USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=23 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 65 LYS NZ :NH3+ -177:sc= 0.163 (180deg=-0.00184) USER MOD Set 1.2: F 71 TYR OH : rot 30:sc= 0.0179 USER MOD Set 2.1: F 54 LYS NZ :NH3+ 174:sc= 0.782 (180deg=0) USER MOD Set 2.2: F 57 HIS : no HD1:sc= -4.65! C(o=-3.9!,f=-11!) USER MOD Set 3.1: F 46 SER OG : rot 154:sc= -5.43! USER MOD Set 3.2: F 60 HIS : no HD1:sc= -8.34! C(o=-14!,f=-14!) USER MOD Set 4.1: F 8 TYR OH : rot -173:sc= -0.3! USER MOD Set 4.2: F 43 TYR OH : rot 180:sc= -0.104 USER MOD Single : F 3 GLN : amide:sc= 0 X(o=0,f=0) 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= -2.66 K(o=-2.7,f=-1.8!) USER MOD Single : F 23 SER OG : rot -160:sc= -0.238 USER MOD Single : F 26 ASN : amide:sc= -2.29 X(o=-2.3,f=-1.8) USER MOD Single : F 30 THR OG1 : rot 85:sc= 0.833 USER MOD Single : F 36 SER OG : rot 108:sc= -0.683 USER MOD Single : F 38 THR OG1 : rot 180:sc= 0 USER MOD Single : F 39 THR OG1 : rot -150:sc= 0.0301 USER MOD Single : F 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 44 SER OG : rot 140:sc= -0.659 USER MOD Single : F 53 MET CE :methyl -121:sc= -12.1! (180deg=-17.6!) USER MOD Single : F 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 61 TYR OH : rot 15:sc= -1.84! USER MOD Single : F 62 LYS NZ :NH3+ -140:sc= -0.908 (180deg=-1.37) USER MOD Single : F 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : F 72 TYR OH : rot 180:sc= -0.093 USER MOD Single : F 74 THR OG1 : rot -160:sc= 0.571 USER MOD Single : F 75 THR OG1 : rot 180:sc= 0 USER MOD Single : F 78 GLN : amide:sc= -0.201 X(o=-0.2,f=0) USER MOD Single : F 81 THR OG1 : rot -128:sc= -0.807! USER MOD Single : F 83 GLN : amide:sc= -0.843 K(o=-0.84,f=-2.3!) USER MOD Single : F 84 GLN : amide:sc= -12! C(o=-12!,f=-19!) USER MOD Single : F 87 GLN : amide:sc=-0.000314 X(o=-0.00031,f=0) USER MOD Single : F 88 HIS : no HD1:sc= -0.624 X(o=-0.62,f=-0.48) USER MOD Single : F 89 TYR OH : rot 180:sc= 0 USER MOD Single : F 90 SER OG : rot 180:sc= -2.82! USER MOD Single : F 97 SER OG : rot 180:sc= 0 USER MOD Single : F 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 14 N ILE F 2 -6.206 -7.425 -22.327 1.00 0.00 N ATOM 15 CA ILE F 2 -6.627 -6.163 -21.653 1.00 0.00 C ATOM 16 C ILE F 2 -5.950 -4.971 -22.336 1.00 0.00 C ATOM 17 O ILE F 2 -5.382 -5.097 -23.403 1.00 0.00 O ATOM 18 CB ILE F 2 -6.236 -6.207 -20.171 1.00 0.00 C ATOM 19 CG1 ILE F 2 -4.858 -6.857 -20.013 1.00 0.00 C ATOM 20 CG2 ILE F 2 -7.270 -7.024 -19.396 1.00 0.00 C ATOM 21 CD1 ILE F 2 -4.370 -6.672 -18.575 1.00 0.00 C ATOM 0 HA ILE F 2 -7.709 -6.056 -21.729 1.00 0.00 H new ATOM 0 HB ILE F 2 -6.201 -5.190 -19.781 1.00 0.00 H new ATOM 0 HG12 ILE F 2 -4.914 -7.918 -20.256 1.00 0.00 H new ATOM 0 HG13 ILE F 2 -4.150 -6.408 -20.709 1.00 0.00 H new ATOM 0 HG21 ILE F 2 -6.993 -7.056 -18.342 1.00 0.00 H new ATOM 0 HG22 ILE F 2 -8.251 -6.561 -19.499 1.00 0.00 H new ATOM 0 HG23 ILE F 2 -7.304 -8.039 -19.793 1.00 0.00 H new ATOM 0 HD11 ILE F 2 -3.389 -7.134 -18.461 1.00 0.00 H new ATOM 0 HD12 ILE F 2 -4.298 -5.608 -18.349 1.00 0.00 H new ATOM 0 HD13 ILE F 2 -5.074 -7.142 -17.888 1.00 0.00 H new ATOM 33 N GLN F 3 -6.008 -3.813 -21.733 1.00 0.00 N ATOM 34 CA GLN F 3 -5.372 -2.614 -22.350 1.00 0.00 C ATOM 35 C GLN F 3 -3.896 -2.557 -21.958 1.00 0.00 C ATOM 36 O GLN F 3 -3.434 -1.594 -21.380 1.00 0.00 O ATOM 37 CB GLN F 3 -6.078 -1.351 -21.855 1.00 0.00 C ATOM 38 CG GLN F 3 -6.319 -0.405 -23.033 1.00 0.00 C ATOM 39 CD GLN F 3 -7.438 0.576 -22.680 1.00 0.00 C ATOM 40 OE1 GLN F 3 -8.591 0.330 -22.974 1.00 0.00 O ATOM 41 NE2 GLN F 3 -7.146 1.685 -22.058 1.00 0.00 N ATOM 0 H GLN F 3 -6.469 -3.646 -20.839 1.00 0.00 H new ATOM 0 HA GLN F 3 -5.457 -2.678 -23.435 1.00 0.00 H new ATOM 0 HB2 GLN F 3 -7.026 -1.612 -21.385 1.00 0.00 H new ATOM 0 HB3 GLN F 3 -5.472 -0.857 -21.096 1.00 0.00 H new ATOM 0 HG2 GLN F 3 -5.405 0.140 -23.269 1.00 0.00 H new ATOM 0 HG3 GLN F 3 -6.588 -0.975 -23.922 1.00 0.00 H new ATOM 0 HE21 GLN F 3 -6.178 1.892 -21.811 1.00 0.00 H new ATOM 0 HE22 GLN F 3 -7.886 2.345 -21.819 1.00 0.00 H new ATOM 50 N ALA F 4 -3.152 -3.582 -22.266 1.00 0.00 N ATOM 51 CA ALA F 4 -1.705 -3.588 -21.910 1.00 0.00 C ATOM 52 C ALA F 4 -0.965 -2.548 -22.755 1.00 0.00 C ATOM 53 O ALA F 4 -0.882 -2.676 -23.957 1.00 0.00 O ATOM 54 CB ALA F 4 -1.120 -4.975 -22.185 1.00 0.00 C ATOM 0 H ALA F 4 -3.483 -4.417 -22.749 1.00 0.00 H new ATOM 0 HA ALA F 4 -1.590 -3.345 -20.854 1.00 0.00 H new ATOM 0 HB1 ALA F 4 -0.061 -4.981 -21.925 1.00 0.00 H new ATOM 0 HB2 ALA F 4 -1.646 -5.717 -21.584 1.00 0.00 H new ATOM 0 HB3 ALA F 4 -1.236 -5.216 -23.242 1.00 0.00 H new ATOM 60 N GLU F 5 -0.422 -1.536 -22.113 1.00 0.00 N ATOM 61 CA GLU F 5 0.340 -0.459 -22.824 1.00 0.00 C ATOM 62 C GLU F 5 0.148 0.875 -22.096 1.00 0.00 C ATOM 63 O GLU F 5 0.834 1.840 -22.369 1.00 0.00 O ATOM 64 CB GLU F 5 -0.142 -0.311 -24.265 1.00 0.00 C ATOM 65 CG GLU F 5 0.745 -1.173 -25.158 1.00 0.00 C ATOM 66 CD GLU F 5 -0.018 -1.549 -26.431 1.00 0.00 C ATOM 67 OE1 GLU F 5 -1.183 -1.202 -26.524 1.00 0.00 O ATOM 68 OE2 GLU F 5 0.579 -2.178 -27.289 1.00 0.00 O ATOM 0 H GLU F 5 -0.478 -1.411 -21.102 1.00 0.00 H new ATOM 0 HA GLU F 5 1.394 -0.736 -22.830 1.00 0.00 H new ATOM 0 HB2 GLU F 5 -1.183 -0.622 -24.351 1.00 0.00 H new ATOM 0 HB3 GLU F 5 -0.094 0.733 -24.576 1.00 0.00 H new ATOM 0 HG2 GLU F 5 1.656 -0.632 -25.414 1.00 0.00 H new ATOM 0 HG3 GLU F 5 1.049 -2.074 -24.625 1.00 0.00 H new ATOM 75 N GLU F 6 -0.780 0.946 -21.181 1.00 0.00 N ATOM 76 CA GLU F 6 -1.005 2.229 -20.455 1.00 0.00 C ATOM 77 C GLU F 6 -1.032 1.980 -18.946 1.00 0.00 C ATOM 78 O GLU F 6 -0.259 2.545 -18.199 1.00 0.00 O ATOM 79 CB GLU F 6 -2.339 2.833 -20.894 1.00 0.00 C ATOM 80 CG GLU F 6 -2.531 2.611 -22.396 1.00 0.00 C ATOM 81 CD GLU F 6 -1.600 3.545 -23.172 1.00 0.00 C ATOM 82 OE1 GLU F 6 -1.870 4.734 -23.195 1.00 0.00 O ATOM 83 OE2 GLU F 6 -0.633 3.054 -23.730 1.00 0.00 O ATOM 0 H GLU F 6 -1.389 0.176 -20.906 1.00 0.00 H new ATOM 0 HA GLU F 6 -0.193 2.918 -20.688 1.00 0.00 H new ATOM 0 HB2 GLU F 6 -3.158 2.374 -20.340 1.00 0.00 H new ATOM 0 HB3 GLU F 6 -2.360 3.899 -20.668 1.00 0.00 H new ATOM 0 HG2 GLU F 6 -2.318 1.573 -22.651 1.00 0.00 H new ATOM 0 HG3 GLU F 6 -3.568 2.801 -22.673 1.00 0.00 H new ATOM 90 N TRP F 7 -1.922 1.147 -18.492 1.00 0.00 N ATOM 91 CA TRP F 7 -2.010 0.868 -17.033 1.00 0.00 C ATOM 92 C TRP F 7 -1.615 -0.581 -16.754 1.00 0.00 C ATOM 93 O TRP F 7 -1.717 -1.048 -15.642 1.00 0.00 O ATOM 94 CB TRP F 7 -3.445 1.108 -16.551 1.00 0.00 C ATOM 95 CG TRP F 7 -4.408 0.369 -17.428 1.00 0.00 C ATOM 96 CD1 TRP F 7 -5.127 0.922 -18.434 1.00 0.00 C ATOM 97 CD2 TRP F 7 -4.774 -1.042 -17.394 1.00 0.00 C ATOM 98 NE1 TRP F 7 -5.909 -0.060 -19.016 1.00 0.00 N ATOM 99 CE2 TRP F 7 -5.726 -1.286 -18.412 1.00 0.00 C ATOM 100 CE3 TRP F 7 -4.378 -2.123 -16.588 1.00 0.00 C ATOM 101 CZ2 TRP F 7 -6.265 -2.555 -18.624 1.00 0.00 C ATOM 102 CZ3 TRP F 7 -4.919 -3.404 -16.798 1.00 0.00 C ATOM 103 CH2 TRP F 7 -5.860 -3.618 -17.814 1.00 0.00 C ATOM 0 H TRP F 7 -2.596 0.645 -19.070 1.00 0.00 H new ATOM 0 HA TRP F 7 -1.330 1.533 -16.501 1.00 0.00 H new ATOM 0 HB2 TRP F 7 -3.551 0.776 -15.518 1.00 0.00 H new ATOM 0 HB3 TRP F 7 -3.670 2.174 -16.567 1.00 0.00 H new ATOM 0 HD1 TRP F 7 -5.095 1.959 -18.733 1.00 0.00 H new ATOM 0 HE1 TRP F 7 -6.544 0.103 -19.797 1.00 0.00 H new ATOM 0 HE3 TRP F 7 -3.653 -1.969 -15.802 1.00 0.00 H new ATOM 0 HZ2 TRP F 7 -6.990 -2.714 -19.409 1.00 0.00 H new ATOM 0 HZ3 TRP F 7 -4.607 -4.228 -16.173 1.00 0.00 H new ATOM 0 HH2 TRP F 7 -6.272 -4.604 -17.970 1.00 0.00 H new ATOM 114 N TYR F 8 -1.170 -1.296 -17.754 1.00 0.00 N ATOM 115 CA TYR F 8 -0.769 -2.718 -17.546 1.00 0.00 C ATOM 116 C TYR F 8 0.351 -3.064 -18.523 1.00 0.00 C ATOM 117 O TYR F 8 0.264 -2.809 -19.707 1.00 0.00 O ATOM 118 CB TYR F 8 -1.997 -3.611 -17.755 1.00 0.00 C ATOM 119 CG TYR F 8 -1.616 -5.050 -18.012 1.00 0.00 C ATOM 120 CD1 TYR F 8 -0.956 -5.417 -19.190 1.00 0.00 C ATOM 121 CD2 TYR F 8 -1.956 -6.027 -17.071 1.00 0.00 C ATOM 122 CE1 TYR F 8 -0.634 -6.759 -19.422 1.00 0.00 C ATOM 123 CE2 TYR F 8 -1.640 -7.365 -17.304 1.00 0.00 C ATOM 124 CZ TYR F 8 -0.979 -7.733 -18.478 1.00 0.00 C ATOM 125 OH TYR F 8 -0.667 -9.057 -18.706 1.00 0.00 O ATOM 0 H TYR F 8 -1.067 -0.954 -18.710 1.00 0.00 H new ATOM 0 HA TYR F 8 -0.398 -2.877 -16.534 1.00 0.00 H new ATOM 0 HB2 TYR F 8 -2.637 -3.558 -16.875 1.00 0.00 H new ATOM 0 HB3 TYR F 8 -2.579 -3.235 -18.596 1.00 0.00 H new ATOM 0 HD1 TYR F 8 -0.695 -4.665 -19.920 1.00 0.00 H new ATOM 0 HD2 TYR F 8 -2.465 -5.744 -16.161 1.00 0.00 H new ATOM 0 HE1 TYR F 8 -0.120 -7.043 -20.328 1.00 0.00 H new ATOM 0 HE2 TYR F 8 -1.907 -8.117 -16.576 1.00 0.00 H new ATOM 0 HH TYR F 8 -1.077 -9.614 -18.011 1.00 0.00 H new ATOM 135 N PHE F 9 1.424 -3.607 -18.019 1.00 0.00 N ATOM 136 CA PHE F 9 2.583 -3.936 -18.891 1.00 0.00 C ATOM 137 C PHE F 9 2.615 -5.433 -19.214 1.00 0.00 C ATOM 138 O PHE F 9 3.051 -5.833 -20.276 1.00 0.00 O ATOM 139 CB PHE F 9 3.867 -3.540 -18.158 1.00 0.00 C ATOM 140 CG PHE F 9 4.150 -2.069 -18.389 1.00 0.00 C ATOM 141 CD1 PHE F 9 3.092 -1.168 -18.598 1.00 0.00 C ATOM 142 CD2 PHE F 9 5.473 -1.604 -18.394 1.00 0.00 C ATOM 143 CE1 PHE F 9 3.361 0.189 -18.810 1.00 0.00 C ATOM 144 CE2 PHE F 9 5.737 -0.246 -18.606 1.00 0.00 C ATOM 145 CZ PHE F 9 4.683 0.650 -18.815 1.00 0.00 C ATOM 0 H PHE F 9 1.547 -3.838 -17.033 1.00 0.00 H new ATOM 0 HA PHE F 9 2.495 -3.389 -19.830 1.00 0.00 H new ATOM 0 HB2 PHE F 9 3.765 -3.738 -17.091 1.00 0.00 H new ATOM 0 HB3 PHE F 9 4.702 -4.142 -18.515 1.00 0.00 H new ATOM 0 HD1 PHE F 9 2.072 -1.523 -18.595 1.00 0.00 H new ATOM 0 HD2 PHE F 9 6.288 -2.294 -18.234 1.00 0.00 H new ATOM 0 HE1 PHE F 9 2.548 0.881 -18.970 1.00 0.00 H new ATOM 0 HE2 PHE F 9 6.756 0.111 -18.608 1.00 0.00 H new ATOM 0 HZ PHE F 9 4.889 1.697 -18.980 1.00 0.00 H new ATOM 155 N GLY F 10 2.169 -6.268 -18.317 1.00 0.00 N ATOM 156 CA GLY F 10 2.197 -7.731 -18.598 1.00 0.00 C ATOM 157 C GLY F 10 2.635 -8.488 -17.346 1.00 0.00 C ATOM 158 O GLY F 10 2.002 -8.431 -16.310 1.00 0.00 O ATOM 0 H GLY F 10 1.789 -6.004 -17.408 1.00 0.00 H new ATOM 0 HA2 GLY F 10 1.210 -8.070 -18.912 1.00 0.00 H new ATOM 0 HA3 GLY F 10 2.882 -7.940 -19.419 1.00 0.00 H new ATOM 162 N LYS F 11 3.726 -9.187 -17.441 1.00 0.00 N ATOM 163 CA LYS F 11 4.245 -9.952 -16.277 1.00 0.00 C ATOM 164 C LYS F 11 5.454 -9.199 -15.740 1.00 0.00 C ATOM 165 O LYS F 11 6.587 -9.599 -15.918 1.00 0.00 O ATOM 166 CB LYS F 11 4.654 -11.351 -16.736 1.00 0.00 C ATOM 167 CG LYS F 11 3.697 -11.814 -17.838 1.00 0.00 C ATOM 168 CD LYS F 11 3.219 -13.236 -17.534 1.00 0.00 C ATOM 169 CE LYS F 11 4.116 -14.242 -18.257 1.00 0.00 C ATOM 170 NZ LYS F 11 5.036 -14.884 -17.275 1.00 0.00 N ATOM 0 H LYS F 11 4.289 -9.263 -18.288 1.00 0.00 H new ATOM 0 HA LYS F 11 3.487 -10.052 -15.500 1.00 0.00 H new ATOM 0 HB2 LYS F 11 5.679 -11.341 -17.107 1.00 0.00 H new ATOM 0 HB3 LYS F 11 4.626 -12.046 -15.897 1.00 0.00 H new ATOM 0 HG2 LYS F 11 2.844 -11.138 -17.902 1.00 0.00 H new ATOM 0 HG3 LYS F 11 4.199 -11.786 -18.805 1.00 0.00 H new ATOM 0 HD2 LYS F 11 3.244 -13.417 -16.459 1.00 0.00 H new ATOM 0 HD3 LYS F 11 2.184 -13.359 -17.854 1.00 0.00 H new ATOM 0 HE2 LYS F 11 3.507 -15.000 -18.750 1.00 0.00 H new ATOM 0 HE3 LYS F 11 4.691 -13.739 -19.035 1.00 0.00 H new ATOM 0 HZ1 LYS F 11 5.646 -15.568 -17.767 1.00 0.00 H new ATOM 0 HZ2 LYS F 11 5.626 -14.156 -16.824 1.00 0.00 H new ATOM 0 HZ3 LYS F 11 4.479 -15.377 -16.548 1.00 0.00 H new ATOM 184 N LEU F 12 5.210 -8.087 -15.116 1.00 0.00 N ATOM 185 CA LEU F 12 6.334 -7.259 -14.595 1.00 0.00 C ATOM 186 C LEU F 12 6.387 -7.318 -13.067 1.00 0.00 C ATOM 187 O LEU F 12 5.464 -7.770 -12.418 1.00 0.00 O ATOM 188 CB LEU F 12 6.118 -5.813 -15.043 1.00 0.00 C ATOM 189 CG LEU F 12 7.374 -4.997 -14.772 1.00 0.00 C ATOM 190 CD1 LEU F 12 8.571 -5.657 -15.461 1.00 0.00 C ATOM 191 CD2 LEU F 12 7.185 -3.581 -15.315 1.00 0.00 C ATOM 0 H LEU F 12 4.278 -7.711 -14.942 1.00 0.00 H new ATOM 0 HA LEU F 12 7.276 -7.644 -14.985 1.00 0.00 H new ATOM 0 HB2 LEU F 12 5.876 -5.784 -16.105 1.00 0.00 H new ATOM 0 HB3 LEU F 12 5.270 -5.381 -14.511 1.00 0.00 H new ATOM 0 HG