USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 839 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: F 83 GLN : amide:sc= -0.271 X(o=-13,f=-13) USER MOD Set 1.2: F 84 GLN : amide:sc= -12.5! C(o=-13!,f=-26!) USER MOD Set 1.3: F 87 GLN : amide:sc= -0.239 X(o=-13,f=-13) USER MOD Set 2.1: F 46 SER OG : rot -101:sc= -6.11! USER MOD Set 2.2: F 60 HIS : no HD1:sc= -5.71! C(o=-12!,f=-13!) USER MOD Set 3.1: F 26 ASN : amide:sc= -2.08! C(o=-3.3!,f=-3.9!) USER MOD Set 3.2: F 30 THR OG1 : rot 179:sc= -1.27! USER MOD Set 4.1: F 8 TYR OH : rot 54:sc= 0.703 USER MOD Set 4.2: F 43 TYR OH : rot -70:sc= -0.337! USER MOD Single : F 3 GLN : amide:sc= -0.342 X(o=-0.34,f=-0.28) USER MOD Single : F 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 20 GLN : amide:sc= -0.275 K(o=-0.28,f=-3.2!) USER MOD Single : F 23 SER OG : rot 180:sc= 0 USER MOD Single : F 36 SER OG : rot 134:sc= -1.82! USER MOD Single : F 38 THR OG1 : rot 180:sc= 0 USER MOD Single : F 39 THR OG1 : rot 130:sc= 0 USER MOD Single : F 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 44 SER OG : rot -90:sc= -1.03 USER MOD Single : F 53 MET CE :methyl 158:sc= -20.4! (180deg=-22.8!) USER MOD Single : F 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 57 HIS :FLIP no HE2:sc= -5.13! C(o=-7.1!,f=-5.1!) USER MOD Single : F 59 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.077) USER MOD Single : F 61 TYR OH : rot 180:sc= -0.504 USER MOD Single : F 62 LYS NZ :NH3+ 152:sc= -0.867 (180deg=-2.18!) USER MOD Single : F 65 LYS NZ :NH3+ -153:sc= -0.361 (180deg=-1.5!) USER MOD Single : F 68 ASN : amide:sc= 0 X(o=0,f=-0.0085) USER MOD Single : F 71 TYR OH : rot 180:sc= 0 USER MOD Single : F 72 TYR OH : rot 180:sc= 0 USER MOD Single : F 74 THR OG1 : rot -97:sc= 0.583 USER MOD Single : F 75 THR OG1 : rot 180:sc= 0 USER MOD Single : F 78 GLN :FLIP amide:sc= -2.4! C(o=-4.2!,f=-2.4!) USER MOD Single : F 81 THR OG1 : rot 180:sc= -0.486! USER MOD Single : F 88 HIS : no HD1:sc= -7.85! C(o=-7.9!,f=-9.5!) USER MOD Single : F 89 TYR OH : rot 180:sc= -0.0231 USER MOD Single : F 90 SER OG : rot 180:sc= -0.0506 USER MOD Single : F 97 SER OG : rot -132:sc= -1.14 USER MOD Single : F 98 SER OG : rot -20:sc= -3.69! USER MOD ----------------------------------------------------------------- ATOM 14 N ILE F 2 -6.495 -8.330 -23.047 1.00 0.00 N ATOM 15 CA ILE F 2 -6.983 -7.097 -22.363 1.00 0.00 C ATOM 16 C ILE F 2 -6.147 -5.898 -22.818 1.00 0.00 C ATOM 17 O ILE F 2 -5.364 -5.990 -23.742 1.00 0.00 O ATOM 18 CB ILE F 2 -6.864 -7.263 -20.844 1.00 0.00 C ATOM 19 CG1 ILE F 2 -5.551 -7.972 -20.500 1.00 0.00 C ATOM 20 CG2 ILE F 2 -8.039 -8.097 -20.330 1.00 0.00 C ATOM 21 CD1 ILE F 2 -5.310 -7.894 -18.990 1.00 0.00 C ATOM 0 HA ILE F 2 -8.029 -6.930 -22.622 1.00 0.00 H new ATOM 0 HB ILE F 2 -6.877 -6.280 -20.374 1.00 0.00 H new ATOM 0 HG12 ILE F 2 -5.593 -9.013 -20.819 1.00 0.00 H new ATOM 0 HG13 ILE F 2 -4.723 -7.508 -21.036 1.00 0.00 H new ATOM 0 HG21 ILE F 2 -7.956 -8.216 -19.250 1.00 0.00 H new ATOM 0 HG22 ILE F 2 -8.975 -7.592 -20.568 1.00 0.00 H new ATOM 0 HG23 ILE F 2 -8.024 -9.078 -20.805 1.00 0.00 H new ATOM 0 HD11 ILE F 2 -4.376 -8.398 -18.744 1.00 0.00 H new ATOM 0 HD12 ILE F 2 -5.250 -6.849 -18.685 1.00 0.00 H new ATOM 0 HD13 ILE F 2 -6.133 -8.379 -18.465 1.00 0.00 H new ATOM 33 N GLN F 3 -6.309 -4.772 -22.177 1.00 0.00 N ATOM 34 CA GLN F 3 -5.523 -3.568 -22.575 1.00 0.00 C ATOM 35 C GLN F 3 -4.170 -3.584 -21.867 1.00 0.00 C ATOM 36 O GLN F 3 -3.817 -2.659 -21.164 1.00 0.00 O ATOM 37 CB GLN F 3 -6.285 -2.303 -22.174 1.00 0.00 C ATOM 38 CG GLN F 3 -6.249 -1.299 -23.329 1.00 0.00 C ATOM 39 CD GLN F 3 -6.466 0.113 -22.782 1.00 0.00 C ATOM 40 OE1 GLN F 3 -7.513 0.698 -22.978 1.00 0.00 O ATOM 41 NE2 GLN F 3 -5.514 0.691 -22.102 1.00 0.00 N ATOM 0 H GLN F 3 -6.950 -4.633 -21.396 1.00 0.00 H new ATOM 0 HA GLN F 3 -5.372 -3.578 -23.654 1.00 0.00 H new ATOM 0 HB2 GLN F 3 -7.317 -2.551 -21.925 1.00 0.00 H new ATOM 0 HB3 GLN F 3 -5.838 -1.864 -21.282 1.00 0.00 H new ATOM 0 HG2 GLN F 3 -5.291 -1.357 -23.846 1.00 0.00 H new ATOM 0 HG3 GLN F 3 -7.021 -1.541 -24.060 1.00 0.00 H new ATOM 0 HE21 GLN F 3 -4.635 0.201 -21.937 1.00 0.00 H new ATOM 0 HE22 GLN F 3 -5.649 1.633 -21.735 1.00 0.00 H new ATOM 50 N ALA F 4 -3.407 -4.625 -22.044 1.00 0.00 N ATOM 51 CA ALA F 4 -2.079 -4.691 -21.378 1.00 0.00 C ATOM 52 C ALA F 4 -1.111 -3.731 -22.073 1.00 0.00 C ATOM 53 O ALA F 4 -0.558 -4.036 -23.111 1.00 0.00 O ATOM 54 CB ALA F 4 -1.532 -6.116 -21.465 1.00 0.00 C ATOM 0 H ALA F 4 -3.646 -5.432 -22.620 1.00 0.00 H new ATOM 0 HA ALA F 4 -2.185 -4.407 -20.331 1.00 0.00 H new ATOM 0 HB1 ALA F 4 -0.559 -6.163 -20.976 1.00 0.00 H new ATOM 0 HB2 ALA F 4 -2.220 -6.801 -20.969 1.00 0.00 H new ATOM 0 HB3 ALA F 4 -1.427 -6.402 -22.512 1.00 0.00 H new ATOM 60 N GLU F 5 -0.901 -2.573 -21.510 1.00 0.00 N ATOM 61 CA GLU F 5 0.032 -1.597 -22.142 1.00 0.00 C ATOM 62 C GLU F 5 -0.040 -0.257 -21.403 1.00 0.00 C ATOM 63 O GLU F 5 0.958 0.407 -21.206 1.00 0.00 O ATOM 64 CB GLU F 5 -0.361 -1.391 -23.606 1.00 0.00 C ATOM 65 CG GLU F 5 -1.881 -1.494 -23.747 1.00 0.00 C ATOM 66 CD GLU F 5 -2.324 -0.792 -25.033 1.00 0.00 C ATOM 67 OE1 GLU F 5 -1.654 0.146 -25.432 1.00 0.00 O ATOM 68 OE2 GLU F 5 -3.325 -1.205 -25.594 1.00 0.00 O ATOM 0 H GLU F 5 -1.334 -2.260 -20.641 1.00 0.00 H new ATOM 0 HA GLU F 5 1.049 -1.985 -22.087 1.00 0.00 H new ATOM 0 HB2 GLU F 5 -0.019 -0.416 -23.951 1.00 0.00 H new ATOM 0 HB3 GLU F 5 0.124 -2.139 -24.232 1.00 0.00 H new ATOM 0 HG2 GLU F 5 -2.185 -2.541 -23.768 1.00 0.00 H new ATOM 0 HG3 GLU F 5 -2.368 -1.038 -22.885 1.00 0.00 H new ATOM 75 N GLU F 6 -1.211 0.147 -20.994 1.00 0.00 N ATOM 76 CA GLU F 6 -1.341 1.446 -20.273 1.00 0.00 C ATOM 77 C GLU F 6 -1.522 1.189 -18.777 1.00 0.00 C ATOM 78 O GLU F 6 -0.654 1.473 -17.977 1.00 0.00 O ATOM 79 CB GLU F 6 -2.556 2.207 -20.809 1.00 0.00 C ATOM 80 CG GLU F 6 -2.398 2.423 -22.316 1.00 0.00 C ATOM 81 CD GLU F 6 -2.753 3.869 -22.665 1.00 0.00 C ATOM 82 OE1 GLU F 6 -2.270 4.757 -21.983 1.00 0.00 O ATOM 83 OE2 GLU F 6 -3.504 4.064 -23.607 1.00 0.00 O ATOM 0 H GLU F 6 -2.083 -0.365 -21.127 1.00 0.00 H new ATOM 0 HA GLU F 6 -0.440 2.038 -20.431 1.00 0.00 H new ATOM 0 HB2 GLU F 6 -3.469 1.647 -20.605 1.00 0.00 H new ATOM 0 HB3 GLU F 6 -2.651 3.167 -20.301 1.00 0.00 H new ATOM 0 HG2 GLU F 6 -1.374 2.205 -22.620 1.00 0.00 H new ATOM 0 HG3 GLU F 6 -3.045 1.737 -22.862 1.00 0.00 H new ATOM 90 N TRP F 7 -2.645 0.652 -18.398 1.00 0.00 N ATOM 91 CA TRP F 7 -2.892 0.370 -16.961 1.00 0.00 C ATOM 92 C TRP F 7 -2.438 -1.055 -16.641 1.00 0.00 C ATOM 93 O TRP F 7 -2.645 -1.543 -15.553 1.00 0.00 O ATOM 94 CB TRP F 7 -4.388 0.505 -16.666 1.00 0.00 C ATOM 95 CG TRP F 7 -5.167 -0.218 -17.716 1.00 0.00 C ATOM 96 CD1 TRP F 7 -5.793 0.366 -18.762 1.00 0.00 C ATOM 97 CD2 TRP F 7 -5.411 -1.648 -17.838 1.00 0.00 C ATOM 98 NE1 TRP F 7 -6.408 -0.615 -19.519 1.00 0.00 N ATOM 99 CE2 TRP F 7 -6.201 -1.873 -18.990 1.00 0.00 C ATOM 100 CE3 TRP F 7 -5.028 -2.760 -17.068 1.00 0.00 C ATOM 101 CZ2 TRP F 7 -6.597 -3.158 -19.363 1.00 0.00 C ATOM 102 CZ3 TRP F 7 -5.424 -4.054 -17.442 1.00 0.00 C ATOM 103 CH2 TRP F 7 -6.208 -4.253 -18.587 1.00 0.00 C ATOM 0 H TRP F 7 -3.406 0.395 -19.026 1.00 0.00 H new ATOM 0 HA TRP F 7 -2.335 1.078 -16.348 1.00 0.00 H new ATOM 0 HB2 TRP F 7 -4.615 0.095 -15.682 1.00 0.00 H new ATOM 0 HB3 TRP F 7 -4.673 1.557 -16.646 1.00 0.00 H new ATOM 0 HD1 TRP F 7 -5.810 1.425 -18.972 1.00 0.00 H new ATOM 0 HE1 TRP F 7 -6.948 -0.431 -20.364 1.00 0.00 H new ATOM 0 HE3 TRP F 7 -4.425 -2.618 -16.183 1.00 0.00 H new ATOM 0 HZ2 TRP F 7 -7.201 -3.305 -20.246 1.00 0.00 H new ATOM 0 HZ3 TRP F 7 -5.123 -4.901 -16.844 1.00 0.00 H new ATOM 0 HH2 TRP F 7 -6.511 -5.251 -18.869 1.00 0.00 H new ATOM 114 N TYR F 8 -1.831 -1.726 -17.590 1.00 0.00 N ATOM 115 CA TYR F 8 -1.366 -3.124 -17.359 1.00 0.00 C ATOM 116 C TYR F 8 -0.217 -3.433 -18.320 1.00 0.00 C ATOM 117 O TYR F 8 -0.412 -3.785 -19.464 1.00 0.00 O ATOM 118 CB TYR F 8 -2.552 -4.062 -17.565 1.00 0.00 C ATOM 119 CG TYR F 8 -2.097 -5.469 -17.859 1.00 0.00 C ATOM 120 CD1 TYR F 8 -0.994 -6.006 -17.190 1.00 0.00 C ATOM 121 CD2 TYR F 8 -2.795 -6.241 -18.796 1.00 0.00 C ATOM 122 CE1 TYR F 8 -0.587 -7.316 -17.462 1.00 0.00 C ATOM 123 CE2 TYR F 8 -2.386 -7.549 -19.069 1.00 0.00 C ATOM 124 CZ TYR F 8 -1.281 -8.086 -18.402 1.00 0.00 C ATOM 125 OH TYR F 8 -0.876 -9.379 -18.669 1.00 0.00 O ATOM 0 H TYR F 8 -1.638 -1.359 -18.522 1.00 0.00 H new ATOM 0 HA TYR F 8 -0.993 -3.258 -16.344 1.00 0.00 H new ATOM 0 HB2 TYR F 8 -3.179 -4.060 -16.673 1.00 0.00 H new ATOM 0 HB3 TYR F 8 -3.167 -3.698 -18.388 1.00 0.00 H new ATOM 0 HD1 TYR F 8 -0.458 -5.411 -16.465 1.00 0.00 H new ATOM 0 HD2 TYR F 8 -3.650 -5.825 -19.308 1.00 0.00 H new ATOM 0 HE1 TYR F 8 0.264 -7.734 -16.946 1.00 0.00 H new ATOM 0 HE2 TYR F 8 -2.922 -8.144 -19.794 1.00 0.00 H new ATOM 0 HH TYR F 8 -0.825 -9.885 -17.832 1.00 0.00 H new ATOM 135 N PHE F 9 0.988 -3.266 -17.847 1.00 0.00 N ATOM 136 CA PHE F 9 2.190 -3.500 -18.696 1.00 0.00 C ATOM 137 C PHE F 9 2.362 -4.985 -19.019 1.00 0.00 C ATOM 138 O PHE F 9 2.824 -5.342 -20.085 1.00 0.00 O ATOM 139 CB PHE F 9 3.423 -3.001 -17.940 1.00 0.00 C ATOM 140 CG PHE F 9 3.584 -1.517 -18.177 1.00 0.00 C ATOM 141 CD1 PHE F 9 2.453 -0.717 -18.399 1.00 0.00 C ATOM 142 CD2 PHE F 9 4.860 -0.937 -18.174 1.00 0.00 C ATOM 143 CE1 PHE F 9 2.601 0.659 -18.617 1.00 0.00 C ATOM 144 CE2 PHE F 9 5.006 0.438 -18.394 1.00 0.00 C ATOM 145 CZ PHE F 9 3.876 1.234 -18.615 1.00 0.00 C ATOM 0 H PHE F 9 1.193 -2.972 -16.892 1.00 0.00 H new ATOM 0 HA PHE F 9 2.067 -2.962 -19.636 1.00 0.00 H new ATOM 0 HB2 PHE F 9 3.317 -3.202 -16.874 1.00 0.00 H new ATOM 0 HB3 PHE F 9 4.312 -3.534 -18.278 1.00 0.00 H new ATOM 0 HD1 PHE F 9 1.469 -1.162 -18.402 1.00 0.00 H new ATOM 0 HD2 PHE F 9 5.731 -1.551 -18.002 1.00 0.00 H new ATOM 0 HE1 PHE F 9 1.731 1.276 -18.787 1.00 0.00 H new ATOM 0 HE2 PHE F 9 5.990 0.884 -18.393 1.00 0.00 H new ATOM 0 HZ PHE F 9 3.989 2.295 -18.784 1.00 0.00 H new ATOM 155 N GLY F 10 2.009 -5.855 -18.119 1.00 0.00 N ATOM 156 CA GLY F 10 2.179 -7.309 -18.405 1.00 0.00 C ATOM 157 C GLY F 10 2.620 -8.041 -17.138 1.00 0.00 C ATOM 158 O GLY F 10 2.134 -7.788 -16.054 1.00 0.00 O ATOM 0 H GLY F 10 1.614 -5.629 -17.206 1.00 0.00 H new ATOM 0 HA2 GLY F 10 1.242 -7.729 -18.770 1.00 0.00 H new ATOM 0 HA3 GLY F 10 2.919 -7.449 -19.193 1.00 0.00 H new ATOM 162 N LYS F 11 3.550 -8.942 -17.269 1.00 0.00 N ATOM 163 CA LYS F 11 4.039 -9.691 -16.084 1.00 0.00 C ATOM 164 C LYS F 11 5.482 -9.281 -15.821 1.00 0.00 C ATOM 165 O LYS F 11 6.411 -10.026 -16.062 1.00 0.00 O ATOM 166 CB LYS F 11 3.968 -11.195 -16.356 1.00 0.00 C ATOM 167 CG LYS F 11 2.715 -11.506 -17.177 1.00 0.00 C ATOM 168 CD LYS F 11 3.121 -11.886 -18.602 1.00 0.00 C ATOM 169 CE LYS F 11 2.144 -11.253 -19.596 1.00 0.00 C ATOM 170 NZ LYS F 11 1.516 -12.321 -20.425 1.00 0.00 N ATOM 0 H LYS F 11 3.995 -9.193 -18.152 1.00 0.00 H new ATOM 0 HA LYS F 11 3.421 -9.465 -15.215 1.00 0.00 H new ATOM 0 HB2 LYS F 11 4.858 -11.521 -16.894 1.00 0.00 H new ATOM 0 HB3 LYS F 11 3.945 -11.745 -15.415 1.00 0.00 H new ATOM 0 HG2 LYS F 11 2.158 -12.322 -16.716 1.00 0.00 H new ATOM 0 HG3 LYS F 11 2.054 -10.639 -17.194 1.00 0.00 H new ATOM 0 HD2 LYS F 11 4.136 -11.545 -18.806 1.00 0.00 H new ATOM 0 HD3 LYS F 11 3.120 -12.970 -18.715 1.00 0.00 H new ATOM 0 HE2 LYS F 11 1.376 -10.694 -19.061 1.00 0.00 H new ATOM 0 HE3 LYS F 11 2.668 -10.543 -20.235 1.00 0.00 H new ATOM 0 HZ1 LYS F 11 0.852 -11.891 -21.100 1.00 0.00 H new ATOM 0 HZ2 LYS F 11 2.255 -12.836 -20.946 1.00 0.00 H new ATOM 0 HZ3 LYS F 11 1.002 -12.982 -19.808 1.00 0.00 H new ATOM 184 N LEU F 12 5.673 -8.087 -15.348 1.00 0.00 N ATOM 185 CA LEU F 12 7.054 -7.598 -15.086 1.00 0.00 C ATOM 186 C LEU F 12 7.292 -7.515 -13.572 1.00 0.00 C ATOM 187 O LEU F 12 6.489 -7.976 -12.785 1.00 0.00 O ATOM 188 CB LEU F 12 7.224 -6.231 -15.796 1.00 0.00 C ATOM 189 CG LEU F 12 7.274 -5.041 -14.821 1.00 0.00 C ATOM 190 CD1 LEU F 12 7.105 -3.737 -15.606 1.00 0.00 C ATOM 191 CD2 LEU F 12 6.162 -5.126 -13.789 1.00 0.00 C ATOM 0 H LEU F 12 4.930 -7.423 -15.130 1.00 0.00 H new ATOM 0 HA LEU F 12 7.802 -8.284 -15.483 1.00 0.00 H new ATOM 0 HB2 