE A 70 21.583 -5.875 5.798 1.00 25.00 H new ATOM 0 HB3 PHE A 70 21.710 -4.354 6.658 1.00 25.00 H new ATOM 0 HD1 PHE A 70 23.946 -2.991 6.305 1.00 25.00 H new ATOM 0 HD2 PHE A 70 22.575 -6.115 3.693 1.00 25.00 H new ATOM 0 HE1 PHE A 70 25.378 -2.080 4.485 1.00 25.00 H new ATOM 0 HE2 PHE A 70 24.007 -5.218 1.857 1.00 25.00 H new ATOM 0 HZ PHE A 70 25.411 -3.192 2.251 1.00 25.00 H new ATOM 1210 N GLY A 71 22.587 -5.534 9.702 1.00 25.00 N ATOM 1211 CA GLY A 71 22.554 -4.774 10.940 1.00 25.00 C ATOM 1212 C GLY A 71 21.395 -3.794 11.059 1.00 25.00 C ATOM 1213 O GLY A 71 20.514 -3.717 10.187 1.00 25.00 O ATOM 0 H GLY A 71 22.244 -6.492 9.776 1.00 25.00 H new ATOM 0 HA2 GLY A 71 22.509 -5.471 11.776 1.00 25.00 H new ATOM 0 HA3 GLY A 71 23.489 -4.222 11.036 1.00 25.00 H new ATOM 1217 N PRO A 72 21.373 -2.996 12.142 1.00 25.00 N ATOM 1218 CA PRO A 72 20.279 -2.046 12.383 1.00 25.00 C ATOM 1219 C PRO A 72 20.285 -0.820 11.473 1.00 25.00 C ATOM 1220 O PRO A 72 19.360 -0.014 11.508 1.00 25.00 O ATOM 1221 CB PRO A 72 20.509 -1.635 13.839 1.00 25.00 C ATOM 1222 CG PRO A 72 21.972 -1.713 14.004 1.00 25.00 C ATOM 1223 CD PRO A 72 22.362 -2.955 13.238 1.00 25.00 C ATOM 0 HA PRO A 72 19.311 -2.503 12.177 1.00 25.00 H new ATOM 0 HB2 PRO A 72 20.138 -0.628 14.033 1.00 25.00 H new ATOM 0 HB3 PRO A 72 19.993 -2.303 14.529 1.00 25.00 H new ATOM 0 HG2 PRO A 72 22.466 -0.827 13.605 1.00 25.00 H new ATOM 0 HG3 PRO A 72 22.251 -1.788 15.055 1.00 25.00 H new ATOM 0 HD2 PRO A 72 23.382 -2.891 12.859 1.00 25.00 H new ATOM 0 HD3 PRO A 72 22.309 -3.847 13.862 1.00 25.00 H new ATOM 1231 N GLU A 73 21.315 -0.677 10.651 1.00 25.00 N ATOM 1232 CA GLU A 73 21.414 0.469 9.745 1.00 25.00 C ATOM 1233 C GLU A 73 20.518 0.328 8.529 1.00 25.00 C ATOM 1234 O GLU A 73 20.377 1.253 7.726 1.00 25.00 O ATOM 1235 CB GLU A 73 22.859 0.675 9.298 1.00 25.00 C ATOM 1236 CG GLU A 73 23.477 -0.525 8.605 1.00 25.00 C ATOM 1237 CD GLU A 73 24.693 -0.142 7.785 1.00 25.00 C ATOM 1238 OE1 GLU A 73 25.607 0.507 8.325 1.00 25.00 O ATOM 1239 OE2 GLU A 73 24.687 -0.417 6.563 1.00 25.00 O ATOM 0 H GLU A 73 22.093 -1.334 10.589 1.00 25.00 H new ATOM 0 HA GLU A 73 21.075 1.341 10.305 1.00 25.00 H new ATOM 0 HB2 GLU A 73 22.899 1.530 8.623 1.00 25.00 H new ATOM 0 HB3 GLU A 73 23.464 0.928 10.169 1.00 25.00 H new ATOM 0 HG2 GLU A 73 23.761 -1.268 9.350 1.00 25.00 H new ATOM 0 HG3 GLU A 73 22.735 -0.992 7.957 1.00 25.00 H new ATOM 1246 N LYS A 74 19.901 -0.833 8.402 1.00 25.00 N ATOM 1247 CA LYS A 74 18.985 -1.097 7.298 1.00 25.00 C ATOM 1248 C LYS A 74 17.572 -1.369 7.767 1.00 25.00 C ATOM 1249 O LYS A 74 16.623 -0.908 7.135 1.00 25.00 O ATOM 1250 CB LYS A 74 19.512 -2.264 6.488 1.00 25.00 C ATOM 1251 CG LYS A 74 20.751 -1.934 5.648 1.00 25.00 C ATOM 1252 CD LYS A 74 20.521 -0.838 4.611 1.00 25.00 C ATOM 1253 CE LYS A 74 21.777 -0.610 3.785 1.00 25.00 C ATOM 1254 NZ LYS A 74 22.850 0.052 4.603 1.00 25.00 N ATOM 0 H LYS A 74 20.016 -1.612 9.050 1.00 25.00 H new ATOM 0 HA LYS A 74 18.936 -0.202 6.678 1.00 25.00 H new ATOM 0 HB2 LYS A 74 19.753 -3.083 7.165 1.00 25.00 H new ATOM 0 HB3 LYS A 74 18.722 -2.620 5.827 1.00 25.00 H new ATOM 0 HG2 LYS A 74 21.558 -1.627 6.314 1.00 25.00 H new ATOM 0 HG3 LYS A 74 21.084 -2.838 5.139 1.00 25.00 H new ATOM 0 HD2 LYS A 74 19.695 -1.117 3.957 1.00 25.00 H new ATOM 0 HD3 LYS A 74 20.234 0.088 5.110 1.00 25.00 H new ATOM 0 HE2 LYS A 74 22.143 -1.563 3.403 1.00 25.00 H new ATOM 0 HE3 LYS A 74 21.540 0.010 2.920 1.00 25.00 H new ATOM 0 HZ1 LYS A 74 23.596 0.409 3.973 1.00 25.00 H new ATOM 0 HZ2 LYS A 74 22.440 0.844 5.138 1.00 25.00 H new ATOM 0 HZ3 LYS A 74 23.257 -0.639 5.265 1.00 25.00 H new ATOM 1268 N VAL A 75 17.412 -2.039 8.898 1.00 25.00 N ATOM 1269 CA VAL A 75 16.083 -2.175 9.489 1.00 25.00 C ATOM 1270 C VAL A 75 16.170 -1.640 10.917 1.00 25.00 C ATOM 1271 O VAL A 75 17.020 -2.071 11.689 1.00 25.00 O ATOM 1272 CB VAL A 75 15.644 -3.676 9.518 1.00 25.00 C ATOM 1273 CG1 VAL A 75 14.256 -3.838 10.148 1.00 25.00 C ATOM 1274 CG2 VAL A 75 15.630 -4.261 8.104 1.00 25.00 C ATOM 0 H VAL A 75 18.165 -2.489 9.418 1.00 25.00 H new ATOM 0 HA VAL A 75 15.349 -1.623 8.902 1.00 25.00 H new ATOM 0 HB VAL A 75 16.370 -4.216 10.126 1.00 25.00 H new ATOM 0 HG11 VAL A 75 13.980 -4.892 10.153 1.00 25.00 H new ATOM 0 HG12 VAL A 75 14.275 -3.463 11.171 1.00 25.00 H new ATOM 0 HG13 VAL A 75 13.525 -3.274 9.568 1.00 25.00 H new ATOM 0 HG21 VAL A 75 15.322 -5.306 8.146 1.00 25.00 H new ATOM 0 HG22 VAL A 75 14.929 -3.700 7.485 1.00 25.00 H new ATOM 0 HG23 VAL A 75 16.629 -4.194 7.673 1.00 25.00 H new ATOM 1284 N PRO A 76 15.238 -0.758 11.319 1.00 25.00 N ATOM 1285 CA PRO A 76 15.300 -0.308 12.712 1.00 25.00 C ATOM 1286 C PRO A 76 14.615 -1.280 13.659 1.00 25.00 C ATOM 1287 O PRO A 76 13.707 -2.006 13.268 1.00 25.00 O ATOM 1288 CB PRO A 76 14.547 