LEU F 12 7.556 -4.953 -13.698 1.00 0.00 H new ATOM 0 HD11 LEU F 12 9.470 -5.073 -15.267 1.00 0.00 H new ATOM 0 HD12 LEU F 12 8.703 -6.667 -15.072 1.00 0.00 H new ATOM 0 HD13 LEU F 12 8.393 -5.702 -16.535 1.00 0.00 H new ATOM 0 HD21 LEU F 12 8.083 -2.994 -15.122 1.00 0.00 H new ATOM 0 HD22 LEU F 12 7.004 -3.624 -16.389 1.00 0.00 H new ATOM 0 HD23 LEU F 12 6.333 -3.113 -14.822 1.00 0.00 H new ATOM 203 N GLY F 13 7.467 -6.858 -12.488 1.00 0.00 N ATOM 204 CA GLY F 13 7.589 -6.881 -11.005 1.00 0.00 C ATOM 205 C GLY F 13 7.555 -5.447 -10.471 1.00 0.00 C ATOM 206 O GLY F 13 7.095 -4.538 -11.133 1.00 0.00 O ATOM 0 H GLY F 13 8.269 -6.467 -12.982 1.00 0.00 H new ATOM 0 HA2 GLY F 13 6.775 -7.462 -10.571 1.00 0.00 H new ATOM 0 HA3 GLY F 13 8.519 -7.368 -10.713 1.00 0.00 H new ATOM 210 N ARG F 14 8.032 -5.240 -9.275 1.00 0.00 N ATOM 211 CA ARG F 14 8.021 -3.867 -8.691 1.00 0.00 C ATOM 212 C ARG F 14 9.319 -3.134 -9.038 1.00 0.00 C ATOM 213 O ARG F 14 9.389 -1.921 -8.991 1.00 0.00 O ATOM 214 CB ARG F 14 7.903 -3.968 -7.171 1.00 0.00 C ATOM 215 CG ARG F 14 8.874 -5.030 -6.652 1.00 0.00 C ATOM 216 CD ARG F 14 9.692 -4.450 -5.496 1.00 0.00 C ATOM 217 NE ARG F 14 8.839 -3.523 -4.700 1.00 0.00 N ATOM 218 CZ ARG F 14 9.389 -2.694 -3.857 1.00 0.00 C ATOM 219 NH1 ARG F 14 10.344 -1.899 -4.252 1.00 0.00 N ATOM 220 NH2 ARG F 14 8.982 -2.659 -2.617 1.00 0.00 N ATOM 0 H ARG F 14 8.430 -5.963 -8.675 1.00 0.00 H new ATOM 0 HA ARG F 14 7.175 -3.315 -9.101 1.00 0.00 H new ATOM 0 HB2 ARG F 14 8.124 -3.004 -6.714 1.00 0.00 H new ATOM 0 HB3 ARG F 14 6.882 -4.226 -6.891 1.00 0.00 H new ATOM 0 HG2 ARG F 14 8.324 -5.909 -6.317 1.00 0.00 H new ATOM 0 HG3 ARG F 14 9.537 -5.355 -7.454 1.00 0.00 H new ATOM 0 HD2 ARG F 14 10.065 -5.254 -4.861 1.00 0.00 H new ATOM 0 HD3 ARG F 14 10.562 -3.919 -5.882 1.00 0.00 H new ATOM 0 HE ARG F 14 7.826 -3.537 -4.814 1.00 0.00 H new ATOM 0 HH11 ARG F 14 10.661 -1.925 -5.221 1.00 0.00 H new ATOM 0 HH12 ARG F 14 10.774 -1.251 -3.592 1.00 0.00 H new ATOM 0 HH21 ARG F 14 8.234 -3.280 -2.308 1.00 0.00 H new ATOM 0 HH22 ARG F 14 9.412 -2.011 -1.957 1.00 0.00 H new ATOM 234 N LYS F 15 10.347 -3.857 -9.377 1.00 0.00 N ATOM 235 CA LYS F 15 11.634 -3.209 -9.715 1.00 0.00 C ATOM 236 C LYS F 15 11.502 -2.519 -11.063 1.00 0.00 C ATOM 237 O LYS F 15 12.021 -1.439 -11.281 1.00 0.00 O ATOM 238 CB LYS F 15 12.738 -4.265 -9.782 1.00 0.00 C ATOM 239 CG LYS F 15 14.003 -3.724 -9.111 1.00 0.00 C ATOM 240 CD LYS F 15 15.086 -3.502 -10.170 1.00 0.00 C ATOM 241 CE LYS F 15 16.420 -4.049 -9.656 1.00 0.00 C ATOM 242 NZ LYS F 15 17.528 -3.547 -10.518 1.00 0.00 N ATOM 0 H LYS F 15 10.347 -4.875 -9.434 1.00 0.00 H new ATOM 0 HA LYS F 15 11.889 -2.475 -8.951 1.00 0.00 H new ATOM 0 HB2 LYS F 15 12.412 -5.179 -9.285 1.00 0.00 H new ATOM 0 HB3 LYS F 15 12.946 -4.523 -10.820 1.00 0.00 H new ATOM 0 HG2 LYS F 15 13.784 -2.788 -8.598 1.00 0.00 H new ATOM 0 HG3 LYS F 15 14.356 -4.426 -8.356 1.00 0.00 H new ATOM 0 HD2 LYS F 15 14.810 -4.001 -11.099 1.00 0.00 H new ATOM 0 HD3 LYS F 15 15.178 -2.439 -10.394 1.00 0.00 H new ATOM 0 HE2 LYS F 15 16.579 -3.738 -8.623 1.00 0.00 H new ATOM 0 HE3 LYS F 15 16.405 -5.139 -9.662 1.00 0.00 H new ATOM 0 HZ1 LYS F 15 18.435 -3.918 -10.169 1.00 0.00 H new ATOM 0 HZ2 LYS F 15 17.377 -3.864 -11.497 1.00 0.00 H new ATOM 0 HZ3 LYS F 15 17.546 -2.508 -10.490 1.00 0.00 H new ATOM 256 N ASP F 16 10.806 -3.128 -11.975 1.00 0.00 N ATOM 257 CA ASP F 16 10.642 -2.508 -13.293 1.00 0.00 C ATOM 258 C ASP F 16 9.512 -1.490 -13.219 1.00 0.00 C ATOM 259 O ASP F 16 9.641 -0.366 -13.654 1.00 0.00 O ATOM 260 CB ASP F 16 10.299 -3.579 -14.318 1.00 0.00 C ATOM 261 CG ASP F 16 10.612 -3.066 -15.725 1.00 0.00 C ATOM 262 OD1 ASP F 16 9.944 -2.141 -16.159 1.00 0.00 O ATOM 263 OD2 ASP F 16 11.513 -3.605 -16.345 1.00 0.00 O ATOM 0 H ASP F 16 10.346 -4.030 -11.855 1.00 0.00 H new ATOM 0 HA ASP F 16 11.567 -2.013 -13.589 1.00 0.00 H new ATOM 0 HB2 ASP F 16 10.870 -4.485 -14.116 1.00 0.00 H new ATOM 0 HB3 ASP F 16 9.244 -3.843 -14.243 1.00 0.00 H new ATOM 268 N ALA F 17 8.405 -1.882 -12.658 1.00 0.00 N ATOM 269 CA ALA F 17 7.260 -0.941 -12.544 1.00 0.00 C ATOM 270 C ALA F 17 7.775 0.419 -12.088 1.00 0.00 C ATOM 271 O ALA F 17 7.419 1.443 -12.634 1.00 0.00 O ATOM 272 CB ALA F 17 6.249 -1.482 -11.534 1.00 0.00 C ATOM 0 H ALA F 17 8.244 -2.813 -12.274 1.00 0.00 H new ATOM 0 HA ALA F 17 6.771 -0.837 -13.512 1.00 0.00 H new ATOM 0 HB1 ALA F 17 5.411 -0.790 -11.452 1.00 0.00 H new ATOM 0 HB2 ALA F 17 5.886 -2.454 -11.868 1.00 0.00 H new ATOM 0 HB3 ALA F 17 6.728 -1.588 -10.561 1.00 0.00 H new ATOM 278 N GLU F 18 8.626 0.439 -11.103 1.00 0.00 N ATOM 279 CA GLU F 18 9.175 1.738 -10.631 1.00 0.00 C ATOM 280 C GLU F 18 10.141 2.274 -11.690 1.00 0.00 C ATOM 281 O GLU F 18 10.206 3.460 -11.940 1.00 0.00 O ATOM 282 CB GLU F 18 9.916 1.539 -9.307 1.00 0.00 C ATOM 283 CG GLU F 18 11.033 0.513 -9.497 1.00 0.00 C ATOM 284 CD GLU F 18 12.282 1.213 -10.037 1.00 0.00 C ATOM 285 OE1 GLU F 18 12.665 2.222 -9.466 1.00 0.00 O ATOM 286 OE2 GLU F 18 12.834 0.730 -11.011 1.00 0.00 O ATOM 0 H GLU F 18 8.964 -0.385 -10.606 1.00 0.00 H new ATOM 0 HA GLU F 18 8.363 2.448 -10.474 1.00 0.00 H new ATOM 0 HB2 GLU F 18 10.332 2.487 -8.965 1.00 0.00 H new ATOM 0 HB3 GLU F 18 9.223 1.199 -8.538 1.00 0.00 H new ATOM 0 HG2 GLU F 18 11.258 0.025 -8.549 1.00 0.00 H new ATOM 0 HG3 GLU F 18 10.712 -0.266 -10.188 1.00 0.00 H new ATOM 293 N ARG F 19 10.889 1.405 -12.318 1.00 0.00 N ATOM 294 CA ARG F 19 11.846 1.865 -13.365 1.00 0.00 C ATOM 295 C ARG F 19 11.077 2.439 -14.560 1.00 0.00 C ATOM 296 O ARG F 19 11.011 3.637 -14.752 1.00 0.00 O ATOM 297 CB ARG F 19 12.697 0.681 -13.830 1.00 0.00 C ATOM 298 CG ARG F 19 14.178 1.004 -13.620 1.00 0.00 C ATOM 299 CD ARG F 19 14.554 2.234 -14.449 1.00 0.00 C ATOM 300 NE ARG F 19 15.955 2.093 -14.938 1.00 0.00 N ATOM 301 CZ ARG F 19 16.426 2.932 -15.819 1.00 0.00 C ATOM 302 NH1 ARG F 19 16.514 4.202 -15.529 1.00 0.00 N ATOM 303 NH2 ARG F 19 16.811 2.502 -16.989 1.00 0.00 N ATOM 0 H ARG F 19 10.878 0.399 -12.151 1.00 0.00 H new ATOM 0 HA ARG F 19 12.489 2.640 -12.947 1.00 0.00 H new ATOM 0 HB2 ARG F 19 12.427 -0.216 -13.273 1.00 0.00 H new ATOM 0 HB3 ARG F 19 12.505 0.472 -14.882 1.00 0.00 H new ATOM 0 HG2 ARG F 19 14.375 1.190 -12.564 1.00 0.00 H new ATOM 0 HG3 ARG F 19 14.792 0.153 -13.914 1.00 0.00 H new ATOM 0 HD2 ARG F 19 13.872 2.340 -15.293 1.00 0.00 H new ATOM 0 HD3 ARG F 19 14.457 3.136 -13.845 1.00 0.00 H new ATOM 0 HE ARG F 19 16.545 1.340 -14.584 1.00 0.00 H new ATOM 0 HH11 ARG F 19 16.215 4.538 -14.614 1.00 0.00 H new ATOM 0 HH12 ARG F 19 16.882 4.858 -16.218 1.00 0.00 H new ATOM 0 HH21 ARG F 19 16.744 1.510 -17.215 1.00 0.00 H new ATOM 0 HH22 ARG F 19 17.179 3.158 -17.678 1.00 0.00 H new ATOM 317 N GLN F 20 10.503 1.589 -15.368 1.00 0.00 N ATOM 318 CA GLN F 20 9.744 2.068 -16.562 1.00 0.00 C ATOM 319 C GLN F 20 8.920 3.306 -16.198 1.00 0.00 C ATOM 320 O GLN F 20 8.937 4.299 -16.899 1.00 0.00 O ATOM 321 CB GLN F 20 8.811 0.958 -17.054 1.00 0.00 C ATOM 322 CG GLN F 20 9.069 0.700 -18.540 1.00 0.00 C ATOM 323 CD GLN F 20 9.168 -0.806 -18.788 1.00 0.00 C ATOM 324 OE1 GLN F 20 8.255 -1.546 -18.478 1.00 0.00 O ATOM 325 NE2 GLN F 20 10.246 -1.295 -19.338 1.00 0.00 N ATOM 0 H GLN F 20 10.527 0.576 -15.252 1.00 0.00 H new ATOM 0 HA GLN F 20 10.449 2.329 -17.351 1.00 0.00 H new ATOM 0 HB2 GLN F 20 8.978 0.046 -16.481 1.00 0.00 H new ATOM 0 HB3 GLN F 20 7.771 1.246 -16.899 1.00 0.00 H new ATOM 0 HG2 GLN F 20 8.264 1.125 -19.139 1.00 0.00 H new ATOM 0 HG3 GLN F 20 9.991 1.192 -18.850 1.00 0.00 H new ATOM 0 HE21 GLN F 20 11.012 -0.674 -19.598 1.00 0.00 H new ATOM 0 HE22 GLN F 20 10.322 -2.298 -19.508 1.00 0.00 H new ATOM 334 N LEU F 21 8.194 3.260 -15.114 1.00 0.00 N ATOM 335 CA LEU F 21 7.372 4.441 -14.723 1.00 0.00 C ATOM 336 C LEU F 21 8.237 5.700 -14.753 1.00 0.00 C ATOM 337 O LEU F 21 8.045 6.579 -15.569 1.00 0.00 O ATOM 338 CB LEU F 21 6.815 4.237 -13.312 1.00 0.00 C ATOM 339 CG LEU F 21 5.379 3.716 -13.400 1.00 0.00 C ATOM 340 CD1 LEU F 21 5.311 2.559 -14.399 1.00 0.00 C ATOM 341 CD2 LEU F 21 4.928 3.225 -12.022 1.00 0.00 C ATOM 0 H LEU F 21 8.134 2.460 -14.485 1.00 0.00 H new ATOM 0 HA LEU F 21 6.546 4.552 -15.425 1.00 0.00 H new ATOM 0 HB2 LEU F 21 7.437 3.530 -12.763 1.00 0.00 H new ATOM 0 HB3 LEU F 21 6.839 5.177 -12.761 1.00 0.00 H new ATOM 0 HG LEU F 21 4.724 4.521 -13.733 1.00 0.00 H new ATOM 0 HD11 LEU F 21 4.287 2.190 -14.459 1.00 0.00 H new ATOM 0 HD12 LEU F 21 5.630 2.907 -15.381 1.00 0.00 H new ATOM 0 HD13 LEU F 21 5.968 1.754 -14.069 1.00 0.00 H new ATOM 0 HD21 LEU F 21 3.905 2.854 -12.085 1.00 0.00 H new ATOM 0 HD22 LEU F 21 5.585 2.422 -11.689 1.00 0.00 H new ATOM 0 HD23 LEU F 21 4.972 4.049 -11.310 1.00 0.00 H new ATOM 353 N LEU F 22 9.187 5.792 -13.868 1.00 0.00 N ATOM 354 CA LEU F 22 10.066 6.996 -13.842 1.00 0.00 C ATOM 355 C LEU F 22 10.567 7.293 -15.257 1.00 0.00 C ATOM 356 O LEU F 22 10.893 8.416 -15.586 1.00 0.00 O ATOM 357 CB LEU F 22 11.260 6.739 -12.918 1.00 0.00 C ATOM 358 CG LEU F 22 10.761 6.479 -11.492 1.00 0.00 C ATOM 359 CD1 LEU F 22 11.932 6.592 -10.515 1.00 0.00 C ATOM 360 CD2 LEU F 22 9.691 7.509 -11.123 1.00 0.00 C ATOM 0 H LEU F 22 9.395 5.087 -13.161 1.00 0.00 H new ATOM 0 HA LEU F 22 9.500 7.851 -13.471 1.00 0.00 H new ATOM 0 HB2 LEU F 22 11.832 5.883 -13.276 1.00 0.00 H new ATOM 0 HB3 LEU F 22 11.932 7.597 -12.928 1.00 0.00 H new ATOM 0 HG LEU F 22 10.333 5.478 -11.437 1.00 0.00 H new ATOM 0 HD11 LEU F 22 11.579 6.407 -9.501 1.00 0.00 H new ATOM 0 HD12 LEU F 22 12.694 5.856 -10.773 1.00 0.00 H new ATOM 0 HD13 LEU F 22 12.360 7.593 -10.574 1.00 0.00 H new ATOM 0 HD21 LEU F 22 9.339 7.321 -10.109 1.00 0.00 H new ATOM 0 HD22 LEU F 22 10.116 8.511 -11.179 1.00 0.00 H new ATOM 0 HD23 LEU F 22 8.855 7.430 -11.818 1.00 0.00 H new ATOM 372 N SER F 23 10.630 6.295 -16.096 1.00 0.00 N ATOM 373 CA SER F 23 11.108 6.525 -17.488 1.00 0.00 C ATOM 374 C SER F 23 10.104 7.407 -18.233 1.00 0.00 C ATOM 375 O SER F 23 8.907 7.243 -18.108 1.00 0.00 O ATOM 376 CB SER F 23 11.241 5.183 -18.211 1.00 0.00 C ATOM 377 OG SER F 23 11.900 4.252 -17.363 1.00 0.00 O ATOM 0 H SER F 23 10.372 5.333 -15.878 1.00 0.00 H new ATOM 0 HA SER F 23 12.078 7.021 -17.461 1.00 0.00 H new ATOM 0 HB2 SER F 23 10.256 4.807 -18.486 1.00 0.00 H new ATOM 0 HB3 SER F 23 11.803 5.310 -19.136 1.00 0.00 H new ATOM 0 HG SER F 23 12.267 3.521 -17.903 1.00 0.00 H new ATOM 383 N PHE F 24 10.580 8.345 -19.005 1.00 0.00 N ATOM 384 CA PHE F 24 9.652 9.236 -19.755 1.00 0.00 C ATOM 385 C PHE F 24 8.530 8.402 -20.375 1.00 0.00 C ATOM 386 O PHE F 24 8.766 7.544 -21.203 1.00 0.00 O ATOM 387 CB PHE F 24 10.422 9.958 -20.864 1.00 0.00 C ATOM 388 CG PHE F 24 11.225 8.953 -21.654 1.00 0.00 C ATOM 389 CD1 PHE F 24 10.657 8.323 -22.768 1.00 0.00 C ATOM 390 CD2 PHE F 24 12.537 8.649 -21.273 1.00 0.00 C ATOM 391 CE1 PHE F 24 11.402 7.392 -23.501 1.00 0.00 C ATOM 392 CE2 PHE F 24 13.282 7.718 -22.005 1.00 0.00 C ATOM 393 CZ PHE F 24 12.714 7.089 -23.120 1.00 0.00 C ATOM 0 H PHE F 24 11.572 8.533 -19.149 1.00 0.00 H new ATOM 0 HA PHE F 24 9.224 9.969 -19.072 1.00 0.00 H new ATOM 0 HB2 PHE F 24 9.728 10.483 -21.521 1.00 0.00 H new ATOM 0 HB3 PHE F 24 11.083 10.710 -20.433 1.00 0.00 H new ATOM 0 HD1 PHE F 24 9.644 8.555 -23.062 1.00 0.00 H new ATOM 0 HD2 PHE F 24 12.975 9.134 -20.413 1.00 0.00 H new ATOM 0 HE1 PHE F 24 10.964 6.907 -24.361 1.00 0.00 H new ATOM 0 HE2 PHE F 24 14.294 7.485 -21.710 1.00 0.00 H new ATOM 0 HZ PHE F 24 13.288 6.370 -23.686 1.00 0.00 H new ATOM 403 N GLY F 25 7.309 8.645 -19.982 1.00 0.00 N ATOM 404 CA GLY F 25 6.174 7.866 -20.550 1.00 0.00 C ATOM 405 C GLY F 25 5.129 7.616 -19.460 1.00 0.00 C ATOM 406 O GLY F 25 4.019 7.204 -19.733 1.00 0.00 O ATOM 0 H GLY F 25 7.049 9.350 -19.292 1.00 0.00 H new ATOM 0 HA2 GLY F 25 5.725 8.411 -21.381 1.00 0.00 H new ATOM 0 HA3 GLY F 25 6.534 6.917 -20.948 1.00 0.00 H new ATOM 410 N ASN F 26 5.474 7.863 -18.225 1.00 0.00 N ATOM 411 CA ASN F 26 4.498 7.639 -17.121 1.00 0.00 C ATOM 412 C ASN F 26 4.756 8.649 -15.998 1.00 0.00 C ATOM 413 O ASN F 26 5.421 8.340 -15.030 1.00 0.00 O ATOM 414 CB ASN F 26 4.662 6.218 -16.577 