LEU F 12 8.140 -6.247 -16.386 1.00 0.00 H new ATOM 0 HB3 LEU F 12 6.399 -6.086 -16.493 1.00 0.00 H new ATOM 0 HG LEU F 12 8.235 -5.066 -14.308 1.00 0.00 H new ATOM 0 HD11 LEU F 12 7.140 -2.892 -14.919 1.00 0.00 H new ATOM 0 HD12 LEU F 12 7.909 -3.645 -16.336 1.00 0.00 H new ATOM 0 HD13 LEU F 12 6.145 -3.745 -16.123 1.00 0.00 H new ATOM 0 HD21 LEU F 12 6.225 -4.271 -13.115 1.00 0.00 H new ATOM 0 HD22 LEU F 12 5.196 -5.120 -14.294 1.00 0.00 H new ATOM 0 HD23 LEU F 12 6.267 -6.048 -13.217 1.00 0.00 H new ATOM 203 N GLY F 13 8.379 -6.929 -13.158 1.00 0.00 N ATOM 204 CA GLY F 13 8.652 -6.818 -11.697 1.00 0.00 C ATOM 205 C GLY F 13 8.299 -5.404 -11.219 1.00 0.00 C ATOM 206 O GLY F 13 8.321 -4.459 -11.981 1.00 0.00 O ATOM 0 H GLY F 13 9.090 -6.522 -13.766 1.00 0.00 H new ATOM 0 HA2 GLY F 13 8.066 -7.556 -11.149 1.00 0.00 H new ATOM 0 HA3 GLY F 13 9.702 -7.031 -11.495 1.00 0.00 H new ATOM 210 N ARG F 14 7.976 -5.250 -9.966 1.00 0.00 N ATOM 211 CA ARG F 14 7.630 -3.894 -9.450 1.00 0.00 C ATOM 212 C ARG F 14 8.831 -2.970 -9.633 1.00 0.00 C ATOM 213 O ARG F 14 8.706 -1.761 -9.694 1.00 0.00 O ATOM 214 CB ARG F 14 7.291 -3.990 -7.964 1.00 0.00 C ATOM 215 CG ARG F 14 8.559 -4.320 -7.173 1.00 0.00 C ATOM 216 CD ARG F 14 8.931 -3.131 -6.286 1.00 0.00 C ATOM 217 NE ARG F 14 9.339 -3.623 -4.940 1.00 0.00 N ATOM 218 CZ ARG F 14 10.254 -2.987 -4.262 1.00 0.00 C ATOM 219 NH1 ARG F 14 10.520 -1.739 -4.536 1.00 0.00 N ATOM 220 NH2 ARG F 14 10.903 -3.598 -3.309 1.00 0.00 N ATOM 0 H ARG F 14 7.936 -6.001 -9.277 1.00 0.00 H new ATOM 0 HA ARG F 14 6.773 -3.500 -9.996 1.00 0.00 H new ATOM 0 HB2 ARG F 14 6.866 -3.049 -7.615 1.00 0.00 H new ATOM 0 HB3 ARG F 14 6.537 -4.760 -7.801 1.00 0.00 H new ATOM 0 HG2 ARG F 14 8.398 -5.207 -6.561 1.00 0.00 H new ATOM 0 HG3 ARG F 14 9.377 -4.548 -7.856 1.00 0.00 H new ATOM 0 HD2 ARG F 14 9.745 -2.566 -6.740 1.00 0.00 H new ATOM 0 HD3 ARG F 14 8.083 -2.452 -6.195 1.00 0.00 H new ATOM 0 HE ARG F 14 8.903 -4.458 -4.549 1.00 0.00 H new ATOM 0 HH11 ARG F 14 10.012 -1.261 -5.280 1.00 0.00 H new ATOM 0 HH12 ARG F 14 11.236 -1.242 -4.006 1.00 0.00 H new ATOM 0 HH21 ARG F 14 10.695 -4.573 -3.094 1.00 0.00 H new ATOM 0 HH22 ARG F 14 11.618 -3.100 -2.779 1.00 0.00 H new ATOM 234 N LYS F 15 9.996 -3.540 -9.732 1.00 0.00 N ATOM 235 CA LYS F 15 11.213 -2.725 -9.917 1.00 0.00 C ATOM 236 C LYS F 15 11.229 -2.216 -11.346 1.00 0.00 C ATOM 237 O LYS F 15 11.743 -1.154 -11.644 1.00 0.00 O ATOM 238 CB LYS F 15 12.450 -3.590 -9.671 1.00 0.00 C ATOM 239 CG LYS F 15 13.700 -2.709 -9.684 1.00 0.00 C ATOM 240 CD LYS F 15 14.713 -3.246 -8.670 1.00 0.00 C ATOM 241 CE LYS F 15 14.983 -4.725 -8.954 1.00 0.00 C ATOM 242 NZ LYS F 15 16.192 -5.163 -8.199 1.00 0.00 N ATOM 0 H LYS F 15 10.153 -4.547 -9.692 1.00 0.00 H new ATOM 0 HA LYS F 15 11.218 -1.890 -9.217 1.00 0.00 H new ATOM 0 HB2 LYS F 15 12.364 -4.103 -8.713 1.00 0.00 H new ATOM 0 HB3 LYS F 15 12.527 -4.360 -10.439 1.00 0.00 H new ATOM 0 HG2 LYS F 15 14.139 -2.697 -10.682 1.00 0.00 H new ATOM 0 HG3 LYS F 15 13.435 -1.680 -9.440 1.00 0.00 H new ATOM 0 HD2 LYS F 15 15.641 -2.678 -8.731 1.00 0.00 H new ATOM 0 HD3 LYS F 15 14.330 -3.123 -7.657 1.00 0.00 H new ATOM 0 HE2 LYS F 15 14.121 -5.326 -8.662 1.00 0.00 H new ATOM 0 HE3 LYS F 15 15.132 -4.880 -10.023 1.00 0.00 H new ATOM 0 HZ1 LYS F 15 16.376 -6.168 -8.392 1.00 0.00 H new ATOM 0 HZ2 LYS F 15 17.012 -4.597 -8.498 1.00 0.00 H new ATOM 0 HZ3 LYS F 15 16.032 -5.029 -7.180 1.00 0.00 H new ATOM 256 N ASP F 16 10.652 -2.969 -12.235 1.00 0.00 N ATOM 257 CA ASP F 16 10.607 -2.558 -13.634 1.00 0.00 C ATOM 258 C ASP F 16 9.549 -1.471 -13.779 1.00 0.00 C ATOM 259 O ASP F 16 9.561 -0.689 -14.705 1.00 0.00 O ATOM 260 CB ASP F 16 10.203 -3.761 -14.454 1.00 0.00 C ATOM 261 CG ASP F 16 11.026 -3.822 -15.742 1.00 0.00 C ATOM 262 OD1 ASP F 16 11.681 -2.839 -16.049 1.00 0.00 O ATOM 263 OD2 ASP F 16 10.988 -4.849 -16.399 1.00 0.00 O ATOM 0 H ASP F 16 10.206 -3.864 -12.034 1.00 0.00 H new ATOM 0 HA ASP F 16 11.573 -2.180 -13.967 1.00 0.00 H new ATOM 0 HB2 ASP F 16 10.352 -4.672 -13.875 1.00 0.00 H new ATOM 0 HB3 ASP F 16 9.141 -3.707 -14.694 1.00 0.00 H new ATOM 268 N ALA F 17 8.624 -1.433 -12.859 1.00 0.00 N ATOM 269 CA ALA F 17 7.549 -0.408 -12.917 1.00 0.00 C ATOM 270 C ALA F 17 8.109 0.932 -12.452 1.00 0.00 C ATOM 271 O ALA F 17 7.752 1.975 -12.959 1.00 0.00 O ATOM 272 CB ALA F 17 6.391 -0.835 -12.016 1.00 0.00 C ATOM 0 H ALA F 17 8.568 -2.072 -12.066 1.00 0.00 H new ATOM 0 HA ALA F 17 7.185 -0.309 -13.940 1.00 0.00 H new ATOM 0 HB1 ALA F 17 5.602 -0.084 -12.057 1.00 0.00 H new ATOM 0 HB2 ALA F 17 5.999 -1.793 -12.357 1.00 0.00 H new ATOM 0 HB3 ALA F 17 6.745 -0.933 -10.990 1.00 0.00 H new ATOM 278 N GLU F 18 8.996 0.917 -11.501 1.00 0.00 N ATOM 279 CA GLU F 18 9.585 2.199 -11.025 1.00 0.00 C ATOM 280 C GLU F 18 10.589 2.697 -12.063 1.00 0.00 C ATOM 281 O GLU F 18 10.798 3.883 -12.230 1.00 0.00 O ATOM 282 CB GLU F 18 10.299 1.973 -9.689 1.00 0.00 C ATOM 283 CG GLU F 18 11.345 0.869 -9.851 1.00 0.00 C ATOM 284 CD GLU F 18 12.414 1.016 -8.766 1.00 0.00 C ATOM 285 OE1 GLU F 18 13.166 1.976 -8.830 1.00 0.00 O ATOM 286 OE2 GLU F 18 12.464 0.168 -7.892 1.00 0.00 O ATOM 0 H GLU F 18 9.339 0.078 -11.033 1.00 0.00 H new ATOM 0 HA GLU F 18 8.796 2.939 -10.887 1.00 0.00 H new ATOM 0 HB2 GLU F 18 10.776 2.896 -9.359 1.00 0.00 H new ATOM 0 HB3 GLU F 18 9.577 1.695 -8.921 1.00 0.00 H new ATOM 0 HG2 GLU F 18 10.871 -0.110 -9.779 1.00 0.00 H new ATOM 0 HG3 GLU F 18 11.803 0.929 -10.838 1.00 0.00 H new ATOM 293 N ARG F 19 11.212 1.792 -12.765 1.00 0.00 N ATOM 294 CA ARG F 19 12.212 2.196 -13.796 1.00 0.00 C ATOM 295 C ARG F 19 11.496 2.693 -15.054 1.00 0.00 C ATOM 296 O ARG F 19 11.899 3.661 -15.668 1.00 0.00 O ATOM 297 CB ARG F 19 13.087 0.993 -14.153 1.00 0.00 C ATOM 298 CG ARG F 19 14.124 1.409 -15.199 1.00 0.00 C ATOM 299 CD ARG F 19 15.466 0.749 -14.878 1.00 0.00 C ATOM 300 NE ARG F 19 16.570 1.548 -15.479 1.00 0.00 N ATOM 301 CZ ARG F 19 17.780 1.450 -15.004 1.00 0.00 C ATOM 302 NH1 ARG F 19 18.147 0.369 -14.370 1.00 0.00 N ATOM 303 NH2 ARG F 19 18.626 2.432 -15.161 1.00 0.00 N ATOM 0 H ARG F 19 11.072 0.786 -12.670 1.00 0.00 H new ATOM 0 HA ARG F 19 12.832 2.998 -13.397 1.00 0.00 H new ATOM 0 HB2 ARG F 19 13.586 0.615 -13.261 1.00 0.00 H new ATOM 0 HB3 ARG F 19 12.469 0.183 -14.540 1.00 0.00 H new ATOM 0 HG2 ARG F 19 13.791 1.114 -16.194 1.00 0.00 H new ATOM 0 HG3 ARG F 19 14.233 2.494 -15.207 1.00 0.00 H new ATOM 0 HD2 ARG F 19 15.600 0.679 -13.798 1.00 0.00 H new ATOM 0 HD3 ARG F 19 15.485 -0.269 -15.268 1.00 0.00 H new ATOM 0 HE ARG F 19 16.379 2.172 -16.263 1.00 0.00 H new ATOM 0 HH11 ARG F 19 17.487 -0.399 -14.246 1.00 0.00 H new ATOM 0 HH12 ARG F 19 19.094 0.292 -13.998 1.00 0.00 H new ATOM 0 HH21 ARG F 19 18.340 3.277 -15.656 1.00 0.00 H new ATOM 0 HH22 ARG F 19 19.572 2.354 -14.789 1.00 0.00 H new ATOM 317 N GLN F 20 10.436 2.042 -15.438 1.00 0.00 N ATOM 318 CA GLN F 20 9.692 2.476 -16.653 1.00 0.00 C ATOM 319 C GLN F 20 8.893 3.734 -16.322 1.00 0.00 C ATOM 320 O GLN F 20 9.051 4.767 -16.942 1.00 0.00 O ATOM 321 CB GLN F 20 8.739 1.362 -17.098 1.00 0.00 C ATOM 322 CG GLN F 20 9.488 0.380 -18.001 1.00 0.00 C ATOM 323 CD GLN F 20 9.138 0.663 -19.463 1.00 0.00 C ATOM 324 OE1 GLN F 20 8.020 1.023 -19.774 1.00 0.00 O ATOM 325 NE2 GLN F 20 10.054 0.516 -20.381 1.00 0.00 N ATOM 0 H GLN F 20 10.051 1.226 -14.962 1.00 0.00 H new ATOM 0 HA GLN F 20 10.394 2.687 -17.460 1.00 0.00 H new ATOM 0 HB2 GLN F 20 8.340 0.841 -16.228 1.00 0.00 H new ATOM 0 HB3 GLN F 20 7.889 1.788 -17.632 1.00 0.00 H new ATOM 0 HG2 GLN F 20 10.563 0.476 -17.848 1.00 0.00 H new ATOM 0 HG3 GLN F 20 9.220 -0.645 -17.743 1.00 0.00 H new ATOM 0 HE21 GLN F 20 10.993 0.214 -20.121 1.00 0.00 H new ATOM 0 HE22 GLN F 20 9.831 0.703 -21.359 1.00 0.00 H new ATOM 334 N LEU F 21 8.041 3.657 -15.340 1.00 0.00 N ATOM 335 CA LEU F 21 7.235 4.845 -14.957 1.00 0.00 C ATOM 336 C LEU F 21 8.160 6.051 -14.790 1.00 0.00 C ATOM 337 O LEU F 21 8.051 7.031 -15.501 1.00 0.00 O ATOM 338 CB LEU F 21 6.507 4.558 -13.640 1.00 0.00 C ATOM 339 CG LEU F 21 5.470 3.450 -13.855 1.00 0.00 C ATOM 340 CD1 LEU F 21 4.492 3.433 -12.678 1.00 0.00 C ATOM 341 CD2 LEU F 21 4.697 3.707 -15.151 1.00 0.00 C ATOM 0 H LEU F 21 7.868 2.819 -14.785 1.00 0.00 H new ATOM 0 HA LEU F 21 6.501 5.061 -15.733 1.00 0.00 H new ATOM 0 HB2 LEU F 21 7.223 4.256 -12.876 1.00 0.00 H new ATOM 0 HB3 LEU F 21 6.018 5.463 -13.279 1.00 0.00 H new ATOM 0 HG LEU F 21 5.980 2.489 -13.923 1.00 0.00 H new ATOM 0 HD11 LEU F 21 3.754 2.645 -12.830 1.00 0.00 H new ATOM 0 HD12 LEU F 21 5.038 3.245 -11.754 1.00 0.00 H new ATOM 0 HD13 LEU F 21 3.986 4.396 -12.611 1.00 0.00 H new ATOM 0 HD21 LEU F 21 3.961 2.916 -15.299 1.00 0.00 H new ATOM 0 HD22 LEU F 21 4.188 4.669 -15.086 1.00 0.00 H new ATOM 0 HD23 LEU F 21 5.390 3.719 -15.992 1.00 0.00 H new ATOM 353 N LEU F 22 9.070 5.989 -13.860 1.00 0.00 N ATOM 354 CA LEU F 22 10.001 7.134 -13.656 1.00 0.00 C ATOM 355 C LEU F 22 10.729 7.440 -14.967 1.00 0.00 C ATOM 356 O LEU F 22 10.941 8.584 -15.317 1.00 0.00 O ATOM 357 CB LEU F 22 11.025 6.776 -12.575 1.00 0.00 C ATOM 358 CG LEU F 22 10.300 6.473 -11.260 1.00 0.00 C ATOM 359 CD1 LEU F 22 11.306 6.500 -10.107 1.00 0.00 C ATOM 360 CD2 LEU F 22 9.218 7.527 -11.015 1.00 0.00 C ATOM 0 H LEU F 22 9.210 5.197 -13.233 1.00 0.00 H new ATOM 0 HA LEU F 22 9.434 8.010 -13.342 1.00 0.00 H new ATOM 0 HB2 LEU F 22 11.610 5.911 -12.887 1.00 0.00 H new ATOM 0 HB3 LEU F 22 11.724 7.600 -12.435 1.00 0.00 H new ATOM 0 HG LEU F 22 9.838 5.487 -11.320 1.00 0.00 H new ATOM 0 HD11 LEU F 22 10.792 6.285 -9.170 1.00 0.00 H new ATOM 0 HD12 LEU F 22 12.077 5.749 -10.279 1.00 0.00 H new ATOM 0 HD13 LEU F 22 11.767 7.486 -10.049 1.00 0.00 H new ATOM 0 HD21 LEU F 22 8.703 7.309 -10.079 1.00 0.00 H new ATOM 0 HD22 LEU F 22 9.678 8.513 -10.956 1.00 0.00 H new ATOM 0 HD23 LEU F 22 8.501 7.510 -11.836 1.00 0.00 H new ATOM 372 N SER F 23 11.112 6.428 -15.696 1.00 0.00 N ATOM 373 CA SER F 23 11.823 6.666 -16.983 1.00 0.00 C ATOM 374 C SER F 23 11.075 7.729 -17.789 1.00 0.00 C ATOM 375 O SER F 23 9.862 7.720 -17.871 1.00 0.00 O ATOM 376 CB SER F 23 11.879 5.363 -17.784 1.00 0.00 C ATOM 377 OG SER F 23 11.708 5.647 -19.164 1.00 0.00 O ATOM 0 H SER F 23 10.963 5.448 -15.456 1.00 0.00 H new ATOM 0 HA SER F 23 12.837 7.011 -16.780 1.00 0.00 H new ATOM 0 HB2 SER F 23 12.834 4.864 -17.620 1.00 0.00 H new ATOM 0 HB3 SER F 23 11.100 4.681 -17.443 1.00 0.00 H new ATOM 0 HG SER F 23 11.745 4.813 -19.677 1.00 0.00 H new ATOM 383 N PHE F 24 11.786 8.647 -18.384 1.00 0.00 N ATOM 384 CA PHE F 24 11.115 9.710 -19.183 1.00 0.00 C ATOM 385 C PHE F 24 10.018 9.083 -20.047 1.00 0.00 C ATOM 386 O PHE F 24 10.236 8.100 -20.726 1.00 0.00 O ATOM 387 CB PHE F 24 12.143 10.398 -20.083 1.00 0.00 C ATOM 388 CG PHE F 24 12.829 11.501 -19.313 1.00 0.00 C ATOM 389 CD1 PHE F 24 13.650 11.187 -18.223 1.00 0.00 C ATOM 390 CD2 PHE F 24 12.644 12.837 -19.689 1.00 0.00 C ATOM 391 CE1 PHE F 24 14.286 12.210 -17.508 1.00 0.00 C ATOM 392 CE2 PHE F 24 13.280 13.859 -18.974 1.00 0.00 C ATOM 393 CZ PHE F 24 14.101 13.546 -17.884 1.00 0.00 C ATOM 0 H PHE F 24 12.804 8.707 -18.351 1.00 0.00 H new ATOM 0 HA PHE F 24 10.672 10.445 -18.511 1.00 0.00 H new ATOM 0 HB2 PHE F 24 12.878 9.673 -20.433 1.00 0.00 H new ATOM 0 HB3 PHE F 24 11.653 10.807 -20.966 1.00 0.00 H new ATOM 0 HD1 PHE F 24 13.793 10.156 -17.934 1.00 0.00 H new ATOM 0 HD2 PHE F 24 12.011 13.079 -20.530 1.00 0.00 H new ATOM 0 HE1 PHE F 24 14.919 11.968 -16.667 1.00 0.00 H new ATOM 0 HE2 PHE F 24 13.137 14.890 -19.264 1.00 0.00 H new ATOM 0 HZ PHE F 24 14.592 14.335 -17.333 1.00 0.00 H new ATOM 403 N GLY F 25 8.841 9.645 -20.027 1.00 0.00 N ATOM 404 CA GLY F 25 7.732 9.082 -20.846 1.00 0.00 C ATOM 405 C GLY F 25 6.403 9.686 -20.391 1.00 0.00 C ATOM 406 O GLY F 25 5.942 10.674 -20.927 1.00 0.00 O ATOM 0 H GLY F 25 8.600 10.470 -19.478 1.00 0.00 H new ATOM 0 HA2 GLY F 25 7.899 9.298 -21.901 1.00 0.00 H new ATOM 0 HA3 GLY F 25 7.705 7.997 -20.743 1.00 0.00 H new ATOM 410 N ASN F 26 5.783 9.099 -19.404 1.00 0.00 N ATOM 411 CA ASN F 26 4.483 9.639 -18.915 1.00 0.00 C ATOM 412 C ASN F 26 4.681 10.270 -17.533 1.00 0.00 