1.014 12.667 1.00 25.00 C ATOM 1289 CG PRO A 76 13.515 0.810 11.621 1.00 25.00 C ATOM 1290 CD PRO A 76 14.161 -0.074 10.575 1.00 25.00 C ATOM 0 HA PRO A 76 16.322 -0.227 13.082 1.00 25.00 H new ATOM 0 HB2 PRO A 76 14.096 1.248 13.631 1.00 25.00 H new ATOM 0 HB3 PRO A 76 15.210 1.842 12.416 1.00 25.00 H new ATOM 0 HG2 PRO A 76 12.624 0.338 12.036 1.00 25.00 H new ATOM 0 HG3 PRO A 76 13.201 1.761 11.190 1.00 25.00 H new ATOM 0 HD2 PRO A 76 13.449 -0.785 10.155 1.00 25.00 H new ATOM 0 HD3 PRO A 76 14.556 0.510 9.744 1.00 25.00 H new ATOM 1298 N VAL A 77 14.968 -1.233 14.933 1.00 25.00 N ATOM 1299 CA VAL A 77 14.308 -2.085 15.921 1.00 25.00 C ATOM 1300 C VAL A 77 12.824 -1.714 16.081 1.00 25.00 C ATOM 1301 O VAL A 77 12.000 -2.554 16.438 1.00 25.00 O ATOM 1302 CB VAL A 77 15.035 -2.042 17.293 1.00 25.00 C ATOM 1303 CG1 VAL A 77 16.446 -2.640 17.159 1.00 25.00 C ATOM 1304 CG2 VAL A 77 15.130 -0.604 17.830 1.00 25.00 C ATOM 0 H VAL A 77 15.696 -0.625 15.308 1.00 25.00 H new ATOM 0 HA VAL A 77 14.363 -3.107 15.547 1.00 25.00 H new ATOM 0 HB VAL A 77 14.453 -2.633 18.001 1.00 25.00 H new ATOM 0 HG11 VAL A 77 16.949 -2.606 18.125 1.00 25.00 H new ATOM 0 HG12 VAL A 77 16.372 -3.675 16.824 1.00 25.00 H new ATOM 0 HG13 VAL A 77 17.018 -2.064 16.432 1.00 25.00 H new ATOM 0 HG21 VAL A 77 15.644 -0.608 18.791 1.00 25.00 H new ATOM 0 HG22 VAL A 77 15.686 0.012 17.124 1.00 25.00 H new ATOM 0 HG23 VAL A 77 14.127 -0.196 17.956 1.00 25.00 H new ATOM 1314 N THR A 78 12.458 -0.482 15.740 1.00 25.00 N ATOM 1315 CA THR A 78 11.052 -0.075 15.821 1.00 25.00 C ATOM 1316 C THR A 78 10.228 -0.723 14.723 1.00 25.00 C ATOM 1317 O THR A 78 9.026 -0.865 14.865 1.00 25.00 O ATOM 1318 CB THR A 78 10.859 1.468 15.766 1.00 25.00 C ATOM 1319 OG1 THR A 78 9.537 1.798 16.192 1.00 25.00 O ATOM 1320 CG2 THR A 78 11.067 2.044 14.381 1.00 25.00 C ATOM 0 H THR A 78 13.097 0.241 15.411 1.00 25.00 H new ATOM 0 HA THR A 78 10.702 -0.418 16.795 1.00 25.00 H new ATOM 0 HB THR A 78 11.613 1.899 16.425 1.00 25.00 H new ATOM 0 HG1 THR A 78 9.416 2.770 16.159 1.00 25.00 H new ATOM 0 HG21 THR A 78 10.918 3.123 14.410 1.00 25.00 H new ATOM 0 HG22 THR A 78 12.081 1.826 14.045 1.00 25.00 H new ATOM 0 HG23 THR A 78 10.352 1.597 13.690 1.00 25.00 H new ATOM 1328 N ALA A 79 10.858 -1.168 13.643 1.00 25.00 N ATOM 1329 CA ALA A 79 10.102 -1.817 12.585 1.00 25.00 C ATOM 1330 C ALA A 79 9.507 -3.113 13.123 1.00 25.00 C ATOM 1331 O ALA A 79 8.375 -3.443 12.818 1.00 25.00 O ATOM 1332 CB ALA A 79 10.980 -2.081 11.386 1.00 25.00 C ATOM 0 H ALA A 79 11.862 -1.094 13.480 1.00 25.00 H new ATOM 0 HA ALA A 79 9.295 -1.161 12.260 1.00 25.00 H new ATOM 0 HB1 ALA A 79 10.394 -2.567 10.606 1.00 25.00 H new ATOM 0 HB2 ALA A 79 11.374 -1.137 11.009 1.00 25.00 H new ATOM 0 HB3 ALA A 79 11.807 -2.729 11.676 1.00 25.00 H new ATOM 1338 N PHE A 80 10.252 -3.808 13.972 1.00 25.00 N ATOM 1339 CA PHE A 80 9.756 -5.036 14.591 1.00 25.00 C ATOM 1340 C PHE A 80 8.688 -4.717 15.625 1.00 25.00 C ATOM 1341 O PHE A 80 7.773 -5.494 15.844 1.00 25.00 O ATOM 1342 CB PHE A 80 10.892 -5.785 15.282 1.00 25.00 C ATOM 1343 CG PHE A 80 12.006 -6.166 14.359 1.00 25.00 C ATOM 1344 CD1 PHE A 80 11.968 -7.386 13.661 1.00 25.00 C ATOM 1345 CD2 PHE A 80 13.102 -5.308 14.180 1.00 25.00 C ATOM 1346 CE1 PHE A 80 13.022 -7.752 12.801 1.00 25.00 C ATOM 1347 CE2 PHE A 80 14.163 -5.656 13.326 1.00 25.00 C ATOM 1348 CZ PHE A 80 14.121 -6.883 12.627 1.00 25.00 C ATOM 0 H PHE A 80 11.198 -3.546 14.249 1.00 25.00 H new ATOM 0 HA PHE A 80 9.332 -5.658 13.802 1.00 25.00 H new ATOM 0 HB2 PHE A 80 11.292 -5.163 16.083 1.00 25.00 H new ATOM 0 HB3 PHE A 80 10.492 -6.686 15.747 1.00 25.00 H new ATOM 0 HD1 PHE A 80 11.124 -8.048 13.785 1.00 25.00 H new ATOM 0 HD2 PHE A 80 13.131 -4.366 14.707 1.00 25.00 H new ATOM 0 HE1 PHE A 80 12.989 -8.695 12.276 1.00 25.00 H new ATOM 0 HE2 PHE A 80 15.004 -4.990 13.205 1.00 25.00 H new ATOM 0 HZ PHE A 80 14.927 -7.155 11.962 1.00 25.00 H new ATOM 1358 N SER A 81 8.814 -3.572 16.273 1.00 25.00 N ATOM 1359 CA SER A 81 7.861 -3.169 17.311 1.00 25.00 C ATOM 1360 C SER A 81 6.522 -2.856 16.658 1.00 25.00 C ATOM 1361 O SER A 81 5.479 -3.365 17.070 1.00 25.00 O ATOM 1362 CB SER A 81 8.376 -1.943 18.069 1.00 25.00 C ATOM 1363 OG SER A 81 7.489 -1.580 19.111 1.00 25.00 O ATOM 0 H SER A 81 9.563 -2.901 16.104 1.00 25.00 H new ATOM 0 HA SER A 81 7.742 -3.983 18.026 1.00 25.00 H new ATOM 0 HB2 SER A 81 9.362 -2.155 18.483 1.00 25.00 H new ATOM 0 HB3 SER A 81 8.493 -1.107 17.379 1.00 25.00 H new ATOM 0 HG SER A 81 7.841 -0.795 19.581 1.00 25.00 H new ATOM 1369 N TYR A 82 6.571 -2.086 15.583 1.00 25.00 N ATOM 1370 CA TYR A 82 5.384 -1.778 14.801 1.00 25.00 C ATOM 1371 C TYR A 82 4.810 -3.063 14.235 1.00 25.00 C ATOM 1372 O TYR A 82 3.614 -3.290 14.289 1.00 25.00 O ATOM 1373 CB TYR A 82 