1.00 0.00 C ATOM 415 CG ASN F 26 4.776 5.235 -17.744 1.00 0.00 C ATOM 416 OD1 ASN F 26 5.854 5.003 -18.254 1.00 0.00 O ATOM 417 ND2 ASN F 26 3.702 4.645 -18.191 1.00 0.00 N ATOM 0 H ASN F 26 6.388 8.210 -17.934 1.00 0.00 H new ATOM 0 HA ASN F 26 3.484 7.769 -17.500 1.00 0.00 H new ATOM 0 HB2 ASN F 26 5.551 6.158 -15.949 1.00 0.00 H new ATOM 0 HB3 ASN F 26 3.810 5.957 -15.949 1.00 0.00 H new ATOM 0 HD21 ASN F 26 3.767 3.989 -18.969 1.00 0.00 H new ATOM 0 HD22 ASN F 26 2.797 4.840 -17.763 1.00 0.00 H new ATOM 424 N PRO F 27 4.216 9.830 -16.166 1.00 0.00 N ATOM 425 CA PRO F 27 4.364 10.916 -15.182 1.00 0.00 C ATOM 426 C PRO F 27 3.421 10.696 -13.996 1.00 0.00 C ATOM 427 O PRO F 27 2.966 9.597 -13.748 1.00 0.00 O ATOM 428 CB PRO F 27 3.969 12.169 -15.968 1.00 0.00 C ATOM 429 CG PRO F 27 3.089 11.683 -17.147 1.00 0.00 C ATOM 430 CD PRO F 27 3.409 10.190 -17.350 1.00 0.00 C ATOM 0 HA PRO F 27 5.368 10.980 -14.763 1.00 0.00 H new ATOM 0 HB2 PRO F 27 3.421 12.868 -15.336 1.00 0.00 H new ATOM 0 HB3 PRO F 27 4.852 12.694 -16.332 1.00 0.00 H new ATOM 0 HG2 PRO F 27 2.031 11.826 -16.925 1.00 0.00 H new ATOM 0 HG3 PRO F 27 3.305 12.252 -18.051 1.00 0.00 H new ATOM 0 HD2 PRO F 27 2.500 9.592 -17.409 1.00 0.00 H new ATOM 0 HD3 PRO F 27 3.961 10.023 -18.275 1.00 0.00 H new ATOM 438 N ARG F 28 3.123 11.732 -13.260 1.00 0.00 N ATOM 439 CA ARG F 28 2.210 11.581 -12.093 1.00 0.00 C ATOM 440 C ARG F 28 0.790 11.299 -12.589 1.00 0.00 C ATOM 441 O ARG F 28 0.342 11.861 -13.568 1.00 0.00 O ATOM 442 CB ARG F 28 2.215 12.871 -11.270 1.00 0.00 C ATOM 443 CG ARG F 28 1.965 12.538 -9.798 1.00 0.00 C ATOM 444 CD ARG F 28 0.763 13.337 -9.291 1.00 0.00 C ATOM 445 NE ARG F 28 1.053 13.862 -7.927 1.00 0.00 N ATOM 446 CZ ARG F 28 0.340 14.840 -7.439 1.00 0.00 C ATOM 447 NH1 ARG F 28 -0.877 15.037 -7.866 1.00 0.00 N ATOM 448 NH2 ARG F 28 0.845 15.619 -6.522 1.00 0.00 N ATOM 0 H ARG F 28 3.473 12.677 -13.417 1.00 0.00 H new ATOM 0 HA ARG F 28 2.550 10.752 -11.472 1.00 0.00 H new ATOM 0 HB2 ARG F 28 3.171 13.382 -11.381 1.00 0.00 H new ATOM 0 HB3 ARG F 28 1.446 13.551 -11.636 1.00 0.00 H new ATOM 0 HG2 ARG F 28 1.780 11.470 -9.682 1.00 0.00 H new ATOM 0 HG3 ARG F 28 2.849 12.775 -9.205 1.00 0.00 H new ATOM 0 HD2 ARG F 28 0.548 14.161 -9.971 1.00 0.00 H new ATOM 0 HD3 ARG F 28 -0.124 12.704 -9.267 1.00 0.00 H new ATOM 0 HE ARG F 28 1.809 13.457 -7.375 1.00 0.00 H new ATOM 0 HH11 ARG F 28 -1.272 14.426 -8.582 1.00 0.00 H new ATOM 0 HH12 ARG F 28 -1.434 15.802 -7.484 1.00 0.00 H new ATOM 0 HH21 ARG F 28 1.796 15.463 -6.188 1.00 0.00 H new ATOM 0 HH22 ARG F 28 0.289 16.384 -6.140 1.00 0.00 H new ATOM 462 N GLY F 29 0.080 10.433 -11.920 1.00 0.00 N ATOM 463 CA GLY F 29 -1.311 10.117 -12.354 1.00 0.00 C ATOM 464 C GLY F 29 -1.302 8.870 -13.242 1.00 0.00 C ATOM 465 O GLY F 29 -2.329 8.429 -13.717 1.00 0.00 O ATOM 0 H GLY F 29 0.402 9.931 -11.093 1.00 0.00 H new ATOM 0 HA2 GLY F 29 -1.945 9.951 -11.483 1.00 0.00 H new ATOM 0 HA3 GLY F 29 -1.733 10.961 -12.900 1.00 0.00 H new ATOM 469 N THR F 30 -0.150 8.298 -13.470 1.00 0.00 N ATOM 470 CA THR F 30 -0.081 7.079 -14.326 1.00 0.00 C ATOM 471 C THR F 30 -0.038 5.838 -13.433 1.00 0.00 C ATOM 472 O THR F 30 0.734 5.761 -12.499 1.00 0.00 O ATOM 473 CB THR F 30 1.181 7.133 -15.190 1.00 0.00 C ATOM 474 OG1 THR F 30 1.369 8.457 -15.669 1.00 0.00 O ATOM 475 CG2 THR F 30 1.033 6.176 -16.373 1.00 0.00 C ATOM 0 H THR F 30 0.744 8.622 -13.101 1.00 0.00 H new ATOM 0 HA THR F 30 -0.958 7.034 -14.971 1.00 0.00 H new ATOM 0 HB THR F 30 2.043 6.837 -14.593 1.00 0.00 H new ATOM 0 HG1 THR F 30 1.852 8.982 -14.998 1.00 0.00 H new ATOM 0 HG21 THR F 30 1.932 6.215 -16.988 1.00 0.00 H new ATOM 0 HG22 THR F 30 0.890 5.160 -16.004 1.00 0.00 H new ATOM 0 HG23 THR F 30 0.171 6.469 -16.972 1.00 0.00 H new ATOM 483 N PHE F 31 -0.862 4.865 -13.710 1.00 0.00 N ATOM 484 CA PHE F 31 -0.864 3.635 -12.870 1.00 0.00 C ATOM 485 C PHE F 31 -0.599 2.409 -13.742 1.00 0.00 C ATOM 486 O PHE F 31 -1.457 1.950 -14.469 1.00 0.00 O ATOM 487 CB PHE F 31 -2.220 3.487 -12.186 1.00 0.00 C ATOM 488 CG PHE F 31 -2.490 4.708 -11.340 1.00 0.00 C ATOM 489 CD1 PHE F 31 -2.645 5.960 -11.945 1.00 0.00 C ATOM 490 CD2 PHE F 31 -2.576 4.589 -9.947 1.00 0.00 C ATOM 491 CE1 PHE F 31 -2.888 7.093 -11.160 1.00 0.00 C ATOM 492 CE2 PHE F 31 -2.819 5.721 -9.162 1.00 0.00 C ATOM 493 CZ PHE F 31 -2.974 6.973 -9.767 1.00 0.00 C ATOM 0 H PHE F 31 -1.532 4.869 -14.479 1.00 0.00 H new ATOM 0 HA PHE F 31 -0.081 3.716 -12.117 1.00 0.00 H new ATOM 0 HB2 PHE F 31 -3.005 3.367 -12.932 1.00 0.00 H new ATOM 0 HB3 PHE F 31 -2.231 2.591 -11.565 1.00 0.00 H new ATOM 0 HD1 PHE F 31 -2.577 6.052 -13.019 1.00 0.00 H new ATOM 0 HD2 PHE F 31 -2.455 3.623 -9.479 1.00 0.00 H new ATOM 0 HE1 PHE F 31 -3.009 8.059 -11.628 1.00 0.00 H new ATOM 0 HE2 PHE F 31 -2.887 5.628 -8.088 1.00 0.00 H new ATOM 0 HZ PHE F 31 -3.160 7.847 -9.160 1.00 0.00 H new ATOM 503 N LEU F 32 0.587 1.875 -13.669 1.00 0.00 N ATOM 504 CA LEU F 32 0.932 0.677 -14.482 1.00 0.00 C ATOM 505 C LEU F 32 0.427 -0.581 -13.762 1.00 0.00 C ATOM 506 O LEU F 32 0.177 -0.565 -12.577 1.00 0.00 O ATOM 507 CB LEU F 32 2.465 0.633 -14.639 1.00 0.00 C ATOM 508 CG LEU F 32 2.966 -0.801 -14.865 1.00 0.00 C ATOM 509 CD1 LEU F 32 4.367 -0.753 -15.484 1.00 0.00 C ATOM 510 CD2 LEU F 32 3.038 -1.543 -13.527 1.00 0.00 C ATOM 0 H LEU F 32 1.340 2.221 -13.074 1.00 0.00 H new ATOM 0 HA LEU F 32 0.465 0.724 -15.466 1.00 0.00 H new ATOM 0 HB2 LEU F 32 2.764 1.261 -15.478 1.00 0.00 H new ATOM 0 HB3 LEU F 32 2.935 1.048 -13.747 1.00 0.00 H new ATOM 0 HG LEU F 32 2.279 -1.321 -15.532 1.00 0.00 H new ATOM 0 HD11 LEU F 32 4.728 -1.769 -15.647 1.00 0.00 H new ATOM 0 HD12 LEU F 32 4.326 -0.225 -16.437 1.00 0.00 H new ATOM 0 HD13 LEU F 32 5.045 -0.231 -14.809 1.00 0.00 H new ATOM 0 HD21 LEU F 32 3.394 -2.560 -13.693 1.00 0.00 H new ATOM 0 HD22 LEU F 32 3.725 -1.023 -12.859 1.00 0.00 H new ATOM 0 HD23 LEU F 32 2.047 -1.575 -13.075 1.00 0.00 H new ATOM 522 N ILE F 33 0.290 -1.671 -14.466 1.00 0.00 N ATOM 523 CA ILE F 33 -0.170 -2.932 -13.815 1.00 0.00 C ATOM 524 C ILE F 33 0.837 -4.027 -14.162 1.00 0.00 C ATOM 525 O ILE F 33 1.704 -3.836 -14.990 1.00 0.00 O ATOM 526 CB ILE F 33 -1.582 -3.308 -14.303 1.00 0.00 C ATOM 527 CG1 ILE F 33 -2.616 -2.521 -13.491 1.00 0.00 C ATOM 528 CG2 ILE F 33 -1.833 -4.809 -14.121 1.00 0.00 C ATOM 529 CD1 ILE F 33 -4.017 -3.071 -13.770 1.00 0.00 C ATOM 0 H ILE F 33 0.477 -1.744 -15.466 1.00 0.00 H new ATOM 0 HA ILE F 33 -0.226 -2.805 -12.734 1.00 0.00 H new ATOM 0 HB ILE F 33 -1.668 -3.065 -15.362 1.00 0.00 H new ATOM 0 HG12 ILE F 33 -2.391 -2.595 -12.427 1.00 0.00 H new ATOM 0 HG13 ILE F 33 -2.571 -1.464 -13.753 1.00 0.00 H new ATOM 0 HG21 ILE F 33 -2.835 -5.055 -14.471 1.00 0.00 H new ATOM 0 HG22 ILE F 33 -1.099 -5.373 -14.696 1.00 0.00 H new ATOM 0 HG23 ILE F 33 -1.744 -5.068 -13.066 1.00 0.00 H new ATOM 0 HD11 ILE F 33 -4.750 -2.509 -13.191 1.00 0.00 H new ATOM 0 HD12 ILE F 33 -4.241 -2.973 -14.832 1.00 0.00 H new ATOM 0 HD13 ILE F 33 -4.058 -4.122 -13.486 1.00 0.00 H new ATOM 541 N ARG F 34 0.758 -5.161 -13.533 1.00 0.00 N ATOM 542 CA ARG F 34 1.747 -6.230 -13.842 1.00 0.00 C ATOM 543 C ARG F 34 1.568 -7.406 -12.885 1.00 0.00 C ATOM 544 O ARG F 34 0.963 -7.290 -11.840 1.00 0.00 O ATOM 545 CB ARG F 34 3.154 -5.663 -13.677 1.00 0.00 C ATOM 546 CG ARG F 34 3.224 -4.862 -12.376 1.00 0.00 C ATOM 547 CD ARG F 34 4.670 -4.442 -12.108 1.00 0.00 C ATOM 548 NE ARG F 34 4.781 -3.927 -10.714 1.00 0.00 N ATOM 549 CZ ARG F 34 4.936 -4.759 -9.720 1.00 0.00 C ATOM 550 NH1 ARG F 34 4.743 -6.037 -9.903 1.00 0.00 N ATOM 551 NH2 ARG F 34 5.282 -4.314 -8.544 1.00 0.00 N ATOM 0 H ARG F 34 0.061 -5.395 -12.826 1.00 0.00 H new ATOM 0 HA ARG F 34 1.595 -6.576 -14.864 1.00 0.00 H new ATOM 0 HB2 ARG F 34 3.885 -6.471 -13.660 1.00 0.00 H new ATOM 0 HB3 ARG F 34 3.404 -5.025 -14.525 1.00 0.00 H new ATOM 0 HG2 ARG F 34 2.586 -3.981 -12.445 1.00 0.00 H new ATOM 0 HG3 ARG F 34 2.850 -5.463 -11.547 1.00 0.00 H new ATOM 0 HD2 ARG F 34 5.340 -5.290 -12.249 1.00 0.00 H new ATOM 0 HD3 ARG F 34 4.975 -3.673 -12.818 1.00 0.00 H new ATOM 0 HE ARG F 34 4.736 -2.924 -10.536 1.00 0.00 H new ATOM 0 HH11 ARG F 34 4.471 -6.385 -10.822 1.00 0.00 H new ATOM 0 HH12 ARG F 34 4.864 -6.687 -9.127 1.00 0.00 H new ATOM 0 HH21 ARG F 34 5.432 -3.315 -8.400 1.00 0.00 H new ATOM 0 HH22 ARG F 34 5.403 -4.965 -7.768 1.00 0.00 H new ATOM 565 N GLU F 35 2.096 -8.538 -13.245 1.00 0.00 N ATOM 566 CA GLU F 35 1.967 -9.741 -12.379 1.00 0.00 C ATOM 567 C GLU F 35 2.856 -9.601 -11.134 1.00 0.00 C ATOM 568 O GLU F 35 4.037 -9.334 -11.234 1.00 0.00 O ATOM 569 CB GLU F 35 2.380 -10.971 -13.205 1.00 0.00 C ATOM 570 CG GLU F 35 3.863 -11.303 -12.996 1.00 0.00 C ATOM 571 CD GLU F 35 4.193 -12.626 -13.689 1.00 0.00 C ATOM 572 OE1 GLU F 35 3.265 -13.329 -14.052 1.00 0.00 O ATOM 573 OE2 GLU F 35 5.369 -12.913 -13.847 1.00 0.00 O ATOM 0 H GLU F 35 2.617 -8.684 -14.110 1.00 0.00 H new ATOM 0 HA GLU F 35 0.937 -9.851 -12.039 1.00 0.00 H new ATOM 0 HB2 GLU F 35 1.769 -11.827 -12.919 1.00 0.00 H new ATOM 0 HB3 GLU F 35 2.191 -10.783 -14.262 1.00 0.00 H new ATOM 0 HG2 GLU F 35 4.486 -10.504 -13.399 1.00 0.00 H new ATOM 0 HG3 GLU F 35 4.084 -11.373 -11.931 1.00 0.00 H new ATOM 580 N SER F 36 2.307 -9.797 -9.962 1.00 0.00 N ATOM 581 CA SER F 36 3.130 -9.692 -8.730 1.00 0.00 C ATOM 582 C SER F 36 3.899 -10.994 -8.518 1.00 0.00 C ATOM 583 O SER F 36 3.322 -12.060 -8.439 1.00 0.00 O ATOM 584 CB SER F 36 2.224 -9.469 -7.522 1.00 0.00 C ATOM 585 OG SER F 36 1.544 -8.232 -7.659 1.00 0.00 O ATOM 0 H SER F 36 1.324 -10.025 -9.810 1.00 0.00 H new ATOM 0 HA SER F 36 3.822 -8.857 -8.838 1.00 0.00 H new ATOM 0 HB2 SER F 36 1.505 -10.284 -7.439 1.00 0.00 H new ATOM 0 HB3 SER F 36 2.815 -9.471 -6.606 1.00 0.00 H new ATOM 0 HG SER F 36 0.598 -8.399 -7.854 1.00 0.00 H new ATOM 591 N GLU F 37 5.191 -10.915 -8.395 1.00 0.00 N ATOM 592 CA GLU F 37 5.985 -12.148 -8.153 1.00 0.00 C ATOM 593 C GLU F 37 6.073 -12.380 -6.647 1.00 0.00 C ATOM 594 O GLU F 37 6.873 -13.158 -6.168 1.00 0.00 O ATOM 595 CB GLU F 37 7.390 -11.964 -8.707 1.00 0.00 C ATOM 596 CG GLU F 37 7.330 -11.811 -10.227 1.00 0.00 C ATOM 597 CD GLU F 37 8.266 -12.828 -10.881 1.00 0.00 C ATOM 598 OE1 GLU F 37 9.452 -12.552 -10.952 1.00 0.00 O ATOM 599 OE2 GLU F 37 7.780 -13.866 -11.300 1.00 0.00 O ATOM 0 H GLU F 37 5.732 -10.052 -8.451 1.00 0.00 H new ATOM 0 HA GLU F 37 5.509 -12.998 -8.642 1.00 0.00 H new ATOM 0 HB2 GLU F 37 7.854 -11.084 -8.262 1.00 0.00 H new ATOM 0 HB3 GLU F 37 8.010 -12.820 -8.442 1.00 0.00 H new ATOM 0 HG2 GLU F 37 6.309 -11.962 -10.578 1.00 0.00 H new ATOM 0 HG3 GLU F 37 7.619 -10.799 -10.513 1.00 0.00 H new ATOM 606 N THR F 38 5.254 -11.697 -5.898 1.00 0.00 N ATOM 607 CA THR F 38 5.279 -11.854 -4.420 1.00 0.00 C ATOM 608 C THR F 38 4.553 -13.139 -4.050 1.00 0.00 C ATOM 609 O THR F 38 4.991 -13.899 -3.208 1.00 0.00 O ATOM 610 CB THR F 38 4.577 -10.653 -3.775 1.00 0.00 C ATOM 611 OG1 THR F 38 5.006 -10.523 -2.427 1.00 0.00 O ATOM 612 CG2 THR F 38 3.056 -10.838 -3.814 1.00 0.00 C ATOM 0 H THR F 38 4.564 -11.033 -6.250 1.00 0.00 H new ATOM 0 HA THR F 38 6.308 -11.902 -4.063 1.00 0.00 H new ATOM 0 HB THR F 38 4.835 -9.752 -4.332 1.00 0.00 H new ATOM 0 HG1 THR F 38 4.559 -9.755 -2.014 1.00 0.00 H new ATOM 0 HG21 THR F 38 2.573 -9.977 -3.352 1.00 0.00 H new ATOM 0 HG22 THR F 38 2.727 -10.927 -4.849 1.00 0.00 H new ATOM 0 HG23 THR F 38 2.785 -11.742 -3.268 1.00 0.00 H new ATOM 620 N THR F 39 3.443 -13.385 -4.677 1.00 0.00 N ATOM 621 CA THR F 39 2.680 -14.627 -4.363 1.00 0.00 C ATOM 622 C THR F 39 2.798 -15.608 -5.532 1.00 0.00 C ATOM 623 O THR F 39 3.548 -15.387 -6.462 1.00 0.00 O ATOM 624 CB THR F 39 1.208 -14.277 -4.102 1.00 0.00 C ATOM 625 OG1 THR F 39 0.616 -15.298 -3.313 1.00 0.00 O ATOM 626 CG2 THR F 39 0.448 -14.151 -5.424 1.00 0.00 C ATOM 0 H THR F 39 3.029 -12.786 -5.391 1.00 0.00 H new ATOM 0 HA THR F 39 3.091 -15.094 -3.468 1.00 0.00 H new ATOM 0 HB THR F 39 1.158 -13.324 -3.575 1.00 0.00 H new ATOM 0 HG1 THR F 39 -0.338 -15.364 -3.525 1.00 0.00 H new ATOM 0 HG21 THR F 39 -0.594 -13.903 -5.222 1.00 0.00 H new ATOM 0 HG22 THR F 39 0.898 -13.364 -6.029 