C ATOM 413 O ASN F 26 5.524 9.839 -16.771 1.00 0.00 O ATOM 414 CB ASN F 26 3.465 8.501 -18.815 1.00 0.00 C ATOM 415 CG ASN F 26 4.164 7.231 -18.329 1.00 0.00 C ATOM 416 OD1 ASN F 26 4.295 7.011 -17.141 1.00 0.00 O ATOM 417 ND2 ASN F 26 4.624 6.378 -19.204 1.00 0.00 N ATOM 0 H ASN F 26 6.120 8.270 -18.916 1.00 0.00 H new ATOM 0 HA ASN F 26 4.117 10.394 -19.610 1.00 0.00 H new ATOM 0 HB2 ASN F 26 2.665 8.774 -18.127 1.00 0.00 H new ATOM 0 HB3 ASN F 26 3.004 8.325 -19.787 1.00 0.00 H new ATOM 0 HD21 ASN F 26 5.093 5.528 -18.890 1.00 0.00 H new ATOM 0 HD22 ASN F 26 4.515 6.561 -20.201 1.00 0.00 H new ATOM 424 N PRO F 27 3.892 11.276 -17.253 1.00 0.00 N ATOM 425 CA PRO F 27 3.949 11.998 -15.970 1.00 0.00 C ATOM 426 C PRO F 27 3.245 11.195 -14.871 1.00 0.00 C ATOM 427 O PRO F 27 2.962 10.024 -15.029 1.00 0.00 O ATOM 428 CB PRO F 27 3.201 13.301 -16.258 1.00 0.00 C ATOM 429 CG PRO F 27 2.284 13.018 -17.473 1.00 0.00 C ATOM 430 CD PRO F 27 2.872 11.788 -18.192 1.00 0.00 C ATOM 0 HA PRO F 27 4.967 12.165 -15.617 1.00 0.00 H new ATOM 0 HB2 PRO F 27 2.615 13.612 -15.393 1.00 0.00 H new ATOM 0 HB3 PRO F 27 3.899 14.109 -16.478 1.00 0.00 H new ATOM 0 HG2 PRO F 27 1.261 12.825 -17.150 1.00 0.00 H new ATOM 0 HG3 PRO F 27 2.250 13.878 -18.142 1.00 0.00 H new ATOM 0 HD2 PRO F 27 2.105 11.040 -18.395 1.00 0.00 H new ATOM 0 HD3 PRO F 27 3.313 12.060 -19.151 1.00 0.00 H new ATOM 438 N ARG F 28 2.962 11.817 -13.759 1.00 0.00 N ATOM 439 CA ARG F 28 2.278 11.092 -12.652 1.00 0.00 C ATOM 440 C ARG F 28 0.852 10.736 -13.078 1.00 0.00 C ATOM 441 O ARG F 28 0.348 11.232 -14.066 1.00 0.00 O ATOM 442 CB ARG F 28 2.228 11.988 -11.413 1.00 0.00 C ATOM 443 CG ARG F 28 1.556 13.315 -11.770 1.00 0.00 C ATOM 444 CD ARG F 28 2.370 14.473 -11.188 1.00 0.00 C ATOM 445 NE ARG F 28 2.077 15.719 -11.951 1.00 0.00 N ATOM 446 CZ ARG F 28 1.533 16.740 -11.348 1.00 0.00 C ATOM 447 NH1 ARG F 28 2.286 17.626 -10.755 1.00 0.00 N ATOM 448 NH2 ARG F 28 0.234 16.875 -11.339 1.00 0.00 N ATOM 0 H ARG F 28 3.175 12.796 -13.570 1.00 0.00 H new ATOM 0 HA ARG F 28 2.827 10.179 -12.422 1.00 0.00 H new ATOM 0 HB2 ARG F 28 1.676 11.492 -10.614 1.00 0.00 H new ATOM 0 HB3 ARG F 28 3.236 12.168 -11.040 1.00 0.00 H new ATOM 0 HG2 ARG F 28 1.481 13.417 -12.853 1.00 0.00 H new ATOM 0 HG3 ARG F 28 0.540 13.337 -11.377 1.00 0.00 H new ATOM 0 HD2 ARG F 28 2.123 14.612 -10.135 1.00 0.00 H new ATOM 0 HD3 ARG F 28 3.435 14.245 -11.239 1.00 0.00 H new ATOM 0 HE ARG F 28 2.302 15.774 -12.944 1.00 0.00 H new ATOM 0 HH11 ARG F 28 3.300 17.520 -10.763 1.00 0.00 H new ATOM 0 HH12 ARG F 28 1.860 18.424 -10.284 1.00 0.00 H new ATOM 0 HH21 ARG F 28 -0.354 16.183 -11.803 1.00 0.00 H new ATOM 0 HH22 ARG F 28 -0.193 17.673 -10.868 1.00 0.00 H new ATOM 462 N GLY F 29 0.196 9.880 -12.340 1.00 0.00 N ATOM 463 CA GLY F 29 -1.196 9.500 -12.707 1.00 0.00 C ATOM 464 C GLY F 29 -1.171 8.277 -13.628 1.00 0.00 C ATOM 465 O GLY F 29 -2.199 7.781 -14.043 1.00 0.00 O ATOM 0 H GLY F 29 0.564 9.430 -11.502 1.00 0.00 H new ATOM 0 HA2 GLY F 29 -1.772 9.279 -11.808 1.00 0.00 H new ATOM 0 HA3 GLY F 29 -1.691 10.333 -13.206 1.00 0.00 H new ATOM 469 N THR F 30 -0.006 7.782 -13.949 1.00 0.00 N ATOM 470 CA THR F 30 0.073 6.588 -14.840 1.00 0.00 C ATOM 471 C THR F 30 0.010 5.322 -13.984 1.00 0.00 C ATOM 472 O THR F 30 1.019 4.814 -13.541 1.00 0.00 O ATOM 473 CB THR F 30 1.391 6.615 -15.618 1.00 0.00 C ATOM 474 OG1 THR F 30 1.982 7.901 -15.499 1.00 0.00 O ATOM 475 CG2 THR F 30 1.121 6.309 -17.092 1.00 0.00 C ATOM 0 H THR F 30 0.891 8.151 -13.634 1.00 0.00 H new ATOM 0 HA THR F 30 -0.759 6.599 -15.544 1.00 0.00 H new ATOM 0 HB THR F 30 2.069 5.864 -15.212 1.00 0.00 H new ATOM 0 HG1 THR F 30 2.835 7.915 -15.981 1.00 0.00 H new ATOM 0 HG21 THR F 30 2.060 6.328 -17.646 1.00 0.00 H new ATOM 0 HG22 THR F 30 0.667 5.322 -17.182 1.00 0.00 H new ATOM 0 HG23 THR F 30 0.443 7.058 -17.501 1.00 0.00 H new ATOM 483 N PHE F 31 -1.168 4.817 -13.730 1.00 0.00 N ATOM 484 CA PHE F 31 -1.278 3.596 -12.881 1.00 0.00 C ATOM 485 C PHE F 31 -1.237 2.342 -13.755 1.00 0.00 C ATOM 486 O PHE F 31 -2.259 1.831 -14.170 1.00 0.00 O ATOM 487 CB PHE F 31 -2.598 3.617 -12.103 1.00 0.00 C ATOM 488 CG PHE F 31 -2.728 4.895 -11.296 1.00 0.00 C ATOM 489 CD1 PHE F 31 -1.693 5.842 -11.274 1.00 0.00 C ATOM 490 CD2 PHE F 31 -3.900 5.130 -10.568 1.00 0.00 C ATOM 491 CE1 PHE F 31 -1.835 7.017 -10.526 1.00 0.00 C ATOM 492 CE2 PHE F 31 -4.040 6.306 -9.823 1.00 0.00 C ATOM 493 CZ PHE F 31 -3.009 7.250 -9.802 1.00 0.00 C ATOM 0 H PHE F 31 -2.052 5.194 -14.071 1.00 0.00 H new ATOM 0 HA PHE F 31 -0.440 3.582 -12.184 1.00 0.00 H new ATOM 0 HB2 PHE F 31 -3.435 3.533 -12.796 1.00 0.00 H new ATOM 0 HB3 PHE F 31 -2.647 2.755 -11.438 1.00 0.00 H new ATOM 0 HD1 PHE F 31 -0.787 5.665 -11.834 1.00 0.00 H new ATOM 0 HD2 PHE F 31 -4.698 4.402 -10.581 1.00 0.00 H new ATOM 0 HE1 PHE F 31 -1.037 7.745 -10.508 1.00 0.00 H new ATOM 0 HE2 PHE F 31 -4.946 6.485 -9.263 1.00 0.00 H new ATOM 0 HZ PHE F 31 -3.119 8.158 -9.228 1.00 0.00 H new ATOM 503 N LEU F 32 -0.068 1.832 -14.030 1.00 0.00 N ATOM 504 CA LEU F 32 0.026 0.604 -14.862 1.00 0.00 C ATOM 505 C LEU F 32 -0.195 -0.623 -13.976 1.00 0.00 C ATOM 506 O LEU F 32 -0.116 -0.549 -12.767 1.00 0.00 O ATOM 507 CB LEU F 32 1.413 0.528 -15.507 1.00 0.00 C ATOM 508 CG LEU F 32 2.470 0.312 -14.422 1.00 0.00 C ATOM 509 CD1 LEU F 32 2.557 -1.176 -14.083 1.00 0.00 C ATOM 510 CD2 LEU F 32 3.830 0.799 -14.930 1.00 0.00 C ATOM 0 H LEU F 32 0.824 2.213 -13.714 1.00 0.00 H new ATOM 0 HA LEU F 32 -0.734 0.632 -15.643 1.00 0.00 H new ATOM 0 HB2 LEU F 32 1.446 -0.288 -16.229 1.00 0.00 H new ATOM 0 HB3 LEU F 32 1.622 1.447 -16.055 1.00 0.00 H new ATOM 0 HG LEU F 32 2.193 0.873 -13.529 1.00 0.00 H new ATOM 0 HD11 LEU F 32 3.310 -1.330 -13.310 1.00 0.00 H new ATOM 0 HD12 LEU F 32 1.589 -1.524 -13.721 1.00 0.00 H new ATOM 0 HD13 LEU F 32 2.834 -1.737 -14.976 1.00 0.00 H new ATOM 0 HD21 LEU F 32 4.583 0.645 -14.157 1.00 0.00 H new ATOM 0 HD22 LEU F 32 4.107 0.239 -15.823 1.00 0.00 H new ATOM 0 HD23 LEU F 32 3.769 1.860 -15.172 1.00 0.00 H new ATOM 522 N ILE F 33 -0.461 -1.751 -14.570 1.00 0.00 N ATOM 523 CA ILE F 33 -0.675 -2.996 -13.770 1.00 0.00 C ATOM 524 C ILE F 33 0.479 -3.958 -14.074 1.00 0.00 C ATOM 525 O ILE F 33 1.276 -3.717 -14.958 1.00 0.00 O ATOM 526 CB ILE F 33 -2.037 -3.633 -14.131 1.00 0.00 C ATOM 527 CG1 ILE F 33 -3.144 -2.962 -13.310 1.00 0.00 C ATOM 528 CG2 ILE F 33 -2.035 -5.136 -13.831 1.00 0.00 C ATOM 529 CD1 ILE F 33 -4.484 -3.643 -13.600 1.00 0.00 C ATOM 0 H ILE F 33 -0.541 -1.869 -15.580 1.00 0.00 H new ATOM 0 HA ILE F 33 -0.692 -2.768 -12.704 1.00 0.00 H new ATOM 0 HB ILE F 33 -2.214 -3.488 -15.197 1.00 0.00 H new ATOM 0 HG12 ILE F 33 -2.913 -3.029 -12.247 1.00 0.00 H new ATOM 0 HG13 ILE F 33 -3.202 -1.902 -13.557 1.00 0.00 H new ATOM 0 HG21 ILE F 33 -3.004 -5.561 -14.093 1.00 0.00 H new ATOM 0 HG22 ILE F 33 -1.255 -5.623 -14.416 1.00 0.00 H new ATOM 0 HG23 ILE F 33 -1.845 -5.295 -12.770 1.00 0.00 H new ATOM 0 HD11 ILE F 33 -5.269 -3.164 -13.015 1.00 0.00 H new ATOM 0 HD12 ILE F 33 -4.716 -3.553 -14.661 1.00 0.00 H new ATOM 0 HD13 ILE F 33 -4.422 -4.697 -13.330 1.00 0.00 H new ATOM 541 N ARG F 34 0.586 -5.032 -13.347 1.00 0.00 N ATOM 542 CA ARG F 34 1.705 -5.986 -13.599 1.00 0.00 C ATOM 543 C ARG F 34 1.625 -7.161 -12.622 1.00 0.00 C ATOM 544 O ARG F 34 1.285 -7.004 -11.467 1.00 0.00 O ATOM 545 CB ARG F 34 3.039 -5.265 -13.410 1.00 0.00 C ATOM 546 CG ARG F 34 3.004 -4.455 -12.112 1.00 0.00 C ATOM 547 CD ARG F 34 3.658 -5.262 -10.990 1.00 0.00 C ATOM 548 NE ARG F 34 3.921 -4.372 -9.824 1.00 0.00 N ATOM 549 CZ ARG F 34 4.404 -4.869 -8.719 1.00 0.00 C ATOM 550 NH1 ARG F 34 4.866 -6.089 -8.697 1.00 0.00 N ATOM 551 NH2 ARG F 34 4.425 -4.144 -7.633 1.00 0.00 N ATOM 0 H ARG F 34 -0.048 -5.292 -12.592 1.00 0.00 H new ATOM 0 HA ARG F 34 1.628 -6.362 -14.619 1.00 0.00 H new ATOM 0 HB2 ARG F 34 3.854 -5.988 -13.377 1.00 0.00 H new ATOM 0 HB3 ARG F 34 3.231 -4.606 -14.257 1.00 0.00 H new ATOM 0 HG2 ARG F 34 3.528 -3.509 -12.247 1.00 0.00 H new ATOM 0 HG3 ARG F 34 1.974 -4.214 -11.849 1.00 0.00 H new ATOM 0 HD2 ARG F 34 3.008 -6.085 -10.693 1.00 0.00 H new ATOM 0 HD3 ARG F 34 4.591 -5.703 -11.341 1.00 0.00 H new ATOM 0 HE ARG F 34 3.723 -3.374 -9.890 1.00 0.00 H new ATOM 0 HH11 ARG F 34 4.850 -6.656 -9.545 1.00 0.00 H new ATOM 0 HH12 ARG F 34 5.243 -6.476 -7.832 1.00 0.00 H new ATOM 0 HH21 ARG F 34 4.064 -3.190 -7.649 1.00 0.00 H new ATOM 0 HH22 ARG F 34 4.802 -4.532 -6.768 1.00 0.00 H new ATOM 565 N GLU F 35 1.927 -8.341 -13.085 1.00 0.00 N ATOM 566 CA GLU F 35 1.867 -9.544 -12.208 1.00 0.00 C ATOM 567 C GLU F 35 2.647 -9.314 -10.910 1.00 0.00 C ATOM 568 O GLU F 35 3.788 -8.895 -10.926 1.00 0.00 O ATOM 569 CB GLU F 35 2.489 -10.718 -12.958 1.00 0.00 C ATOM 570 CG GLU F 35 1.383 -11.541 -13.613 1.00 0.00 C ATOM 571 CD GLU F 35 1.980 -12.813 -14.216 1.00 0.00 C ATOM 572 OE1 GLU F 35 3.110 -13.129 -13.885 1.00 0.00 O ATOM 573 OE2 GLU F 35 1.295 -13.452 -14.998 1.00 0.00 O ATOM 0 H GLU F 35 2.216 -8.526 -14.045 1.00 0.00 H new ATOM 0 HA GLU F 35 0.827 -9.748 -11.955 1.00 0.00 H new ATOM 0 HB2 GLU F 35 3.184 -10.354 -13.715 1.00 0.00 H new ATOM 0 HB3 GLU F 35 3.063 -11.340 -12.271 1.00 0.00 H new ATOM 0 HG2 GLU F 35 0.622 -11.798 -12.876 1.00 0.00 H new ATOM 0 HG3 GLU F 35 0.890 -10.955 -14.389 1.00 0.00 H new ATOM 580 N SER F 36 2.047 -9.607 -9.784 1.00 0.00 N ATOM 581 CA SER F 36 2.756 -9.428 -8.492 1.00 0.00 C ATOM 582 C SER F 36 3.472 -10.729 -8.128 1.00 0.00 C ATOM 583 O SER F 36 2.878 -11.787 -8.097 1.00 0.00 O ATOM 584 CB SER F 36 1.741 -9.103 -7.400 1.00 0.00 C ATOM 585 OG SER F 36 1.187 -7.819 -7.632 1.00 0.00 O ATOM 0 H SER F 36 1.094 -9.963 -9.709 1.00 0.00 H new ATOM 0 HA SER F 36 3.478 -8.616 -8.581 1.00 0.00 H new ATOM 0 HB2 SER F 36 0.951 -9.854 -7.388 1.00 0.00 H new ATOM 0 HB3 SER F 36 2.222 -9.131 -6.422 1.00 0.00 H new ATOM 0 HG SER F 36 0.213 -7.859 -7.529 1.00 0.00 H new ATOM 591 N GLU F 37 4.740 -10.658 -7.837 1.00 0.00 N ATOM 592 CA GLU F 37 5.485 -11.890 -7.458 1.00 0.00 C ATOM 593 C GLU F 37 5.390 -12.083 -5.947 1.00 0.00 C ATOM 594 O GLU F 37 6.145 -12.824 -5.351 1.00 0.00 O ATOM 595 CB GLU F 37 6.948 -11.732 -7.839 1.00 0.00 C ATOM 596 CG GLU F 37 7.100 -11.826 -9.359 1.00 0.00 C ATOM 597 CD GLU F 37 8.585 -11.863 -9.722 1.00 0.00 C ATOM 598 OE1 GLU F 37 9.323 -11.042 -9.203 1.00 0.00 O ATOM 599 OE2 GLU F 37 8.961 -12.713 -10.513 1.00 0.00 O ATOM 0 H GLU F 37 5.293 -9.801 -7.845 1.00 0.00 H new ATOM 0 HA GLU F 37 5.058 -12.749 -7.975 1.00 0.00 H new ATOM 0 HB2 GLU F 37 7.324 -10.772 -7.485 1.00 0.00 H new ATOM 0 HB3 GLU F 37 7.545 -12.506 -7.356 1.00 0.00 H new ATOM 0 HG2 GLU F 37 6.602 -12.721 -9.730 1.00 0.00 H new ATOM 0 HG3 GLU F 37 6.619 -10.972 -9.837 1.00 0.00 H new ATOM 606 N THR F 38 4.464 -11.415 -5.329 1.00 0.00 N ATOM 607 CA THR F 38 4.303 -11.541 -3.856 1.00 0.00 C ATOM 608 C THR F 38 3.384 -12.717 -3.568 1.00 0.00 C ATOM 609 O THR F 38 3.597 -13.495 -2.660 1.00 0.00 O ATOM 610 CB THR F 38 3.674 -10.253 -3.309 1.00 0.00 C ATOM 611 OG1 THR F 38 3.920 -10.161 -1.913 1.00 0.00 O ATOM 612 CG2 THR F 38 2.161 -10.257 -3.565 1.00 0.00 C ATOM 0 H THR F 38 3.806 -10.782 -5.783 1.00 0.00 H new ATOM 0 HA THR F 38 5.271 -11.702 -3.381 1.00 0.00 H new ATOM 0 HB THR F 38 4.118 -9.396 -3.815 1.00 0.00 H new ATOM 0 HG1 THR F 38 3.520 -9.337 -1.564 1.00 0.00 H new ATOM 0 HG21 THR F 38 1.723 -9.339 -3.173 1.00 0.00 H new ATOM 0 HG22 THR F 38 1.974 -10.320 -4.637 1.00 0.00 H new ATOM 0 HG23 THR F 38 1.710 -11.115 -3.067 1.00 0.00 H new ATOM 620 N THR F 39 2.359 -12.838 -4.351 1.00 0.00 N ATOM 621 CA THR F 39 1.395 -13.945 -4.163 1.00 0.00 C ATOM 622 C THR F 39 1.683 -15.017 -5.217 1.00 0.00 C ATOM 623 O THR F 39 2.479 -14.807 -6.109 1.00 0.00 O ATOM 624 CB THR F 39 -0.021 -13.377 -4.325 1.00 0.00 C ATOM 625 OG1 THR F 39 -0.408 -12.735 -3.117 1.00 0.00 O ATOM 626 CG2 THR F 39 -1.008 -14.491 -4.643 1.00 0.00 C ATOM 0 H THR F 39 2.145 -12.208 -5.124 1.00 0.00 H new ATOM 0 HA THR F 39 1.485 -14.394 -3.174 1.00 0.00 H new ATOM 0 HB THR F 39 -0.023 -12.661 -5.147 1.00 0.00 H new ATOM 0 HG1 THR F 39 -0.748 -11.838 -3.318 1.00 0.00 H new ATOM 0 HG21 THR F 39 -2.007 -14.071 -4.755 1.00 0.00 H new ATOM 0 HG22 THR F 39 -0.715 -14.983 -5.571 1.00 0.00 H new ATOM 0 HG23 THR F 39 -1.009 -15.219 -3.832 1.00 0.00 H new ATOM 634 N LYS F 40 1.052 -16.161 -5.120 1.00 0.00 N ATOM 635 CA LYS F 40 1.295 -17.247 -6.118 1.00 0.00 C ATOM 636 C LYS F 40 1.468 -16.628 -7.503 1.00 0.00 C ATOM 637 O LYS F 40 2.192 -17.123 -8.342 1.00 0.00 O ATOM 638 CB LYS F 40 0.093 -18.189 -6.138 1.00 0.00 C ATOM 639 CG LYS F 40 -0.390 -18.433 -4.710 1.00 0.00 C ATOM 640 CD LYS F 40 -1.286 -19.673 -4.676 1.00 0.00 C ATOM 641 CE LYS F 40 -2.466 -19.424 -3.736 1.00 0.00 C ATOM 642 NZ LYS F 40 -3.197 -20.702 -3.505 1.00 0.00 N ATOM 0 H LYS F 40 0.377 -16.390 -4.390 1.00 0.00 H new ATOM 0 HA LYS F 40 2.194 -17.801 -5.847 1.00 0.00 H new ATOM 0 HB2 LYS F 40 -0.710 -17.758 -6.736 1.00 0.00 H new ATOM 0 HB3 LYS F 40 0.367 -19.134 -6.607 1.00 0.00 H new ATOM 0 HG2 LYS F 40 0.463 -18.570 -4.045 1.00 0.00 H new ATOM 0 HG3 LYS F 40 -0.940 -17.564 -4.348 1.00 0.00 H new ATOM 0 HD2 LYS F 40 -1.648 -19.901 -5.679 1.00 0.00 H new ATOM 0 HD3 LYS F 40 -0.715 -20.538 -4.339 1.00 0.00 H new ATOM 0 HE2 LYS F 40 -2.110 -19.020 -2.788 1.00 0.00 H new ATOM 0 HE3 LYS F 40 -3.138 -18.682 -4.167 1.00 0.00 H new ATOM 0 HZ1 LYS F 40 -3.999 -20.532 -2.866 1.00 0.00 H new ATOM 0 HZ2 LYS F 40 -3.549 -21.070 -4.412 1.00 0.00 H new ATOM 0 HZ3 LYS F 40 -2.554 -21.397 -3.076 1.00 0.00 H new ATOM 656 N GLY F 41 0.803 -15.535 -7.729 1.00 0.00 N ATOM 657 CA GLY F 41 0.901 -14.839 -9.034 1.00 0.00 C ATOM 658 C GLY F 41 -0.312 -13.923 -9.190 1.00 0.00 C ATOM 659 O GLY F 41 -1.069 -14.024 -10.134 1.00 0.00 O ATOM 0 H GLY F 41 0.185 -15.088 -7.052 1.00 0.00 H new ATOM 0 HA2 GLY F 41 1.822 -14.259 -9.085 1.00 0.00 H new ATOM 0 HA3 GLY F 41 0.935 -15.564 -9.848 1.00 0.00 H new ATOM 663 N ALA F 42 -0.490 -13.026 -8.264 1.00 0.00 N ATOM 664 CA ALA F 42 -1.636 -12.084 -8.330 1.00 0.00 C ATOM 665 C ALA F 42 -1.298 -10.993 -9.323 1.00 0.00 C ATOM 666 O ALA F 42 -0.469 -11.167 -10.193 1.00 0.00 O ATOM 667 CB ALA F 42 -1.837 -11.452 -6.956 1.00 0.00 C ATOM 0 H ALA F 42 0.118 -12.905 -7.454 1.00 0.00 H new ATOM 0 HA ALA F 42 -2.542 -12.609 -8.633 1.00 0.00 H new ATOM 0 HB1 ALA F 42 -2.677 -10.758 -6.994 1.00 0.00 H new ATOM 0 HB2 ALA F 42 -2.044 -12.232 -6.223 1.00 0.00 H new ATOM 0 HB3 ALA F 42 -0.934 -10.913 -6.668 1.00 0.00 H new ATOM 673 N TYR F 43 -1.917 -9.864 -9.197 1.00 0.00 N ATOM 674 CA TYR F 43 -1.595 -8.763 -10.134 1.00 0.00 C ATOM 675 C TYR F 43 -1.212 -7.518 -9.337 1.00 0.00 C ATOM 676 O TYR F 43 -1.063 -7.567 -8.133 1.00 0.00 O ATOM 677 CB TYR F 43 -2.786 -8.471 -11.044 1.00 0.00 C ATOM 678 CG TYR F 43 -2.374 -8.765 -12.461 1.00 0.00 C ATOM 679 CD1 TYR F 43 -1.204 -8.192 -12.966 1.00 0.00 C ATOM 680 CD2 TYR F 43 -3.143 -9.617 -13.262 1.00 0.00 C ATOM 681 CE1 TYR F 43 -0.795 -8.475 -14.274 1.00 0.00 C ATOM 682 CE2 TYR F 43 -2.739 -9.896 -14.572 1.00 0.00 C ATOM 683 CZ TYR F 43 -1.565 -9.327 -15.077 1.00 0.00 C ATOM 684 OH TYR F 43 -1.161 -9.610 -16.364 1.00 0.00 O ATOM 0 H TYR F 43 -2.626 -9.654 -8.494 1.00 0.00 H new ATOM 0 HA TYR F 43 -0.755 -9.059 -10.762 1.00 0.00 H new ATOM 0 HB2 TYR F 43 -3.641 -9.085 -10.761 1.00 0.00 H new ATOM 0 HB3 TYR F 43 -3.094 -7.430 -10.945 1.00 0.00 H new ATOM 0 HD1 TYR F 43 -0.616 -7.531 -12.347 1.00 0.00 H new ATOM 0 HD2 TYR F 43 -4.047 -10.058 -12.869 1.00 0.00 H new ATOM 0 HE1 TYR F 43 0.112 -8.038 -14.664 1.00 0.00 H new ATOM 0 HE2 TYR F 43 -3.333 -10.550 -15.193 1.00 0.00 H new ATOM 0 HH TYR F 43 -1.269 -8.813 -16.924 1.00 0.00 H new ATOM 694 N SER F 44 -1.027 -6.409 -9.995 1.00 0.00 N ATOM 695 CA SER F 44 -0.626 -5.177 -9.262 1.00 0.00 C ATOM 696 C SER F 44 -0.984 -3.937 -10.064 1.00 0.00 C ATOM 697 O SER F 44 -1.382 -4.007 -11.208 1.00 0.00 O ATOM 698 CB SER F 44 0.877 -5.198 -9.049 1.00 0.00 C ATOM 699 OG SER F 44 1.341 -3.881 -8.791 1.00 0.00 O ATOM 0 H SER F 44 -1.135 -6.302 -11.004 1.00 0.00 H new ATOM 0 HA SER F 44 -1.152 -5.149 -8.308 1.00 0.00 H new ATOM 0 HB2 SER F 44 1.127 -5.852 -8.214 1.00 0.00 H new ATOM 0 HB3 SER F 44 1.374 -5.603 -9.931 1.00 0.00 H new ATOM 0 HG SER F 44 1.580 -3.447 -9.636 1.00 0.00 H new ATOM 705 N LEU F 45 -0.828 -2.800 -9.459 1.00 0.00 N ATOM 706 CA LEU F 45 -1.141 -1.527 -10.167 1.00 0.00 C ATOM 707 C LEU F 45 -0.072 -0.484 -9.863 1.00 0.00 C ATOM 708 O LEU F 45 -0.237 0.360 -9.005 1.00 0.00 O ATOM 709 CB LEU F 45 -2.489 -0.989 -9.710 1.00 0.00 C ATOM 710 CG LEU F 45 -3.340 -0.648 -10.932 1.00 0.00 C ATOM 711 CD1 LEU F 45 -4.489 0.255 -10.504 1.00 0.00 C ATOM 712 CD2 LEU F 45 -2.488 0.085 -11.975 1.00 0.00 C ATOM 0 H LEU F 45 -0.496 -2.692 -8.501 1.00 0.00 H new ATOM 0 HA LEU F 45 -1.169 -1.728 -11.238 1.00 0.00 H new ATOM 0 HB2 LEU F 45 -2.998 -1.730 -9.094 1.00 0.00 H new ATOM 0 HB3 LEU F 45 -2.348 -0.102 -9.092 1.00 0.00 H new ATOM 0 HG LEU F 45 -3.729 -1.569 -11.367 1.00 0.00 H new ATOM 0 HD11 LEU F 45 -5.100 0.502 -11.372 1.00 0.00 H new ATOM 0 HD12 LEU F 45 -5.101 -0.261 -9.764 1.00 0.00 H new ATOM 0 HD13 LEU F 45 -4.089 1.171 -10.069 1.00 0.00 H new ATOM 0 HD21 LEU F 45 -3.102 0.325 -12.843 1.00 0.00 H new ATOM 0 HD22 LEU F 45 -2.096 1.006 -11.543 1.00 0.00 H new ATOM 0 HD23 LEU F 45 -1.659 -0.553 -12.282 1.00 0.00 H new ATOM 724 N SER F 46 1.014 -0.526 -10.569 1.00 0.00 N ATOM 725 CA SER F 46 2.087 0.472 -10.329 1.00 0.00 C ATOM 726 C SER F 46 1.571 1.859 -10.706 1.00 0.00 C ATOM 727 O SER F 46 0.838 2.015 -11.657 1.00 0.00 O ATOM 728 CB SER F 46 3.307 0.134 -11.185 1.00 0.00 C ATOM 729 OG SER F 46 3.232 -1.221 -11.604 1.00 0.00 O ATOM 0 H SER F 46 1.208 -1.207 -11.303 1.00 0.00 H new ATOM 0 HA SER F 46 2.372 0.456 -9.277 1.00 0.00 H new ATOM 0 HB2 SER F 46 3.349 0.792 -12.053 1.00 0.00 H new ATOM 0 HB3 SER F 46 4.221 0.299 -10.615 1.00 0.00 H new ATOM 0 HG SER F 46 3.820 -1.770 -11.044 1.00 0.00 H new ATOM 735 N ILE F 47 1.945 2.868 -9.973 1.00 0.00 N ATOM 736 CA ILE F 47 1.471 4.242 -10.308 1.00 0.00 C ATOM 737 C ILE F 47 2.657 5.208 -10.318 1.00 0.00 C ATOM 738 O ILE F 47 3.382 5.332 -9.355 1.00 0.00 O ATOM 739 CB ILE F 47 0.433 4.699 -9.278 1.00 0.00 C ATOM 740 CG1 ILE F 47 1.119 5.034 -7.953 1.00 0.00 C ATOM 741 CG2 ILE F 47 -0.588 3.584 -9.051 1.00 0.00 C ATOM 742 CD1 ILE F 47 0.060 5.471 -6.939 1.00 0.00 C ATOM 0 H ILE F 47 2.556 2.804 -9.159 1.00 0.00 H new ATOM 0 HA ILE F 47 1.010 4.232 -11.296 1.00 0.00 H new ATOM 0 HB ILE F 47 -0.071 5.589 -9.655 1.00 0.00 H new ATOM 0 HG12 ILE F 47 1.661 4.165 -7.580 1.00 0.00 H new ATOM 0 HG13 ILE F 47 1.851 5.828 -8.099 1.00 0.00 H new ATOM 0 HG21 ILE F 47 -1.326 3.910 -8.318 1.00 0.00 H new ATOM 0 HG22 ILE F 47 -1.088 3.352 -9.991 1.00 0.00 H new ATOM 0 HG23 ILE F 47 -0.079 2.694 -8.682 1.00 0.00 H new ATOM 0 HD11 ILE F 47 0.541 5.712 -5.991 1.00 0.00 H new ATOM 0 HD12 ILE F 47 -0.462 6.351 -7.315 1.00 0.00 H new ATOM 0 HD13 ILE F 47 -0.655 4.662 -6.788 1.00 0.00 H new ATOM 754 N ARG F 48 2.859 5.896 -11.405 1.00 0.00 N ATOM 755 CA ARG F 48 3.997 6.854 -11.472 1.00 0.00 C ATOM 756 C ARG F 48 3.590 8.160 -10.797 1.00 0.00 C ATOM 757 O ARG F 48 2.468 8.612 -10.915 1.00 0.00 O ATOM 758 CB ARG F 48 4.350 7.129 -12.935 1.00 0.00 C ATOM 759 CG ARG F 48 5.754 7.737 -13.017 1.00 0.00 C ATOM 760 CD ARG F 48 5.694 9.219 -12.641 1.00 0.00 C ATOM 761 NE ARG F 48 6.150 10.042 -13.796 1.00 0.00 N ATOM 762 CZ ARG F 48 6.831 11.136 -13.589 1.00 0.00 C ATOM 763 NH1 ARG F 48 6.211 12.244 -13.289 1.00 0.00 N ATOM 764 NH2 ARG F 48 8.134 11.122 -13.682 1.00 0.00 N ATOM 0 H ARG F 48 2.288 5.837 -12.248 1.00 0.00 H new ATOM 0 HA ARG F 48 4.863 6.429 -10.965 1.00 0.00 H new ATOM 0 HB2 ARG F 48 4.309 6.204 -13.510 1.00 0.00 H new ATOM 0 HB3 ARG F 48 3.621 7.810 -13.374 1.00 0.00 H new ATOM 0 HG2 ARG F 48 6.430 7.208 -12.345 1.00 0.00 H new ATOM 0 HG3 ARG F 48 6.152 7.623 -14.025 1.00 0.00 H new ATOM 0 HD2 ARG F 48 4.676 9.494 -12.364 1.00 0.00 H new ATOM 0 HD3 ARG F 48 6.324 9.411 -11.772 1.00 0.00 H new ATOM 0 HE ARG F 48 5.930 9.751 -14.748 1.00 0.00 H new ATOM 0 HH11 ARG F 48 5.194 12.256 -13.216 1.00 0.00 H new ATOM 0 HH12 ARG F 48 6.744 13.099 -13.127 1.00 0.00 H new ATOM 0 HH21 ARG F 48 8.619 10.256 -13.916 1.00 0.00 H new ATOM 0 HH22 ARG F 48 8.666 11.977 -13.520 1.00 0.00 H new ATOM 778 N ASP F 49 4.494 8.768 -10.089 1.00 0.00 N ATOM 779 CA ASP F 49 4.169 10.043 -9.401 1.00 0.00 C ATOM 780 C ASP F 49 5.446 10.864 -9.231 1.00 0.00 C ATOM 781 O ASP F 49 6.441 10.627 -9.883 1.00 0.00 O ATOM 782 CB ASP F 49 3.570 9.738 -8.027 1.00 0.00 C ATOM 783 CG ASP F 49 2.588 10.845 -7.638 1.00 0.00 C ATOM 784 OD1 ASP F 49 1.899 11.334 -8.518 1.00 0.00 O ATOM 785 OD2 ASP F 49 2.543 11.186 -6.468 1.00 0.00 O ATOM 0 H ASP F 49 5.449 8.435 -9.956 1.00 0.00 H new ATOM 0 HA ASP F 49 3.449 10.608 -9.994 1.00 0.00 H new ATOM 0 HB2 ASP F 49 3.059 8.775 -8.047 1.00 0.00 H new ATOM 0 HB3 ASP F 49 4.362 9.663 -7.282 1.00 0.00 H new ATOM 790 N TRP F 50 5.417 11.834 -8.367 1.00 0.00 N ATOM 791 CA TRP F 50 6.616 12.683 -8.145 1.00 0.00 C ATOM 792 C TRP F 50 6.310 13.714 -7.054 1.00 0.00 C ATOM 793 O TRP F 50 5.169 14.014 -6.767 1.00 0.00 O ATOM 794 CB TRP F 50 6.971 13.386 -9.454 1.00 0.00 C ATOM 795 CG TRP F 50 7.896 14.524 -9.172 1.00 0.00 C ATOM 796 CD1 TRP F 50 9.225 14.544 -9.412 1.00 0.00 C ATOM 797 CD2 TRP F 50 7.567 15.809 -8.595 1.00 0.00 C ATOM 798 NE1 TRP F 50 9.734 15.762 -8.994 1.00 0.00 N ATOM 799 CE2 TRP F 50 8.743 16.580 -8.494 1.00 0.00 C ATOM 800 CE3 TRP F 50 6.364 16.366 -8.153 1.00 0.00 C ATOM 801 CZ2 TRP F 50 8.723 17.871 -7.970 1.00 0.00 C ATOM 802 CZ3 TRP F 50 6.333 17.665 -7.624 1.00 0.00 C ATOM 803 CH2 TRP F 50 7.512 18.418 -7.535 1.00 0.00 C ATOM 0 H TRP F 50 4.606 12.078 -7.799 1.00 0.00 H new ATOM 0 HA TRP F 50 7.459 12.071 -7.825 1.00 0.00 H new ATOM 0 HB2 TRP F 50 7.441 12.683 -10.141 1.00 0.00 H new ATOM 0 HB3 TRP F 50 6.066 13.751 -9.941 1.00 0.00 H new ATOM 0 HD1 TRP F 50 9.796 13.742 -9.856 1.00 0.00 H new ATOM 0 HE1 TRP F 50 10.719 16.022 -9.049 1.00 0.00 H new ATOM 0 HE3 TRP F 50 5.451 15.792 -8.219 1.00 0.00 H new ATOM 0 HZ2 TRP F 50 9.636 18.444 -7.900 1.00 0.00 H new ATOM 0 HZ3 TRP F 50 5.398 18.086 -7.284 1.00 0.00 H new ATOM 0 HH2 TRP F 50 7.485 19.419 -7.131 1.00 0.00 H new ATOM 814 N ASP F 51 7.329 14.250 -6.440 1.00 0.00 N ATOM 815 CA ASP F 51 7.109 15.255 -5.360 1.00 0.00 C ATOM 816 C ASP F 51 8.166 16.363 -5.456 1.00 0.00 C ATOM 817 O ASP F 51 9.232 16.172 -6.004 1.00 0.00 O ATOM 818 CB ASP F 51 7.213 14.558 -4.001 1.00 0.00 C ATOM 819 CG ASP F 51 6.041 14.986 -3.116 1.00 0.00 C ATOM 820 OD1 ASP F 51 5.349 15.917 -3.492 1.00 0.00 O ATOM 821 OD2 ASP F 51 5.855 14.374 -2.077 1.00 0.00 O ATOM 0 H ASP F 51 8.306 14.035 -6.639 1.00 0.00 H new ATOM 0 HA ASP F 51 6.120 15.700 -5.471 1.00 0.00 H new ATOM 0 HB2 ASP F 51 7.206 13.476 -4.134 1.00 0.00 H new ATOM 0 HB3 ASP F 51 8.157 14.814 -3.521 1.00 0.00 H new ATOM 826 N ASP F 52 7.873 17.524 -4.927 1.00 0.00 N ATOM 827 CA ASP F 52 8.853 18.650 -4.988 1.00 0.00 C ATOM 828 C ASP F 52 9.811 18.583 -3.797 1.00 0.00 C ATOM 829 O ASP F 52 10.068 19.573 -3.142 1.00 0.00 O ATOM 830 CB ASP F 52 8.099 19.981 -4.952 1.00 0.00 C ATOM 831 CG ASP F 52 8.767 20.971 -5.908 1.00 0.00 C ATOM 832 OD1 ASP F 52 9.335 20.524 -6.890 1.00 0.00 O ATOM 833 OD2 ASP F 52 8.698 22.160 -5.641 1.00 0.00 O ATOM 0 H ASP F 52 6.995 17.741 -4.455 1.00 0.00 H new ATOM 0 HA ASP F 52 9.426 18.571 -5.912 1.00 0.00 H new ATOM 0 HB2 ASP F 52 7.058 19.829 -5.237 1.00 0.00 H new ATOM 0 HB3 ASP F 52 8.097 20.383 -3.939 1.00 0.00 H new ATOM 838 N MET F 53 10.353 17.432 -3.516 1.00 0.00 N ATOM 839 CA MET F 53 11.300 17.323 -2.379 1.00 0.00 C ATOM 840 C MET F 53 12.140 16.052 -2.515 1.00 0.00 C ATOM 841 O MET F 53 12.698 15.564 -1.552 1.00 0.00 O ATOM 842 CB MET F 53 10.531 17.297 -1.055 1.00 0.00 C ATOM 843 CG MET F 53 9.871 15.929 -0.861 1.00 0.00 C ATOM 844 SD MET F 53 8.082 16.149 -0.710 1.00 0.00 S ATOM 845 CE MET F 53 7.854 17.076 -2.245 1.00 0.00 C ATOM 0 H MET F 53 10.180 16.565 -4.025 1.00 0.00 H new ATOM 0 HA MET F 53 11.961 18.189 -2.389 1.00 0.00 H new ATOM 0 HB2 MET F 53 11.209 17.504 -0.227 1.00 0.00 H new ATOM 0 HB3 MET F 53 9.773 18.080 -1.050 1.00 0.00 H new ATOM 0 HG2 MET F 53 10.100 15.278 -1.705 1.00 0.00 H new ATOM 