5.740 -0.842 13.649 1.00 25.00 C ATOM 1374 CG TYR A 82 5.517 0.616 13.969 1.00 25.00 C ATOM 1375 CD1 TYR A 82 6.529 1.401 14.575 1.00 25.00 C ATOM 1376 CD2 TYR A 82 4.285 1.226 13.662 1.00 25.00 C ATOM 1377 CE1 TYR A 82 6.308 2.775 14.855 1.00 25.00 C ATOM 1378 CE2 TYR A 82 4.065 2.604 13.937 1.00 25.00 C ATOM 1379 CZ TYR A 82 5.082 3.364 14.524 1.00 25.00 C ATOM 1380 OH TYR A 82 4.878 4.696 14.780 1.00 25.00 O ATOM 0 H TYR A 82 7.428 -1.660 15.230 1.00 25.00 H new ATOM 0 HA TYR A 82 4.652 -1.292 15.445 1.00 25.00 H new ATOM 0 HB2 TYR A 82 6.786 -0.991 13.380 1.00 25.00 H new ATOM 0 HB3 TYR A 82 5.145 -1.110 12.776 1.00 25.00 H new ATOM 0 HD1 TYR A 82 7.477 0.950 14.826 1.00 25.00 H new ATOM 0 HD2 TYR A 82 3.497 0.640 13.212 1.00 25.00 H new ATOM 0 HE1 TYR A 82 7.083 3.364 15.322 1.00 25.00 H new ATOM 0 HE2 TYR A 82 3.117 3.061 13.694 1.00 25.00 H new ATOM 0 HH TYR A 82 3.977 4.950 14.491 1.00 25.00 H new ATOM 1390 N TRP A 83 5.674 -3.914 13.709 1.00 25.00 N ATOM 1391 CA TRP A 83 5.252 -5.173 13.113 1.00 25.00 C ATOM 1392 C TRP A 83 4.516 -6.069 14.110 1.00 25.00 C ATOM 1393 O TRP A 83 3.504 -6.697 13.772 1.00 25.00 O ATOM 1394 CB TRP A 83 6.487 -5.907 12.592 1.00 25.00 C ATOM 1395 CG TRP A 83 6.195 -7.268 12.096 1.00 25.00 C ATOM 1396 CD1 TRP A 83 5.750 -7.627 10.868 1.00 25.00 C ATOM 1397 CD2 TRP A 83 6.315 -8.498 12.835 1.00 25.00 C ATOM 1398 NE1 TRP A 83 5.569 -8.973 10.776 1.00 25.00 N ATOM 1399 CE2 TRP A 83 5.898 -9.546 11.971 1.00 25.00 C ATOM 1400 CE3 TRP A 83 6.732 -8.820 14.143 1.00 25.00 C ATOM 1401 CZ2 TRP A 83 5.880 -10.887 12.374 1.00 25.00 C ATOM 1402 CZ3 TRP A 83 6.726 -10.175 14.551 1.00 25.00 C ATOM 1403 CH2 TRP A 83 6.297 -11.197 13.655 1.00 25.00 C ATOM 0 H TRP A 83 6.681 -3.755 13.682 1.00 25.00 H new ATOM 0 HA TRP A 83 4.559 -4.947 12.303 1.00 25.00 H new ATOM 0 HB2 TRP A 83 6.935 -5.323 11.788 1.00 25.00 H new ATOM 0 HB3 TRP A 83 7.227 -5.970 13.390 1.00 25.00 H new ATOM 0 HD1 TRP A 83 5.562 -6.932 10.063 1.00 25.00 H new ATOM 0 HE1 TRP A 83 5.241 -9.472 9.949 1.00 25.00 H new ATOM 0 HE3 TRP A 83 7.051 -8.044 14.823 1.00 25.00 H new ATOM 0 HZ2 TRP A 83 5.548 -11.662 11.699 1.00 25.00 H new ATOM 0 HZ3 TRP A 83 7.049 -10.436 15.548 1.00 25.00 H new ATOM 0 HH2 TRP A 83 6.298 -12.227 13.981 1.00 25.00 H new ATOM 1414 N ASN A 84 5.007 -6.109 15.342 1.00 25.00 N ATOM 1415 CA ASN A 84 4.408 -6.933 16.393 1.00 25.00 C ATOM 1416 C ASN A 84 2.991 -6.469 16.703 1.00 25.00 C ATOM 1417 O ASN A 84 2.134 -7.279 17.044 1.00 25.00 O ATOM 1418 CB ASN A 84 5.246 -6.870 17.678 1.00 25.00 C ATOM 1419 CG ASN A 84 6.227 -8.016 17.796 1.00 25.00 C ATOM 1420 OD1 ASN A 84 5.855 -9.134 18.114 1.00 25.00 O ATOM 1421 ND2 ASN A 84 7.474 -7.747 17.552 1.00 25.00 N ATOM 0 H ASN A 84 5.824 -5.578 15.643 1.00 25.00 H new ATOM 0 HA ASN A 84 4.380 -7.960 16.029 1.00 25.00 H new ATOM 0 HB2 ASN A 84 5.792 -5.927 17.704 1.00 25.00 H new ATOM 0 HB3 ASN A 84 4.580 -6.877 18.541 1.00 25.00 H new ATOM 0 HD21 ASN A 84 8.178 -8.482 17.624 1.00 25.00 H new ATOM 0 HD22 ASN A 84 7.750 -6.801 17.289 1.00 25.00 H new ATOM 1428 N LEU A 85 2.747 -5.173 16.552 1.00 25.00 N ATOM 1429 CA LEU A 85 1.446 -4.582 16.857 1.00 25.00 C ATOM 1430 C LEU A 85 0.392 -5.142 15.911 1.00 25.00 C ATOM 1431 O LEU A 85 -0.703 -5.512 16.317 1.00 25.00 O ATOM 1432 CB LEU A 85 1.561 -3.055 16.718 1.00 25.00 C ATOM 1433 CG LEU A 85 0.472 -2.149 17.304 1.00 25.00 C ATOM 1434 CD1 LEU A 85 1.045 -0.730 17.407 1.00 25.00 C ATOM 1435 CD2 LEU A 85 -0.807 -2.115 16.473 1.00 25.00 C ATOM 0 H LEU A 85 3.440 -4.504 16.217 1.00 25.00 H new ATOM 0 HA LEU A 85 1.144 -4.826 17.875 1.00 25.00 H new ATOM 0 HB2 LEU A 85 2.508 -2.758 17.170 1.00 25.00 H new ATOM 0 HB3 LEU A 85 1.632 -2.831 15.654 1.00 25.00 H new ATOM 0 HG LEU A 85 0.194 -2.553 18.278 1.00 25.00 H new ATOM 0 HD11 LEU A 85 0.290 -0.062 17.822 1.00 25.00 H new ATOM 0 HD12 LEU A 85 1.920 -0.737 18.057 1.00 25.00 H new ATOM 0 HD13 LEU A 85 1.333 -0.381 16.415 1.00 25.00 H new ATOM 0 HD21 LEU A 85 -1.532 -1.454 16.948 1.00 25.00 H new ATOM 0 HD22 LEU A 85 -0.581 -1.746 15.472 1.00 25.00 H new ATOM 0 HD23 LEU A 85 -1.223 -3.120 16.404 1.00 25.00 H new ATOM 1447 N ILE A 86 0.738 -5.238 14.640 1.00 25.00 N ATOM 1448 CA ILE A 86 -0.191 -5.789 13.659 1.00 25.00 C ATOM 1449 C ILE A 86 -0.251 -7.312 13.804 1.00 25.00 C ATOM 1450 O ILE A 86 -1.288 -7.924 13.579 1.00 25.00 O ATOM 1451 CB ILE A 86 0.191 -5.405 12.215 1.00 25.00 C ATOM 1452 CG1 ILE A 86 0.246 -3.876 12.077 1.00 25.00 C ATOM 1453 CG2 ILE A 86 -0.833 -5.958 11.217 1.00 25.00 C ATOM 1454 CD1 ILE A 86 1.622 -3.369 11.763 1.00 25.00 C ATOM 0 H ILE A 86 1.640 -4.948 14.263 1.00 25.00 H new ATOM 0 HA ILE A 86 -1.174 -5.361 13.856 1.00 25.00 H new ATOM 0 HB ILE A 86 1.169 -5.834 11.998 1.00 25.00 H new ATOM 0 HG12 ILE A 86 -0.440 -3.562 11.290 1.00 