1.00 0.00 H new ATOM 0 HG23 THR F 39 0.498 -15.097 -5.964 1.00 0.00 H new ATOM 634 N LYS F 40 2.062 -16.688 -5.493 1.00 0.00 N ATOM 635 CA LYS F 40 2.131 -17.678 -6.601 1.00 0.00 C ATOM 636 C LYS F 40 2.140 -16.924 -7.927 1.00 0.00 C ATOM 637 O LYS F 40 2.832 -17.282 -8.859 1.00 0.00 O ATOM 638 CB LYS F 40 0.904 -18.592 -6.550 1.00 0.00 C ATOM 639 CG LYS F 40 0.583 -18.956 -5.100 1.00 0.00 C ATOM 640 CD LYS F 40 1.867 -19.353 -4.368 1.00 0.00 C ATOM 641 CE LYS F 40 1.678 -20.722 -3.713 1.00 0.00 C ATOM 642 NZ LYS F 40 2.585 -21.712 -4.361 1.00 0.00 N ATOM 0 H LYS F 40 1.416 -16.925 -4.740 1.00 0.00 H new ATOM 0 HA LYS F 40 3.034 -18.281 -6.503 1.00 0.00 H new ATOM 0 HB2 LYS F 40 0.049 -18.093 -7.006 1.00 0.00 H new ATOM 0 HB3 LYS F 40 1.090 -19.497 -7.128 1.00 0.00 H new ATOM 0 HG2 LYS F 40 0.115 -18.109 -4.598 1.00 0.00 H new ATOM 0 HG3 LYS F 40 -0.132 -19.779 -5.072 1.00 0.00 H new ATOM 0 HD2 LYS F 40 2.702 -19.385 -5.068 1.00 0.00 H new ATOM 0 HD3 LYS F 40 2.113 -18.607 -3.612 1.00 0.00 H new ATOM 0 HE2 LYS F 40 1.893 -20.660 -2.646 1.00 0.00 H new ATOM 0 HE3 LYS F 40 0.641 -21.044 -3.811 1.00 0.00 H new ATOM 0 HZ1 LYS F 40 2.457 -22.643 -3.916 1.00 0.00 H new ATOM 0 HZ2 LYS F 40 2.359 -21.778 -5.374 1.00 0.00 H new ATOM 0 HZ3 LYS F 40 3.572 -21.406 -4.246 1.00 0.00 H new ATOM 656 N GLY F 41 1.378 -15.875 -8.003 1.00 0.00 N ATOM 657 CA GLY F 41 1.327 -15.070 -9.248 1.00 0.00 C ATOM 658 C GLY F 41 0.065 -14.209 -9.239 1.00 0.00 C ATOM 659 O GLY F 41 -0.869 -14.441 -9.983 1.00 0.00 O ATOM 0 H GLY F 41 0.782 -15.537 -7.247 1.00 0.00 H new ATOM 0 HA2 GLY F 41 2.212 -14.438 -9.323 1.00 0.00 H new ATOM 0 HA3 GLY F 41 1.328 -15.725 -10.119 1.00 0.00 H new ATOM 663 N ALA F 42 0.042 -13.208 -8.409 1.00 0.00 N ATOM 664 CA ALA F 42 -1.137 -12.307 -8.337 1.00 0.00 C ATOM 665 C ALA F 42 -0.953 -11.209 -9.367 1.00 0.00 C ATOM 666 O ALA F 42 -0.153 -11.328 -10.272 1.00 0.00 O ATOM 667 CB ALA F 42 -1.201 -11.679 -6.945 1.00 0.00 C ATOM 0 H ALA F 42 0.800 -12.973 -7.769 1.00 0.00 H new ATOM 0 HA ALA F 42 -2.055 -12.862 -8.530 1.00 0.00 H new ATOM 0 HB1 ALA F 42 -2.064 -11.016 -6.884 1.00 0.00 H new ATOM 0 HB2 ALA F 42 -1.294 -12.465 -6.195 1.00 0.00 H new ATOM 0 HB3 ALA F 42 -0.291 -11.108 -6.761 1.00 0.00 H new ATOM 673 N TYR F 43 -1.663 -10.132 -9.237 1.00 0.00 N ATOM 674 CA TYR F 43 -1.478 -9.033 -10.206 1.00 0.00 C ATOM 675 C TYR F 43 -0.974 -7.807 -9.464 1.00 0.00 C ATOM 676 O TYR F 43 -0.644 -7.876 -8.298 1.00 0.00 O ATOM 677 CB TYR F 43 -2.782 -8.720 -10.923 1.00 0.00 C ATOM 678 CG TYR F 43 -2.610 -9.092 -12.370 1.00 0.00 C ATOM 679 CD1 TYR F 43 -1.535 -8.564 -13.095 1.00 0.00 C ATOM 680 CD2 TYR F 43 -3.504 -9.978 -12.980 1.00 0.00 C ATOM 681 CE1 TYR F 43 -1.357 -8.925 -14.437 1.00 0.00 C ATOM 682 CE2 TYR F 43 -3.325 -10.340 -14.318 1.00 0.00 C ATOM 683 CZ TYR F 43 -2.253 -9.815 -15.047 1.00 0.00 C ATOM 684 OH TYR F 43 -2.076 -10.177 -16.367 1.00 0.00 O ATOM 0 H TYR F 43 -2.357 -9.967 -8.508 1.00 0.00 H new ATOM 0 HA TYR F 43 -0.750 -9.334 -10.959 1.00 0.00 H new ATOM 0 HB2 TYR F 43 -3.606 -9.280 -10.480 1.00 0.00 H new ATOM 0 HB3 TYR F 43 -3.027 -7.662 -10.827 1.00 0.00 H new ATOM 0 HD1 TYR F 43 -0.845 -7.881 -12.622 1.00 0.00 H new ATOM 0 HD2 TYR F 43 -4.332 -10.382 -12.417 1.00 0.00 H new ATOM 0 HE1 TYR F 43 -0.531 -8.518 -15.001 1.00 0.00 H new ATOM 0 HE2 TYR F 43 -4.014 -11.025 -14.789 1.00 0.00 H new ATOM 0 HH TYR F 43 -2.784 -10.800 -16.633 1.00 0.00 H new ATOM 694 N SER F 44 -0.879 -6.691 -10.120 1.00 0.00 N ATOM 695 CA SER F 44 -0.354 -5.492 -9.424 1.00 0.00 C ATOM 696 C SER F 44 -0.756 -4.222 -10.154 1.00 0.00 C ATOM 697 O SER F 44 -1.235 -4.244 -11.267 1.00 0.00 O ATOM 698 CB SER F 44 1.159 -5.585 -9.410 1.00 0.00 C ATOM 699 OG SER F 44 1.714 -4.315 -9.100 1.00 0.00 O ATOM 0 H SER F 44 -1.139 -6.557 -11.097 1.00 0.00 H new ATOM 0 HA SER F 44 -0.761 -5.455 -8.414 1.00 0.00 H new ATOM 0 HB2 SER F 44 1.481 -6.322 -8.675 1.00 0.00 H new ATOM 0 HB3 SER F 44 1.521 -5.924 -10.381 1.00 0.00 H new ATOM 0 HG SER F 44 2.478 -4.430 -8.498 1.00 0.00 H new ATOM 705 N LEU F 45 -0.540 -3.109 -9.525 1.00 0.00 N ATOM 706 CA LEU F 45 -0.882 -1.813 -10.170 1.00 0.00 C ATOM 707 C LEU F 45 0.079 -0.721 -9.695 1.00 0.00 C ATOM 708 O LEU F 45 -0.199 0.005 -8.765 1.00 0.00 O ATOM 709 CB LEU F 45 -2.310 -1.410 -9.817 1.00 0.00 C ATOM 710 CG LEU F 45 -2.658 -0.144 -10.594 1.00 0.00 C ATOM 711 CD1 LEU F 45 -4.160 -0.098 -10.858 1.00 0.00 C ATOM 712 CD2 LEU F 45 -2.243 1.081 -9.784 1.00 0.00 C ATOM 0 H LEU F 45 -0.140 -3.037 -8.589 1.00 0.00 H new ATOM 0 HA LEU F 45 -0.795 -1.931 -11.250 1.00 0.00 H new ATOM 0 HB2 LEU F 45 -3.004 -2.212 -10.068 1.00 0.00 H new ATOM 0 HB3 LEU F 45 -2.401 -1.234 -8.745 1.00 0.00 H new ATOM 0 HG LEU F 45 -2.126 -0.147 -11.546 1.00 0.00 H new ATOM 0 HD11 LEU F 45 -4.404 0.808 -11.413 1.00 0.00 H new ATOM 0 HD12 LEU F 45 -4.454 -0.971 -11.441 1.00 0.00 H new ATOM 0 HD13 LEU F 45 -4.696 -0.098 -9.909 1.00 0.00 H new ATOM 0 HD21 LEU F 45 -2.492 1.986 -10.339 1.00 0.00 H new ATOM 0 HD22 LEU F 45 -2.772 1.083 -8.831 1.00 0.00 H new ATOM 0 HD23 LEU F 45 -1.169 1.050 -9.603 1.00 0.00 H new ATOM 724 N SER F 46 1.205 -0.592 -10.332 1.00 0.00 N ATOM 725 CA SER F 46 2.167 0.462 -9.914 1.00 0.00 C ATOM 726 C SER F 46 1.632 1.828 -10.311 1.00 0.00 C ATOM 727 O SER F 46 0.694 1.953 -11.072 1.00 0.00 O ATOM 728 CB SER F 46 3.521 0.250 -10.585 1.00 0.00 C ATOM 729 OG SER F 46 4.354 1.372 -10.328 1.00 0.00 O ATOM 0 H SER F 46 1.501 -1.167 -11.121 1.00 0.00 H new ATOM 0 HA SER F 46 2.290 0.406 -8.832 1.00 0.00 H new ATOM 0 HB2 SER F 46 3.989 -0.659 -10.207 1.00 0.00 H new ATOM 0 HB3 SER F 46 3.391 0.118 -11.659 1.00 0.00 H new ATOM 0 HG SER F 46 5.294 1.098 -10.371 1.00 0.00 H new ATOM 735 N ILE F 47 2.236 2.849 -9.797 1.00 0.00 N ATOM 736 CA ILE F 47 1.788 4.232 -10.132 1.00 0.00 C ATOM 737 C ILE F 47 2.972 5.200 -10.041 1.00 0.00 C ATOM 738 O ILE F 47 3.598 5.336 -9.010 1.00 0.00 O ATOM 739 CB ILE F 47 0.678 4.664 -9.163 1.00 0.00 C ATOM 740 CG1 ILE F 47 1.286 5.201 -7.862 1.00 0.00 C ATOM 741 CG2 ILE F 47 -0.212 3.463 -8.844 1.00 0.00 C ATOM 742 CD1 ILE F 47 0.164 5.556 -6.885 1.00 0.00 C ATOM 0 H ILE F 47 3.026 2.794 -9.155 1.00 0.00 H new ATOM 0 HA ILE F 47 1.398 4.247 -11.150 1.00 0.00 H new ATOM 0 HB ILE F 47 0.088 5.452 -9.631 1.00 0.00 H new ATOM 0 HG12 ILE F 47 1.945 4.454 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE F 47 1.895 6.081 -8.068 1.00 0.00 H new ATOM 0 HG21 ILE F 47 -1.001 3.767 -8.156 1.00 0.00 H new ATOM 0 HG22 ILE F 47 -0.658 3.086 -9.764 1.00 0.00 H new ATOM 0 HG23 ILE F 47 0.388 2.678 -8.384 1.00 0.00 H new ATOM 0 HD11 ILE F 47 0.595 5.938 -5.959 1.00 0.00 H new ATOM 0 HD12 ILE F 47 -0.477 6.318 -7.328 1.00 0.00 H new ATOM 0 HD13 ILE F 47 -0.426 4.665 -6.670 1.00 0.00 H new ATOM 754 N ARG F 48 3.278 5.881 -11.111 1.00 0.00 N ATOM 755 CA ARG F 48 4.413 6.847 -11.080 1.00 0.00 C ATOM 756 C ARG F 48 3.950 8.140 -10.407 1.00 0.00 C ATOM 757 O ARG F 48 3.056 8.810 -10.883 1.00 0.00 O ATOM 758 CB ARG F 48 4.867 7.150 -12.510 1.00 0.00 C ATOM 759 CG ARG F 48 6.365 7.462 -12.514 1.00 0.00 C ATOM 760 CD ARG F 48 6.570 8.979 -12.491 1.00 0.00 C ATOM 761 NE ARG F 48 7.596 9.355 -13.505 1.00 0.00 N ATOM 762 CZ ARG F 48 8.019 10.588 -13.578 1.00 0.00 C ATOM 763 NH1 ARG F 48 7.975 11.358 -12.526 1.00 0.00 N ATOM 764 NH2 ARG F 48 8.487 11.051 -14.705 1.00 0.00 N ATOM 0 H ARG F 48 2.792 5.811 -12.005 1.00 0.00 H new ATOM 0 HA ARG F 48 5.245 6.418 -10.522 1.00 0.00 H new ATOM 0 HB2 ARG F 48 4.660 6.297 -13.157 1.00 0.00 H new ATOM 0 HB3 ARG F 48 4.307 7.996 -12.909 1.00 0.00 H new ATOM 0 HG2 ARG F 48 6.845 7.006 -11.648 1.00 0.00 H new ATOM 0 HG3 ARG F 48 6.834 7.034 -13.400 1.00 0.00 H new ATOM 0 HD2 ARG F 48 5.630 9.487 -12.703 1.00 0.00 H new ATOM 0 HD3 ARG F 48 6.889 9.299 -11.499 1.00 0.00 H new ATOM 0 HE ARG F 48 7.967 8.650 -14.141 1.00 0.00 H new ATOM 0 HH11 ARG F 48 7.610 10.997 -11.645 1.00 0.00 H new ATOM 0 HH12 ARG F 48 8.306 12.321 -12.585 1.00 0.00 H new ATOM 0 HH21 ARG F 48 8.522 10.450 -15.528 1.00 0.00 H new ATOM 0 HH22 ARG F 48 8.818 12.014 -14.763 1.00 0.00 H new ATOM 778 N ASP F 49 4.544 8.493 -9.299 1.00 0.00 N ATOM 779 CA ASP F 49 4.122 9.739 -8.602 1.00 0.00 C ATOM 780 C ASP F 49 5.352 10.566 -8.215 1.00 0.00 C ATOM 781 O ASP F 49 6.094 10.216 -7.319 1.00 0.00 O ATOM 782 CB ASP F 49 3.340 9.372 -7.339 1.00 0.00 C ATOM 783 CG ASP F 49 3.133 10.625 -6.487 1.00 0.00 C ATOM 784 OD1 ASP F 49 2.493 11.546 -6.968 1.00 0.00 O ATOM 785 OD2 ASP F 49 3.617 10.643 -5.367 1.00 0.00 O ATOM 0 H ASP F 49 5.299 7.975 -8.849 1.00 0.00 H new ATOM 0 HA ASP F 49 3.492 10.327 -9.270 1.00 0.00 H new ATOM 0 HB2 ASP F 49 2.377 8.938 -7.608 1.00 0.00 H new ATOM 0 HB3 ASP F 49 3.882 8.617 -6.769 1.00 0.00 H new ATOM 790 N TRP F 50 5.564 11.668 -8.880 1.00 0.00 N ATOM 791 CA TRP F 50 6.732 12.535 -8.554 1.00 0.00 C ATOM 792 C TRP F 50 6.227 13.772 -7.797 1.00 0.00 C ATOM 793 O TRP F 50 5.053 14.086 -7.817 1.00 0.00 O ATOM 794 CB TRP F 50 7.433 12.950 -9.858 1.00 0.00 C ATOM 795 CG TRP F 50 8.261 14.170 -9.620 1.00 0.00 C ATOM 796 CD1 TRP F 50 9.606 14.204 -9.513 1.00 0.00 C ATOM 797 CD2 TRP F 50 7.806 15.531 -9.460 1.00 0.00 C ATOM 798 NE1 TRP F 50 10.001 15.510 -9.278 1.00 0.00 N ATOM 799 CE2 TRP F 50 8.922 16.367 -9.247 1.00 0.00 C ATOM 800 CE3 TRP F 50 6.535 16.106 -9.477 1.00 0.00 C ATOM 801 CZ2 TRP F 50 8.776 17.741 -9.061 1.00 0.00 C ATOM 802 CZ3 TRP F 50 6.378 17.486 -9.290 1.00 0.00 C ATOM 803 CH2 TRP F 50 7.498 18.304 -9.083 1.00 0.00 C ATOM 0 H TRP F 50 4.975 12.007 -9.640 1.00 0.00 H new ATOM 0 HA TRP F 50 7.446 11.998 -7.930 1.00 0.00 H new ATOM 0 HB2 TRP F 50 8.063 12.136 -10.218 1.00 0.00 H new ATOM 0 HB3 TRP F 50 6.692 13.147 -10.633 1.00 0.00 H new ATOM 0 HD1 TRP F 50 10.265 13.353 -9.597 1.00 0.00 H new ATOM 0 HE1 TRP F 50 10.969 15.801 -9.145 1.00 0.00 H new ATOM 0 HE3 TRP F 50 5.667 15.484 -9.635 1.00 0.00 H new ATOM 0 HZ2 TRP F 50 9.643 18.364 -8.901 1.00 0.00 H new ATOM 0 HZ3 TRP F 50 5.390 17.922 -9.305 1.00 0.00 H new ATOM 0 HH2 TRP F 50 7.373 19.367 -8.941 1.00 0.00 H new ATOM 814 N ASP F 51 7.102 14.473 -7.127 1.00 0.00 N ATOM 815 CA ASP F 51 6.668 15.683 -6.368 1.00 0.00 C ATOM 816 C ASP F 51 7.756 16.759 -6.442 1.00 0.00 C ATOM 817 O ASP F 51 8.910 16.473 -6.694 1.00 0.00 O ATOM 818 CB ASP F 51 6.425 15.306 -4.906 1.00 0.00 C ATOM 819 CG ASP F 51 4.995 15.682 -4.513 1.00 0.00 C ATOM 820 OD1 ASP F 51 4.093 15.380 -5.276 1.00 0.00 O ATOM 821 OD2 ASP F 51 4.827 16.265 -3.454 1.00 0.00 O ATOM 0 H ASP F 51 8.098 14.261 -7.072 1.00 0.00 H new ATOM 0 HA ASP F 51 5.748 16.071 -6.804 1.00 0.00 H new ATOM 0 HB2 ASP F 51 6.583 14.237 -4.764 1.00 0.00 H new ATOM 0 HB3 ASP F 51 7.138 15.822 -4.263 1.00 0.00 H new ATOM 826 N ASP F 52 7.396 17.996 -6.224 1.00 0.00 N ATOM 827 CA ASP F 52 8.405 19.096 -6.286 1.00 0.00 C ATOM 828 C ASP F 52 9.136 19.219 -4.947 1.00 0.00 C ATOM 829 O ASP F 52 9.465 20.305 -4.513 1.00 0.00 O ATOM 830 CB ASP F 52 7.694 20.418 -6.597 1.00 0.00 C ATOM 831 CG ASP F 52 6.957 20.914 -5.350 1.00 0.00 C ATOM 832 OD1 ASP F 52 6.599 20.086 -4.529 1.00 0.00 O ATOM 833 OD2 ASP F 52 6.765 22.114 -5.238 1.00 0.00 O ATOM 0 H ASP F 52 6.445 18.294 -6.005 1.00 0.00 H new ATOM 0 HA ASP F 52 9.130 18.870 -7.068 1.00 0.00 H new ATOM 0 HB2 ASP F 52 8.419 21.164 -6.923 1.00 0.00 H new ATOM 0 HB3 ASP F 52 6.989 20.279 -7.417 1.00 0.00 H new ATOM 838 N MET F 53 9.401 18.125 -4.287 1.00 0.00 N ATOM 839 CA MET F 53 10.111 18.209 -2.989 1.00 0.00 C ATOM 840 C MET F 53 10.705 16.848 -2.621 1.00 0.00 C ATOM 841 O MET F 53 10.741 16.475 -1.466 1.00 0.00 O ATOM 842 CB MET F 53 9.143 18.665 -1.893 1.00 0.00 C ATOM 843 CG MET F 53 7.774 18.008 -2.098 1.00 0.00 C ATOM 844 SD MET F 53 7.444 16.869 -0.732 1.00 0.00 S ATOM 845 CE MET F 53 7.990 15.362 -1.569 1.00 0.00 C ATOM 0 H MET F 53 9.156 17.183 -4.592 1.00 0.00 H new ATOM 0 HA MET F 53 10.920 18.934 -3.079 1.00 0.00 H new ATOM 0 HB2 MET F 53 9.540 18.401 -0.913 1.00 0.00 H new ATOM 0 HB3 MET F 53 9.042 19.750 -1.914 1.00 0.00 H new ATOM 0 HG2 MET F 53 6.996 18.770 -2.147 1.00 0.00 H new ATOM 0 HG3 MET F 53 7.754 17.471 -3.047 1.00 0.00 H new