0 HG3 MET F 53 10.267 15.444 0.031 1.00 0.00 H new ATOM 0 HE1 MET F 53 6.817 16.993 -2.570 1.00 0.00 H new ATOM 0 HE2 MET F 53 8.098 18.125 -2.076 1.00 0.00 H new ATOM 0 HE3 MET F 53 8.509 16.670 -3.016 1.00 0.00 H new ATOM 855 N LYS F 54 12.242 15.506 -3.697 1.00 0.00 N ATOM 856 CA LYS F 54 13.054 14.275 -3.862 1.00 0.00 C ATOM 857 C LYS F 54 13.113 13.856 -5.334 1.00 0.00 C ATOM 858 O LYS F 54 14.068 13.240 -5.765 1.00 0.00 O ATOM 859 CB LYS F 54 12.438 13.145 -3.035 1.00 0.00 C ATOM 860 CG LYS F 54 10.948 13.025 -3.364 1.00 0.00 C ATOM 861 CD LYS F 54 10.349 11.849 -2.590 1.00 0.00 C ATOM 862 CE LYS F 54 9.530 12.380 -1.411 1.00 0.00 C ATOM 863 NZ LYS F 54 8.721 11.271 -0.829 1.00 0.00 N ATOM 0 H LYS F 54 11.801 15.858 -4.546 1.00 0.00 H new ATOM 0 HA LYS F 54 14.068 14.478 -3.518 1.00 0.00 H new ATOM 0 HB2 LYS F 54 12.946 12.205 -3.250 1.00 0.00 H new ATOM 0 HB3 LYS F 54 12.572 13.344 -1.972 1.00 0.00 H new ATOM 0 HG2 LYS F 54 10.431 13.948 -3.102 1.00 0.00 H new ATOM 0 HG3 LYS F 54 10.812 12.877 -4.435 1.00 0.00 H new ATOM 0 HD2 LYS F 54 9.716 11.252 -3.247 1.00 0.00 H new ATOM 0 HD3 LYS F 54 11.143 11.194 -2.230 1.00 0.00 H new ATOM 0 HE2 LYS F 54 10.192 12.798 -0.653 1.00 0.00 H new ATOM 0 HE3 LYS F 54 8.876 13.187 -1.742 1.00 0.00 H new ATOM 0 HZ1 LYS F 54 8.164 11.631 -0.028 1.00 0.00 H new ATOM 0 HZ2 LYS F 54 8.079 10.892 -1.554 1.00 0.00 H new ATOM 0 HZ3 LYS F 54 9.355 10.515 -0.498 1.00 0.00 H new ATOM 877 N GLY F 55 12.111 14.162 -6.109 1.00 0.00 N ATOM 878 CA GLY F 55 12.136 13.756 -7.527 1.00 0.00 C ATOM 879 C GLY F 55 10.907 12.906 -7.815 1.00 0.00 C ATOM 880 O GLY F 55 9.969 12.873 -7.046 1.00 0.00 O ATOM 0 H GLY F 55 11.280 14.675 -5.816 1.00 0.00 H new ATOM 0 HA2 GLY F 55 12.146 14.635 -8.171 1.00 0.00 H new ATOM 0 HA3 GLY F 55 13.044 13.192 -7.742 1.00 0.00 H new ATOM 884 N ASP F 56 10.898 12.222 -8.916 1.00 0.00 N ATOM 885 CA ASP F 56 9.720 11.385 -9.248 1.00 0.00 C ATOM 886 C ASP F 56 9.740 10.122 -8.383 1.00 0.00 C ATOM 887 O ASP F 56 10.664 9.887 -7.631 1.00 0.00 O ATOM 888 CB ASP F 56 9.778 10.995 -10.725 1.00 0.00 C ATOM 889 CG ASP F 56 11.209 10.596 -11.094 1.00 0.00 C ATOM 890 OD1 ASP F 56 11.754 9.734 -10.423 1.00 0.00 O ATOM 891 OD2 ASP F 56 11.734 11.157 -12.041 1.00 0.00 O ATOM 0 H ASP F 56 11.654 12.205 -9.601 1.00 0.00 H new ATOM 0 HA ASP F 56 8.804 11.944 -9.056 1.00 0.00 H new ATOM 0 HB2 ASP F 56 9.097 10.167 -10.920 1.00 0.00 H new ATOM 0 HB3 ASP F 56 9.451 11.830 -11.345 1.00 0.00 H new ATOM 896 N HIS F 57 8.729 9.310 -8.491 1.00 0.00 N ATOM 897 CA HIS F 57 8.677 8.059 -7.690 1.00 0.00 C ATOM 898 C HIS F 57 7.609 7.147 -8.290 1.00 0.00 C ATOM 899 O HIS F 57 7.061 7.428 -9.333 1.00 0.00 O ATOM 900 CB HIS F 57 8.316 8.387 -6.240 1.00 0.00 C ATOM 901 CG HIS F 57 9.575 8.526 -5.429 1.00 0.00 C ATOM 902 ND1 HIS F 57 10.881 8.201 -5.699 1.00 0.00 N flip ATOM 903 CD2 HIS F 57 9.575 9.061 -4.151 1.00 0.00 C flip ATOM 904 CE1 HIS F 57 11.681 8.529 -4.608 1.00 0.00 C flip ATOM 905 NE2 HIS F 57 10.844 9.043 -3.704 1.00 0.00 N flip ATOM 0 H HIS F 57 7.929 9.461 -9.106 1.00 0.00 H new ATOM 0 HA HIS F 57 9.648 7.564 -7.707 1.00 0.00 H new ATOM 0 HB2 HIS F 57 7.740 9.311 -6.198 1.00 0.00 H new ATOM 0 HB3 HIS F 57 7.687 7.600 -5.824 1.00 0.00 H new ATOM 0 HD1 HIS F 57 11.215 7.783 -6.567 1.00 0.00 H new ATOM 0 HD2 HIS F 57 8.713 9.426 -3.612 1.00 0.00 H new ATOM 0 HE1 HIS F 57 12.749 8.396 -4.513 1.00 0.00 H new ATOM 913 N VAL F 58 7.311 6.059 -7.648 1.00 0.00 N ATOM 914 CA VAL F 58 6.278 5.140 -8.187 1.00 0.00 C ATOM 915 C VAL F 58 5.804 4.209 -7.068 1.00 0.00 C ATOM 916 O VAL F 58 6.541 3.885 -6.158 1.00 0.00 O ATOM 917 CB VAL F 58 6.876 4.328 -9.337 1.00 0.00 C ATOM 918 CG1 VAL F 58 8.002 3.464 -8.801 1.00 0.00 C ATOM 919 CG2 VAL F 58 5.812 3.428 -9.965 1.00 0.00 C ATOM 0 H VAL F 58 7.739 5.765 -6.770 1.00 0.00 H new ATOM 0 HA VAL F 58 5.427 5.709 -8.562 1.00 0.00 H new ATOM 0 HB VAL F 58 7.253 5.014 -10.096 1.00 0.00 H new ATOM 0 HG11 VAL F 58 8.433 2.882 -9.615 1.00 0.00 H new ATOM 0 HG12 VAL F 58 8.771 4.100 -8.362 1.00 0.00 H new ATOM 0 HG13 VAL F 58 7.612 2.789 -8.040 1.00 0.00 H new ATOM 0 HG21 VAL F 58 6.254 2.857 -10.782 1.00 0.00 H new ATOM 0 HG22 VAL F 58 5.424 2.743 -9.211 1.00 0.00 H new ATOM 0 HG23 VAL F 58 4.998 4.042 -10.350 1.00 0.00 H new ATOM 929 N LYS F 59 4.581 3.778 -7.136 1.00 0.00 N ATOM 930 CA LYS F 59 4.036 2.865 -6.093 1.00 0.00 C ATOM 931 C LYS F 59 3.360 1.693 -6.789 1.00 0.00 C ATOM 932 O LYS F 59 3.571 1.459 -7.958 1.00 0.00 O ATOM 933 CB LYS F 59 3.014 3.616 -5.239 1.00 0.00 C ATOM 934 CG LYS F 59 3.619 3.920 -3.867 1.00 0.00 C ATOM 935 CD LYS F 59 2.588 3.625 -2.777 1.00 0.00 C ATOM 936 CE LYS F 59 3.287 3.555 -1.418 1.00 0.00 C ATOM 937 NZ LYS F 59 3.831 4.899 -1.069 1.00 0.00 N ATOM 0 H LYS F 59 3.925 4.021 -7.878 1.00 0.00 H new ATOM 0 HA LYS F 59 4.839 2.506 -5.449 1.00 0.00 H new ATOM 0 HB2 LYS F 59 2.723 4.543 -5.733 1.00 0.00 H new ATOM 0 HB3 LYS F 59 2.110 3.018 -5.125 1.00 0.00 H new ATOM 0 HG2 LYS F 59 4.513 3.316 -3.710 1.00 0.00 H new ATOM 0 HG3 LYS F 59 3.928 4.964 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS F 59 1.824 4.402 -2.765 1.00 0.00 H new ATOM 0 HD3 LYS F 59 2.082 2.683 -2.986 1.00 0.00 H new ATOM 0 HE2 LYS F 59 2.585 3.225 -0.652 1.00 0.00 H new ATOM 0 HE3 LYS F 59 4.093 2.822 -1.449 1.00 0.00 H new ATOM 0 HZ1 LYS F 59 4.155 4.897 -0.081 1.00 0.00 H new ATOM 0 HZ2 LYS F 59 4.631 5.123 -1.695 1.00 0.00 H new ATOM 0 HZ3 LYS F 59 3.087 5.616 -1.188 1.00 0.00 H new ATOM 951 N HIS F 60 2.554 0.950 -6.089 1.00 0.00 N ATOM 952 CA HIS F 60 1.870 -0.205 -6.741 1.00 0.00 C ATOM 953 C HIS F 60 0.648 -0.632 -5.933 1.00 0.00 C ATOM 954 O HIS F 60 0.630 -0.564 -4.721 1.00 0.00 O ATOM 955 CB HIS F 60 2.823 -1.398 -6.845 1.00 0.00 C ATOM 956 CG HIS F 60 4.237 -0.923 -7.044 1.00 0.00 C ATOM 957 ND1 HIS F 60 4.804 -0.795 -8.301 1.00 0.00 N ATOM 958 CD2 HIS F 60 5.209 -0.541 -6.152 1.00 0.00 C ATOM 959 CE1 HIS F 60 6.063 -0.352 -8.136 1.00 0.00 C ATOM 960 NE2 HIS F 60 6.363 -0.181 -6.845 1.00 0.00 N ATOM 0 H HIS F 60 2.338 1.088 -5.102 1.00 0.00 H new ATOM 0 HA HIS F 60 1.559 0.111 -7.737 1.00 0.00 H new ATOM 0 HB2 HIS F 60 2.759 -2.002 -5.940 1.00 0.00 H new ATOM 0 HB3 HIS F 60 2.527 -2.037 -7.677 1.00 0.00 H new ATOM 0 HD2 HIS F 60 5.096 -0.522 -5.078 1.00 0.00 H new ATOM 0 HE1 HIS F 60 6.748 -0.158 -8.948 1.00 0.00 H new ATOM 0 HE2 HIS F 60 7.246 0.143 -6.452 1.00 0.00 H new ATOM 968 N TYR F 61 -0.363 -1.104 -6.608 1.00 0.00 N ATOM 969 CA TYR F 61 -1.583 -1.579 -5.896 1.00 0.00 C ATOM 970 C TYR F 61 -1.765 -3.064 -6.206 1.00 0.00 C ATOM 971 O TYR F 61 -2.309 -3.435 -7.226 1.00 0.00 O ATOM 972 CB TYR F 61 -2.815 -0.799 -6.365 1.00 0.00 C ATOM 973 CG TYR F 61 -2.913 0.499 -5.599 1.00 0.00 C ATOM 974 CD1 TYR F 61 -3.498 0.520 -4.327 1.00 0.00 C ATOM 975 CD2 TYR F 61 -2.418 1.683 -6.161 1.00 0.00 C ATOM 976 CE1 TYR F 61 -3.589 1.724 -3.618 1.00 0.00 C ATOM 977 CE2 TYR F 61 -2.509 2.886 -5.452 1.00 0.00 C ATOM 978 CZ TYR F 61 -3.094 2.907 -4.180 1.00 0.00 C ATOM 979 OH TYR F 61 -3.183 4.093 -3.482 1.00 0.00 O ATOM 0 H TYR F 61 -0.397 -1.182 -7.624 1.00 0.00 H new ATOM 0 HA TYR F 61 -1.469 -1.423 -4.823 1.00 0.00 H new ATOM 0 HB2 TYR F 61 -2.746 -0.598 -7.434 1.00 0.00 H new ATOM 0 HB3 TYR F 61 -3.715 -1.394 -6.210 1.00 0.00 H new ATOM 0 HD1 TYR F 61 -3.879 -0.392 -3.893 1.00 0.00 H new ATOM 0 HD2 TYR F 61 -1.966 1.667 -7.142 1.00 0.00 H new ATOM 0 HE1 TYR F 61 -4.041 1.740 -2.637 1.00 0.00 H new ATOM 0 HE2 TYR F 61 -2.128 3.799 -5.886 1.00 0.00 H new ATOM 0 HH TYR F 61 -2.792 4.816 -4.015 1.00 0.00 H new ATOM 989 N LYS F 62 -1.290 -3.916 -5.341 1.00 0.00 N ATOM 990 CA LYS F 62 -1.410 -5.377 -5.585 1.00 0.00 C ATOM 991 C LYS F 62 -2.863 -5.737 -5.892 1.00 0.00 C ATOM 992 O LYS F 62 -3.714 -5.737 -5.025 1.00 0.00 O ATOM 993 CB LYS F 62 -0.939 -6.138 -4.345 1.00 0.00 C ATOM 994 CG LYS F 62 -0.783 -7.621 -4.671 1.00 0.00 C ATOM 995 CD LYS F 62 -1.992 -8.392 -4.138 1.00 0.00 C ATOM 996 CE LYS F 62 -1.805 -8.663 -2.644 1.00 0.00 C ATOM 997 NZ LYS F 62 -2.459 -7.579 -1.857 1.00 0.00 N ATOM 0 H LYS F 62 -0.822 -3.660 -4.472 1.00 0.00 H new ATOM 0 HA LYS F 62 -0.790 -5.652 -6.438 1.00 0.00 H new ATOM 0 HB2 LYS F 62 0.011 -5.732 -3.998 1.00 0.00 H new ATOM 0 HB3 LYS F 62 -1.656 -6.009 -3.535 1.00 0.00 H new ATOM 0 HG2 LYS F 62 -0.696 -7.760 -5.749 1.00 0.00 H new ATOM 0 HG3 LYS F 62 0.133 -8.008 -4.225 1.00 0.00 H new ATOM 0 HD2 LYS F 62 -2.904 -7.819 -4.303 1.00 0.00 H new ATOM 0 HD3 LYS F 62 -2.104 -9.332 -4.678 1.00 0.00 H new ATOM 0 HE2 LYS F 62 -2.237 -9.629 -2.382 1.00 0.00 H new ATOM 0 HE3 LYS F 62 -0.743 -8.713 -2.403 1.00 0.00 H new ATOM 0 HZ1 LYS F 62 -2.757 -7.952 -0.933 1.00 0.00 H new ATOM 0 HZ2 LYS F 62 -1.786 -6.799 -1.714 1.00 0.00 H new ATOM 0 HZ3 LYS F 62 -3.291 -7.228 -2.374 1.00 0.00 H new ATOM 1011 N ILE F 63 -3.146 -6.050 -7.123 1.00 0.00 N ATOM 1012 CA ILE F 63 -4.534 -6.418 -7.507 1.00 0.00 C ATOM 1013 C ILE F 63 -4.797 -7.873 -7.118 1.00 0.00 C ATOM 1014 O ILE F 63 -4.317 -8.791 -7.753 1.00 0.00 O ATOM 1015 CB ILE F 63 -4.699 -6.253 -9.021 1.00 0.00 C ATOM 1016 CG1 ILE F 63 -4.884 -4.773 -9.349 1.00 0.00 C ATOM 1017 CG2 ILE F 63 -5.923 -7.036 -9.505 1.00 0.00 C ATOM 1018 CD1 ILE F 63 -3.760 -4.315 -10.276 1.00 0.00 C ATOM 0 H ILE F 63 -2.469 -6.067 -7.886 1.00 0.00 H new ATOM 0 HA ILE F 63 -5.244 -5.771 -6.991 1.00 0.00 H new ATOM 0 HB ILE F 63 -3.810 -6.636 -9.522 1.00 0.00 H new ATOM 0 HG12 ILE F 63 -5.851 -4.613 -9.825 1.00 0.00 H new ATOM 0 HG13 ILE F 63 -4.878 -4.183 -8.433 1.00 0.00 H new ATOM 0 HG21 ILE F 63 -6.031 -6.912 -10.582 1.00 0.00 H new ATOM 0 HG22 ILE F 63 -5.794 -8.093 -9.272 1.00 0.00 H new ATOM 0 HG23 ILE F 63 -6.816 -6.661 -9.005 1.00 0.00 H new ATOM 0 HD11 ILE F 63 -3.890 -3.259 -10.511 1.00 0.00 H new ATOM 0 HD12 ILE F 63 -2.799 -4.461 -9.783 1.00 0.00 H new ATOM 0 HD13 ILE F 63 -3.787 -4.898 -11.197 1.00 0.00 H new ATOM 1030 N ARG F 64 -5.566 -8.092 -6.092 1.00 0.00 N ATOM 1031 CA ARG F 64 -5.871 -9.486 -5.682 1.00 0.00 C ATOM 1032 C ARG F 64 -6.994 -10.009 -6.569 1.00 0.00 C ATOM 1033 O ARG F 64 -7.412 -9.350 -7.501 1.00 0.00 O ATOM 1034 CB ARG F 64 -6.320 -9.512 -4.220 1.00 0.00 C ATOM 1035 CG ARG F 64 -5.657 -10.688 -3.502 1.00 0.00 C ATOM 1036 CD ARG F 64 -4.138 -10.519 -3.544 1.00 0.00 C ATOM 1037 NE ARG F 64 -3.510 -11.416 -2.535 1.00 0.00 N ATOM 1038 CZ ARG F 64 -4.018 -11.508 -1.336 1.00 0.00 C ATOM 1039 NH1 ARG F 64 -4.164 -10.435 -0.606 1.00 0.00 N ATOM 1040 NH2 ARG F 64 -4.379 -12.670 -0.867 1.00 0.00 N ATOM 0 H ARG F 64 -5.996 -7.366 -5.520 1.00 0.00 H new ATOM 0 HA ARG F 64 -4.983 -10.109 -5.787 1.00 0.00 H new ATOM 0 HB2 ARG F 64 -6.053 -8.576 -3.730 1.00 0.00 H new ATOM 0 HB3 ARG F 64 -7.405 -9.603 -4.163 1.00 0.00 H new ATOM 0 HG2 ARG F 64 -6.000 -10.737 -2.468 1.00 0.00 H new ATOM 0 HG3 ARG F 64 -5.943 -11.626 -3.978 1.00 0.00 H new ATOM 0 HD2 ARG F 64 -3.763 -10.755 -4.540 1.00 0.00 H new ATOM 0 HD3 ARG F 64 -3.871 -9.482 -3.340 1.00 0.00 H new ATOM 0 HE ARG F 64 -2.682 -11.959 -2.781 1.00 0.00 H new ATOM 0 HH11 ARG F 64 -3.881 -9.526 -0.973 1.00 0.00 H new ATOM 0 HH12 ARG F 64 -4.561 -10.506 0.331 1.00 0.00 H new ATOM 0 HH21 ARG F 64 -4.265 -13.508 -1.437 1.00 0.00 H new ATOM 0 HH22 ARG F 64 -4.776 -12.741 0.070 1.00 0.00 H new ATOM 1054 N LYS F 65 -7.494 -11.179 -6.301 1.00 0.00 N ATOM 1055 CA LYS F 65 -8.588 -11.706 -7.154 1.00 0.00 C ATOM 1056 C LYS F 65 -9.483 -12.642 -6.351 1.00 0.00 C ATOM 1057 O LYS F 65 -9.024 -13.557 -5.696 1.00 0.00 O ATOM 1058 CB LYS F 65 -7.991 -12.465 -8.339 1.00 0.00 C ATOM 1059 CG LYS F 65 -9.108 -12.861 -9.307 1.00 0.00 C ATOM 1060 CD LYS F 65 -8.520 -13.688 -10.453 1.00 0.00 C ATOM 1061 CE LYS F 65 -8.679 -15.177 -10.140 1.00 0.00 C ATOM 1062 NZ LYS F 65 -7.654 -15.587 -9.139 1.00 0.00 N ATOM 0 H LYS F 65 -7.197 -11.787 -5.538 1.00 0.00 H new ATOM 0 HA LYS F 65 -9.186 -10.870 -7.515 1.00 0.00 H new ATOM 0 HB2 LYS F 65 -7.256 -11.843 -8.850 1.00 0.00 H new ATOM 0 HB3 LYS F 65 -7.467 -13.354 -7.988 1.00 0.00 H new ATOM 0 HG2 LYS F 65 -9.871 -13.437 -8.783 1.00 0.00 H new ATOM 0 HG3 LYS F 65 -9.596 -11.969 -9.701 1.00 0.00 H new ATOM 0 HD2 LYS F 65 -9.026 -13.446 -11.388 1.00 0.00 