25.00 H new ATOM 0 HG13 ILE A 86 -0.102 -3.420 13.004 1.00 25.00 H new ATOM 0 HG21 ILE A 86 -0.544 -5.675 10.205 1.00 25.00 H new ATOM 0 HG22 ILE A 86 -0.867 -7.045 11.295 1.00 25.00 H new ATOM 0 HG23 ILE A 86 -1.818 -5.548 11.441 1.00 25.00 H new ATOM 0 HD11 ILE A 86 1.599 -2.283 11.677 1.00 25.00 H new ATOM 0 HD12 ILE A 86 2.306 -3.655 12.562 1.00 25.00 H new ATOM 0 HD13 ILE A 86 1.963 -3.800 10.822 1.00 25.00 H new ATOM 1466 N LYS A 87 0.847 -7.925 14.225 1.00 25.00 N ATOM 1467 CA LYS A 87 0.875 -9.378 14.406 1.00 25.00 C ATOM 1468 C LYS A 87 -0.179 -9.797 15.424 1.00 25.00 C ATOM 1469 O LYS A 87 -0.935 -10.722 15.169 1.00 25.00 O ATOM 1470 CB LYS A 87 2.291 -9.847 14.801 1.00 25.00 C ATOM 1471 CG LYS A 87 2.376 -10.813 15.991 1.00 25.00 C ATOM 1472 CD LYS A 87 3.811 -11.115 16.340 1.00 25.00 C ATOM 1473 CE LYS A 87 3.902 -11.865 17.665 1.00 25.00 C ATOM 1474 NZ LYS A 87 5.324 -11.949 18.143 1.00 25.00 N ATOM 0 H LYS A 87 1.722 -7.450 14.446 1.00 25.00 H new ATOM 0 HA LYS A 87 0.631 -9.865 13.462 1.00 25.00 H new ATOM 0 HB2 LYS A 87 2.747 -10.328 13.936 1.00 25.00 H new ATOM 0 HB3 LYS A 87 2.892 -8.967 15.030 1.00 25.00 H new ATOM 0 HG2 LYS A 87 1.872 -10.378 16.854 1.00 25.00 H new ATOM 0 HG3 LYS A 87 1.854 -11.739 15.750 1.00 25.00 H new ATOM 0 HD2 LYS A 87 4.264 -11.711 15.548 1.00 25.00 H new ATOM 0 HD3 LYS A 87 4.377 -10.186 16.404 1.00 25.00 H new ATOM 0 HE2 LYS A 87 3.292 -11.360 18.415 1.00 25.00 H new ATOM 0 HE3 LYS A 87 3.495 -12.869 17.547 1.00 25.00 H new ATOM 0 HZ1 LYS A 87 5.351 -12.419 19.070 1.00 25.00 H new ATOM 0 HZ2 LYS A 87 5.888 -12.495 17.461 1.00 25.00 H new ATOM 0 HZ3 LYS A 87 5.718 -10.991 18.229 1.00 25.00 H new ATOM 1488 N GLU A 88 -0.269 -9.109 16.550 1.00 25.00 N ATOM 1489 CA GLU A 88 -1.259 -9.486 17.555 1.00 25.00 C ATOM 1490 C GLU A 88 -2.660 -9.074 17.108 1.00 25.00 C ATOM 1491 O GLU A 88 -3.632 -9.733 17.449 1.00 25.00 O ATOM 1492 CB GLU A 88 -0.898 -8.904 18.927 1.00 25.00 C ATOM 1493 CG GLU A 88 -0.805 -7.399 18.972 1.00 25.00 C ATOM 1494 CD GLU A 88 -0.250 -6.905 20.285 1.00 25.00 C ATOM 1495 OE1 GLU A 88 -1.019 -6.815 21.263 1.00 25.00 O ATOM 1496 OE2 GLU A 88 0.929 -6.498 20.324 1.00 25.00 O ATOM 0 H GLU A 88 0.313 -8.307 16.791 1.00 25.00 H new ATOM 0 HA GLU A 88 -1.254 -10.571 17.658 1.00 25.00 H new ATOM 0 HB2 GLU A 88 -1.644 -9.230 19.652 1.00 25.00 H new ATOM 0 HB3 GLU A 88 0.057 -9.323 19.243 1.00 25.00 H new ATOM 0 HG2 GLU A 88 -0.171 -7.051 18.157 1.00 25.00 H new ATOM 0 HG3 GLU A 88 -1.794 -6.970 18.812 1.00 25.00 H new ATOM 1503 N LEU A 89 -2.764 -8.043 16.278 1.00 25.00 N ATOM 1504 CA LEU A 89 -4.065 -7.646 15.737 1.00 25.00 C ATOM 1505 C LEU A 89 -4.631 -8.714 14.805 1.00 25.00 C ATOM 1506 O LEU A 89 -5.820 -8.998 14.850 1.00 25.00 O ATOM 1507 CB LEU A 89 -3.974 -6.313 14.991 1.00 25.00 C ATOM 1508 CG LEU A 89 -4.050 -5.040 15.853 1.00 25.00 C ATOM 1509 CD1 LEU A 89 -3.765 -3.819 14.975 1.00 25.00 C ATOM 1510 CD2 LEU A 89 -5.427 -4.878 16.519 1.00 25.00 C ATOM 0 H LEU A 89 -1.978 -7.472 15.967 1.00 25.00 H new ATOM 0 HA LEU A 89 -4.738 -7.530 16.586 1.00 25.00 H new ATOM 0 HB2 LEU A 89 -3.036 -6.295 14.437 1.00 25.00 H new ATOM 0 HB3 LEU A 89 -4.779 -6.277 14.257 1.00 25.00 H new ATOM 0 HG LEU A 89 -3.305 -5.126 16.644 1.00 25.00 H new ATOM 0 HD11 LEU A 89 -3.818 -2.915 15.581 1.00 25.00 H new ATOM 0 HD12 LEU A 89 -2.769 -3.907 14.541 1.00 25.00 H new ATOM 0 HD13 LEU A 89 -4.505 -3.764 14.177 1.00 25.00 H new ATOM 0 HD21 LEU A 89 -5.437 -3.967 17.118 1.00 25.00 H new ATOM 0 HD22 LEU A 89 -6.198 -4.816 15.751 1.00 25.00 H new ATOM 0 HD23 LEU A 89 -5.624 -5.736 17.161 1.00 25.00 H new ATOM 1522 N ILE A 90 -3.793 -9.315 13.970 1.00 25.00 N ATOM 1523 CA ILE A 90 -4.264 -10.370 13.068 1.00 25.00 C ATOM 1524 C ILE A 90 -4.472 -11.661 13.864 1.00 25.00 C ATOM 1525 O ILE A 90 -5.458 -12.361 13.665 1.00 25.00 O ATOM 1526 CB ILE A 90 -3.272 -10.662 11.894 1.00 25.00 C ATOM 1527 CG1 ILE A 90 -3.041 -9.403 11.034 1.00 25.00 C ATOM 1528 CG2 ILE A 90 -3.842 -11.786 10.975 1.00 25.00 C ATOM 1529 CD1 ILE A 90 -1.833 -9.523 10.076 1.00 25.00 C ATOM 0 H ILE A 90 -2.799 -9.098 13.895 1.00 25.00 H new ATOM 0 HA ILE A 90 -5.197 -10.017 12.630 1.00 25.00 H new ATOM 0 HB ILE A 90 -2.326 -10.976 12.335 1.00 25.00 H new ATOM 0 HG12 ILE A 90 -3.939 -9.202 10.450 1.00 25.00 H new ATOM 0 HG13 ILE A 90 -2.890 -8.547 11.691 1.00 25.00 H new ATOM 0 HG21 ILE A 90 -3.143 -11.980 10.162 1.00 25.00 H new ATOM 0 HG22 ILE A 90 -3.983 -12.696 11.558 1.00 25.00 H new ATOM 0 HG23 ILE A 90 -4.799 -11.468 10.562 1.00 25.00 H new ATOM 0 HD11 ILE A 90 -1.730 -8.602 9.503 1.00 25.00 H new ATOM 0 HD12 ILE A 90 -0.925 -9.693 10.655 1.00 25.00 H new ATOM 0 HD13 ILE A 90 -1.991 -10.359 9.394 1.00 25.00 H new ATOM 1541 N ASP A 91 -3.557 -11.976 14.772 1.00 25.00 N ATOM 1542 CA ASP A 