ATOM 0 HE1 MET F 53 7.166 14.649 -1.609 1.00 0.00 H new ATOM 0 HE2 MET F 53 8.310 15.604 -2.583 1.00 0.00 H new ATOM 0 HE3 MET F 53 8.824 14.923 -1.021 1.00 0.00 H new ATOM 855 N LYS F 54 11.180 16.104 -3.584 1.00 0.00 N ATOM 856 CA LYS F 54 11.774 14.779 -3.266 1.00 0.00 C ATOM 857 C LYS F 54 12.215 14.073 -4.549 1.00 0.00 C ATOM 858 O LYS F 54 13.127 13.270 -4.538 1.00 0.00 O ATOM 859 CB LYS F 54 10.739 13.911 -2.546 1.00 0.00 C ATOM 860 CG LYS F 54 9.576 13.616 -3.493 1.00 0.00 C ATOM 861 CD LYS F 54 8.487 12.849 -2.739 1.00 0.00 C ATOM 862 CE LYS F 54 8.705 11.346 -2.917 1.00 0.00 C ATOM 863 NZ LYS F 54 8.069 10.616 -1.783 1.00 0.00 N ATOM 0 H LYS F 54 11.181 16.357 -4.572 1.00 0.00 H new ATOM 0 HA LYS F 54 12.642 14.930 -2.624 1.00 0.00 H new ATOM 0 HB2 LYS F 54 11.197 12.979 -2.214 1.00 0.00 H new ATOM 0 HB3 LYS F 54 10.376 14.423 -1.655 1.00 0.00 H new ATOM 0 HG2 LYS F 54 9.171 14.547 -3.890 1.00 0.00 H new ATOM 0 HG3 LYS F 54 9.925 13.031 -4.344 1.00 0.00 H new ATOM 0 HD2 LYS F 54 8.512 13.108 -1.680 1.00 0.00 H new ATOM 0 HD3 LYS F 54 7.503 13.131 -3.113 1.00 0.00 H new ATOM 0 HE2 LYS F 54 8.277 11.015 -3.863 1.00 0.00 H new ATOM 0 HE3 LYS F 54 9.771 11.124 -2.955 1.00 0.00 H new ATOM 0 HZ1 LYS F 54 8.127 9.592 -1.953 1.00 0.00 H new ATOM 0 HZ2 LYS F 54 8.565 10.849 -0.899 1.00 0.00 H new ATOM 0 HZ3 LYS F 54 7.071 10.898 -1.705 1.00 0.00 H new ATOM 877 N GLY F 55 11.576 14.345 -5.653 1.00 0.00 N ATOM 878 CA GLY F 55 11.962 13.671 -6.907 1.00 0.00 C ATOM 879 C GLY F 55 10.803 12.799 -7.370 1.00 0.00 C ATOM 880 O GLY F 55 9.690 12.930 -6.902 1.00 0.00 O ATOM 0 H GLY F 55 10.804 15.007 -5.733 1.00 0.00 H new ATOM 0 HA2 GLY F 55 12.209 14.408 -7.671 1.00 0.00 H new ATOM 0 HA3 GLY F 55 12.853 13.063 -6.750 1.00 0.00 H new ATOM 884 N ASP F 56 11.046 11.913 -8.285 1.00 0.00 N ATOM 885 CA ASP F 56 9.947 11.046 -8.774 1.00 0.00 C ATOM 886 C ASP F 56 9.850 9.809 -7.880 1.00 0.00 C ATOM 887 O ASP F 56 10.764 9.495 -7.142 1.00 0.00 O ATOM 888 CB ASP F 56 10.239 10.617 -10.212 1.00 0.00 C ATOM 889 CG ASP F 56 11.718 10.249 -10.350 1.00 0.00 C ATOM 890 OD1 ASP F 56 12.275 9.745 -9.388 1.00 0.00 O ATOM 891 OD2 ASP F 56 12.268 10.478 -11.415 1.00 0.00 O ATOM 0 H ASP F 56 11.956 11.751 -8.716 1.00 0.00 H new ATOM 0 HA ASP F 56 9.005 11.593 -8.746 1.00 0.00 H new ATOM 0 HB2 ASP F 56 9.615 9.764 -10.481 1.00 0.00 H new ATOM 0 HB3 ASP F 56 9.989 11.424 -10.900 1.00 0.00 H new ATOM 896 N HIS F 57 8.758 9.101 -7.939 1.00 0.00 N ATOM 897 CA HIS F 57 8.613 7.886 -7.097 1.00 0.00 C ATOM 898 C HIS F 57 7.624 6.938 -7.763 1.00 0.00 C ATOM 899 O HIS F 57 7.204 7.150 -8.883 1.00 0.00 O ATOM 900 CB HIS F 57 8.094 8.273 -5.712 1.00 0.00 C ATOM 901 CG HIS F 57 9.239 8.307 -4.738 1.00 0.00 C ATOM 902 ND1 HIS F 57 9.056 8.573 -3.390 1.00 0.00 N ATOM 903 CD2 HIS F 57 10.588 8.107 -4.901 1.00 0.00 C ATOM 904 CE1 HIS F 57 10.265 8.527 -2.801 1.00 0.00 C ATOM 905 NE2 HIS F 57 11.233 8.247 -3.676 1.00 0.00 N ATOM 0 H HIS F 57 7.959 9.313 -8.536 1.00 0.00 H new ATOM 0 HA HIS F 57 9.582 7.398 -6.990 1.00 0.00 H new ATOM 0 HB2 HIS F 57 7.609 9.248 -5.753 1.00 0.00 H new ATOM 0 HB3 HIS F 57 7.342 7.557 -5.381 1.00 0.00 H new ATOM 0 HD2 HIS F 57 11.074 7.876 -5.837 1.00 0.00 H new ATOM 0 HE1 HIS F 57 10.432 8.696 -1.747 1.00 0.00 H new ATOM 0 HE2 HIS F 57 12.231 8.155 -3.487 1.00 0.00 H new ATOM 913 N VAL F 58 7.255 5.889 -7.090 1.00 0.00 N ATOM 914 CA VAL F 58 6.301 4.926 -7.691 1.00 0.00 C ATOM 915 C VAL F 58 5.650 4.083 -6.588 1.00 0.00 C ATOM 916 O VAL F 58 6.300 3.312 -5.910 1.00 0.00 O ATOM 917 CB VAL F 58 7.072 4.049 -8.690 1.00 0.00 C ATOM 918 CG1 VAL F 58 6.636 2.580 -8.605 1.00 0.00 C ATOM 919 CG2 VAL F 58 6.804 4.566 -10.096 1.00 0.00 C ATOM 0 H VAL F 58 7.573 5.657 -6.149 1.00 0.00 H new ATOM 0 HA VAL F 58 5.502 5.448 -8.217 1.00 0.00 H new ATOM 0 HB VAL F 58 8.134 4.101 -8.449 1.00 0.00 H new ATOM 0 HG11 VAL F 58 7.202 1.990 -9.326 1.00 0.00 H new ATOM 0 HG12 VAL F 58 6.823 2.202 -7.600 1.00 0.00 H new ATOM 0 HG13 VAL F 58 5.572 2.503 -8.829 1.00 0.00 H new ATOM 0 HG21 VAL F 58 7.345 3.954 -10.818 1.00 0.00 H new ATOM 0 HG22 VAL F 58 5.735 4.515 -10.305 1.00 0.00 H new ATOM 0 HG23 VAL F 58 7.140 5.600 -10.174 1.00 0.00 H new ATOM 929 N LYS F 59 4.363 4.213 -6.426 1.00 0.00 N ATOM 930 CA LYS F 59 3.649 3.411 -5.395 1.00 0.00 C ATOM 931 C LYS F 59 2.935 2.263 -6.104 1.00 0.00 C ATOM 932 O LYS F 59 2.429 2.426 -7.195 1.00 0.00 O ATOM 933 CB LYS F 59 2.625 4.292 -4.676 1.00 0.00 C ATOM 934 CG LYS F 59 2.603 3.937 -3.187 1.00 0.00 C ATOM 935 CD LYS F 59 3.789 4.601 -2.487 1.00 0.00 C ATOM 936 CE LYS F 59 3.336 5.920 -1.856 1.00 0.00 C ATOM 937 NZ LYS F 59 4.478 6.877 -1.829 1.00 0.00 N ATOM 0 H LYS F 59 3.772 4.844 -6.967 1.00 0.00 H new ATOM 0 HA LYS F 59 4.353 3.023 -4.659 1.00 0.00 H new ATOM 0 HB2 LYS F 59 2.879 5.344 -4.806 1.00 0.00 H new ATOM 0 HB3 LYS F 59 1.636 4.147 -5.110 1.00 0.00 H new ATOM 0 HG2 LYS F 59 1.668 4.270 -2.737 1.00 0.00 H new ATOM 0 HG3 LYS F 59 2.651 2.856 -3.059 1.00 0.00 H new ATOM 0 HD2 LYS F 59 4.190 3.938 -1.721 1.00 0.00 H new ATOM 0 HD3 LYS F 59 4.591 4.784 -3.202 1.00 0.00 H new ATOM 0 HE2 LYS F 59 2.508 6.342 -2.425 1.00 0.00 H new ATOM 0 HE3 LYS F 59 2.971 5.745 -0.844 1.00 0.00 H new ATOM 0 HZ1 LYS F 59 4.170 7.773 -1.400 1.00 0.00 H new ATOM 0 HZ2 LYS F 59 5.255 6.474 -1.268 1.00 0.00 H new ATOM 0 HZ3 LYS F 59 4.807 7.053 -2.800 1.00 0.00 H new ATOM 951 N HIS F 60 2.902 1.098 -5.525 1.00 0.00 N ATOM 952 CA HIS F 60 2.234 -0.031 -6.226 1.00 0.00 C ATOM 953 C HIS F 60 1.057 -0.566 -5.420 1.00 0.00 C ATOM 954 O HIS F 60 1.047 -0.544 -4.205 1.00 0.00 O ATOM 955 CB HIS F 60 3.234 -1.164 -6.452 1.00 0.00 C ATOM 956 CG HIS F 60 4.607 -0.595 -6.686 1.00 0.00 C ATOM 957 ND1 HIS F 60 5.272 -0.748 -7.891 1.00 0.00 N ATOM 958 CD2 HIS F 60 5.454 0.121 -5.877 1.00 0.00 C ATOM 959 CE1 HIS F 60 6.465 -0.138 -7.776 1.00 0.00 C ATOM 960 NE2 HIS F 60 6.627 0.408 -6.567 1.00 0.00 N ATOM 0 H HIS F 60 3.301 0.880 -4.612 1.00 0.00 H new ATOM 0 HA HIS F 60 1.863 0.343 -7.181 1.00 0.00 H new ATOM 0 HB2 HIS F 60 3.248 -1.827 -5.587 1.00 0.00 H new ATOM 0 HB3 HIS F 60 2.929 -1.765 -7.309 1.00 0.00 H new ATOM 0 HD2 HIS F 60 5.242 0.416 -4.860 1.00 0.00 H new ATOM 0 HE1 HIS F 60 7.202 -0.095 -8.564 1.00 0.00 H new ATOM 0 HE2 HIS F 60 7.437 0.924 -6.224 1.00 0.00 H new ATOM 968 N TYR F 61 0.071 -1.067 -6.110 1.00 0.00 N ATOM 969 CA TYR F 61 -1.119 -1.640 -5.422 1.00 0.00 C ATOM 970 C TYR F 61 -1.263 -3.107 -5.828 1.00 0.00 C ATOM 971 O TYR F 61 -1.669 -3.419 -6.930 1.00 0.00 O ATOM 972 CB TYR F 61 -2.374 -0.869 -5.840 1.00 0.00 C ATOM 973 CG TYR F 61 -2.164 0.604 -5.586 1.00 0.00 C ATOM 974 CD1 TYR F 61 -1.340 1.023 -4.536 1.00 0.00 C ATOM 975 CD2 TYR F 61 -2.790 1.550 -6.405 1.00 0.00 C ATOM 976 CE1 TYR F 61 -1.141 2.389 -4.304 1.00 0.00 C ATOM 977 CE2 TYR F 61 -2.591 2.916 -6.173 1.00 0.00 C ATOM 978 CZ TYR F 61 -1.767 3.336 -5.123 1.00 0.00 C ATOM 979 OH TYR F 61 -1.570 4.682 -4.894 1.00 0.00 O ATOM 0 H TYR F 61 0.038 -1.104 -7.129 1.00 0.00 H new ATOM 0 HA TYR F 61 -0.995 -1.563 -4.342 1.00 0.00 H new ATOM 0 HB2 TYR F 61 -2.585 -1.041 -6.895 1.00 0.00 H new ATOM 0 HB3 TYR F 61 -3.238 -1.227 -5.279 1.00 0.00 H new ATOM 0 HD1 TYR F 61 -0.857 0.292 -3.904 1.00 0.00 H new ATOM 0 HD2 TYR F 61 -3.426 1.227 -7.216 1.00 0.00 H new ATOM 0 HE1 TYR F 61 -0.505 2.712 -3.493 1.00 0.00 H new ATOM 0 HE2 TYR F 61 -3.074 3.647 -6.805 1.00 0.00 H new ATOM 0 HH TYR F 61 -0.802 4.803 -4.298 1.00 0.00 H new ATOM 989 N LYS F 62 -0.922 -4.012 -4.952 1.00 0.00 N ATOM 990 CA LYS F 62 -1.027 -5.456 -5.296 1.00 0.00 C ATOM 991 C LYS F 62 -2.460 -5.788 -5.704 1.00 0.00 C ATOM 992 O LYS F 62 -3.393 -5.618 -4.944 1.00 0.00 O ATOM 993 CB LYS F 62 -0.627 -6.302 -4.084 1.00 0.00 C ATOM 994 CG LYS F 62 -0.194 -7.695 -4.546 1.00 0.00 C ATOM 995 CD LYS F 62 0.178 -8.544 -3.327 1.00 0.00 C ATOM 996 CE LYS F 62 -0.901 -8.403 -2.252 1.00 0.00 C ATOM 997 NZ LYS F 62 -0.840 -9.571 -1.329 1.00 0.00 N ATOM 0 H LYS F 62 -0.575 -3.813 -4.014 1.00 0.00 H new ATOM 0 HA LYS F 62 -0.358 -5.677 -6.128 1.00 0.00 H new ATOM 0 HB2 LYS F 62 0.187 -5.818 -3.544 1.00 0.00 H new ATOM 0 HB3 LYS F 62 -1.465 -6.382 -3.392 1.00 0.00 H new ATOM 0 HG2 LYS F 62 -1.001 -8.172 -5.103 1.00 0.00 H new ATOM 0 HG3 LYS F 62 0.657 -7.617 -5.222 1.00 0.00 H new ATOM 0 HD2 LYS F 62 0.281 -9.589 -3.618 1.00 0.00 H new ATOM 0 HD3 LYS F 62 1.143 -8.227 -2.931 1.00 0.00 H new ATOM 0 HE2 LYS F 62 -0.755 -7.478 -1.695 1.00 0.00 H new ATOM 0 HE3 LYS F 62 -1.886 -8.344 -2.716 1.00 0.00 H new ATOM 0 HZ1 LYS F 62 -1.805 -9.872 -1.086 1.00 0.00 H new ATOM 0 HZ2 LYS F 62 -0.339 -10.355 -1.794 1.00 0.00 H new ATOM 0 HZ3 LYS F 62 -0.333 -9.302 -0.462 1.00 0.00 H new ATOM 1011 N ILE F 63 -2.637 -6.261 -6.904 1.00 0.00 N ATOM 1012 CA ILE F 63 -4.000 -6.609 -7.383 1.00 0.00 C ATOM 1013 C ILE F 63 -4.328 -8.053 -6.995 1.00 0.00 C ATOM 1014 O ILE F 63 -3.524 -8.950 -7.148 1.00 0.00 O ATOM 1015 CB ILE F 63 -4.037 -6.450 -8.903 1.00 0.00 C ATOM 1016 CG1 ILE F 63 -4.339 -4.992 -9.238 1.00 0.00 C ATOM 1017 CG2 ILE F 63 -5.123 -7.346 -9.513 1.00 0.00 C ATOM 1018 CD1 ILE F 63 -4.636 -4.877 -10.728 1.00 0.00 C ATOM 0 H ILE F 63 -1.889 -6.422 -7.579 1.00 0.00 H new ATOM 0 HA ILE F 63 -4.739 -5.950 -6.927 1.00 0.00 H new ATOM 0 HB ILE F 63 -3.072 -6.743 -9.316 1.00 0.00 H new ATOM 0 HG12 ILE F 63 -5.191 -4.641 -8.656 1.00 0.00 H new ATOM 0 HG13 ILE F 63 -3.490 -4.361 -8.973 1.00 0.00 H new ATOM 0 HG21 ILE F 63 -5.134 -7.219 -10.596 1.00 0.00 H new ATOM 0 HG22 ILE F 63 -4.913 -8.388 -9.272 1.00 0.00 H new ATOM 0 HG23 ILE F 63 -6.095 -7.068 -9.105 1.00 0.00 H new ATOM 0 HD11 ILE F 63 -4.853 -3.838 -10.977 1.00 0.00 H new ATOM 0 HD12 ILE F 63 -3.770 -5.213 -11.299 1.00 0.00 H new ATOM 0 HD13 ILE F 63 -5.497 -5.497 -10.976 1.00 0.00 H new ATOM 1030 N ARG F 64 -5.515 -8.278 -6.512 1.00 0.00 N ATOM 1031 CA ARG F 64 -5.924 -9.652 -6.128 1.00 0.00 C ATOM 1032 C ARG F 64 -7.299 -9.930 -6.728 1.00 0.00 C ATOM 1033 O ARG F 64 -8.155 -9.068 -6.762 1.00 0.00 O ATOM 1034 CB ARG F 64 -5.994 -9.766 -4.604 1.00 0.00 C ATOM 1035 CG ARG F 64 -4.673 -9.297 -3.991 1.00 0.00 C ATOM 1036 CD ARG F 64 -3.514 -10.050 -4.644 1.00 0.00 C ATOM 1037 NE ARG F 64 -2.699 -10.718 -3.591 1.00 0.00 N ATOM 1038 CZ ARG F 64 -2.544 -12.014 -3.611 1.00 0.00 C ATOM 1039 NH1 ARG F 64 -3.507 -12.780 -4.046 1.00 0.00 N ATOM 1040 NH2 ARG F 64 -1.426 -12.545 -3.196 1.00 0.00 N ATOM 0 H ARG F 64 -6.225 -7.561 -6.366 1.00 0.00 H new ATOM 0 HA ARG F 64 -5.198 -10.375 -6.500 1.00 0.00 H new ATOM 0 HB2 ARG F 64 -6.818 -9.163 -4.222 1.00 0.00 H new ATOM 0 HB3 ARG F 64 -6.194 -10.798 -4.316 1.00 0.00 H new ATOM 0 HG2 ARG F 64 -4.552 -8.224 -4.138 1.00 0.00 H new ATOM 0 HG3 ARG F 64 -4.676 -9.473 -2.915 1.00 0.00 H new ATOM 0 HD2 ARG F 64 -3.897 -10.790 -5.346 1.00 0.00 H new ATOM 0 HD3 ARG F 64 -2.894 -9.359 -5.215 1.00 0.00 H new ATOM 0 HE ARG F 64 -2.262 -10.163 -2.855 1.00 0.00 H new ATOM 0 HH11 ARG F 64 -4.381 -12.366 -4.370 1.00 0.00 H new ATOM 0 HH12 ARG F 64 -3.386 -13.793 -4.062 1.00 0.00 H new ATOM 0 HH21 ARG F 64 -0.673 -11.947 -2.856 1.00 0.00 H new ATOM 0 HH22 ARG F 64 -1.306 -13.558 -3.212 1.00 0.00 H new ATOM 1054 N LYS F 65 -7.521 -11.117 -7.209 1.00 0.00 N ATOM 1055 CA LYS F 65 -8.841 -11.428 -7.815 1.00 0.00 C ATOM 1056 C LYS F 65 -9.561 -12.470 -6.966 1.00 0.00 C ATOM 1057 O LYS F 65 -8.959 -13.381 -6.436 1.00 0.00 O ATOM 1058 CB LYS F 65 -8.641 -11.972 -9.231 1.00 0.00 C ATOM 1059 CG LYS F 65 -9.983 -12.439 -9.798 1.00 0.00 C ATOM 1060 CD LYS F 65 -9.738 -13.396 -10.965 1.00 0.00 C ATOM 1061 CE LYS F 65 -10.976 -13.434 -11.863 1.00 0.00 C ATOM 1062 NZ LYS F 65 -10.620 -14.046 -13.175 1.00 0.00 N ATOM 0 H LYS F 65 -6.848 -11.884 -7.209 1.00 0.00 H new ATOM 0 HA LYS F 65 -9.441 -10.519 -7.858 1.00 0.00 H new ATOM 0 HB2 LYS F 65 -8.214 -11.200 -9.871 1.00 0.00 H new ATOM 0 HB3 LYS F 65 -7.933 -12.801 -9.216 1.00 0.00 H new ATOM 0 HG2 LYS F 65 -10.565 -12.936 -9.022 1.00 0.00 H new ATOM 0 HG3 LYS F 65 -10.566 -11.582 -10.133 1.00 0.00 H new ATOM 0 HD2 LYS F 65 -8.870 -13.072 -11.539 1.00 0.00 H new ATOM 0 HD3 LYS F 65 -9.517 -14.395 -10.589 1.00 0.00 H new