H new ATOM 0 HD3 LYS F 65 -7.466 -13.444 -10.588 1.00 0.00 H new ATOM 0 HE2 LYS F 65 -9.679 -15.373 -9.753 1.00 0.00 H new ATOM 0 HE3 LYS F 65 -8.568 -15.765 -11.051 1.00 0.00 H new ATOM 0 HZ1 LYS F 65 -7.442 -16.599 -9.254 1.00 0.00 H new ATOM 0 HZ2 LYS F 65 -6.786 -15.033 -9.284 1.00 0.00 H new ATOM 0 HZ3 LYS F 65 -8.018 -15.416 -8.180 1.00 0.00 H new ATOM 1076 N LEU F 66 -10.763 -12.423 -6.416 1.00 0.00 N ATOM 1077 CA LEU F 66 -11.710 -13.302 -5.676 1.00 0.00 C ATOM 1078 C LEU F 66 -11.658 -14.699 -6.276 1.00 0.00 C ATOM 1079 O LEU F 66 -11.397 -14.873 -7.449 1.00 0.00 O ATOM 1080 CB LEU F 66 -13.137 -12.760 -5.813 1.00 0.00 C ATOM 1081 CG LEU F 66 -13.389 -11.640 -4.798 1.00 0.00 C ATOM 1082 CD1 LEU F 66 -12.879 -12.053 -3.418 1.00 0.00 C ATOM 1083 CD2 LEU F 66 -12.663 -10.373 -5.242 1.00 0.00 C ATOM 0 H LEU F 66 -11.198 -11.671 -6.951 1.00 0.00 H new ATOM 0 HA LEU F 66 -11.430 -13.330 -4.623 1.00 0.00 H new ATOM 0 HB2 LEU F 66 -13.293 -12.384 -6.824 1.00 0.00 H new ATOM 0 HB3 LEU F 66 -13.854 -13.566 -5.659 1.00 0.00 H new ATOM 0 HG LEU F 66 -14.461 -11.452 -4.743 1.00 0.00 H new ATOM 0 HD11 LEU F 66 -13.064 -11.249 -2.706 1.00 0.00 H new ATOM 0 HD12 LEU F 66 -13.400 -12.953 -3.092 1.00 0.00 H new ATOM 0 HD13 LEU F 66 -11.809 -12.252 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU F 66 -12.844 -9.578 -4.519 1.00 0.00 H new ATOM 0 HD22 LEU F 66 -11.593 -10.570 -5.305 1.00 0.00 H new ATOM 0 HD23 LEU F 66 -13.033 -10.065 -6.220 1.00 0.00 H new ATOM 1095 N ASP F 67 -11.930 -15.698 -5.489 1.00 0.00 N ATOM 1096 CA ASP F 67 -11.931 -17.075 -6.036 1.00 0.00 C ATOM 1097 C ASP F 67 -13.161 -17.208 -6.922 1.00 0.00 C ATOM 1098 O ASP F 67 -13.256 -18.084 -7.760 1.00 0.00 O ATOM 1099 CB ASP F 67 -12.010 -18.082 -4.892 1.00 0.00 C ATOM 1100 CG ASP F 67 -10.678 -18.822 -4.767 1.00 0.00 C ATOM 1101 OD1 ASP F 67 -9.721 -18.209 -4.324 1.00 0.00 O ATOM 1102 OD2 ASP F 67 -10.637 -19.990 -5.116 1.00 0.00 O ATOM 0 H ASP F 67 -12.150 -15.620 -4.496 1.00 0.00 H new ATOM 0 HA ASP F 67 -11.021 -17.268 -6.604 1.00 0.00 H new ATOM 0 HB2 ASP F 67 -12.242 -17.569 -3.958 1.00 0.00 H new ATOM 0 HB3 ASP F 67 -12.816 -18.792 -5.074 1.00 0.00 H new ATOM 1107 N ASN F 68 -14.098 -16.316 -6.750 1.00 0.00 N ATOM 1108 CA ASN F 68 -15.327 -16.347 -7.585 1.00 0.00 C ATOM 1109 C ASN F 68 -15.095 -15.482 -8.823 1.00 0.00 C ATOM 1110 O ASN F 68 -15.937 -15.380 -9.693 1.00 0.00 O ATOM 1111 CB ASN F 68 -16.498 -15.778 -6.785 1.00 0.00 C ATOM 1112 CG ASN F 68 -16.753 -16.655 -5.558 1.00 0.00 C ATOM 1113 OD1 ASN F 68 -16.995 -17.839 -5.682 1.00 0.00 O ATOM 1114 ND2 ASN F 68 -16.709 -16.120 -4.367 1.00 0.00 N ATOM 0 H ASN F 68 -14.063 -15.564 -6.062 1.00 0.00 H new ATOM 0 HA ASN F 68 -15.554 -17.372 -7.879 1.00 0.00 H new ATOM 0 HB2 ASN F 68 -16.278 -14.756 -6.475 1.00 0.00 H new ATOM 0 HB3 ASN F 68 -17.392 -15.737 -7.408 1.00 0.00 H new ATOM 0 HD21 ASN F 68 -16.878 -16.696 -3.542 1.00 0.00 H new ATOM 0 HD22 ASN F 68 -16.506 -15.126 -4.262 1.00 0.00 H new ATOM 1121 N GLY F 69 -13.956 -14.848 -8.899 1.00 0.00 N ATOM 1122 CA GLY F 69 -13.658 -13.982 -10.064 1.00 0.00 C ATOM 1123 C GLY F 69 -13.965 -12.529 -9.699 1.00 0.00 C ATOM 1124 O GLY F 69 -15.026 -12.016 -9.993 1.00 0.00 O ATOM 0 H GLY F 69 -13.218 -14.896 -8.197 1.00 0.00 H new ATOM 0 HA2 GLY F 69 -12.611 -14.085 -10.351 1.00 0.00 H new ATOM 0 HA3 GLY F 69 -14.255 -14.288 -10.923 1.00 0.00 H new ATOM 1128 N GLY F 70 -13.046 -11.863 -9.055 1.00 0.00 N ATOM 1129 CA GLY F 70 -13.284 -10.455 -8.667 1.00 0.00 C ATOM 1130 C GLY F 70 -11.946 -9.729 -8.474 1.00 0.00 C ATOM 1131 O GLY F 70 -11.425 -9.670 -7.383 1.00 0.00 O ATOM 0 H GLY F 70 -12.138 -12.240 -8.782 1.00 0.00 H new ATOM 0 HA2 GLY F 70 -13.872 -9.952 -9.435 1.00 0.00 H new ATOM 0 HA3 GLY F 70 -13.864 -10.417 -7.745 1.00 0.00 H new ATOM 1135 N TYR F 71 -11.384 -9.168 -9.513 1.00 0.00 N ATOM 1136 CA TYR F 71 -10.084 -8.447 -9.341 1.00 0.00 C ATOM 1137 C TYR F 71 -10.332 -7.177 -8.517 1.00 0.00 C ATOM 1138 O TYR F 71 -11.163 -6.363 -8.866 1.00 0.00 O ATOM 1139 CB TYR F 71 -9.517 -8.035 -10.708 1.00 0.00 C ATOM 1140 CG TYR F 71 -8.744 -9.170 -11.351 1.00 0.00 C ATOM 1141 CD1 TYR F 71 -7.975 -10.045 -10.572 1.00 0.00 C ATOM 1142 CD2 TYR F 71 -8.797 -9.339 -12.742 1.00 0.00 C ATOM 1143 CE1 TYR F 71 -7.264 -11.086 -11.188 1.00 0.00 C ATOM 1144 CE2 TYR F 71 -8.091 -10.375 -13.353 1.00 0.00 C ATOM 1145 CZ TYR F 71 -7.324 -11.251 -12.578 1.00 0.00 C ATOM 1146 OH TYR F 71 -6.624 -12.276 -13.181 1.00 0.00 O ATOM 0 H TYR F 71 -11.761 -9.176 -10.461 1.00 0.00 H new ATOM 0 HA TYR F 71 -9.375 -9.106 -8.840 1.00 0.00 H new ATOM 0 HB2 TYR F 71 -10.332 -7.730 -11.365 1.00 0.00 H new ATOM 0 HB3 TYR F 71 -8.864 -7.171 -10.587 1.00 0.00 H new ATOM 0 HD1 TYR F 71 -7.930 -9.918 -9.500 1.00 0.00 H new ATOM 0 HD2 TYR F 71 -9.387 -8.664 -13.343 1.00 0.00 H new ATOM 0 HE1 TYR F 71 -6.670 -11.761 -10.590 1.00 0.00 H new ATOM 0 HE2 TYR F 71 -8.137 -10.501 -14.425 1.00 0.00 H new ATOM 0 HH TYR F 71 -6.775 -12.250 -14.149 1.00 0.00 H new ATOM 1156 N TYR F 72 -9.627 -6.990 -7.433 1.00 0.00 N ATOM 1157 CA TYR F 72 -9.853 -5.761 -6.614 1.00 0.00 C ATOM 1158 C TYR F 72 -8.550 -5.296 -5.960 1.00 0.00 C ATOM 1159 O TYR F 72 -7.863 -6.062 -5.313 1.00 0.00 O ATOM 1160 CB TYR F 72 -10.856 -6.067 -5.496 1.00 0.00 C ATOM 1161 CG TYR F 72 -10.253 -7.071 -4.540 1.00 0.00 C ATOM 1162 CD1 TYR F 72 -9.494 -6.637 -3.445 1.00 0.00 C ATOM 1163 CD2 TYR F 72 -10.444 -8.436 -4.757 1.00 0.00 C ATOM 1164 CE1 TYR F 72 -8.928 -7.566 -2.573 1.00 0.00 C ATOM 1165 CE2 TYR F 72 -9.878 -9.371 -3.884 1.00 0.00 C ATOM 1166 CZ TYR F 72 -9.117 -8.937 -2.790 1.00 0.00 C ATOM 1167 OH TYR F 72 -8.557 -9.857 -1.928 1.00 0.00 O ATOM 0 H TYR F 72 -8.912 -7.627 -7.081 1.00 0.00 H new ATOM 0 HA TYR F 72 -10.231 -4.981 -7.275 1.00 0.00 H new ATOM 0 HB2 TYR F 72 -11.114 -5.152 -4.964 1.00 0.00 H new ATOM 0 HB3 TYR F 72 -11.780 -6.461 -5.919 1.00 0.00 H new ATOM 0 HD1 TYR F 72 -9.347 -5.580 -3.276 1.00 0.00 H new ATOM 0 HD2 TYR F 72 -11.030 -8.771 -5.600 1.00 0.00 H new ATOM 0 HE1 TYR F 72 -8.344 -7.229 -1.730 1.00 0.00 H new ATOM 0 HE2 TYR F 72 -10.027 -10.427 -4.053 1.00 0.00 H new ATOM 0 HH TYR F 72 -8.786 -10.763 -2.223 1.00 0.00 H new ATOM 1177 N ILE F 73 -8.228 -4.034 -6.066 1.00 0.00 N ATOM 1178 CA ILE F 73 -7.008 -3.535 -5.375 1.00 0.00 C ATOM 1179 C ILE F 73 -7.410 -3.359 -3.915 1.00 0.00 C ATOM 1180 O ILE F 73 -6.620 -3.508 -3.003 1.00 0.00 O ATOM 1181 CB ILE F 73 -6.557 -2.192 -5.970 1.00 0.00 C ATOM 1182 CG1 ILE F 73 -5.755 -2.442 -7.246 1.00 0.00 C ATOM 1183 CG2 ILE F 73 -5.681 -1.441 -4.965 1.00 0.00 C ATOM 1184 CD1 ILE F 73 -5.455 -1.108 -7.929 1.00 0.00 C ATOM 0 H ILE F 73 -8.751 -3.336 -6.595 1.00 0.00 H new ATOM 0 HA ILE F 73 -6.173 -4.227 -5.487 1.00 0.00 H new ATOM 0 HB ILE F 73 -7.438 -1.593 -6.199 1.00 0.00 H new ATOM 0 HG12 ILE F 73 -4.825 -2.958 -7.008 1.00 0.00 H new ATOM 0 HG13 ILE F 73 -6.316 -3.090 -7.920 1.00 0.00 H new ATOM 0 HG21 ILE F 73 -5.366 -0.490 -5.396 1.00 0.00 H new ATOM 0 HG22 ILE F 73 -6.250 -1.256 -4.054 1.00 0.00 H new ATOM 0 HG23 ILE F 73 -4.802 -2.041 -4.729 1.00 0.00 H new ATOM 0 HD11 ILE F 73 -4.883 -1.286 -8.839 1.00 0.00 H new ATOM 0 HD12 ILE F 73 -6.391 -0.609 -8.180 1.00 0.00 H new ATOM 0 HD13 ILE F 73 -4.877 -0.476 -7.255 1.00 0.00 H new ATOM 1196 N THR F 74 -8.669 -3.085 -3.709 1.00 0.00 N ATOM 1197 CA THR F 74 -9.213 -2.938 -2.338 1.00 0.00 C ATOM 1198 C THR F 74 -10.429 -3.852 -2.249 1.00 0.00 C ATOM 1199 O THR F 74 -11.170 -4.009 -3.198 1.00 0.00 O ATOM 1200 CB THR F 74 -9.613 -1.484 -2.057 1.00 0.00 C ATOM 1201 OG1 THR F 74 -10.895 -1.450 -1.455 1.00 0.00 O ATOM 1202 CG2 THR F 74 -9.642 -0.678 -3.358 1.00 0.00 C ATOM 0 H THR F 74 -9.355 -2.955 -4.453 1.00 0.00 H new ATOM 0 HA THR F 74 -8.462 -3.208 -1.596 1.00 0.00 H new ATOM 0 HB THR F 74 -8.878 -1.044 -1.383 1.00 0.00 H new ATOM 0 HG1 THR F 74 -11.574 -1.275 -2.140 1.00 0.00 H new ATOM 0 HG21 THR F 74 -9.928 0.352 -3.142 1.00 0.00 H new ATOM 0 HG22 THR F 74 -8.653 -0.692 -3.817 1.00 0.00 H new ATOM 0 HG23 THR F 74 -10.366 -1.119 -4.043 1.00 0.00 H new ATOM 1210 N THR F 75 -10.616 -4.493 -1.139 1.00 0.00 N ATOM 1211 CA THR F 75 -11.761 -5.443 -1.009 1.00 0.00 C ATOM 1212 C THR F 75 -13.106 -4.713 -1.074 1.00 0.00 C ATOM 1213 O THR F 75 -14.153 -5.327 -1.025 1.00 0.00 O ATOM 1214 CB THR F 75 -11.626 -6.191 0.313 1.00 0.00 C ATOM 1215 OG1 THR F 75 -11.726 -5.272 1.393 1.00 0.00 O ATOM 1216 CG2 THR F 75 -10.263 -6.876 0.337 1.00 0.00 C ATOM 0 H THR F 75 -10.028 -4.405 -0.310 1.00 0.00 H new ATOM 0 HA THR F 75 -11.735 -6.146 -1.842 1.00 0.00 H new ATOM 0 HB THR F 75 -12.418 -6.933 0.412 1.00 0.00 H new ATOM 0 HG1 THR F 75 -11.641 -5.754 2.242 1.00 0.00 H new ATOM 0 HG21 THR F 75 -10.145 -7.418 1.275 1.00 0.00 H new ATOM 0 HG22 THR F 75 -10.192 -7.574 -0.497 1.00 0.00 H new ATOM 0 HG23 THR F 75 -9.477 -6.126 0.250 1.00 0.00 H new ATOM 1224 N ARG F 76 -13.094 -3.418 -1.199 1.00 0.00 N ATOM 1225 CA ARG F 76 -14.375 -2.673 -1.284 1.00 0.00 C ATOM 1226 C ARG F 76 -14.895 -2.712 -2.725 1.00 0.00 C ATOM 1227 O ARG F 76 -16.025 -2.354 -2.992 1.00 0.00 O ATOM 1228 CB ARG F 76 -14.149 -1.219 -0.863 1.00 0.00 C ATOM 1229 CG ARG F 76 -15.474 -0.609 -0.402 1.00 0.00 C ATOM 1230 CD ARG F 76 -15.229 0.808 0.118 1.00 0.00 C ATOM 1231 NE ARG F 76 -16.519 1.554 0.155 1.00 0.00 N ATOM 1232 CZ ARG F 76 -16.569 2.791 -0.257 1.00 0.00 C ATOM 1233 NH1 ARG F 76 -16.468 3.060 -1.530 1.00 0.00 N ATOM 1234 NH2 ARG F 76 -16.720 3.760 0.605 1.00 0.00 N ATOM 0 H ARG F 76 -12.252 -2.844 -1.246 1.00 0.00 H new ATOM 0 HA ARG F 76 -15.107 -3.134 -0.621 1.00 0.00 H new ATOM 0 HB2 ARG F 76 -13.415 -1.172 -0.058 1.00 0.00 H new ATOM 0 HB3 ARG F 76 -13.744 -0.647 -1.697 1.00 0.00 H new ATOM 0 HG2 ARG F 76 -16.184 -0.587 -1.229 1.00 0.00 H new ATOM 0 HG3 ARG F 76 -15.917 -1.224 0.382 1.00 0.00 H new ATOM 0 HD2 ARG F 76 -14.790 0.770 1.115 1.00 0.00 H new ATOM 0 HD3 ARG F 76 -14.516 1.325 -0.525 1.00 0.00 H new ATOM 0 HE ARG F 76 -17.362 1.098 0.502 1.00 0.00 H new ATOM 0 HH11 ARG F 76 -16.350 2.303 -2.203 1.00 0.00 H new ATOM 0 HH12 ARG F 76 -16.507 4.027 -1.852 1.00 0.00 H new ATOM 0 HH21 ARG F 76 -16.799 3.550 1.600 1.00 0.00 H new ATOM 0 HH22 ARG F 76 -16.759 4.727 0.283 1.00 0.00 H new ATOM 1248 N ALA F 77 -14.084 -3.139 -3.664 1.00 0.00 N ATOM 1249 CA ALA F 77 -14.564 -3.181 -5.080 1.00 0.00 C ATOM 1250 C ALA F 77 -13.713 -4.140 -5.924 1.00 0.00 C ATOM 1251 O ALA F 77 -12.513 -3.988 -6.041 1.00 0.00 O ATOM 1252 CB ALA F 77 -14.481 -1.777 -5.684 1.00 0.00 C ATOM 0 H ALA F 77 -13.126 -3.455 -3.514 1.00 0.00 H new ATOM 0 HA ALA F 77 -15.594 -3.536 -5.082 1.00 0.00 H new ATOM 0 HB1 ALA F 77 -14.830 -1.804 -6.716 1.00 0.00 H new ATOM 0 HB2 ALA F 77 -15.106 -1.095 -5.107 1.00 0.00 H new ATOM 0 HB3 ALA F 77 -13.448 -1.431 -5.659 1.00 0.00 H new ATOM 1258 N GLN F 78 -14.341 -5.112 -6.534 1.00 0.00 N ATOM 1259 CA GLN F 78 -13.607 -6.075 -7.401 1.00 0.00 C ATOM 1260 C GLN F 78 -14.181 -5.986 -8.816 1.00 0.00 C ATOM 1261 O GLN F 78 -15.108 -5.242 -9.071 1.00 0.00 O ATOM 1262 CB GLN F 78 -13.777 -7.509 -6.878 1.00 0.00 C ATOM 1263 CG GLN F 78 -15.011 -7.598 -5.978 1.00 0.00 C ATOM 1264 CD GLN F 78 -14.707 -6.946 -4.628 1.00 0.00 C ATOM 1265 OE1 GLN F 78 -13.576 -7.206 -4.029 1.00 0.00 O flip ATOM 1266 NE2 GLN F 78 -15.507 -6.192 -4.111 1.00 0.00 N flip ATOM 0 H GLN F 78 -15.345 -5.279 -6.466 1.00 0.00 H new ATOM 0 HA GLN F 78 -12.546 -5.827 -7.398 1.00 0.00 H new ATOM 0 HB2 GLN F 78 -13.877 -8.200 -7.715 1.00 0.00 H new ATOM 0 HB3 GLN F 78 -12.889 -7.809 -6.321 1.00 0.00 H new ATOM 0 HG2 GLN F 78 -15.857 -7.100 -6.452 1.00 0.00 H new ATOM 0 HG3 GLN F 78 -15.295 -8.641 -5.834 1.00 0.00 H new ATOM 0 HE21 GLN F 78 -16.391 -5.988 -4.578 1.00 0.00 H new ATOM 0 HE22 GLN F 78 -15.295 -5.763 -3.210 1.00 0.00 H new ATOM 1275 N PHE F 79 -13.642 -6.731 -9.740 1.00 0.00 N ATOM 1276 CA PHE F 79 -14.163 -6.678 -11.137 1.00 0.00 C ATOM 1277 C PHE F 79 -14.016 -8.049 -11.780 1.00 0.00 C ATOM 1278 O PHE F 79 -13.679 -9.010 -11.139 1.00 0.00 O ATOM 1279 CB PHE F 79 -13.355 -5.666 -11.947 1.00 0.00 C ATOM 1280 CG PHE F 79 -13.715 -4.275 -11.498 1.00 0.00 C ATOM 1281 CD1 PHE F 79 -13.251 -3.806 -10.268 1.00 0.00 C ATOM 1282 CD2 PHE F 79 -14.516 -3.461 -12.304 1.00 0.00 C ATOM 1283 CE1 PHE F 79 -13.586 -2.523 -9.840 1.00 0.00 C ATOM 1284 CE2 PHE F 79 -14.853 -2.171 -11.877 1.00 0.00 C ATOM 1285 CZ PHE F 79 -14.388 -1.701 -10.642 1.00 0.00 C ATOM 0 H PHE F 79 -12.864 -7.374 -9.590 1.00 0.00 H new ATOM 0 HA PHE F 79 -15.212 -6.383 -11.119 1.00 0.00 H new ATOM 0 HB2 PHE F 79 -12.288 -5.841 -11.810 1.00 0.00 H new ATOM 0 HB3 PHE F 79 -13.563 -5.783 -13.010 1.00 0.00 H new ATOM 0 HD1 PHE F 79 -12.632 -4.438 -9.648 1.00 0.00 H new ATOM 0 HD2 PHE F 79 -14.874 -3.827 -13.255 1.00 0.00 H new ATOM 0 HE1 PHE F 79 -13.227 -2.162 -8.888 1.00 0.00 H new ATOM 0 HE2 PHE F 79 -15.470 -1.539 -12.499 1.00 0.00 H new ATOM 0 HZ PHE F 79 -14.647 -0.707 -10.309 1.00 0.00 H new ATOM 1295 N GLU F 80 -14.260 -8.153 -13.045 1.00 0.00 N ATOM 1296 CA GLU F 80 -14.117 -9.473 -13.697 1.00 0.00 C ATOM 1297 C GLU F 80 -12.758 -9.543 -14.390 1.00 0.00 C ATOM 1298 O GLU F 80 -12.226 -10.609 -14.632 1.00 0.00 O ATOM 1299 CB GLU F 80 -15.235 -9.647 -14.719 1.00 0.00 C ATOM 1300 CG GLU F 80 -15.274 -8.435 -15.651 1.00 0.00 C ATOM 1301 CD GLU F 80 -16.625 -7.729 -15.514 1.00 0.00 C ATOM 1302 OE1 GLU F 80 -17.565 -8.373 -15.080 1.00 0.00 O ATOM 1303 OE2 GLU F 80 -16.695 -6.558 -15.846 1.00 0.00 O ATOM 0 H GLU F 80 -14.550 -7.388 -13.654 1.00 0.00 H new ATOM 0 HA GLU F 80 -14.182 -10.269 -12.955 1.00 0.00 H new ATOM 0 HB2 GLU F 80 -15.074 -10.557 -15.297 1.00 0.00 H new ATOM 0 HB3 GLU F 80 -16.192 -9.757 -14.210 1.00 0.00 H new ATOM 0 HG2 GLU F 80 -14.465 -7.747 -15.404 1.00 0.00 H new ATOM 0 HG3 GLU F 80 -15.120 -8.751 -16.683 1.00 0.00 H new ATOM 1310 N THR F 81 -12.193 -8.415 -14.715 1.00 0.00 N ATOM 1311 CA THR F 81 -10.870 -8.415 -15.400 1.00 0.00 C ATOM 1312 C THR F 81 -10.080 -7.178 -14.982 1.00 0.00 C ATOM 1313 O THR F 81 -10.546 -6.356 -14.218 1.00 0.00 O ATOM 1314 CB THR F 81 -11.077 -8.392 -16.917 1.00 0.00 C ATOM 1315 OG1 THR F 81 -10.072 -7.599 -17.528 1.00 0.00 O ATOM 1316 CG2 THR F 81 -12.427 -7.777 -17.230 1.00 0.00 C ATOM 0 H THR F 81 -12.590 -7.492 -14.536 1.00 0.00 H new ATOM 0 HA THR F 81 -10.320 -9.313 -15.120 1.00 0.00 H new ATOM 0 HB THR F 81 -11.027 -9.412 -17.297 1.00 0.00 H new ATOM 0 HG1 THR F 81 -10.208 -7.589 -18.498 1.00 0.00 H new ATOM 0 HG21 THR F 81 -12.577 -7.759 -18.309 1.00 0.00 H new ATOM 0 HG22 THR F 81 -13.214 -8.370 -16.764 1.00 0.00 H new ATOM 0 HG23 THR F 81 -12.462 -6.759 -16.842 1.00 0.00 H new ATOM 1324 N LEU F 82 -8.893 -7.035 -15.492 1.00 0.00 N ATOM 1325 CA LEU F 82 -8.067 -5.851 -15.142 1.00 0.00 C ATOM 1326 C LEU F 82 -8.503 -4.687 -16.020 1.00 0.00 C ATOM 1327 O LEU F 82 -8.520 -3.550 -15.602 1.00 0.00 O ATOM 1328 CB LEU F 82 -6.594 -6.173 -15.371 1.00 0.00 C ATOM 1329 CG LEU F 82 -6.289 -7.530 -14.738 1.00 0.00 C ATOM 1330 CD1 LEU F 82 -5.826 -8.502 -15.818 1.00 0.00 C ATOM 1331 CD2 LEU F 82 -5.196 -7.377 -13.681 1.00 0.00 C ATOM 0 H LEU F 82 -8.457 -7.691 -16.140 1.00 0.00 H new ATOM 0 HA LEU F 82 -8.201 -5.586 -14.093 1.00 0.00 H new ATOM 0 HB2 LEU F 82 -6.373 -6.195 -16.438 1.00 0.00 H new ATOM 0 HB3 LEU F 82 -5.965 -5.400 -14.931 1.00 0.00 H new ATOM 0 HG LEU F 82 -7.191 -7.916 -14.264 1.00 0.00 H new ATOM 0 HD11 LEU F 82 -5.608 -9.470 -15.367 1.00 0.00 H new ATOM 0 HD12 LEU F 82 -6.612 -8.618 -16.564 1.00 0.00 H new ATOM 0 HD13 LEU F 82 -4.926 -8.114 -16.296 1.00 0.00 H new ATOM 0 HD21 LEU F 82 -4.984 -8.348 -13.234 1.00 0.00 H new ATOM 0 HD22 LEU F 82 -4.291 -6.986 -14.147 1.00 0.00 H new ATOM 0 HD23 LEU F 82 -5.532 -6.687 -12.907 1.00 0.00 H new ATOM 1343 N GLN F 83 -8.881 -4.970 -17.233 1.00 0.00 N ATOM 1344 CA GLN F 83 -9.351 -3.890 -18.132 1.00 0.00 C ATOM 1345 C GLN F 83 -10.666 -3.336 -17.577 1.00 0.00 C ATOM 1346 O GLN F 83 -11.019 -2.195 -17.795 1.00 0.00 O ATOM 1347 CB GLN F 83 -9.589 -4.458 -19.533 1.00 0.00 C ATOM 1348 CG GLN F 83 -9.745 -3.309 -20.532 1.00 0.00 C ATOM 1349 CD GLN F 83 -11.202 -3.224 -20.988 1.00 0.00 C ATOM 1350 OE1 GLN F 83 -11.897 -2.279 -20.671 1.00 0.00 O ATOM 1351 NE2 GLN F 83 -11.699 -4.180 -21.725 1.00 0.00 N ATOM 0 H GLN F 83 -8.884 -5.906 -17.639 1.00 0.00 H new ATOM 0 HA GLN F 83 -8.604 -3.099 -18.190 1.00 0.00 H new ATOM 0 HB2 GLN F 83 -8.755 -5.096 -19.824 1.00 0.00 H new ATOM 0 HB3 GLN F 83 -10.483 -5.081 -19.537 1.00 0.00 H new ATOM 0 HG2 GLN F 83 -9.442 -2.369 -20.071 1.00 0.00 H new ATOM 0 HG3 GLN F 83 -9.093 -3.468 -21.391 1.00 0.00 H new ATOM 0 HE21 GLN F 83 -11.116 -4.974 -21.992 1.00 0.00 H new ATOM 0 HE22 GLN F 83 -12.670 -4.133 -22.034 1.00 0.00 H new ATOM 1360 N GLN F 84 -11.394 -4.153 -16.863 1.00 0.00 N ATOM 1361 CA GLN F 84 -12.699 -3.710 -16.293 1.00 0.00 C ATOM 1362 C GLN F 84 -12.488 -2.828 -15.061 1.00 0.00 C ATOM 1363 O GLN F 84 -13.031 -1.746 -14.965 1.00 0.00 O ATOM 1364 CB GLN F 84 -13.510 -4.944 -15.910 1.00 0.00 C ATOM 1365 CG GLN F 84 -14.335 -5.437 -17.115 1.00 0.00 C ATOM 1366 CD GLN F 84 -13.559 -5.308 -18.438 1.00 0.00 C ATOM 1367 OE1 GLN F 84 -12.934 -4.304 -18.713 1.00 0.00 O ATOM 1368 NE2 GLN F 84 -13.599 -6.291 -19.295 1.00 0.00 N ATOM 0 H GLN F 84 -11.138 -5.117 -16.649 1.00 0.00 H new ATOM 0 HA GLN F 84 -13.233 -3.123 -17.041 1.00 0.00 H new ATOM 0 HB2 GLN F 84 -12.842 -5.735 -15.570 1.00 0.00 H new ATOM 0 HB3 GLN F 84 -14.174 -4.708 -15.078 1.00 0.00 H new ATOM 0 HG2 GLN F 84 -14.616 -6.479 -16.960 1.00 0.00 H new ATOM 0 HG3 GLN F 84 -15.260 -4.864 -17.180 1.00 0.00 H new ATOM 0 HE21 GLN F 84 -14.121 -7.139 -19.074 1.00 0.00 H new ATOM 0 HE22 GLN F 84 -13.108 -6.211 -20.186 1.00 0.00 H new ATOM 1377 N LEU F 85 -11.708 -3.273 -14.121 1.00 0.00 N ATOM 1378 CA LEU F 85 -11.473 -2.439 -12.895 1.00 0.00 C ATOM 1379 C LEU F 85 -10.602 -1.257 -13.261 1.00 0.00 C ATOM 1380 O LEU F 85 -10.626 -0.239 -12.612 1.00 0.00 O ATOM 1381 CB LEU F 85 -10.795 -3.275 -11.807 1.00 0.00 C ATOM 1382 CG LEU F 85 -9.295 -3.352 -12.085 1.00 0.00 C ATOM 1383 CD1 LEU F 85 -8.535 -2.544 -11.032 1.00 0.00 C ATOM 1384 CD2 LEU F 85 -8.849 -4.806 -12.040 1.00 0.00 C ATOM 0 H LEU F 85 -11.222 -4.170 -14.139 1.00 0.00 H new ATOM 0 HA LEU F 85 -12.429 -2.084 -12.510 1.00 0.00 H new ATOM 0 HB2 LEU F 85 -10.972 -2.830 -10.828 1.00 0.00 H new ATOM 0 HB3 LEU F 85 -11.223 -4.277 -11.783 1.00 0.00 H new ATOM 0 HG LEU F 85 -9.085 -2.939 -13.071 1.00 0.00 H new ATOM 0 HD11 LEU F 85 -7.465 -2.600 -11.232 1.00 0.00 H new ATOM 0 HD12 LEU F 85 -8.857 -1.503 -11.070 1.00 0.00 H new ATOM 0 HD13 LEU F 85 -8.741 -2.952 -10.042 1.00 0.00 H new ATOM 0 HD21 LEU F 85 -7.779 -4.865 -12.238 1.00 0.00 H new ATOM 0 HD22 LEU F 85 -9.059 -5.221 -11.054 1.00 0.00 H new ATOM 0 HD23 LEU F 85 -9.390 -5.376 -12.796 1.00 0.00 H new ATOM 1396 N VAL F 86 -9.848 -1.366 -14.306 1.00 0.00 N ATOM 1397 CA VAL F 86 -9.028 -0.213 -14.697 1.00 0.00 C ATOM 1398 C VAL F 86 -9.940 0.698 -15.508 1.00 0.00 C ATOM 1399 O VAL F 86 -9.714 1.883 -15.646 1.00 0.00 O ATOM 1400 CB VAL F 86 -7.816 -0.645 -15.522 1.00 0.00 C ATOM 1401 CG1 VAL F 86 -7.005 -1.674 -14.734 1.00 0.00 C ATOM 1402 CG2 VAL F 86 -8.284 -1.260 -16.836 1.00 0.00 C ATOM 0 H VAL F 86 -9.767 -2.193 -14.897 1.00 0.00 H new ATOM 0 HA VAL F 86 -8.631 0.298 -13.820 1.00 0.00 H new ATOM 0 HB VAL F 86 -7.193 0.224 -15.733 1.00 0.00 H new ATOM 0 HG11 VAL F 86 -6.140 -1.983 -15.321 1.00 0.00 H new ATOM 0 HG12 VAL F 86 -6.668 -1.231 -13.797 1.00 0.00 H new ATOM 0 HG13 VAL F 86 -7.628 -2.543 -14.521 1.00 0.00 H new ATOM 0 HG21 VAL F 86 -7.418 -1.567 -17.423 1.00 0.00 H new ATOM 0 HG22 VAL F 86 -8.909 -2.129 -16.629 1.00 0.00 H new ATOM 0 HG23 VAL F 86 -8.860 -0.524 -17.397 1.00 0.00 H new ATOM 1412 N GLN F 87 -11.001 0.135 -16.020 1.00 0.00 N ATOM 1413 CA GLN F 87 -11.978 0.931 -16.790 1.00 0.00 C ATOM 1414 C GLN F 87 -12.756 1.801 -15.814 1.00 0.00 C ATOM 1415 O GLN F 87 -13.022 2.960 -16.055 1.00 0.00 O ATOM 1416 CB GLN F 87 -12.958 -0.009 -17.479 1.00 0.00 C ATOM 1417 CG GLN F 87 -13.927 0.805 -18.334 1.00 0.00 C ATOM 1418 CD GLN F 87 -14.637 -0.119 -19.325 1.00 0.00 C ATOM 1419 OE1 GLN F 87 -14.001 -0.768 -20.130 1.00 0.00 O ATOM 1420 NE2 GLN F 87 -15.938 -0.207 -19.297 1.00 0.00 N ATOM 0 H GLN F 87 -11.228 -0.855 -15.932 1.00 0.00 H new ATOM 0 HA GLN F 87 -11.463 1.541 -17.532 1.00 0.00 H new ATOM 0 HB2 GLN F 87 -12.418 -0.722 -18.101 1.00 0.00 H new ATOM 0 HB3 GLN F 87 -13.508 -0.587 -16.736 1.00 0.00 H new ATOM 0 HG2 GLN F 87 -14.658 1.304 -17.698 1.00 0.00 H new ATOM 0 HG3 GLN F 87 -13.387 1.585 -18.871 1.00 0.00 H new ATOM 0 HE21 GLN F 87 -16.472 0.339 -18.620 1.00 0.00 H new ATOM 0 HE22 GLN F 87 -16.422 -0.821 -19.952 1.00 0.00 H new ATOM 1429 N HIS F 88 -13.120 1.224 -14.707 1.00 0.00 N ATOM 1430 CA HIS F 88 -13.884 1.968 -13.684 1.00 0.00 C ATOM 1431 C HIS F 88 -12.916 2.815 -12.874 1.00 0.00 C ATOM 1432 O HIS F 88 -13.242 3.878 -12.385 1.00 0.00 O ATOM 1433 CB HIS F 88 -14.568 0.964 -12.762 1.00 0.00 C ATOM 1434 CG HIS F 88 -15.802 1.581 -12.165 1.00 0.00 C ATOM 1435 ND1 HIS F 88 -16.991 1.686 -12.870 1.00 0.00 N ATOM 1436 CD2 HIS F 88 -16.049 2.128 -10.930 1.00 0.00 C ATOM 1437 CE1 HIS F 88 -17.891 2.276 -12.061 1.00 0.00 C ATOM 1438 NE2 HIS F 88 -17.368 2.566 -10.867 1.00 0.00 N ATOM 0 H HIS F 88 -12.915 0.254 -14.468 1.00 0.00 H new ATOM 0 HA HIS F 88 -14.630 2.608 -14.155 1.00 0.00 H new ATOM 0 HB2 HIS F 88 -14.833 0.066 -13.320 1.00 0.00 H new ATOM 0 HB3 HIS F 88 -13.884 0.658 -11.971 1.00 0.00 H new ATOM 0 HD2 HIS F 88 -15.329 2.206 -10.129 1.00 0.00 H new ATOM 0 HE1 HIS F 88 -18.912 2.489 -12.343 1.00 0.00 H new ATOM 0 HE2 HIS F 88 -17.835 3.013 -10.078 1.00 0.00 H new ATOM 1446 N TYR F 89 -11.729 2.321 -12.719 1.00 0.00 N ATOM 1447 CA TYR F 89 -10.700 3.043 -11.928 1.00 0.00 C ATOM 1448 C TYR F 89 -10.145 4.209 -12.748 1.00 0.00 C ATOM 1449 O TYR F 89 -9.672 5.190 -12.209 1.00 0.00 O ATOM 1450 CB TYR F 89 -9.590 2.057 -11.556 1.00 0.00 C ATOM 1451 CG TYR F 89 -10.079 1.105 -10.485 1.00 0.00 C ATOM 1452 CD1 TYR F 89 -11.434 0.756 -10.410 1.00 0.00 C ATOM 1453 CD2 TYR F 89 -9.172 0.563 -9.567 1.00 0.00 C ATOM 1454 CE1 TYR F 89 -11.878 -0.124 -9.429 1.00 0.00 C ATOM 1455 CE2 TYR F 89 -9.619 -0.321 -8.578 1.00 0.00 C ATOM 1456 CZ TYR F 89 -10.974 -0.665 -8.508 1.00 0.00 C ATOM 1457 OH TYR F 89 -11.418 -1.537 -7.536 1.00 0.00 O ATOM 0 H TYR F 89 -11.420 1.432 -13.113 1.00 0.00 H new ATOM 0 HA TYR F 89 -11.137 3.450 -11.016 1.00 0.00 H new ATOM 0 HB2 TYR F 89 -9.280 1.497 -12.438 1.00 0.00 H new ATOM 0 HB3 TYR F 89 -8.715 2.600 -11.199 1.00 0.00 H new ATOM 0 HD1 TYR F 89 -12.136 1.172 -11.117 1.00 0.00 H new ATOM 0 HD2 TYR F 89 -8.126 0.827 -9.622 1.00 0.00 H new ATOM 0 HE1 TYR F 89 -12.923 -0.391 -9.378 1.00 0.00 H new ATOM 0 HE2 TYR F 89 -8.919 -0.737 -7.869 1.00 0.00 H new ATOM 0 HH TYR F 89 -10.662 -1.820 -6.980 1.00 0.00 H new ATOM 1467 N SER F 90 -10.219 4.131 -14.043 1.00 0.00 N ATOM 1468 CA SER F 90 -9.721 5.248 -14.873 1.00 0.00 C ATOM 1469 C SER F 90 -10.781 6.344 -14.899 1.00 0.00 C ATOM 1470 O SER F 90 -10.480 7.521 -14.931 1.00 0.00 O ATOM 1471 CB SER F 90 -9.456 4.753 -16.289 1.00 0.00 C ATOM 1472 OG SER F 90 -8.155 4.189 -16.361 1.00 0.00 O ATOM 0 H SER F 90 -10.604 3.340 -14.560 1.00 0.00 H new ATOM 0 HA SER F 90 -8.793 5.640 -14.456 1.00 0.00 H new ATOM 0 HB2 SER F 90 -10.202 4.010 -16.571 1.00 0.00 H new ATOM 0 HB3 SER F 90 -9.545 5.578 -16.996 1.00 0.00 H new ATOM 0 HG SER F 90 -7.987 3.870 -17.272 1.00 0.00 H new ATOM 1478 N GLU F 91 -12.026 5.959 -14.859 1.00 0.00 N ATOM 1479 CA GLU F 91 -13.121 6.966 -14.853 1.00 0.00 C ATOM 1480 C GLU F 91 -13.454 7.313 -13.401 1.00 0.00 C ATOM 1481 O GLU F 91 -14.193 8.236 -13.122 1.00 0.00 O ATOM 1482 CB GLU F 91 -14.359 6.382 -15.539 1.00 0.00 C ATOM 1483 CG GLU F 91 -14.001 5.956 -16.964 1.00 0.00 C ATOM 1484 CD GLU F 91 -14.955 6.627 -17.952 1.00 0.00 C ATOM 1485 OE1 GLU F 91 -16.111 6.805 -17.602 1.00 0.00 O ATOM 1486 OE2 GLU F 91 -14.515 6.952 -19.043 1.00 0.00 O ATOM 0 H GLU F 91 -12.332 4.987 -14.830 1.00 0.00 H new ATOM 0 HA GLU F 91 -12.808 7.862 -15.389 1.00 0.00 H new ATOM 0 HB2 GLU F 91 -14.730 5.526 -14.975 1.00 0.00 H new ATOM 0 HB3 GLU F 91 -15.159 7.122 -15.560 1.00 0.00 H new ATOM 0 HG2 GLU F 91 -12.972 6.234 -17.190 1.00 0.00 H new ATOM 0 HG3 GLU F 91 -14.066 4.872 -17.058 1.00 