91 -3.662 -13.213 15.559 1.00 25.00 C ATOM 1543 C ASP A 91 -4.944 -13.194 16.386 1.00 25.00 C ATOM 1544 O ASP A 91 -5.621 -14.210 16.532 1.00 25.00 O ATOM 1545 CB ASP A 91 -2.441 -13.368 16.474 1.00 25.00 C ATOM 1546 CG ASP A 91 -2.301 -14.778 17.036 1.00 25.00 C ATOM 1547 OD1 ASP A 91 -2.926 -15.088 18.075 1.00 25.00 O ATOM 1548 OD2 ASP A 91 -1.498 -15.562 16.463 1.00 25.00 O ATOM 0 H ASP A 91 -2.740 -11.404 14.985 1.00 25.00 H new ATOM 0 HA ASP A 91 -3.693 -14.063 14.878 1.00 25.00 H new ATOM 0 HB2 ASP A 91 -1.540 -13.113 15.917 1.00 25.00 H new ATOM 0 HB3 ASP A 91 -2.518 -12.659 17.298 1.00 25.00 H new ATOM 1553 N LYS A 92 -5.315 -12.012 16.866 1.00 25.00 N ATOM 1554 CA LYS A 92 -6.537 -11.839 17.650 1.00 25.00 C ATOM 1555 C LYS A 92 -7.584 -11.021 16.919 1.00 25.00 C ATOM 1556 O LYS A 92 -8.364 -10.283 17.526 1.00 25.00 O ATOM 1557 CB LYS A 92 -6.200 -11.268 19.038 1.00 25.00 C ATOM 1558 CG LYS A 92 -5.288 -12.203 19.865 1.00 25.00 C ATOM 1559 CD LYS A 92 -5.974 -13.559 20.107 1.00 25.00 C ATOM 1560 CE LYS A 92 -5.076 -14.583 20.735 1.00 25.00 C ATOM 1561 NZ LYS A 92 -5.562 -15.918 20.245 1.00 25.00 N ATOM 0 H LYS A 92 -4.784 -11.153 16.726 1.00 25.00 H new ATOM 0 HA LYS A 92 -6.989 -12.821 17.794 1.00 25.00 H new ATOM 0 HB2 LYS A 92 -5.710 -10.302 18.919 1.00 25.00 H new ATOM 0 HB3 LYS A 92 -7.125 -11.091 19.587 1.00 25.00 H new ATOM 0 HG2 LYS A 92 -4.345 -12.356 19.341 1.00 25.00 H new ATOM 0 HG3 LYS A 92 -5.050 -11.735 20.820 1.00 25.00 H new ATOM 0 HD2 LYS A 92 -6.843 -13.408 20.748 1.00 25.00 H new ATOM 0 HD3 LYS A 92 -6.342 -13.945 19.157 1.00 25.00 H new ATOM 0 HE2 LYS A 92 -4.037 -14.418 20.450 1.00 25.00 H new ATOM 0 HE3 LYS A 92 -5.121 -14.527 21.823 1.00 25.00 H new ATOM 0 HZ1 LYS A 92 -5.432 -16.630 20.991 1.00 25.00 H new ATOM 0 HZ2 LYS A 92 -6.571 -15.852 20.002 1.00 25.00 H new ATOM 0 HZ3 LYS A 92 -5.020 -16.197 19.402 1.00 25.00 H new ATOM 1575 N LYS A 93 -7.680 -11.257 15.615 1.00 25.00 N ATOM 1576 CA LYS A 93 -8.753 -10.690 14.790 1.00 25.00 C ATOM 1577 C LYS A 93 -10.105 -11.221 15.266 1.00 25.00 C ATOM 1578 O LYS A 93 -11.138 -10.610 15.034 1.00 25.00 O ATOM 1579 CB LYS A 93 -8.523 -11.060 13.317 1.00 25.00 C ATOM 1580 CG LYS A 93 -8.617 -12.579 13.032 1.00 25.00 C ATOM 1581 CD LYS A 93 -8.013 -12.957 11.676 1.00 25.00 C ATOM 1582 CE LYS A 93 -8.869 -12.504 10.512 1.00 25.00 C ATOM 1583 NZ LYS A 93 -10.134 -13.308 10.388 1.00 25.00 N ATOM 0 H LYS A 93 -7.023 -11.842 15.098 1.00 25.00 H new ATOM 0 HA LYS A 93 -8.749 -9.604 14.885 1.00 25.00 H new ATOM 0 HB2 LYS A 93 -9.257 -10.538 12.702 1.00 25.00 H new ATOM 0 HB3 LYS A 93 -7.540 -10.703 13.012 1.00 25.00 H new ATOM 0 HG2 LYS A 93 -8.102 -13.127 13.821 1.00 25.00 H new ATOM 0 HG3 LYS A 93 -9.662 -12.887 13.060 1.00 25.00 H new ATOM 0 HD2 LYS A 93 -7.021 -12.513 11.588 1.00 25.00 H new ATOM 0 HD3 LYS A 93 -7.884 -14.038 11.628 1.00 25.00 H new ATOM 0 HE2 LYS A 93 -9.121 -11.451 10.637 1.00 25.00 H new ATOM 0 HE3 LYS A 93 -8.296 -12.587 9.588 1.00 25.00 H new ATOM 0 HZ1 LYS A 93 -10.054 -13.958 9.580 1.00 25.00 H new ATOM 0 HZ2 LYS A 93 -10.284 -13.855 11.259 1.00 25.00 H new ATOM 0 HZ3 LYS A 93 -10.939 -12.667 10.239 1.00 25.00 H new ATOM 1597 N GLU A 94 -10.060 -12.353 15.953 1.00 25.00 N ATOM 1598 CA GLU A 94 -11.241 -13.024 16.499 1.00 25.00 C ATOM 1599 C GLU A 94 -12.000 -12.174 17.523 1.00 25.00 C ATOM 1600 O GLU A 94 -13.217 -12.251 17.605 1.00 25.00 O ATOM 1601 CB GLU A 94 -10.809 -14.359 17.139 1.00 25.00 C ATOM 1602 CG GLU A 94 -9.535 -14.262 18.017 1.00 25.00 C ATOM 1603 CD GLU A 94 -9.109 -15.599 18.622 1.00 25.00 C ATOM 1604 OE1 GLU A 94 -9.394 -16.650 18.021 1.00 25.00 O ATOM 1605 OE2 GLU A 94 -8.411 -15.583 19.666 1.00 25.00 O ATOM 0 H GLU A 94 -9.188 -12.843 16.153 1.00 25.00 H new ATOM 0 HA GLU A 94 -11.930 -13.196 15.672 1.00 25.00 H new ATOM 0 HB2 GLU A 94 -11.629 -14.738 17.749 1.00 25.00 H new ATOM 0 HB3 GLU A 94 -10.636 -15.089 16.348 1.00 25.00 H new ATOM 0 HG2 GLU A 94 -8.717 -13.868 17.414 1.00 25.00 H new ATOM 0 HG3 GLU A 94 -9.711 -13.548 18.821 1.00 25.00 H new ATOM 1612 N VAL A 95 -11.286 -11.344 18.275 1.00 25.00 N ATOM 1613 CA VAL A 95 -11.911 -10.492 19.296 1.00 25.00 C ATOM 1614 C VAL A 95 -11.774 -9.022 18.916 1.00 25.00 C ATOM 1615 O VAL A 95 -12.098 -8.125 19.687 1.00 25.00 O ATOM 1616 CB VAL A 95 -11.291 -10.749 20.704 1.00 25.00 C ATOM 1617 CG1 VAL A 95 -11.600 -12.183 21.167 1.00 25.00 C ATOM 1618 CG2 VAL A 95 -9.768 -10.528 20.692 1.00 25.00 C ATOM 0 H VAL A 95 -10.274 -11.239 18.202 1.00 25.00 H new ATOM 0 HA VAL A 95 -12.970 -10.747 19.344 1.00 25.00 H new ATOM 0 HB VAL A 95 -11.737 -10.038 21.399 1.00 25.00 H new ATOM 0 HG11 VAL A 95 -11.162 -12.350 22.151 1.00 25.00 H new ATOM 0 HG12 VAL A 95 -12.680 -12.323 21.222 1.00 25.00 H new ATOM 0 HG13 VAL A 95 -11.178 -12.894 20.457 