ATOM 0 HE2 LYS F 65 -11.768 -14.010 -11.384 1.00 0.00 H new ATOM 0 HE3 LYS F 65 -11.361 -12.425 -12.013 1.00 0.00 H new ATOM 0 HZ1 LYS F 65 -11.448 -14.026 -13.804 1.00 0.00 H new ATOM 0 HZ2 LYS F 65 -9.842 -13.509 -13.609 1.00 0.00 H new ATOM 0 HZ3 LYS F 65 -10.321 -15.031 -13.029 1.00 0.00 H new ATOM 1076 N LEU F 66 -10.850 -12.345 -6.844 1.00 0.00 N ATOM 1077 CA LEU F 66 -11.614 -13.334 -6.039 1.00 0.00 C ATOM 1078 C LEU F 66 -11.810 -14.599 -6.861 1.00 0.00 C ATOM 1079 O LEU F 66 -11.968 -14.551 -8.064 1.00 0.00 O ATOM 1080 CB LEU F 66 -12.991 -12.762 -5.674 1.00 0.00 C ATOM 1081 CG LEU F 66 -12.879 -11.743 -4.531 1.00 0.00 C ATOM 1082 CD1 LEU F 66 -11.869 -12.214 -3.486 1.00 0.00 C ATOM 1083 CD2 LEU F 66 -12.429 -10.395 -5.087 1.00 0.00 C ATOM 0 H LEU F 66 -11.407 -11.602 -7.266 1.00 0.00 H new ATOM 0 HA LEU F 66 -11.061 -13.557 -5.127 1.00 0.00 H new ATOM 0 HB2 LEU F 66 -13.434 -12.285 -6.548 1.00 0.00 H new ATOM 0 HB3 LEU F 66 -13.659 -13.572 -5.380 1.00 0.00 H new ATOM 0 HG LEU F 66 -13.857 -11.645 -4.060 1.00 0.00 H new ATOM 0 HD11 LEU F 66 -11.804 -11.478 -2.685 1.00 0.00 H new ATOM 0 HD12 LEU F 66 -12.190 -13.171 -3.075 1.00 0.00 H new ATOM 0 HD13 LEU F 66 -10.890 -12.330 -3.952 1.00 0.00 H new ATOM 0 HD21 LEU F 66 -12.350 -9.674 -4.273 1.00 0.00 H new ATOM 0 HD22 LEU F 66 -11.457 -10.506 -5.569 1.00 0.00 H new ATOM 0 HD23 LEU F 66 -13.157 -10.041 -5.817 1.00 0.00 H new ATOM 1095 N ASP F 67 -11.821 -15.731 -6.221 1.00 0.00 N ATOM 1096 CA ASP F 67 -12.039 -16.991 -6.969 1.00 0.00 C ATOM 1097 C ASP F 67 -13.498 -17.020 -7.405 1.00 0.00 C ATOM 1098 O ASP F 67 -13.884 -17.739 -8.305 1.00 0.00 O ATOM 1099 CB ASP F 67 -11.752 -18.182 -6.061 1.00 0.00 C ATOM 1100 CG ASP F 67 -10.459 -18.868 -6.505 1.00 0.00 C ATOM 1101 OD1 ASP F 67 -9.401 -18.403 -6.115 1.00 0.00 O ATOM 1102 OD2 ASP F 67 -10.549 -19.847 -7.229 1.00 0.00 O ATOM 0 H ASP F 67 -11.689 -15.836 -5.215 1.00 0.00 H new ATOM 0 HA ASP F 67 -11.378 -17.045 -7.834 1.00 0.00 H new ATOM 0 HB2 ASP F 67 -11.662 -17.850 -5.027 1.00 0.00 H new ATOM 0 HB3 ASP F 67 -12.581 -18.888 -6.098 1.00 0.00 H new ATOM 1107 N ASN F 68 -14.307 -16.216 -6.773 1.00 0.00 N ATOM 1108 CA ASN F 68 -15.744 -16.157 -7.145 1.00 0.00 C ATOM 1109 C ASN F 68 -15.899 -15.183 -8.309 1.00 0.00 C ATOM 1110 O ASN F 68 -16.955 -15.061 -8.901 1.00 0.00 O ATOM 1111 CB ASN F 68 -16.556 -15.650 -5.954 1.00 0.00 C ATOM 1112 CG ASN F 68 -16.372 -16.598 -4.767 1.00 0.00 C ATOM 1113 OD1 ASN F 68 -16.962 -17.659 -4.726 1.00 0.00 O ATOM 1114 ND2 ASN F 68 -15.571 -16.258 -3.795 1.00 0.00 N ATOM 0 H ASN F 68 -14.031 -15.595 -6.012 1.00 0.00 H new ATOM 0 HA ASN F 68 -16.100 -17.147 -7.429 1.00 0.00 H new ATOM 0 HB2 ASN F 68 -16.234 -14.645 -5.683 1.00 0.00 H new ATOM 0 HB3 ASN F 68 -17.611 -15.586 -6.221 1.00 0.00 H new ATOM 0 HD21 ASN F 68 -15.440 -16.883 -3.000 1.00 0.00 H new ATOM 0 HD22 ASN F 68 -15.076 -15.367 -3.830 1.00 0.00 H new ATOM 1121 N GLY F 69 -14.848 -14.482 -8.638 1.00 0.00 N ATOM 1122 CA GLY F 69 -14.919 -13.510 -9.753 1.00 0.00 C ATOM 1123 C GLY F 69 -15.032 -12.097 -9.180 1.00 0.00 C ATOM 1124 O GLY F 69 -16.112 -11.558 -9.041 1.00 0.00 O ATOM 0 H GLY F 69 -13.941 -14.545 -8.176 1.00 0.00 H new ATOM 0 HA2 GLY F 69 -14.031 -13.591 -10.380 1.00 0.00 H new ATOM 0 HA3 GLY F 69 -15.778 -13.728 -10.388 1.00 0.00 H new ATOM 1128 N GLY F 70 -13.925 -11.494 -8.844 1.00 0.00 N ATOM 1129 CA GLY F 70 -13.966 -10.127 -8.279 1.00 0.00 C ATOM 1130 C GLY F 70 -12.573 -9.492 -8.353 1.00 0.00 C ATOM 1131 O GLY F 70 -11.801 -9.565 -7.423 1.00 0.00 O ATOM 0 H GLY F 70 -12.992 -11.896 -8.939 1.00 0.00 H new ATOM 0 HA2 GLY F 70 -14.683 -9.518 -8.829 1.00 0.00 H new ATOM 0 HA3 GLY F 70 -14.305 -10.162 -7.244 1.00 0.00 H new ATOM 1135 N TYR F 71 -12.244 -8.861 -9.447 1.00 0.00 N ATOM 1136 CA TYR F 71 -10.901 -8.215 -9.556 1.00 0.00 C ATOM 1137 C TYR F 71 -10.902 -6.936 -8.717 1.00 0.00 C ATOM 1138 O TYR F 71 -11.716 -6.059 -8.916 1.00 0.00 O ATOM 1139 CB TYR F 71 -10.614 -7.869 -11.017 1.00 0.00 C ATOM 1140 CG TYR F 71 -9.939 -9.038 -11.690 1.00 0.00 C ATOM 1141 CD1 TYR F 71 -8.596 -9.325 -11.413 1.00 0.00 C ATOM 1142 CD2 TYR F 71 -10.651 -9.829 -12.598 1.00 0.00 C ATOM 1143 CE1 TYR F 71 -7.969 -10.406 -12.044 1.00 0.00 C ATOM 1144 CE2 TYR F 71 -10.024 -10.910 -13.227 1.00 0.00 C ATOM 1145 CZ TYR F 71 -8.682 -11.198 -12.951 1.00 0.00 C ATOM 1146 OH TYR F 71 -8.062 -12.263 -13.573 1.00 0.00 O ATOM 0 H TYR F 71 -12.842 -8.764 -10.267 1.00 0.00 H new ATOM 0 HA TYR F 71 -10.131 -8.897 -9.194 1.00 0.00 H new ATOM 0 HB2 TYR F 71 -11.543 -7.626 -11.533 1.00 0.00 H new ATOM 0 HB3 TYR F 71 -9.977 -6.986 -11.074 1.00 0.00 H new ATOM 0 HD1 TYR F 71 -8.045 -8.713 -10.714 1.00 0.00 H new ATOM 0 HD2 TYR F 71 -11.685 -9.605 -12.814 1.00 0.00 H new ATOM 0 HE1 TYR F 71 -6.934 -10.629 -11.831 1.00 0.00 H new ATOM 0 HE2 TYR F 71 -10.575 -11.522 -13.925 1.00 0.00 H new ATOM 0 HH TYR F 71 -7.367 -12.626 -12.985 1.00 0.00 H new ATOM 1156 N TYR F 72 -10.009 -6.822 -7.772 1.00 0.00 N ATOM 1157 CA TYR F 72 -9.997 -5.596 -6.923 1.00 0.00 C ATOM 1158 C TYR F 72 -8.573 -5.248 -6.487 1.00 0.00 C ATOM 1159 O TYR F 72 -7.862 -6.071 -5.948 1.00 0.00 O ATOM 1160 CB TYR F 72 -10.828 -5.852 -5.660 1.00 0.00 C ATOM 1161 CG TYR F 72 -10.149 -6.904 -4.810 1.00 0.00 C ATOM 1162 CD1 TYR F 72 -9.210 -6.525 -3.842 1.00 0.00 C ATOM 1163 CD2 TYR F 72 -10.450 -8.258 -4.993 1.00 0.00 C ATOM 1164 CE1 TYR F 72 -8.576 -7.493 -3.063 1.00 0.00 C ATOM 1165 CE2 TYR F 72 -9.814 -9.230 -4.213 1.00 0.00 C ATOM 1166 CZ TYR F 72 -8.876 -8.848 -3.246 1.00 0.00 C ATOM 1167 OH TYR F 72 -8.249 -9.805 -2.476 1.00 0.00 O ATOM 0 H TYR F 72 -9.295 -7.516 -7.552 1.00 0.00 H new ATOM 0 HA TYR F 72 -10.409 -4.773 -7.506 1.00 0.00 H new ATOM 0 HB2 TYR F 72 -10.940 -4.928 -5.093 1.00 0.00 H new ATOM 0 HB3 TYR F 72 -11.830 -6.182 -5.933 1.00 0.00 H new ATOM 0 HD1 TYR F 72 -8.976 -5.480 -3.698 1.00 0.00 H new ATOM 0 HD2 TYR F 72 -11.174 -8.553 -5.738 1.00 0.00 H new ATOM 0 HE1 TYR F 72 -7.853 -7.197 -2.318 1.00 0.00 H new ATOM 0 HE2 TYR F 72 -10.047 -10.275 -4.357 1.00 0.00 H new ATOM 0 HH TYR F 72 -8.573 -10.694 -2.731 1.00 0.00 H new ATOM 1177 N ILE F 73 -8.165 -4.020 -6.658 1.00 0.00 N ATOM 1178 CA ILE F 73 -6.812 -3.630 -6.175 1.00 0.00 C ATOM 1179 C ILE F 73 -6.957 -3.431 -4.672 1.00 0.00 C ATOM 1180 O ILE F 73 -6.048 -3.656 -3.897 1.00 0.00 O ATOM 1181 CB ILE F 73 -6.358 -2.325 -6.838 1.00 0.00 C ATOM 1182 CG1 ILE F 73 -6.742 -2.344 -8.320 1.00 0.00 C ATOM 1183 CG2 ILE F 73 -4.840 -2.180 -6.704 1.00 0.00 C ATOM 1184 CD1 ILE F 73 -6.000 -1.225 -9.056 1.00 0.00 C ATOM 0 H ILE F 73 -8.703 -3.278 -7.106 1.00 0.00 H new ATOM 0 HA ILE F 73 -6.067 -4.388 -6.417 1.00 0.00 H new ATOM 0 HB ILE F 73 -6.845 -1.482 -6.347 1.00 0.00 H new ATOM 0 HG12 ILE F 73 -6.492 -3.310 -8.759 1.00 0.00 H new ATOM 0 HG13 ILE F 73 -7.819 -2.213 -8.429 1.00 0.00 H new ATOM 0 HG21 ILE F 73 -4.520 -1.251 -7.176 1.00 0.00 H new ATOM 0 HG22 ILE F 73 -4.568 -2.163 -5.649 1.00 0.00 H new ATOM 0 HG23 ILE F 73 -4.350 -3.023 -7.191 1.00 0.00 H new ATOM 0 HD11 ILE F 73 -6.274 -1.239 -10.111 1.00 0.00 H new ATOM 0 HD12 ILE F 73 -6.272 -0.262 -8.623 1.00 0.00 H new ATOM 0 HD13 ILE F 73 -4.925 -1.376 -8.958 1.00 0.00 H new ATOM 1196 N THR F 74 -8.139 -3.052 -4.269 1.00 0.00 N ATOM 1197 CA THR F 74 -8.445 -2.870 -2.831 1.00 0.00 C ATOM 1198 C THR F 74 -9.725 -3.652 -2.554 1.00 0.00 C ATOM 1199 O THR F 74 -10.611 -3.720 -3.381 1.00 0.00 O ATOM 1200 CB THR F 74 -8.639 -1.386 -2.493 1.00 0.00 C ATOM 1201 OG1 THR F 74 -9.799 -1.226 -1.693 1.00 0.00 O ATOM 1202 CG2 THR F 74 -8.789 -0.562 -3.773 1.00 0.00 C ATOM 0 H THR F 74 -8.920 -2.858 -4.895 1.00 0.00 H new ATOM 0 HA THR F 74 -7.622 -3.230 -2.214 1.00 0.00 H new ATOM 0 HB THR F 74 -7.763 -1.036 -1.946 1.00 0.00 H new ATOM 0 HG1 THR F 74 -10.103 -0.296 -1.740 1.00 0.00 H new ATOM 0 HG21 THR F 74 -8.926 0.488 -3.516 1.00 0.00 H new ATOM 0 HG22 THR F 74 -7.893 -0.672 -4.384 1.00 0.00 H new ATOM 0 HG23 THR F 74 -9.655 -0.914 -4.333 1.00 0.00 H new ATOM 1210 N THR F 75 -9.813 -4.280 -1.425 1.00 0.00 N ATOM 1211 CA THR F 75 -11.020 -5.105 -1.120 1.00 0.00 C ATOM 1212 C THR F 75 -12.276 -4.236 -1.002 1.00 0.00 C ATOM 1213 O THR F 75 -13.367 -4.736 -0.821 1.00 0.00 O ATOM 1214 CB THR F 75 -10.778 -5.867 0.178 1.00 0.00 C ATOM 1215 OG1 THR F 75 -10.600 -4.945 1.245 1.00 0.00 O ATOM 1216 CG2 THR F 75 -9.518 -6.714 0.008 1.00 0.00 C ATOM 0 H THR F 75 -9.103 -4.263 -0.693 1.00 0.00 H new ATOM 0 HA THR F 75 -11.186 -5.805 -1.938 1.00 0.00 H new ATOM 0 HB THR F 75 -11.630 -6.507 0.406 1.00 0.00 H new ATOM 0 HG1 THR F 75 -10.446 -5.436 2.079 1.00 0.00 H new ATOM 0 HG21 THR F 75 -9.326 -7.269 0.926 1.00 0.00 H new ATOM 0 HG22 THR F 75 -9.658 -7.414 -0.816 1.00 0.00 H new ATOM 0 HG23 THR F 75 -8.670 -6.065 -0.208 1.00 0.00 H new ATOM 1224 N ARG F 76 -12.141 -2.947 -1.115 1.00 0.00 N ATOM 1225 CA ARG F 76 -13.334 -2.067 -1.023 1.00 0.00 C ATOM 1226 C ARG F 76 -14.072 -2.068 -2.366 1.00 0.00 C ATOM 1227 O ARG F 76 -15.192 -1.607 -2.464 1.00 0.00 O ATOM 1228 CB ARG F 76 -12.892 -0.642 -0.685 1.00 0.00 C ATOM 1229 CG ARG F 76 -13.910 -0.003 0.261 1.00 0.00 C ATOM 1230 CD ARG F 76 -15.299 -0.050 -0.376 1.00 0.00 C ATOM 1231 NE ARG F 76 -16.260 0.716 0.467 1.00 0.00 N ATOM 1232 CZ ARG F 76 -17.389 1.129 -0.041 1.00 0.00 C ATOM 1233 NH1 ARG F 76 -18.351 0.278 -0.269 1.00 0.00 N ATOM 1234 NH2 ARG F 76 -17.555 2.393 -0.320 1.00 0.00 N ATOM 0 H ARG F 76 -11.255 -2.465 -1.267 1.00 0.00 H new ATOM 0 HA ARG F 76 -13.999 -2.435 -0.242 1.00 0.00 H new ATOM 0 HB2 ARG F 76 -11.906 -0.656 -0.220 1.00 0.00 H new ATOM 0 HB3 ARG F 76 -12.806 -0.051 -1.597 1.00 0.00 H new ATOM 0 HG2 ARG F 76 -13.918 -0.531 1.214 1.00 0.00 H new ATOM 0 HG3 ARG F 76 -13.629 1.029 0.471 1.00 0.00 H new ATOM 0 HD2 ARG F 76 -15.264 0.372 -1.381 1.00 0.00 H new ATOM 0 HD3 ARG F 76 -15.630 -1.084 -0.475 1.00 0.00 H new ATOM 0 HE ARG F 76 -16.035 0.918 1.441 1.00 0.00 H new ATOM 0 HH11 ARG F 76 -18.221 -0.710 -0.050 1.00 0.00 H new ATOM 0 HH12 ARG F 76 -19.234 0.600 -0.666 1.00 0.00 H new ATOM 0 HH21 ARG F 76 -16.802 3.058 -0.141 1.00 0.00 H new ATOM 0 HH22 ARG F 76 -18.437 2.716 -0.717 1.00 0.00 H new ATOM 1248 N ALA F 77 -13.459 -2.575 -3.408 1.00 0.00 N ATOM 1249 CA ALA F 77 -14.149 -2.587 -4.733 1.00 0.00 C ATOM 1250 C ALA F 77 -13.552 -3.660 -5.652 1.00 0.00 C ATOM 1251 O ALA F 77 -12.368 -3.676 -5.922 1.00 0.00 O ATOM 1252 CB ALA F 77 -13.992 -1.215 -5.394 1.00 0.00 C ATOM 0 H ALA F 77 -12.521 -2.976 -3.398 1.00 0.00 H new ATOM 0 HA ALA F 77 -15.203 -2.813 -4.574 1.00 0.00 H new ATOM 0 HB1 ALA F 77 -14.494 -1.218 -6.362 1.00 0.00 H new ATOM 0 HB2 ALA F 77 -14.437 -0.451 -4.757 1.00 0.00 H new ATOM 0 HB3 ALA F 77 -12.933 -0.998 -5.535 1.00 0.00 H new ATOM 1258 N GLN F 78 -14.379 -4.543 -6.150 1.00 0.00 N ATOM 1259 CA GLN F 78 -13.900 -5.608 -7.071 1.00 0.00 C ATOM 1260 C GLN F 78 -14.693 -5.514 -8.378 1.00 0.00 C ATOM 1261 O GLN F 78 -15.620 -4.738 -8.495 1.00 0.00 O ATOM 1262 CB GLN F 78 -14.104 -7.002 -6.452 1.00 0.00 C ATOM 1263 CG GLN F 78 -15.128 -6.965 -5.308 1.00 0.00 C ATOM 1264 CD GLN F 78 -14.726 -7.985 -4.242 1.00 0.00 C ATOM 1265 OE1 GLN F 78 -15.300 -9.053 -4.158 1.00 0.00 O ATOM 1266 NE2 GLN F 78 -13.756 -7.696 -3.416 1.00 0.00 N ATOM 0 H GLN F 78 -15.379 -4.568 -5.952 1.00 0.00 H new ATOM 0 HA GLN F 78 -12.835 -5.467 -7.255 1.00 0.00 H new ATOM 0 HB2 GLN F 78 -14.441 -7.697 -7.221 1.00 0.00 H new ATOM 0 HB3 GLN F 78 -13.152 -7.378 -6.078 1.00 0.00 H new ATOM 0 HG2 GLN F 78 -15.171 -5.966 -4.875 1.00 0.00 H new ATOM 0 HG3 GLN F 78 -16.124 -7.191 -5.688 1.00 0.00 H new ATOM 0 HE21 GLN F 78 -13.275 -6.799 -3.488 1.00 0.00 H new ATOM 0 HE22 GLN F 78 -13.479 -8.367 -2.699 1.00 0.00 H new ATOM 1275 N PHE F 79 -14.334 -6.289 -9.365 1.00 0.00 N ATOM 1276 CA PHE F 79 -15.066 -6.230 -10.665 1.00 0.00 C ATOM 1277 C PHE F 79 -15.097 -7.620 -11.286 1.00 0.00 C ATOM 1278 O PHE F 79 -14.857 -8.606 -10.630 1.00 0.00 O ATOM 1279 CB PHE F 79 -14.351 -5.257 -11.604 1.00 0.00 C ATOM 1280 CG PHE F 79 -14.595 -3.849 -11.123 1.00 0.00 C ATOM 1281 CD1 PHE F 79 -13.934 -3.382 -9.984 1.00 0.00 C ATOM 1282 CD2 PHE F 79 -15.489 -3.018 -11.806 1.00 0.00 C ATOM 1283 CE1 PHE F 79 -14.164 -2.084 -9.525 1.00 0.00 C ATOM 1284 CE2 PHE F 79 -15.721 -1.716 -11.346 1.00 0.00 C ATOM 1285 CZ PHE F 79 -15.057 -1.248 -10.204 1.00 0.00 C ATOM 0 H PHE F 79 -13.567 -6.960 -9.329 1.00 0.00 H new ATOM 0 HA PHE F 79 -16.087 -5.886 -10.500 1.00 0.00 H new ATOM 0 HB2 PHE F 79 -13.282 -5.469 -11.624 1.00 0.00 H new ATOM 0 HB3 PHE F 79 -14.719 -5.377 -12.623 1.00 0.00 H new ATOM 0 HD1 PHE F 79 -13.245 -4.026 -9.458 1.00 0.00 H new ATOM 0 HD2 PHE F 79 -15.999 -3.380 -12.686 1.00 0.00 H new ATOM 0 HE1 PHE F 79 -13.652 -1.725 -8.645 1.00 0.00 H new ATOM 0 HE2 PHE F 79 -16.411 -1.073 -11.871 1.00 0.00 H new ATOM 0 HZ PHE F 79 -15.234 -0.244 -9.849 1.00 0.00 H new ATOM 1295 N GLU F 80 -15.408 -7.719 -12.540 1.00 0.00 N ATOM 1296 CA GLU F 80 -15.459 -9.061 -13.166 1.00 0.00 C ATOM 1297 C GLU F 80 -14.150 -9.354 -13.905 1.00 0.00 C ATOM 1298 O GLU F 80 -13.709 -10.485 -13.964 1.00 0.00 O ATOM 1299 CB GLU F 80 -16.640 -9.121 -14.133 1.00 0.00 C ATOM 1300 CG GLU F 80 -16.571 -7.946 -15.109 1.00 0.00 C ATOM 1301 CD GLU F 80 -16.748 -8.462 -16.539 1.00 0.00 C ATOM 1302 OE1 GLU F 80 -16.238 -9.532 -16.829 1.00 0.00 O ATOM 1303 OE2 GLU F 80 -17.391 -7.778 -17.319 1.00 0.00 O ATOM 0 H GLU F 80 -15.628 -6.936 -13.156 1.00 0.00 H new ATOM 0 HA GLU F 80 -15.589 -9.816 -12.391 1.00 0.00 H new ATOM 0 HB2 GLU F 80 -16.625 -10.063 -14.682 1.00 0.00 H new ATOM 0 HB3 GLU F 80 -17.578 -9.090 -13.578 1.00 0.00 H new ATOM 0 HG2 GLU F 80 -17.348 -7.218 -14.875 1.00 0.00 H new ATOM 0 HG3 GLU F 80 -15.614 -7.434 -15.011 1.00 0.00 H new ATOM 1310 N THR F 81 -13.513 -8.360 -14.467 1.00 0.00 N ATOM 1311 CA THR F 81 -12.233 -8.626 -15.184 1.00 0.00 C ATOM 1312 C THR F 81 -11.236 -7.508 -14.893 1.00 0.00 C ATOM 1313 O THR F 81 -11.537 -6.546 -14.209 1.00 0.00 O ATOM 1314 CB THR F 81 -12.474 -8.713 -16.696 1.00 0.00 C ATOM 1315 OG1 THR F 81 -11.349 -8.188 -17.388 1.00 0.00 O ATOM 1316 CG2 THR F 81 -13.694 -7.893 -17.078 1.00 0.00 C ATOM 0 H THR F 81 -13.820 -7.387 -14.461 1.00 0.00 H new ATOM 0 HA THR F 81 -11.830 -9.576 -14.834 1.00 0.00 H new ATOM 0 HB THR F 81 -12.631 -9.758 -16.964 1.00 0.00 H new ATOM 0 HG1 THR F 81 -11.648 -7.515 -18.035 1.00 0.00 H new ATOM 0 HG21 THR F 81 -13.856 -7.962 -18.154 1.00 0.00 H new ATOM 0 HG22 THR F 81 -14.569 -8.277 -16.554 1.00 0.00 H new ATOM 0 HG23 THR F 81 -13.533 -6.851 -16.801 1.00 0.00 H new ATOM 1324 N LEU F 82 -10.049 -7.625 -15.415 1.00 0.00 N ATOM 1325 CA LEU F 82 -9.027 -6.578 -15.176 1.00 0.00 C ATOM 1326 C LEU F 82 -9.297 -5.410 -16.111 1.00 0.00 C ATOM 1327 O LEU F 82 -9.109 -4.266 -15.759 1.00 0.00 O ATOM 1328 CB LEU F 82 -7.632 -7.149 -15.437 1.00 0.00 C ATOM 1329 CG LEU F 82 -7.094 -7.764 -14.143 1.00 0.00 C ATOM 1330 CD1 LEU F 82 -5.846 -8.592 -14.447 1.00 0.00 C ATOM 1331 CD2 LEU F 82 -6.737 -6.653 -13.156 1.00 0.00 C ATOM 0 H LEU F 82 -9.744 -8.404 -15.998 1.00 0.00 H new ATOM 0 HA LEU F 82 -9.076 -6.238 -14.142 1.00 0.00 H new ATOM 0 HB2 LEU F 82 -7.675 -7.903 -16.223 1.00 0.00 H new ATOM 0 HB3 LEU F 82 -6.963 -6.363 -15.787 1.00 0.00 H new ATOM 0 HG LEU F 82 -7.859 -8.406 -13.707 1.00 0.00 H new ATOM 0 HD11 LEU F 82 -5.465 -9.029 -13.524 1.00 0.00 H new ATOM 0 HD12 LEU F 82 -6.099 -9.388 -15.147 1.00 0.00 H new ATOM 0 HD13 LEU F 82 -5.082 -7.951 -14.887 1.00 0.00 H new ATOM 0 HD21 LEU F 82 -6.354 -7.093 -12.235 1.00 0.00 H new ATOM 0 HD22 LEU F 82 -5.975 -6.008 -13.594 1.00 0.00 H new ATOM 0 HD23 LEU F 82 -7.627 -6.064 -12.934 1.00 0.00 H new ATOM 1343 N GLN F 83 -9.754 -5.688 -17.297 1.00 0.00 N ATOM 1344 CA GLN F 83 -10.055 -4.588 -18.246 1.00 0.00 C ATOM 1345 C GLN F 83 -11.315 -3.864 -17.768 1.00 0.00 C ATOM 1346 O GLN F 83 -11.459 -2.667 -17.923 1.00 0.00 O ATOM 1347 CB GLN F 83 -10.291 -5.163 -19.645 1.00 0.00 C ATOM 1348 CG GLN F 83 -9.632 -4.257 -20.686 1.00 0.00 C ATOM 1349 CD GLN F 83 -9.922 -4.796 -22.088 1.00 0.00 C ATOM 1350 OE1 GLN F 83 -10.711 -5.705 -22.251 1.00 0.00 O ATOM 1351 NE2 GLN F 83 -9.312 -4.268 -23.115 1.00 0.00 N ATOM 0 H GLN F 83 -9.932 -6.629 -17.649 1.00 0.00 H new ATOM 0 HA GLN F 83 -9.217 -3.892 -18.287 1.00 0.00 H new ATOM 0 HB2 GLN F 83 -9.879 -6.170 -19.710 1.00 0.00 H new ATOM 0 HB3 GLN F 83 -11.360 -5.243 -19.841 1.00 0.00 H new ATOM 0 HG2 GLN F 83 -10.011 -3.240 -20.590 1.00 0.00 H new ATOM 0 HG3 GLN F 83 -8.556 -4.213 -20.517 1.00 0.00 H new ATOM 0 HE21 GLN F 83 -8.650 -3.505 -22.978 1.00 0.00 H new ATOM 0 HE22 GLN F 83 -9.498 -4.619 -24.054 1.00 0.00 H new ATOM 1360 N GLN F 84 -12.228 -4.585 -17.176 1.00 0.00 N ATOM 1361 CA GLN F 84 -13.475 -3.942 -16.678 1.00 0.00 C ATOM 1362 C GLN F 84 -13.132 -3.031 -15.506 1.00 0.00 C ATOM 1363 O GLN F 84 -13.720 -1.982 -15.329 1.00 0.00 O ATOM 1364 CB GLN F 84 -14.464 -5.014 -16.229 1.00 0.00 C ATOM 1365 CG GLN F 84 -15.305 -5.502 -17.425 1.00 0.00 C ATOM 1366 CD GLN F 84 -14.472 -5.588 -18.717 1.00 0.00 C ATOM 1367 OE1 GLN F 84 -13.741 -4.681 -19.059 1.00 0.00 O ATOM 1368 NE2 GLN F 84 -14.579 -6.647 -19.472 1.00 0.00 N ATOM 0 H GLN F 84 -12.164 -5.590 -17.016 1.00 0.00 H new ATOM 0 HA GLN F 84 -13.929 -3.355 -17.476 1.00 0.00 H new ATOM 0 HB2 GLN F 84 -13.926 -5.853 -15.788 1.00 0.00 H new ATOM 0 HB3 GLN F 84 -15.119 -4.613 -15.455 1.00 0.00 H new ATOM 0 HG2 GLN F 84 -15.724 -6.482 -17.198 1.00 0.00 H new ATOM 0 HG3 GLN F 84 -16.144 -4.824 -17.579 1.00 0.00 H new ATOM 0 HE21 GLN F 84 -15.191 -7.413 -19.192 1.00 0.00 H new ATOM 0 HE22 GLN F 84 -14.051 -6.708 -20.342 1.00 0.00 H new ATOM 1377 N LEU F 85 -12.173 -3.410 -14.712 1.00 0.00 N ATOM 1378 CA LEU F 85 -11.789 -2.544 -13.565 1.00 0.00 C ATOM 1379 C LEU F 85 -10.968 -1.376 -14.092 1.00 0.00 C ATOM 1380 O LEU F 85 -11.069 -0.285 -13.607 1.00 0.00 O ATOM 1381 CB LEU F 85 -11.006 -3.362 -12.522 1.00 0.00 C ATOM 1382 CG LEU F 85 -9.495 -3.207 -12.719 1.00 0.00 C ATOM 1383 CD1 LEU F 85 -8.941 -2.244 -11.670 1.00 0.00 C ATOM 1384 CD2 LEU F 85 -8.825 -4.564 -12.581 1.00 0.00 C ATOM 0 H LEU F 85 -11.641 -4.275 -14.806 1.00 0.00 H new ATOM 0 HA LEU F 85 -12.678 -2.154 -13.070 1.00 0.00 H new ATOM 0 HB2 LEU F 85 -11.280 -3.035 -11.519 1.00 0.00 H new ATOM 0 HB3 LEU F 85 -11.280 -4.414 -12.601 1.00 0.00 H new ATOM 0 HG LEU F 85 -9.294 -2.808 -13.713 1.00 0.00 H new ATOM 0 HD11 LEU F 85 -7.866 -2.133 -11.810 1.00 0.00 H new ATOM 0 HD12 LEU F 85 -9.423 -1.272 -11.778 1.00 0.00 H new ATOM 0 HD13 LEU F 85 -9.139 -2.639 -10.673 1.00 0.00 H new ATOM 0 HD21 LEU F 85 -7.750 -4.455 -12.721 1.00 0.00 H new ATOM 0 HD22 LEU F 85 -9.022 -4.968 -11.588 1.00 0.00 H new ATOM 0 HD23 LEU F 85 -9.222 -5.244 -13.335 1.00 0.00 H new ATOM 1396 N VAL F 86 -10.167 -1.577 -15.091 1.00 0.00 N ATOM 1397 CA VAL F 86 -9.404 -0.425 -15.603 1.00 0.00 C ATOM 1398 C VAL F 86 -10.428 0.559 -16.157 1.00 0.00 C ATOM 1399 O VAL F 86 -10.189 1.742 -16.289 1.00 0.00 O ATOM 1400 CB VAL F 86 -8.425 -0.864 -16.699 1.00 0.00 C ATOM 1401 CG1 VAL F 86 -7.743 -2.162 -16.270 1.00 0.00 C ATOM 1402 CG2 VAL F 86 -9.170 -1.087 -18.017 1.00 0.00 C ATOM 0 H VAL F 86 -10.011 -2.467 -15.564 1.00 0.00 H new ATOM 0 HA VAL F 86 -8.808 0.032 -14.813 1.00 0.00 H new ATOM 0 HB VAL F 86 -7.678 -0.084 -16.847 1.00 0.00 H new ATOM 0 HG11 VAL F 86 -7.045 -2.480 -17.045 1.00 0.00 H new ATOM 0 HG12 VAL F 86 -7.201 -1.998 -15.339 1.00 0.00 H new ATOM 0 HG13 VAL F 86 -8.496 -2.936 -16.120 1.00 0.00 H new ATOM 0 HG21 VAL F 86 -8.463 -1.398 -18.786 1.00 0.00 H new ATOM 0 HG22 VAL F 86 -9.924 -1.862 -17.882 1.00 0.00 H new ATOM 0 HG23 VAL F 86 -9.654 -0.159 -18.323 1.00 0.00 H new ATOM 1412 N GLN F 87 -11.585 0.043 -16.476 1.00 0.00 N ATOM 1413 CA GLN F 87 -12.675 0.880 -17.023 1.00 0.00 C ATOM 1414 C GLN F 87 -13.290 1.739 -15.925 1.00 0.00 C ATOM 1415 O GLN F 87 -13.542 2.914 -16.101 1.00 0.00 O ATOM 1416 CB GLN F 87 -13.762 -0.034 -17.573 1.00 0.00 C ATOM 1417 CG GLN F 87 -14.791 0.803 -18.329 1.00 0.00 C ATOM 1418 CD GLN F 87 -15.607 -0.103 -19.254 1.00 0.00 C ATOM 1419 OE1 GLN F 87 -15.755 0.183 -20.426 1.00 0.00 O ATOM 1420 NE2 GLN F 87 -16.147 -1.189 -18.775 1.00 0.00 N ATOM 0 H GLN F 87 -11.818 -0.945 -16.376 1.00 0.00 H new ATOM 0 HA GLN F 87 -12.268 1.524 -17.803 1.00 0.00 H new ATOM 0 HB2 GLN F 87 -13.325 -0.780 -18.237 1.00 0.00 H new ATOM 0 HB3 GLN F 87 -14.244 -0.575 -16.759 1.00 0.00 H new ATOM 0 HG2 GLN F 87 -15.451 1.310 -17.625 1.00 0.00 H new ATOM 0 HG3 GLN F 87 -14.290 1.577 -18.910 1.00 0.00 H new ATOM 0 HE21 GLN F 87 -16.023 -1.429 -17.791 1.00 0.00 H new ATOM 0 HE22 GLN F 87 -16.693 -1.798 -19.384 1.00 0.00 H new ATOM 1429 N HIS F 88 -13.549 1.150 -14.796 1.00 0.00 N ATOM 1430 CA HIS F 88 -14.166 1.907 -13.684 1.00 0.00 C ATOM 1431 C HIS F 88 -13.125 2.836 -13.087 1.00 0.00 C ATOM 1432 O HIS F 88 -13.385 3.983 -12.771 1.00 0.00 O ATOM 1433 CB HIS F 88 -14.641 0.924 -12.617 1.00 0.00 C ATOM 1434 CG HIS F 88 -15.698 1.572 -11.766 1.00 0.00 C ATOM 1435 ND1 HIS F 88 -17.027 1.627 -12.155 1.00 0.00 N ATOM 1436 CD2 HIS F 88 -15.638 2.198 -10.545 1.00 0.00 C ATOM 1437 CE1 HIS F 88 -17.708 2.266 -11.184 1.00 0.00 C ATOM 1438 NE2 HIS F 88 -16.908 2.634 -10.180 1.00 0.00 N ATOM 0 H HIS F 88 -13.357 0.168 -14.596 1.00 0.00 H new ATOM 0 HA HIS F 88 -15.013 2.488 -14.049 1.00 0.00 H new ATOM 0 HB2 HIS F 88 -15.040 0.026 -13.088 1.00 0.00 H new ATOM 0 HB3 HIS F 88 -13.801 0.612 -11.996 1.00 0.00 H new ATOM 0 HD2 HIS F 88 -14.742 2.332 -9.958 1.00 0.00 H new ATOM 0 HE1 HIS F 88 -18.771 2.457 -11.214 1.00 0.00 H new ATOM 0 HE2 HIS F 88 -17.172 3.129 -9.328 1.00 0.00 H new ATOM 1446 N TYR F 89 -11.941 2.339 -12.937 1.00 0.00 N ATOM 1447 CA TYR F 89 -10.857 3.160 -12.366 1.00 0.00 C ATOM 1448 C TYR F 89 -10.429 4.205 -13.397 1.00 0.00 C ATOM 1449 O TYR F 89 -9.783 5.181 -13.078 1.00 0.00 O ATOM 1450 CB TYR F 89 -9.672 2.261 -12.010 1.00 0.00 C ATOM 1451 CG TYR F 89 -10.004 1.425 -10.796 1.00 0.00 C ATOM 1452 CD1 TYR F 89 -11.035 0.483 -10.860 1.00 0.00 C ATOM 1453 CD2 TYR F 89 -9.274 1.580 -9.611 1.00 0.00 C ATOM 1454 CE1 TYR F 89 -11.339 -0.301 -9.751 1.00 0.00 C ATOM 1455 CE2 TYR F 89 -9.577 0.790 -8.496 1.00 0.00 C ATOM 1456 CZ TYR F 89 -10.611 -0.152 -8.565 1.00 0.00 C ATOM 1457 OH TYR F 89 -10.910 -0.932 -7.466 1.00 0.00 O ATOM 0 H TYR F 89 -11.675 1.387 -13.189 1.00 0.00 H new ATOM 0 HA TYR F 89 -11.205 3.662 -11.463 1.00 0.00 H new ATOM 0 HB2 TYR F 89 -9.430 1.613 -12.853 1.00 0.00 H new ATOM 0 HB3 TYR F 89 -8.790 2.870 -11.812 1.00 0.00 H new ATOM 0 HD1 TYR F 89 -11.598 0.363 -11.774 1.00 0.00 H new ATOM 0 HD2 TYR F 89 -8.478 2.308 -9.558 1.00 0.00 H new ATOM 0 HE1 TYR F 89 -12.138 -1.026 -9.806 1.00 0.00 H new ATOM 0 HE2 TYR F 89 -9.013 0.907 -7.582 1.00 0.00 H new ATOM 0 HH TYR F 89 -10.308 -0.701 -6.728 1.00 0.00 H new ATOM 1467 N SER F 90 -10.788 4.003 -14.637 1.00 0.00 N ATOM 1468 CA SER F 90 -10.413 4.976 -15.691 1.00 0.00 C ATOM 1469 C SER F 90 -11.154 6.289 -15.456 1.00 0.00 C ATOM 1470 O SER F 90 -10.583 7.359 -15.517 1.00 0.00 O ATOM 1471 CB SER F 90 -10.791 4.418 -17.065 1.00 0.00 C ATOM 1472 OG SER F 90 -9.628 4.319 -17.874 1.00 0.00 O ATOM 0 H SER F 90 -11.327 3.200 -14.962 1.00 0.00 H new ATOM 0 HA SER F 90 -9.338 5.151 -15.655 1.00 0.00 H new ATOM 0 HB2 SER F 90 -11.255 3.438 -16.956 1.00 0.00 H new ATOM 0 HB3 SER F 90 -11.525 5.067 -17.543 1.00 0.00 H new ATOM 0 HG SER F 90 -9.871 3.960 -18.753 1.00 0.00 H new ATOM 1478 N GLU F 91 -12.424 6.209 -15.187 1.00 0.00 N ATOM 1479 CA GLU F 91 -13.211 7.447 -14.945 1.00 0.00 C ATOM 1480 C GLU F 91 -13.251 7.741 -13.445 1.00 0.00 C ATOM 1481 O GLU F 91 -13.785 8.744 -13.017 1.00 0.00 O ATOM 1482 CB GLU F 91 -14.638 7.253 -15.463 1.00 0.00 C ATOM 1483 CG GLU F 91 -14.596 6.569 -16.831 1.00 0.00 C ATOM 1484 CD GLU F 91 -15.698 7.144 -17.723 1.00 0.00 C ATOM 1485 OE1 GLU F 91 -16.843 7.122 -17.303 1.00 0.00 O ATOM 1486 OE2 GLU F 91 -15.378 7.594 -18.811 1.00 0.00 O ATOM 0 H GLU F 91 -12.952 5.339 -15.124 1.00 0.00 H new ATOM 0 HA GLU F 91 -12.744 8.282 -15.467 1.00 0.00 H new ATOM 0 HB2 GLU F 91 -15.212 6.649 -14.760 1.00 0.00 H new ATOM 0 HB3 GLU F 91 -15.142 8.216 -15.542 1.00 0.00 H new ATOM 0 HG2 GLU F 91 -13.622 6.720 -17.295 1.00 0.00 H new ATOM 0 HG3 GLU F 91 -14.731 5.493 -16.716 1.00 0.00 H new ATOM 1493 