0.00 H new ATOM 1493 N ARG F 92 -12.898 6.578 -12.474 1.00 0.00 N ATOM 1494 CA ARG F 92 -13.158 6.853 -11.032 1.00 0.00 C ATOM 1495 C ARG F 92 -11.936 6.411 -10.230 1.00 0.00 C ATOM 1496 O ARG F 92 -11.263 5.469 -10.586 1.00 0.00 O ATOM 1497 CB ARG F 92 -14.387 6.073 -10.560 1.00 0.00 C ATOM 1498 CG ARG F 92 -15.335 5.837 -11.739 1.00 0.00 C ATOM 1499 CD ARG F 92 -16.577 5.088 -11.251 1.00 0.00 C ATOM 1500 NE ARG F 92 -17.663 6.066 -10.957 1.00 0.00 N ATOM 1501 CZ ARG F 92 -17.730 6.635 -9.786 1.00 0.00 C ATOM 1502 NH1 ARG F 92 -17.911 5.908 -8.717 1.00 0.00 N ATOM 1503 NH2 ARG F 92 -17.617 7.931 -9.682 1.00 0.00 N ATOM 0 H ARG F 92 -12.271 5.794 -12.656 1.00 0.00 H new ATOM 0 HA ARG F 92 -13.344 7.917 -10.887 1.00 0.00 H new ATOM 0 HB2 ARG F 92 -14.081 5.119 -10.131 1.00 0.00 H new ATOM 0 HB3 ARG F 92 -14.900 6.626 -9.774 1.00 0.00 H new ATOM 0 HG2 ARG F 92 -15.623 6.789 -12.185 1.00 0.00 H new ATOM 0 HG3 ARG F 92 -14.831 5.261 -12.515 1.00 0.00 H new ATOM 0 HD2 ARG F 92 -16.908 4.378 -12.009 1.00 0.00 H new ATOM 0 HD3 ARG F 92 -16.340 4.512 -10.357 1.00 0.00 H new ATOM 0 HE ARG F 92 -18.354 6.290 -11.673 1.00 0.00 H new ATOM 0 HH11 ARG F 92 -18.000 4.895 -8.798 1.00 0.00 H new ATOM 0 HH12 ARG F 92 -17.963 6.353 -7.801 1.00 0.00 H new ATOM 0 HH21 ARG F 92 -17.476 8.499 -10.517 1.00 0.00 H new ATOM 0 HH22 ARG F 92 -17.670 8.376 -8.765 1.00 0.00 H new ATOM 1517 N ALA F 93 -11.631 7.081 -9.159 1.00 0.00 N ATOM 1518 CA ALA F 93 -10.433 6.687 -8.367 1.00 0.00 C ATOM 1519 C ALA F 93 -10.586 5.258 -7.849 1.00 0.00 C ATOM 1520 O ALA F 93 -9.683 4.457 -7.961 1.00 0.00 O ATOM 1521 CB ALA F 93 -10.248 7.640 -7.186 1.00 0.00 C ATOM 0 H ALA F 93 -12.153 7.879 -8.797 1.00 0.00 H new ATOM 0 HA ALA F 93 -9.558 6.740 -9.015 1.00 0.00 H new ATOM 0 HB1 ALA F 93 -9.369 7.343 -6.613 1.00 0.00 H new ATOM 0 HB2 ALA F 93 -10.114 8.656 -7.556 1.00 0.00 H new ATOM 0 HB3 ALA F 93 -11.129 7.601 -6.545 1.00 0.00 H new ATOM 1527 N ALA F 94 -11.715 4.949 -7.269 1.00 0.00 N ATOM 1528 CA ALA F 94 -11.947 3.579 -6.719 1.00 0.00 C ATOM 1529 C ALA F 94 -11.439 3.526 -5.278 1.00 0.00 C ATOM 1530 O ALA F 94 -11.960 2.802 -4.455 1.00 0.00 O ATOM 1531 CB ALA F 94 -11.223 2.528 -7.567 1.00 0.00 C ATOM 0 H ALA F 94 -12.496 5.594 -7.151 1.00 0.00 H new ATOM 0 HA ALA F 94 -13.015 3.361 -6.742 1.00 0.00 H new ATOM 0 HB1 ALA F 94 -11.404 1.537 -7.151 1.00 0.00 H new ATOM 0 HB2 ALA F 94 -11.597 2.566 -8.590 1.00 0.00 H new ATOM 0 HB3 ALA F 94 -10.152 2.733 -7.564 1.00 0.00 H new ATOM 1537 N GLY F 95 -10.435 4.300 -4.958 1.00 0.00 N ATOM 1538 CA GLY F 95 -9.919 4.296 -3.563 1.00 0.00 C ATOM 1539 C GLY F 95 -8.407 4.044 -3.546 1.00 0.00 C ATOM 1540 O GLY F 95 -7.780 4.081 -2.507 1.00 0.00 O ATOM 0 H GLY F 95 -9.954 4.930 -5.600 1.00 0.00 H new ATOM 0 HA2 GLY F 95 -10.139 5.251 -3.086 1.00 0.00 H new ATOM 0 HA3 GLY F 95 -10.428 3.525 -2.984 1.00 0.00 H new ATOM 1544 N LEU F 96 -7.810 3.789 -4.678 1.00 0.00 N ATOM 1545 CA LEU F 96 -6.340 3.540 -4.695 1.00 0.00 C ATOM 1546 C LEU F 96 -5.596 4.876 -4.834 1.00 0.00 C ATOM 1547 O LEU F 96 -5.662 5.719 -3.961 1.00 0.00 O ATOM 1548 CB LEU F 96 -6.002 2.624 -5.870 1.00 0.00 C ATOM 1549 CG LEU F 96 -6.737 3.110 -7.116 1.00 0.00 C ATOM 1550 CD1 LEU F 96 -5.806 3.008 -8.321 1.00 0.00 C ATOM 1551 CD2 LEU F 96 -7.971 2.244 -7.356 1.00 0.00 C ATOM 0 H LEU F 96 -8.272 3.742 -5.586 1.00 0.00 H new ATOM 0 HA LEU F 96 -6.033 3.061 -3.765 1.00 0.00 H new ATOM 0 HB2 LEU F 96 -4.926 2.621 -6.046 1.00 0.00 H new ATOM 0 HB3 LEU F 96 -6.290 1.598 -5.641 1.00 0.00 H new ATOM 0 HG LEU F 96 -7.045 4.146 -6.974 1.00 0.00 H new ATOM 0 HD11 LEU F 96 -6.327 3.354 -9.214 1.00 0.00 H new ATOM 0 HD12 LEU F 96 -4.924 3.626 -8.153 1.00 0.00 H new ATOM 0 HD13 LEU F 96 -5.501 1.971 -8.458 1.00 0.00 H new ATOM 0 HD21 LEU F 96 -8.493 2.594 -8.246 1.00 0.00 H new ATOM 0 HD22 LEU F 96 -7.666 1.207 -7.498 1.00 0.00 H new ATOM 0 HD23 LEU F 96 -8.636 2.312 -6.495 1.00 0.00 H new ATOM 1563 N SER F 97 -4.898 5.088 -5.922 1.00 0.00 N ATOM 1564 CA SER F 97 -4.176 6.376 -6.098 1.00 0.00 C ATOM 1565 C SER F 97 -5.099 7.353 -6.819 1.00 0.00 C ATOM 1566 O SER F 97 -4.882 8.548 -6.812 1.00 0.00 O ATOM 1567 CB SER F 97 -2.910 6.148 -6.924 1.00 0.00 C ATOM 1568 OG SER F 97 -2.370 7.400 -7.319 1.00 0.00 O ATOM 0 H SER F 97 -4.800 4.425 -6.691 1.00 0.00 H new ATOM 0 HA SER F 97 -3.891 6.782 -5.128 1.00 0.00 H new ATOM 0 HB2 SER F 97 -2.177 5.592 -6.339 1.00 0.00 H new ATOM 0 HB3 SER F 97 -3.140 5.546 -7.803 1.00 0.00 H new ATOM 0 HG SER F 97 -2.159 7.378 -8.276 1.00 0.00 H new ATOM 1574 N SER F 98 -6.142 6.841 -7.424 1.00 0.00 N ATOM 1575 CA SER F 98 -7.123 7.718 -8.137 1.00 0.00 C ATOM 1576 C SER F 98 -6.667 8.011 -9.571 1.00 0.00 C ATOM 1577 O SER F 98 -5.567 8.473 -9.806 1.00 0.00 O ATOM 1578 CB SER F 98 -7.289 9.036 -7.378 1.00 0.00 C ATOM 1579 OG SER F 98 -8.502 9.661 -7.771 1.00 0.00 O ATOM 0 H SER F 98 -6.358 5.845 -7.455 1.00 0.00 H new ATOM 0 HA SER F 98 -8.076 7.191 -8.179 1.00 0.00 H new ATOM 0 HB2 SER F 98 -7.295 8.851 -6.304 1.00 0.00 H new ATOM 0 HB3 SER F 98 -6.445 9.695 -7.583 1.00 0.00 H new ATOM 0 HG SER F 98 -8.791 9.300 -8.635 1.00 0.00 H new ATOM 1585 N ARG F 99 -7.526 7.767 -10.527 1.00 0.00 N ATOM 1586 CA ARG F 99 -7.186 8.047 -11.954 1.00 0.00 C ATOM 1587 C ARG F 99 -6.016 7.176 -12.420 1.00 0.00 C ATOM 1588 O ARG F 99 -4.868 7.465 -12.148 1.00 0.00 O ATOM 1589 CB ARG F 99 -6.806 9.522 -12.102 1.00 0.00 C ATOM 1590 CG ARG F 99 -8.033 10.395 -11.822 1.00 0.00 C ATOM 1591 CD ARG F 99 -9.229 9.862 -12.612 1.00 0.00 C ATOM 1592 NE ARG F 99 -10.340 10.854 -12.560 1.00 0.00 N ATOM 1593 CZ ARG F 99 -10.105 12.110 -12.819 1.00 0.00 C ATOM 1594 NH1 ARG F 99 -9.495 12.855 -11.939 1.00 0.00 N ATOM 1595 NH2 ARG F 99 -10.481 12.623 -13.959 1.00 0.00 N ATOM 0 H ARG F 99 -8.458 7.382 -10.378 1.00 0.00 H new ATOM 0 HA ARG F 99 -8.056 7.817 -12.569 1.00 0.00 H new ATOM 0 HB2 ARG F 99 -6.002 9.773 -11.410 1.00 0.00 H new ATOM 0 HB3 ARG F 99 -6.432 9.713 -13.108 1.00 0.00 H new ATOM 0 HG2 ARG F 99 -8.258 10.393 -10.755 1.00 0.00 H new ATOM 0 HG3 ARG F 99 -7.829 11.428 -12.103 1.00 0.00 H new ATOM 0 HD2 ARG F 99 -8.941 9.676 -13.647 1.00 0.00 H new ATOM 0 HD3 ARG F 99 -9.558 8.909 -12.196 1.00 0.00 H new ATOM 0 HE ARG F 99 -11.284 10.550 -12.322 1.00 0.00 H new ATOM 0 HH11 ARG F 99 -9.202 12.455 -11.048 1.00 0.00 H new ATOM 0 HH12 ARG F 99 -9.311 13.838 -12.142 1.00 0.00 H new ATOM 0 HH21 ARG F 99 -10.959 12.041 -14.647 1.00 0.00 H new ATOM 0 HH22 ARG F 99 -10.297 13.606 -14.161 1.00 0.00 H new ATOM 1609 N LEU F 100 -6.298 6.118 -13.136 1.00 0.00 N ATOM 1610 CA LEU F 100 -5.189 5.241 -13.633 1.00 0.00 C ATOM 1611 C LEU F 100 -4.460 5.947 -14.782 1.00 0.00 C ATOM 1612 O LEU F 100 -4.320 7.153 -14.782 1.00 0.00 O ATOM 1613 CB LEU F 100 -5.746 3.901 -14.130 1.00 0.00 C ATOM 1614 CG LEU F 100 -7.093 3.609 -13.466 1.00 0.00 C ATOM 1615 CD1 LEU F 100 -7.491 2.162 -13.726 1.00 0.00 C ATOM 1616 CD2 LEU F 100 -6.998 3.842 -11.958 1.00 0.00 C ATOM 0 H LEU F 100 -7.239 5.823 -13.398 1.00 0.00 H new ATOM 0 HA LEU F 100 -4.496 5.051 -12.814 1.00 0.00 H new ATOM 0 HB2 LEU F 100 -5.865 3.928 -15.213 1.00 0.00 H new ATOM 0 HB3 LEU F 100 -5.041 3.100 -13.906 1.00 0.00 H new ATOM 0 HG LEU F 100 -7.844 4.278 -13.887 1.00 0.00 H new ATOM 0 HD11 LEU F 100 -8.451 1.958 -13.252 1.00 0.00 H new ATOM 0 HD12 LEU F 100 -7.574 1.995 -14.800 1.00 0.00 H new ATOM 0 HD13 LEU F 100 -6.733 1.496 -13.313 1.00 0.00 H new ATOM 0 HD21 LEU F 100 -7.962 3.631 -11.496 1.00 0.00 H new ATOM 0 HD22 LEU F 100 -6.241 3.182 -11.535 1.00 0.00 H new ATOM 0 HD23 LEU F 100 -6.723 4.879 -11.767 1.00 0.00 H new ATOM 1628 N VAL F 101 -3.992 5.214 -15.761 1.00 0.00 N ATOM 1629 CA VAL F 101 -3.276 5.866 -16.891 1.00 0.00 C ATOM 1630 C VAL F 101 -4.113 7.027 -17.426 1.00 0.00 C ATOM 1631 O VAL F 101 -4.956 6.856 -18.284 1.00 0.00 O ATOM 1632 CB VAL F 101 -3.042 4.846 -18.006 1.00 0.00 C ATOM 1633 CG1 VAL F 101 -1.739 4.088 -17.739 1.00 0.00 C ATOM 1634 CG2 VAL F 101 -4.208 3.855 -18.053 1.00 0.00 C ATOM 0 H VAL F 101 -4.076 4.199 -15.824 1.00 0.00 H new ATOM 0 HA VAL F 101 -2.316 6.245 -16.540 1.00 0.00 H new ATOM 0 HB VAL F 101 -2.972 5.366 -18.961 1.00 0.00 H new ATOM 0 HG11 VAL F 101 -1.572 3.361 -18.534 1.00 0.00 H new ATOM 0 HG12 VAL F 101 -0.908 4.792 -17.711 1.00 0.00 H new ATOM 0 HG13 VAL F 101 -1.809 3.570 -16.782 1.00 0.00 H new ATOM 0 HG21 VAL F 101 -4.037 3.130 -18.849 1.00 0.00 H new ATOM 0 HG22 VAL F 101 -4.282 3.335 -17.098 1.00 0.00 H new ATOM 0 HG23 VAL F 101 -5.136 4.394 -18.246 1.00 0.00 H new ATOM 1644 N VAL F 102 -3.884 8.208 -16.924 1.00 0.00 N ATOM 1645 CA VAL F 102 -4.661 9.384 -17.398 1.00 0.00 C ATOM 1646 C VAL F 102 -4.241 9.755 -18.828 1.00 0.00 C ATOM 1647 O VAL F 102 -5.086 9.978 -19.673 1.00 0.00 O ATOM 1648 CB VAL F 102 -4.418 10.575 -16.467 1.00 0.00 C ATOM 1649 CG1 VAL F 102 -5.639 11.496 -16.488 1.00 0.00 C ATOM 1650 CG2 VAL F 102 -4.186 10.072 -15.041 1.00 0.00 C ATOM 0 H VAL F 102 -3.190 8.409 -16.204 1.00 0.00 H new ATOM 0 HA VAL F 102 -5.721 9.130 -17.393 1.00 0.00 H new ATOM 0 HB VAL F 102 -3.540 11.125 -16.805 1.00 0.00 H new ATOM 0 HG11 VAL F 102 -5.466 12.344 -15.825 1.00 0.00 H new ATOM 0 HG12 VAL F 102 -5.805 11.857 -17.503 1.00 0.00 H new ATOM 0 HG13 VAL F 102 -6.517 10.945 -16.151 1.00 0.00 H new ATOM 0 HG21 VAL F 102 -4.013 10.921 -14.379 1.00 0.00 H new ATOM 0 HG22 VAL F 102 -5.063 9.521 -14.702 1.00 0.00 H new ATOM 0 HG23 VAL F 102 -3.316 9.416 -15.024 1.00 0.00 H new ATOM 1797 N GLU P 205 -0.432 -0.343 -1.143 1.00 0.00 N ATOM 1798 CA GLU P 205 -1.399 0.599 -0.513 1.00 0.00 C ATOM 1799 C GLU P 205 -2.787 -0.047 -0.479 1.00 0.00 C ATOM 1800 O GLU P 205 -3.328 -0.428 -1.497 1.00 0.00 O ATOM 1801 CB GLU P 205 -1.459 1.893 -1.328 1.00 0.00 C ATOM 1802 CG GLU P 205 -0.185 2.707 -1.087 1.00 0.00 C ATOM 1803 CD GLU P 205 -0.473 3.816 -0.075 1.00 0.00 C ATOM 1804 OE1 GLU P 205 -0.336 3.560 1.111 1.00 0.00 O ATOM 1805 OE2 GLU P 205 -0.826 4.903 -0.501 1.00 0.00 O ATOM 0 HA GLU P 205 -1.076 0.826 0.503 1.00 0.00 H new ATOM 0 HB2 GLU P 205 -1.561 1.663 -2.389 1.00 0.00 H new ATOM 0 HB3 GLU P 205 -2.335 2.475 -1.042 1.00 0.00 H new ATOM 0 HG2 GLU P 205 0.609 2.059 -0.716 1.00 0.00 H new ATOM 0 HG3 GLU P 205 0.167 3.138 -2.024 1.00 0.00 H new ATOM 1812 N GLU P 206 -3.365 -0.172 0.683 1.00 0.00 N ATOM 1813 CA GLU P 206 -4.716 -0.795 0.779 1.00 0.00 C ATOM 1814 C GLU P 206 -5.737 0.263 1.202 1.00 0.00 C ATOM 1815 O GLU P 206 -5.388 1.363 1.582 1.00 0.00 O ATOM 1816 CB GLU P 206 -4.686 -1.919 1.817 1.00 0.00 C ATOM 1817 CG GLU P 206 -4.457 -3.257 1.112 1.00 0.00 C ATOM 1818 CD GLU P 206 -4.880 -4.401 2.037 1.00 0.00 C ATOM 1819 OE1 GLU P 206 -4.438 -4.411 3.173 1.00 0.00 O ATOM 1820 OE2 GLU P 206 -5.640 -5.246 1.591 1.00 0.00 O ATOM 0 H GLU P 206 -2.961 0.130 1.570 1.00 0.00 H new ATOM 0 HA GLU P 206 -4.998 -1.204 -0.191 1.00 0.00 H new ATOM 0 HB2 GLU P 206 -3.893 -1.738 2.543 1.00 0.00 H new ATOM 0 HB3 GLU P 206 -5.625 -1.943 2.370 1.00 0.00 H new ATOM 0 HG2 GLU P 206 -5.029 -3.294 0.185 1.00 0.00 H new ATOM 0 HG3 GLU P 206 -3.406 -3.363 0.842 1.00 0.00 H new ATOM 1827 N ILE P 207 -7.000 -0.062 1.140 1.00 0.00 N ATOM 1828 CA ILE P 207 -8.045 0.923 1.539 1.00 0.00 C ATOM 1829 C ILE P 207 -8.941 0.307 2.619 1.00 0.00 C ATOM 1830 O ILE P 207 -9.958 -0.284 2.314 1.00 0.00 O ATOM 1831 CB ILE P 207 -8.892 1.288 0.316 1.00 0.00 C ATOM 1832 CG1 ILE P 207 -8.081 2.199 -0.609 1.00 0.00 C ATOM 1833 CG2 ILE P 207 -10.157 2.022 0.768 1.00 0.00 C ATOM 1834 CD1 ILE P 207 -7.521 1.380 -1.774 1.00 0.00 C ATOM 0 H ILE P 207 -7.353 -0.967 0.830 1.00 0.00 H new ATOM 0 HA ILE P 207 -7.569 1.821 1.933 1.00 0.00 H new ATOM 0 HB ILE P 207 -9.171 0.379 -0.216 1.00 0.00 H new ATOM 0 HG12 ILE P 207 -8.711 3.004 -0.987 1.00 0.00 H new ATOM 0 HG13 ILE P 207 -7.267 2.665 -0.054 1.00 0.00 H new ATOM 0 HG21 ILE P 207 -10.758 2.281 -0.103 1.00 0.00 H new ATOM 0 HG22 ILE P 207 -10.735 1.377 1.429 1.00 0.00 H new ATOM 0 HG23 ILE P 207 -9.879 2.932 1.300 1.00 0.00 H new ATOM 0 HD11 ILE P 207 -6.944 2.030 -2.432 1.00 0.00 H new ATOM 0 HD12 ILE P 207 -6.876 0.591 -1.387 1.00 0.00 H new ATOM 0 HD13 ILE P 207 -8.343 0.935 -2.334 1.00 0.00 H new