1.00 25.00 H new ATOM 0 HG21 VAL A 95 -9.365 -10.715 21.688 1.00 25.00 H new ATOM 0 HG22 VAL A 95 -9.307 -11.212 19.980 1.00 25.00 H new ATOM 0 HG23 VAL A 95 -9.552 -9.500 20.400 1.00 25.00 H new ATOM 1628 N ASN A 96 -11.312 -8.779 17.698 1.00 25.00 N ATOM 1629 CA ASN A 96 -11.147 -7.420 17.187 1.00 25.00 C ATOM 1630 C ASN A 96 -11.925 -7.246 15.885 1.00 25.00 C ATOM 1631 O ASN A 96 -11.340 -7.230 14.802 1.00 25.00 O ATOM 1632 CB ASN A 96 -9.665 -7.109 16.955 1.00 25.00 C ATOM 1633 CG ASN A 96 -8.983 -6.625 18.194 1.00 25.00 C ATOM 1634 OD1 ASN A 96 -9.123 -5.468 18.564 1.00 25.00 O ATOM 1635 ND2 ASN A 96 -8.226 -7.478 18.824 1.00 25.00 N ATOM 0 H ASN A 96 -11.042 -9.509 17.039 1.00 25.00 H new ATOM 0 HA ASN A 96 -11.538 -6.725 17.930 1.00 25.00 H new ATOM 0 HB2 ASN A 96 -9.161 -8.005 16.593 1.00 25.00 H new ATOM 0 HB3 ASN A 96 -9.573 -6.354 16.174 1.00 25.00 H new ATOM 0 HD21 ASN A 96 -7.721 -7.190 19.662 1.00 25.00 H new ATOM 0 HD22 ASN A 96 -8.139 -8.434 18.479 1.00 25.00 H new ATOM 1642 N PRO A 97 -13.253 -7.053 15.966 1.00 25.00 N ATOM 1643 CA PRO A 97 -13.973 -6.872 14.699 1.00 25.00 C ATOM 1644 C PRO A 97 -13.594 -5.580 13.971 1.00 25.00 C ATOM 1645 O PRO A 97 -13.791 -5.461 12.764 1.00 25.00 O ATOM 1646 CB PRO A 97 -15.442 -6.863 15.138 1.00 25.00 C ATOM 1647 CG PRO A 97 -15.404 -6.346 16.531 1.00 25.00 C ATOM 1648 CD PRO A 97 -14.169 -6.979 17.122 1.00 25.00 C ATOM 0 HA PRO A 97 -13.737 -7.652 13.976 1.00 25.00 H new ATOM 0 HB2 PRO A 97 -16.046 -6.225 14.493 1.00 25.00 H new ATOM 0 HB3 PRO A 97 -15.876 -7.862 15.096 1.00 25.00 H new ATOM 0 HG2 PRO A 97 -15.343 -5.258 16.551 1.00 25.00 H new ATOM 0 HG3 PRO A 97 -16.300 -6.626 17.085 1.00 25.00 H new ATOM 0 HD2 PRO A 97 -13.753 -6.377 17.930 1.00 25.00 H new ATOM 0 HD3 PRO A 97 -14.379 -7.965 17.536 1.00 25.00 H new ATOM 1656 N GLN A 98 -12.987 -4.640 14.691 1.00 25.00 N ATOM 1657 CA GLN A 98 -12.547 -3.386 14.095 1.00 25.00 C ATOM 1658 C GLN A 98 -11.475 -3.682 13.057 1.00 25.00 C ATOM 1659 O GLN A 98 -11.489 -3.132 11.958 1.00 25.00 O ATOM 1660 CB GLN A 98 -11.995 -2.416 15.166 1.00 25.00 C ATOM 1661 CG GLN A 98 -11.114 -3.066 16.272 1.00 25.00 C ATOM 1662 CD GLN A 98 -10.331 -2.050 17.086 1.00 25.00 C ATOM 1663 OE1 GLN A 98 -10.391 -0.855 16.840 1.00 25.00 O ATOM 1664 NE2 GLN A 98 -9.577 -2.527 18.042 1.00 25.00 N ATOM 0 H GLN A 98 -12.790 -4.725 15.688 1.00 25.00 H new ATOM 0 HA GLN A 98 -13.403 -2.903 13.623 1.00 25.00 H new ATOM 0 HB2 GLN A 98 -11.408 -1.646 14.665 1.00 25.00 H new ATOM 0 HB3 GLN A 98 -12.836 -1.915 15.645 1.00 25.00 H new ATOM 0 HG2 GLN A 98 -11.750 -3.645 16.941 1.00 25.00 H new ATOM 0 HG3 GLN A 98 -10.418 -3.765 15.809 1.00 25.00 H new ATOM 0 HE21 GLN A 98 -9.552 -3.531 18.219 1.00 25.00 H new ATOM 0 HE22 GLN A 98 -9.014 -1.895 18.611 1.00 25.00 H new ATOM 1673 N VAL A 99 -10.539 -4.551 13.412 1.00 25.00 N ATOM 1674 CA VAL A 99 -9.447 -4.876 12.521 1.00 25.00 C ATOM 1675 C VAL A 99 -9.834 -5.969 11.538 1.00 25.00 C ATOM 1676 O VAL A 99 -9.278 -6.047 10.470 1.00 25.00 O ATOM 1677 CB VAL A 99 -8.156 -5.256 13.300 1.00 25.00 C ATOM 1678 CG1 VAL A 99 -8.128 -6.747 13.660 1.00 25.00 C ATOM 1679 CG2 VAL A 99 -6.926 -4.881 12.482 1.00 25.00 C ATOM 0 H VAL A 99 -10.518 -5.039 14.308 1.00 25.00 H new ATOM 0 HA VAL A 99 -9.228 -3.975 11.947 1.00 25.00 H new ATOM 0 HB VAL A 99 -8.150 -4.696 14.235 1.00 25.00 H new ATOM 0 HG11 VAL A 99 -7.211 -6.973 14.203 1.00 25.00 H new ATOM 0 HG12 VAL A 99 -8.988 -6.987 14.285 1.00 25.00 H new ATOM 0 HG13 VAL A 99 -8.165 -7.342 12.748 1.00 25.00 H new ATOM 0 HG21 VAL A 99 -6.026 -5.150 13.034 1.00 25.00 H new ATOM 0 HG22 VAL A 99 -6.943 -5.417 11.533 1.00 25.00 H new ATOM 0 HG23 VAL A 99 -6.928 -3.808 12.293 1.00 25.00 H new ATOM 1689 N MET A 100 -10.798 -6.807 11.887 1.00 25.00 N ATOM 1690 CA MET A 100 -11.199 -7.912 11.016 1.00 25.00 C ATOM 1691 C MET A 100 -11.725 -7.373 9.684 1.00 25.00 C ATOM 1692 O MET A 100 -11.414 -7.896 8.621 1.00 25.00 O ATOM 1693 CB MET A 100 -12.273 -8.737 11.717 1.00 25.00 C ATOM 1694 CG MET A 100 -12.173 -10.249 11.515 1.00 25.00 C ATOM 1695 SD MET A 100 -12.061 -10.789 9.790 1.00 25.00 S ATOM 1696 CE MET A 100 -13.702 -10.408 9.146 1.00 25.00 C ATOM 0 H MET A 100 -11.318 -6.747 12.762 1.00 25.00 H new ATOM 0 HA MET A 100 -10.335 -8.544 10.810 1.00 25.00 H new ATOM 0 HB2 MET A 100 -12.229 -8.526 12.786 1.00 25.00 H new ATOM 0 HB3 MET A 100 -13.250 -8.404 11.366 1.00 25.00 H new ATOM 0 HG2 MET A 100 -11.297 -10.614 12.051 1.00 25.00 H new ATOM 0 HG3 MET A 100 -13.045 -10.719 11.971 1.00 25.00 H new ATOM 0 HE1 MET A 100 -13.756 -10.694 8.096 1.00 25.00 H new ATOM 0 HE2 MET A 100 -14.452 -10.960 9.712 1.00 25.00 H new ATOM 0 HE3 MET A 100 -13.891 -9.339 9.241 1.00 25.00 H new ATOM 1706 N ALA A 101 -12.461 -6.275 9.733 1.00 25.00 N ATOM 1707 CA ALA A 