N ARG F 92 -12.692 6.876 -12.638 1.00 0.00 N ATOM 1494 CA ARG F 92 -12.715 7.130 -11.167 1.00 0.00 C ATOM 1495 C ARG F 92 -11.480 6.514 -10.508 1.00 0.00 C ATOM 1496 O ARG F 92 -10.835 5.650 -11.062 1.00 0.00 O ATOM 1497 CB ARG F 92 -13.976 6.508 -10.564 1.00 0.00 C ATOM 1498 CG ARG F 92 -15.180 6.834 -11.451 1.00 0.00 C ATOM 1499 CD ARG F 92 -16.470 6.478 -10.711 1.00 0.00 C ATOM 1500 NE ARG F 92 -17.637 6.689 -11.615 1.00 0.00 N ATOM 1501 CZ ARG F 92 -18.464 7.673 -11.393 1.00 0.00 C ATOM 1502 NH1 ARG F 92 -18.019 8.897 -11.318 1.00 0.00 N ATOM 1503 NH2 ARG F 92 -19.739 7.433 -11.246 1.00 0.00 N ATOM 0 H ARG F 92 -12.227 6.016 -12.929 1.00 0.00 H new ATOM 0 HA ARG F 92 -12.714 8.206 -10.991 1.00 0.00 H new ATOM 0 HB2 ARG F 92 -13.856 5.428 -10.478 1.00 0.00 H new ATOM 0 HB3 ARG F 92 -14.138 6.892 -9.557 1.00 0.00 H new ATOM 0 HG2 ARG F 92 -15.178 7.893 -11.711 1.00 0.00 H new ATOM 0 HG3 ARG F 92 -15.118 6.276 -12.385 1.00 0.00 H new ATOM 0 HD2 ARG F 92 -16.437 5.440 -10.379 1.00 0.00 H new ATOM 0 HD3 ARG F 92 -16.572 7.095 -9.818 1.00 0.00 H new ATOM 0 HE ARG F 92 -17.789 6.064 -12.407 1.00 0.00 H new ATOM 0 HH11 ARG F 92 -17.023 9.086 -11.433 1.00 0.00 H new ATOM 0 HH12 ARG F 92 -18.667 9.665 -11.144 1.00 0.00 H new ATOM 0 HH21 ARG F 92 -20.088 6.476 -11.305 1.00 0.00 H new ATOM 0 HH22 ARG F 92 -20.386 8.202 -11.072 1.00 0.00 H new ATOM 1517 N ALA F 93 -11.147 6.952 -9.322 1.00 0.00 N ATOM 1518 CA ALA F 93 -9.958 6.383 -8.628 1.00 0.00 C ATOM 1519 C ALA F 93 -10.341 5.052 -7.986 1.00 0.00 C ATOM 1520 O ALA F 93 -9.666 4.059 -8.157 1.00 0.00 O ATOM 1521 CB ALA F 93 -9.475 7.354 -7.546 1.00 0.00 C ATOM 0 H ALA F 93 -11.646 7.677 -8.807 1.00 0.00 H new ATOM 0 HA ALA F 93 -9.157 6.226 -9.350 1.00 0.00 H new ATOM 0 HB1 ALA F 93 -8.605 6.933 -7.041 1.00 0.00 H new ATOM 0 HB2 ALA F 93 -9.203 8.305 -8.005 1.00 0.00 H new ATOM 0 HB3 ALA F 93 -10.272 7.516 -6.820 1.00 0.00 H new ATOM 1527 N ALA F 94 -11.425 5.043 -7.250 1.00 0.00 N ATOM 1528 CA ALA F 94 -11.902 3.799 -6.567 1.00 0.00 C ATOM 1529 C ALA F 94 -11.385 3.780 -5.128 1.00 0.00 C ATOM 1530 O ALA F 94 -11.828 2.996 -4.313 1.00 0.00 O ATOM 1531 CB ALA F 94 -11.414 2.548 -7.303 1.00 0.00 C ATOM 0 H ALA F 94 -12.011 5.862 -7.090 1.00 0.00 H new ATOM 0 HA ALA F 94 -12.992 3.797 -6.572 1.00 0.00 H new ATOM 0 HB1 ALA F 94 -11.774 1.658 -6.787 1.00 0.00 H new ATOM 0 HB2 ALA F 94 -11.796 2.554 -8.324 1.00 0.00 H new ATOM 0 HB3 ALA F 94 -10.324 2.540 -7.323 1.00 0.00 H new ATOM 1537 N GLY F 95 -10.460 4.642 -4.801 1.00 0.00 N ATOM 1538 CA GLY F 95 -9.939 4.665 -3.406 1.00 0.00 C ATOM 1539 C GLY F 95 -8.425 4.891 -3.403 1.00 0.00 C ATOM 1540 O GLY F 95 -7.859 5.327 -2.420 1.00 0.00 O ATOM 0 H GLY F 95 -10.046 5.326 -5.435 1.00 0.00 H new ATOM 0 HA2 GLY F 95 -10.432 5.456 -2.840 1.00 0.00 H new ATOM 0 HA3 GLY F 95 -10.173 3.724 -2.908 1.00 0.00 H new ATOM 1544 N LEU F 96 -7.756 4.589 -4.482 1.00 0.00 N ATOM 1545 CA LEU F 96 -6.281 4.782 -4.512 1.00 0.00 C ATOM 1546 C LEU F 96 -5.940 6.255 -4.745 1.00 0.00 C ATOM 1547 O LEU F 96 -6.795 7.070 -5.028 1.00 0.00 O ATOM 1548 CB LEU F 96 -5.667 3.918 -5.617 1.00 0.00 C ATOM 1549 CG LEU F 96 -5.898 4.545 -6.994 1.00 0.00 C ATOM 1550 CD1 LEU F 96 -5.364 3.593 -8.061 1.00 0.00 C ATOM 1551 CD2 LEU F 96 -7.386 4.771 -7.235 1.00 0.00 C ATOM 0 H LEU F 96 -8.166 4.219 -5.340 1.00 0.00 H new ATOM 0 HA LEU F 96 -5.867 4.479 -3.550 1.00 0.00 H new ATOM 0 HB2 LEU F 96 -4.598 3.802 -5.441 1.00 0.00 H new ATOM 0 HB3 LEU F 96 -6.105 2.920 -5.589 1.00 0.00 H new ATOM 0 HG LEU F 96 -5.383 5.504 -7.040 1.00 0.00 H new ATOM 0 HD11 LEU F 96 -5.522 4.027 -9.048 1.00 0.00 H new ATOM 0 HD12 LEU F 96 -4.298 3.430 -7.903 1.00 0.00 H new ATOM 0 HD13 LEU F 96 -5.890 2.641 -7.995 1.00 0.00 H new ATOM 0 HD21 LEU F 96 -7.532 5.217 -8.219 1.00 0.00 H new ATOM 0 HD22 LEU F 96 -7.911 3.817 -7.188 1.00 0.00 H new ATOM 0 HD23 LEU F 96 -7.781 5.440 -6.471 1.00 0.00 H new ATOM 1563 N SER F 97 -4.687 6.595 -4.604 1.00 0.00 N ATOM 1564 CA SER F 97 -4.252 8.009 -4.787 1.00 0.00 C ATOM 1565 C SER F 97 -4.996 8.651 -5.956 1.00 0.00 C ATOM 1566 O SER F 97 -5.530 9.736 -5.841 1.00 0.00 O ATOM 1567 CB SER F 97 -2.748 8.045 -5.064 1.00 0.00 C ATOM 1568 OG SER F 97 -2.414 9.264 -5.710 1.00 0.00 O ATOM 0 H SER F 97 -3.938 5.945 -4.367 1.00 0.00 H new ATOM 0 HA SER F 97 -4.477 8.566 -3.878 1.00 0.00 H new ATOM 0 HB2 SER F 97 -2.193 7.952 -4.130 1.00 0.00 H new ATOM 0 HB3 SER F 97 -2.462 7.199 -5.690 1.00 0.00 H new ATOM 0 HG SER F 97 -1.450 9.288 -5.886 1.00 0.00 H new ATOM 1574 N SER F 98 -5.028 8.001 -7.080 1.00 0.00 N ATOM 1575 CA SER F 98 -5.733 8.595 -8.250 1.00 0.00 C ATOM 1576 C SER F 98 -6.227 7.489 -9.183 1.00 0.00 C ATOM 1577 O SER F 98 -6.009 6.318 -8.949 1.00 0.00 O ATOM 1578 CB SER F 98 -4.776 9.514 -9.011 1.00 0.00 C ATOM 1579 OG SER F 98 -5.452 10.710 -9.367 1.00 0.00 O ATOM 0 H SER F 98 -4.600 7.089 -7.242 1.00 0.00 H new ATOM 0 HA SER F 98 -6.588 9.170 -7.895 1.00 0.00 H new ATOM 0 HB2 SER F 98 -3.908 9.744 -8.394 1.00 0.00 H new ATOM 0 HB3 SER F 98 -4.407 9.012 -9.905 1.00 0.00 H new ATOM 0 HG SER F 98 -4.839 11.300 -9.853 1.00 0.00 H new ATOM 1585 N ARG F 99 -6.900 7.861 -10.237 1.00 0.00 N ATOM 1586 CA ARG F 99 -7.426 6.843 -11.190 1.00 0.00 C ATOM 1587 C ARG F 99 -6.292 6.282 -12.048 1.00 0.00 C ATOM 1588 O ARG F 99 -5.257 6.895 -12.214 1.00 0.00 O ATOM 1589 CB ARG F 99 -8.481 7.484 -12.100 1.00 0.00 C ATOM 1590 CG ARG F 99 -8.043 8.897 -12.493 1.00 0.00 C ATOM 1591 CD ARG F 99 -8.873 9.372 -13.686 1.00 0.00 C ATOM 1592 NE ARG F 99 -8.766 10.853 -13.806 1.00 0.00 N ATOM 1593 CZ ARG F 99 -9.842 11.574 -13.969 1.00 0.00 C ATOM 1594 NH1 ARG F 99 -10.750 11.207 -14.831 1.00 0.00 N ATOM 1595 NH2 ARG F 99 -10.009 12.662 -13.269 1.00 0.00 N ATOM 0 H ARG F 99 -7.109 8.829 -10.480 1.00 0.00 H new ATOM 0 HA ARG F 99 -7.876 6.031 -10.620 1.00 0.00 H new ATOM 0 HB2 ARG F 99 -8.621 6.876 -12.994 1.00 0.00 H new ATOM 0 HB3 ARG F 99 -9.442 7.522 -11.587 1.00 0.00 H new ATOM 0 HG2 ARG F 99 -8.173 9.577 -11.651 1.00 0.00 H new ATOM 0 HG3 ARG F 99 -6.983 8.904 -12.747 1.00 0.00 H new ATOM 0 HD2 ARG F 99 -8.520 8.896 -14.601 1.00 0.00 H new ATOM 0 HD3 ARG F 99 -9.915 9.081 -13.557 1.00 0.00 H new ATOM 0 HE ARG F 99 -7.852 11.304 -13.761 1.00 0.00 H new ATOM 0 HH11 ARG F 99 -10.619 10.356 -15.378 1.00 0.00 H new ATOM 0 HH12 ARG F 99 -11.590 11.771 -14.958 1.00 0.00 H new ATOM 0 HH21 ARG F 99 -9.299 12.949 -12.595 1.00 0.00 H new ATOM 0 HH22 ARG F 99 -10.849 13.226 -13.396 1.00 0.00 H new ATOM 1609 N LEU F 100 -6.490 5.108 -12.585 1.00 0.00 N ATOM 1610 CA LEU F 100 -5.443 4.469 -13.437 1.00 0.00 C ATOM 1611 C LEU F 100 -4.967 5.448 -14.517 1.00 0.00 C ATOM 1612 O LEU F 100 -5.299 6.616 -14.498 1.00 0.00 O ATOM 1613 CB LEU F 100 -6.020 3.214 -14.101 1.00 0.00 C ATOM 1614 CG LEU F 100 -7.426 3.506 -14.640 1.00 0.00 C ATOM 1615 CD1 LEU F 100 -7.326 4.096 -16.041 1.00 0.00 C ATOM 1616 CD2 LEU F 100 -8.226 2.207 -14.699 1.00 0.00 C ATOM 0 H LEU F 100 -7.341 4.558 -12.469 1.00 0.00 H new ATOM 0 HA LEU F 100 -4.595 4.195 -12.810 1.00 0.00 H new ATOM 0 HB2 LEU F 100 -5.370 2.891 -14.914 1.00 0.00 H new ATOM 0 HB3 LEU F 100 -6.060 2.397 -13.381 1.00 0.00 H new ATOM 0 HG LEU F 100 -7.924 4.217 -13.980 1.00 0.00 H new ATOM 0 HD11 LEU F 100 -8.327 4.302 -16.421 1.00 0.00 H new ATOM 0 HD12 LEU F 100 -6.753 5.023 -16.006 1.00 0.00 H new ATOM 0 HD13 LEU F 100 -6.827 3.386 -16.700 1.00 0.00 H new ATOM 0 HD21 LEU F 100 -9.226 2.412 -15.082 1.00 0.00 H new ATOM 0 HD22 LEU F 100 -7.723 1.500 -15.358 1.00 0.00 H new ATOM 0 HD23 LEU F 100 -8.301 1.780 -13.699 1.00 0.00 H new ATOM 1628 N VAL F 101 -4.188 4.985 -15.464 1.00 0.00 N ATOM 1629 CA VAL F 101 -3.697 5.899 -16.528 1.00 0.00 C ATOM 1630 C VAL F 101 -4.849 6.762 -17.036 1.00 0.00 C ATOM 1631 O VAL F 101 -5.772 6.284 -17.664 1.00 0.00 O ATOM 1632 CB VAL F 101 -3.121 5.073 -17.676 1.00 0.00 C ATOM 1633 CG1 VAL F 101 -1.779 4.474 -17.250 1.00 0.00 C ATOM 1634 CG2 VAL F 101 -4.093 3.949 -18.037 1.00 0.00 C ATOM 0 H VAL F 101 -3.875 4.017 -15.542 1.00 0.00 H new ATOM 0 HA VAL F 101 -2.920 6.547 -16.123 1.00 0.00 H new ATOM 0 HB VAL F 101 -2.972 5.714 -18.545 1.00 0.00 H new ATOM 0 HG11 VAL F 101 -1.367 3.884 -18.069 1.00 0.00 H new ATOM 0 HG12 VAL F 101 -1.086 5.277 -16.997 1.00 0.00 H new ATOM 0 HG13 VAL F 101 -1.926 3.834 -16.380 1.00 0.00 H new ATOM 0 HG21 VAL F 101 -3.680 3.360 -18.856 1.00 0.00 H new ATOM 0 HG22 VAL F 101 -4.245 3.307 -17.170 1.00 0.00 H new ATOM 0 HG23 VAL F 101 -5.047 4.378 -18.343 1.00 0.00 H new ATOM 1644 N VAL F 102 -4.796 8.035 -16.765 1.00 0.00 N ATOM 1645 CA VAL F 102 -5.881 8.945 -17.224 1.00 0.00 C ATOM 1646 C VAL F 102 -5.696 9.277 -18.711 1.00 0.00 C ATOM 1647 O VAL F 102 -6.639 9.204 -19.474 1.00 0.00 O ATOM 1648 CB VAL F 102 -5.850 10.238 -16.402 1.00 0.00 C ATOM 1649 CG1 VAL F 102 -7.269 10.795 -16.279 1.00 0.00 C ATOM 1650 CG2 VAL F 102 -5.294 9.949 -15.004 1.00 0.00 C ATOM 0 H VAL F 102 -4.045 8.486 -16.243 1.00 0.00 H new ATOM 0 HA VAL F 102 -6.842 8.449 -17.087 1.00 0.00 H new ATOM 0 HB VAL F 102 -5.211 10.967 -16.900 1.00 0.00 H new ATOM 0 HG11 VAL F 102 -7.249 11.715 -15.695 1.00 0.00 H new ATOM 0 HG12 VAL F 102 -7.665 11.005 -17.273 1.00 0.00 H new ATOM 0 HG13 VAL F 102 -7.905 10.063 -15.782 1.00 0.00 H new ATOM 0 HG21 VAL F 102 -5.274 10.871 -14.423 1.00 0.00 H new ATOM 0 HG22 VAL F 102 -5.930 9.218 -14.504 1.00 0.00 H new ATOM 0 HG23 VAL F 102 -4.283 9.552 -15.090 1.00 0.00 H new ATOM 1797 N GLU P 205 0.474 -0.422 -0.872 1.00 0.00 N ATOM 1798 CA GLU P 205 -0.463 0.395 -0.052 1.00 0.00 C ATOM 1799 C GLU P 205 -1.903 0.068 -0.452 1.00 0.00 C ATOM 1800 O GLU P 205 -2.339 0.376 -1.543 1.00 0.00 O ATOM 1801 CB GLU P 205 -0.192 1.881 -0.293 1.00 0.00 C ATOM 1802 CG GLU P 205 1.211 2.232 0.205 1.00 0.00 C ATOM 1803 CD GLU P 205 1.143 2.645 1.676 1.00 0.00 C ATOM 1804 OE1 GLU P 205 0.119 3.175 2.076 1.00 0.00 O ATOM 1805 OE2 GLU P 205 2.116 2.424 2.379 1.00 0.00 O ATOM 0 HA GLU P 205 -0.316 0.167 1.004 1.00 0.00 H new ATOM 0 HB2 GLU P 205 -0.280 2.110 -1.355 1.00 0.00 H new ATOM 0 HB3 GLU P 205 -0.935 2.486 0.226 1.00 0.00 H new ATOM 0 HG2 GLU P 205 1.875 1.375 0.087 1.00 0.00 H new ATOM 0 HG3 GLU P 205 1.628 3.043 -0.392 1.00 0.00 H new ATOM 1812 N GLU P 206 -2.643 -0.557 0.421 1.00 0.00 N ATOM 1813 CA GLU P 206 -4.053 -0.905 0.090 1.00 0.00 C ATOM 1814 C GLU P 206 -4.955 0.297 0.374 1.00 0.00 C ATOM 1815 O GLU P 206 -4.877 0.910 1.421 1.00 0.00 O ATOM 1816 CB GLU P 206 -4.500 -2.093 0.943 1.00 0.00 C ATOM 1817 CG GLU P 206 -3.427 -3.183 0.904 1.00 0.00 C ATOM 1818 CD GLU P 206 -4.079 -4.551 1.115 1.00 0.00 C ATOM 1819 OE1 GLU P 206 -5.267 -4.664 0.859 1.00 0.00 O ATOM 1820 OE2 GLU P 206 -3.381 -5.461 1.530 1.00 0.00 O ATOM 0 H GLU P 206 -2.332 -0.842 1.350 1.00 0.00 H new ATOM 0 HA GLU P 206 -4.123 -1.170 -0.965 1.00 0.00 H new ATOM 0 HB2 GLU P 206 -4.670 -1.772 1.971 1.00 0.00 H new ATOM 0 HB3 GLU P 206 -5.446 -2.486 0.571 1.00 0.00 H new ATOM 0 HG2 GLU P 206 -2.906 -3.161 -0.053 1.00 0.00 H new ATOM 0 HG3 GLU P 206 -2.681 -3.001 1.677 1.00 0.00 H new ATOM 1827 N ILE P 207 -5.813 0.639 -0.547 1.00 0.00 N ATOM 1828 CA ILE P 207 -6.720 1.800 -0.326 1.00 0.00 C ATOM 1829 C ILE P 207 -7.303 1.715 1.093 1.00 0.00 C ATOM 1830 O ILE P 207 -7.755 0.667 1.509 1.00 0.00 O ATOM 1831 CB ILE P 207 -7.850 1.763 -1.364 1.00 0.00 C ATOM 1832 CG1 ILE P 207 -7.336 2.324 -2.694 1.00 0.00 C ATOM 1833 CG2 ILE P 207 -9.034 2.610 -0.885 1.00 0.00 C ATOM 1834 CD1 ILE P 207 -6.354 1.335 -3.326 1.00 0.00 C ATOM 0 H ILE P 207 -5.925 0.165 -1.443 1.00 0.00 H new ATOM 0 HA ILE P 207 -6.169 2.734 -0.434 1.00 0.00 H new ATOM 0 HB ILE P 207 -8.177 0.732 -1.496 1.00 0.00 H new ATOM 0 HG12 ILE P 207 -8.171 2.505 -3.371 1.00 0.00 H new ATOM 0 HG13 ILE P 207 -6.846 3.284 -2.530 1.00 0.00 H new ATOM 0 HG21 ILE P 207 -9.830 2.577 -1.629 1.00 0.00 H new ATOM 0 HG22 ILE P 207 -9.405 2.215 0.061 1.00 0.00 H new ATOM 0 HG23 ILE P 207 -8.711 3.642 -0.746 1.00 0.00 H new ATOM 0 HD11 ILE P 207 -5.991 1.737 -4.272 1.00 0.00 H new ATOM 0 HD12 ILE P 207 -5.512 1.177 -2.652 1.00 0.00 H new ATOM 0 HD13 ILE P 207 -6.859 0.386 -3.506 1.00 0.00 H new