101 -12.933 -5.644 8.507 1.00 25.00 C ATOM 1708 C ALA A 101 -11.749 -5.075 7.700 1.00 25.00 C ATOM 1709 O ALA A 101 -11.803 -5.002 6.482 1.00 25.00 O ATOM 1710 CB ALA A 101 -13.930 -4.550 8.848 1.00 25.00 C ATOM 0 H ALA A 101 -12.743 -5.806 10.594 1.00 25.00 H new ATOM 0 HA ALA A 101 -13.429 -6.392 7.889 1.00 25.00 H new ATOM 0 HB1 ALA A 101 -14.282 -4.079 7.930 1.00 25.00 H new ATOM 0 HB2 ALA A 101 -14.776 -4.983 9.381 1.00 25.00 H new ATOM 0 HB3 ALA A 101 -13.448 -3.802 9.478 1.00 25.00 H new ATOM 1716 N ALA A 102 -10.675 -4.701 8.383 1.00 25.00 N ATOM 1717 CA ALA A 102 -9.485 -4.177 7.721 1.00 25.00 C ATOM 1718 C ALA A 102 -8.675 -5.332 7.112 1.00 25.00 C ATOM 1719 O ALA A 102 -8.033 -5.161 6.087 1.00 25.00 O ATOM 1720 CB ALA A 102 -8.628 -3.374 8.720 1.00 25.00 C ATOM 0 H ALA A 102 -10.602 -4.751 9.399 1.00 25.00 H new ATOM 0 HA ALA A 102 -9.789 -3.505 6.918 1.00 25.00 H new ATOM 0 HB1 ALA A 102 -7.743 -2.989 8.213 1.00 25.00 H new ATOM 0 HB2 ALA A 102 -9.212 -2.542 9.114 1.00 25.00 H new ATOM 0 HB3 ALA A 102 -8.322 -4.023 9.541 1.00 25.00 H new ATOM 1726 N VAL A 103 -8.744 -6.510 7.722 1.00 25.00 N ATOM 1727 CA VAL A 103 -8.087 -7.707 7.177 1.00 25.00 C ATOM 1728 C VAL A 103 -8.709 -7.983 5.814 1.00 25.00 C ATOM 1729 O VAL A 103 -8.002 -8.135 4.819 1.00 25.00 O ATOM 1730 CB VAL A 103 -8.299 -8.951 8.123 1.00 25.00 C ATOM 1731 CG1 VAL A 103 -7.831 -10.257 7.483 1.00 25.00 C ATOM 1732 CG2 VAL A 103 -7.569 -8.744 9.460 1.00 25.00 C ATOM 0 H VAL A 103 -9.247 -6.668 8.595 1.00 25.00 H new ATOM 0 HA VAL A 103 -7.013 -7.538 7.095 1.00 25.00 H new ATOM 0 HB VAL A 103 -9.372 -9.031 8.298 1.00 25.00 H new ATOM 0 HG11 VAL A 103 -7.999 -11.082 8.175 1.00 25.00 H new ATOM 0 HG12 VAL A 103 -8.392 -10.434 6.565 1.00 25.00 H new ATOM 0 HG13 VAL A 103 -6.768 -10.188 7.252 1.00 25.00 H new ATOM 0 HG21 VAL A 103 -7.727 -9.613 10.099 1.00 25.00 H new ATOM 0 HG22 VAL A 103 -6.502 -8.618 9.276 1.00 25.00 H new ATOM 0 HG23 VAL A 103 -7.960 -7.854 9.954 1.00 25.00 H new ATOM 1742 N ALA A 104 -10.036 -8.002 5.772 1.00 25.00 N ATOM 1743 CA ALA A 104 -10.755 -8.266 4.533 1.00 25.00 C ATOM 1744 C ALA A 104 -10.482 -7.170 3.501 1.00 25.00 C ATOM 1745 O ALA A 104 -10.186 -7.454 2.349 1.00 25.00 O ATOM 1746 CB ALA A 104 -12.258 -8.375 4.817 1.00 25.00 C ATOM 0 H ALA A 104 -10.635 -7.838 6.581 1.00 25.00 H new ATOM 0 HA ALA A 104 -10.403 -9.211 4.120 1.00 25.00 H new ATOM 0 HB1 ALA A 104 -12.791 -8.572 3.887 1.00 25.00 H new ATOM 0 HB2 ALA A 104 -12.438 -9.190 5.518 1.00 25.00 H new ATOM 0 HB3 ALA A 104 -12.616 -7.440 5.248 1.00 25.00 H new ATOM 1752 N GLN A 105 -10.556 -5.919 3.924 1.00 25.00 N ATOM 1753 CA GLN A 105 -10.323 -4.810 3.008 1.00 25.00 C ATOM 1754 C GLN A 105 -8.917 -4.769 2.449 1.00 25.00 C ATOM 1755 O GLN A 105 -8.733 -4.405 1.300 1.00 25.00 O ATOM 1756 CB GLN A 105 -10.606 -3.482 3.680 1.00 25.00 C ATOM 1757 CG GLN A 105 -12.065 -3.108 3.645 1.00 25.00 C ATOM 1758 CD GLN A 105 -12.258 -1.665 3.976 1.00 25.00 C ATOM 1759 OE1 GLN A 105 -11.725 -0.793 3.296 1.00 25.00 O ATOM 1760 NE2 GLN A 105 -12.992 -1.392 5.020 1.00 25.00 N ATOM 0 H GLN A 105 -10.773 -5.646 4.883 1.00 25.00 H new ATOM 0 HA GLN A 105 -11.010 -4.978 2.179 1.00 25.00 H new ATOM 0 HB2 GLN A 105 -10.272 -3.526 4.717 1.00 25.00 H new ATOM 0 HB3 GLN A 105 -10.024 -2.701 3.191 1.00 25.00 H new ATOM 0 HG2 GLN A 105 -12.473 -3.315 2.656 1.00 25.00 H new ATOM 0 HG3 GLN A 105 -12.619 -3.724 4.354 1.00 25.00 H new ATOM 0 HE21 GLN A 105 -13.416 -2.148 5.557 1.00 25.00 H new ATOM 0 HE22 GLN A 105 -13.141 -0.422 5.299 1.00 25.00 H new ATOM 1769 N THR A 106 -7.915 -5.138 3.231 1.00 25.00 N ATOM 1770 CA THR A 106 -6.556 -5.130 2.704 1.00 25.00 C ATOM 1771 C THR A 106 -6.486 -6.142 1.569 1.00 25.00 C ATOM 1772 O THR A 106 -5.922 -5.854 0.529 1.00 25.00 O ATOM 1773 CB THR A 106 -5.492 -5.459 3.761 1.00 25.00 C ATOM 1774 OG1 THR A 106 -5.650 -4.605 4.891 1.00 25.00 O ATOM 1775 CG2 THR A 106 -4.095 -5.233 3.212 1.00 25.00 C ATOM 0 H THR A 106 -8.008 -5.438 4.202 1.00 25.00 H new ATOM 0 HA THR A 106 -6.335 -4.121 2.357 1.00 25.00 H new ATOM 0 HB THR A 106 -5.619 -6.505 4.041 1.00 25.00 H new ATOM 0 HG1 THR A 106 -6.499 -4.807 5.338 1.00 25.00 H new ATOM 0 HG21 THR A 106 -3.359 -5.473 3.980 1.00 25.00 H new ATOM 0 HG22 THR A 106 -3.937 -5.874 2.345 1.00 25.00 H new ATOM 0 HG23 THR A 106 -3.984 -4.190 2.917 1.00 25.00 H new ATOM 1783 N GLU A 107 -7.119 -7.297 1.730 1.00 25.00 N ATOM 1784 CA GLU A 107 -7.176 -8.266 0.632 1.00 25.00 C ATOM 1785 C GLU A 107 -7.911 -7.710 -0.588 1.00 25.00 C ATOM 1786 O GLU A 107 -7.474 -7.929 -1.705 1.00 25.00 O ATOM 1787 CB GLU A 107 -7.859 -9.562 1.055 1.00 25.00 C ATOM 1788 CG GLU A 107 -7.080 -10.356 2.067 1.00 25.00 C ATOM 1789 CD GLU A 107 -7.637 -11.756 2.273 1.00 25.00 C ATOM 1790 OE1 GLU A 107 -8.506 -12.203 1.483 1.00 25.00 O ATOM 1791 OE2 GLU A 107 -7.152 -12.438 3.204 1.00 25.00 O ATOM 0 H GLU A 107 -7.591 -7.586 2.587 1.00 25.00 H new ATOM 0 HA GLU A 107 -6.139 -8.470 0.365 1.00 25.00 H new ATOM 0 HB2 GLU A 107 -8.840 -9.327 1.468 1.00 25.00 H new ATOM 0 HB3 GLU A 107 -8.025 -10.179 0.172 1.00 25.00 H new ATOM 0 HG2 GLU A 107 -6.041 -10.427 1.745 1.00 25.00 H new ATOM 0 HG3 GLU A 107 -7.083 -9.825 3.019 1.00 25.00 H new ATOM 1798 N GLU A 108 -9.003 -6.981 -0.390 1.00 25.00 N ATOM 1799 CA GLU A 108 -9.743 -6.387 -1.519 1.00 25.00 C ATOM 1800 C GLU A 108 -8.827 -5.448 -2.303 1.00 25.00 C ATOM 1801 O GLU A 108 -8.781 -5.472 -3.533 1.00 25.00 O ATOM 1802 CB GLU A 108 -10.942 -5.560 -1.020 1.00 25.00 C ATOM 1803 CG GLU A 108 -12.072 -6.351 -0.379 1.00 25.00 C ATOM 1804 CD GLU A 108 -13.051 -5.432 0.357 1.00 25.00 C ATOM 1805 OE1 GLU A 108 -13.465 -4.397 -0.221 1.00 25.00 O ATOM 1806 OE2 GLU A 108 -13.362 -5.712 1.536 1.00 25.00 O ATOM 0 H GLU A 108 -9.400 -6.783 0.528 1.00 25.00 H new ATOM 0 HA GLU A 108 -10.095 -7.204 -2.148 1.00 25.00 H new ATOM 0 HB2 GLU A 108 -10.579 -4.830 -0.297 1.00 25.00 H new ATOM 0 HB3 GLU A 108 -11.348 -5.000 -1.862 1.00 25.00 H new ATOM 0 HG2 GLU A 108 -12.605 -6.913 -1.146 1.00 25.00 H new ATOM 0 HG3 GLU A 108 -11.658 -7.078 0.320 1.00 25.00 H new ATOM 1813 N ILE A 109 -8.100 -4.621 -1.571 1.00 25.00 N ATOM 1814 CA ILE A 109 -7.207 -3.624 -2.156 1.00 25.00 C ATOM 1815 C ILE A 109 -6.040 -4.324 -2.859 1.00 25.00 C ATOM 1816 O ILE A 109 -5.658 -3.951 -3.965 1.00 25.00 O ATOM 1817 CB ILE A 109 -6.701 -2.650 -1.038 1.00 25.00 C ATOM 1818 CG1 ILE A 109 -7.899 -1.854 -0.467 1.00 25.00 C ATOM 1819 CG2 ILE A 109 -5.641 -1.667 -1.574 1.00 25.00 C ATOM 1820 CD1 ILE A 109 -7.655 -1.242 0.920 1.00 25.00 C ATOM 0 H ILE A 109 -8.109 -4.619 -0.551 1.00 25.00 H new ATOM 0 HA ILE A 109 -7.745 -3.036 -2.900 1.00 25.00 H new ATOM 0 HB ILE A 109 -6.238 -3.250 -0.255 1.00 25.00 H new ATOM 0 HG12 ILE A 109 -8.152 -1.055 -1.163 1.00 25.00 H new ATOM 0 HG13 ILE A 109 -8.764 -2.515 -0.411 1.00 25.00 H new ATOM 0 HG21 ILE A 109 -5.315 -1.009 -0.769 1.00 25.00 H new ATOM 0 HG22 ILE A 109 -4.786 -2.226 -1.954 1.00 25.00 H new ATOM 0 HG23 ILE A 109 -6.072 -1.071 -2.379 1.00 25.00 H new ATOM 0 HD11 ILE A 109 -8.546 -0.703 1.242 1.00 25.00 H new ATOM 0 HD12 ILE A 109 -7.433 -2.035 1.634 1.00 25.00 H new ATOM 0 HD13 ILE A 109 -6.812 -0.553 0.870 1.00 25.00 H new ATOM 1832 N LEU A 110 -5.506 -5.369 -2.246 1.00 25.00 N ATOM 1833 CA LEU A 110 -4.395 -6.124 -2.828 1.00 25.00 C ATOM 1834 C LEU A 110 -4.806 -6.839 -4.109 1.00 25.00 C ATOM 1835 O LEU A 110 -4.045 -6.881 -5.066 1.00 25.00 O ATOM 1836 CB LEU A 110 -3.889 -7.159 -1.818 1.00 25.00 C ATOM 1837 CG LEU A 110 -2.680 -6.775 -0.948 1.00 25.00 C ATOM 1838 CD1 LEU A 110 -2.689 -5.328 -0.421 1.00 25.00 C ATOM 1839 CD2 LEU A 110 -2.602 -7.752 0.229 1.00 25.00 C ATOM 0 H LEU A 110 -5.822 -5.719 -1.341 1.00 25.00 H new ATOM 0 HA LEU A 110 -3.606 -5.413 -3.072 1.00 25.00 H new ATOM 0 HB2 LEU A 110 -4.715 -7.410 -1.153 1.00 25.00 H new ATOM 0 HB3 LEU A 110 -3.634 -8.066 -2.366 1.00 25.00 H new ATOM 0 HG LEU A 110 -1.803 -6.837 -1.593 1.00 25.00 H new ATOM 0 HD11 LEU A 110 -1.797 -5.154 0.181 1.00 25.00 H new ATOM 0 HD12 LEU A 110 -2.700 -4.635 -1.262 1.00 25.00 H new ATOM 0 HD13 LEU A 110 -3.576 -5.169 0.192 1.00 25.00 H new ATOM 0 HD21 LEU A 110 -1.750 -7.496 0.859 1.00 25.00 H new ATOM 0 HD22 LEU A 110 -3.518 -7.689 0.816 1.00 25.00 H new ATOM 0 HD23 LEU A 110 -2.482 -8.768 -0.148 1.00 25.00 H new ATOM 1851 N LYS A 111 -6.017 -7.380 -4.133 1.00 25.00 N ATOM 1852 CA LYS A 111 -6.527 -8.105 -5.307 1.00 25.00 C ATOM 1853 C LYS A 111 -6.866 -7.156 -6.452 1.00 25.00 C ATOM 1854 O LYS A 111 -6.901 -7.559 -7.606 1.00 25.00 O ATOM 1855 CB LYS A 111 -7.739 -8.930 -4.914 1.00 25.00 C ATOM 1856 CG LYS A 111 -7.339 -10.113 -4.046 1.00 25.00 C ATOM 1857 CD LYS A 111 -8.525 -10.677 -3.341 1.00 25.00 C ATOM 1858 CE LYS A 111 -8.076 -11.655 -2.259 1.00 25.00 C ATOM 1859 NZ LYS A 111 -9.180 -12.075 -1.328 1.00 25.00 N ATOM 0 H LYS A 111 -6.673 -7.334 -3.353 1.00 25.00 H new ATOM 0 HA LYS A 111 -5.741 -8.771 -5.664 1.00 25.00 H new ATOM 0 HB2 LYS A 111 -8.450 -8.304 -4.375 1.00 25.00 H new ATOM 0 HB3 LYS A 111 -8.245 -9.288 -5.811 1.00 25.00 H new ATOM 0 HG2 LYS A 111 -6.877 -10.883 -4.664 1.00 25.00 H new ATOM 0 HG3 LYS A 111 -6.592 -9.799 -3.317 1.00 25.00 H new ATOM 0 HD2 LYS A 111 -9.109 -9.872 -2.895 1.00 25.00 H new ATOM 0 HD3 LYS A 111 -9.174 -11.185 -4.054 1.00 25.00 H new ATOM 0 HE2 LYS A 111 -7.657 -12.542 -2.734 1.00 25.00 H new ATOM 0 HE3 LYS A 111 -7.276 -11.197 -1.677 1.00 25.00 H new ATOM 0 HZ1 LYS A 111 -8.815 -12.122 -0.355 1.00 25.00 H new ATOM 0 HZ2 LYS A 111 -9.955 -11.383 -1.374 1.00 25.00 H new ATOM 0 HZ3 LYS A 111 -9.535 -13.011 -1.610 1.00 25.00 H new