USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=26 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 8 TYR OH : rot -171:sc= 0.0849 USER MOD Set 1.2: F 43 TYR OH : rot -51:sc= 1.86 USER MOD Single : F 3 GLN : amide:sc= -0.028 X(o=-0.028,f=-0.27) 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 :FLIP amide:sc= 0.141! F(o=-0.6,f=0.14!) USER MOD Single : F 23 SER OG : rot 180:sc= 0 USER MOD Single : F 26 ASN : amide:sc= -0.412 X(o=-0.41,f=-0.75) USER MOD Single : F 30 THR OG1 : rot 82:sc= 0.396 USER MOD Single : F 36 SER OG : rot 135:sc= -2.25! USER MOD Single : F 38 THR OG1 : rot 180:sc= 0 USER MOD Single : F 39 THR OG1 : rot 180:sc= 0 USER MOD Single : F 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 44 SER OG : rot -100:sc= -0.95! USER MOD Single : F 46 SER OG : rot -149:sc= -1.06 USER MOD Single : F 53 MET CE :methyl 167:sc= -23.6! (180deg=-25.4!) USER MOD Single : F 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 57 HIS : no HE2:sc= -7.91! C(o=-7.9!,f=-7.6!) USER MOD Single : F 59 LYS NZ :NH3+ -158:sc= -0.0534 (180deg=-0.646) USER MOD Single : F 60 HIS : no HD1:sc= -9.27! C(o=-9.3!,f=-10!) USER MOD Single : F 61 TYR OH : rot -154:sc= 1.44 USER MOD Single : F 62 LYS NZ :NH3+ -137:sc= -4.23! (180deg=-5.35!) USER MOD Single : F 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 68 ASN :FLIP amide:sc= -1.07! C(o=-2.5!,f=-1.1!) USER MOD Single : F 71 TYR OH : rot 180:sc= -0.882 USER MOD Single : F 72 TYR OH : rot 180:sc= -0.0247 USER MOD Single : F 74 THR OG1 : rot 130:sc= 0.571 USER MOD Single : F 75 THR OG1 : rot 180:sc= 0 USER MOD Single : F 78 GLN : amide:sc= -0.653 K(o=-0.65,f=-2.3!) USER MOD Single : F 81 THR OG1 : rot 180:sc= -0.607! USER MOD Single : F 83 GLN : amide:sc= -0.0507 K(o=-0.051,f=-2.1!) USER MOD Single : F 84 GLN : amide:sc= -14.1! C(o=-14!,f=-17!) USER MOD Single : F 87 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : F 88 HIS : no HD1:sc= -4.58! C(o=-4.6!,f=-5.1!) USER MOD Single : F 89 TYR OH : rot 180:sc= 0 USER MOD Single : F 90 SER OG : rot 180:sc=-0.00198 USER MOD Single : F 97 SER OG : rot -123:sc= 1.25 USER MOD Single : F 98 SER OG : rot 180:sc= -0.171 USER MOD ----------------------------------------------------------------- ATOM 14 N ILE F 2 -6.309 -8.071 -22.266 1.00 0.00 N ATOM 15 CA ILE F 2 -6.891 -6.820 -21.704 1.00 0.00 C ATOM 16 C ILE F 2 -6.233 -5.608 -22.368 1.00 0.00 C ATOM 17 O ILE F 2 -5.322 -5.742 -23.161 1.00 0.00 O ATOM 18 CB ILE F 2 -6.647 -6.775 -20.194 1.00 0.00 C ATOM 19 CG1 ILE F 2 -5.142 -6.749 -19.919 1.00 0.00 C ATOM 20 CG2 ILE F 2 -7.262 -8.014 -19.541 1.00 0.00 C ATOM 21 CD1 ILE F 2 -4.892 -6.940 -18.421 1.00 0.00 C ATOM 0 HA ILE F 2 -7.964 -6.800 -21.896 1.00 0.00 H new ATOM 0 HB ILE F 2 -7.107 -5.878 -19.779 1.00 0.00 H new ATOM 0 HG12 ILE F 2 -4.645 -7.537 -20.485 1.00 0.00 H new ATOM 0 HG13 ILE F 2 -4.717 -5.802 -20.251 1.00 0.00 H new ATOM 0 HG21 ILE F 2 -7.088 -7.982 -18.465 1.00 0.00 H new ATOM 0 HG22 ILE F 2 -8.334 -8.033 -19.735 1.00 0.00 H new ATOM 0 HG23 ILE F 2 -6.802 -8.911 -19.957 1.00 0.00 H new ATOM 0 HD11 ILE F 2 -3.820 -6.921 -18.226 1.00 0.00 H new ATOM 0 HD12 ILE F 2 -5.376 -6.136 -17.866 1.00 0.00 H new ATOM 0 HD13 ILE F 2 -5.302 -7.899 -18.103 1.00 0.00 H new ATOM 33 N GLN F 3 -6.688 -4.425 -22.052 1.00 0.00 N ATOM 34 CA GLN F 3 -6.090 -3.205 -22.667 1.00 0.00 C ATOM 35 C GLN F 3 -4.571 -3.330 -22.685 1.00 0.00 C ATOM 36 O GLN F 3 -3.942 -3.277 -23.723 1.00 0.00 O ATOM 37 CB GLN F 3 -6.482 -1.975 -21.848 1.00 0.00 C ATOM 38 CG GLN F 3 -6.612 -0.765 -22.776 1.00 0.00 C ATOM 39 CD GLN F 3 -7.947 -0.065 -22.517 1.00 0.00 C ATOM 40 OE1 GLN F 3 -8.013 0.881 -21.758 1.00 0.00 O ATOM 41 NE2 GLN F 3 -9.022 -0.492 -23.121 1.00 0.00 N ATOM 0 H GLN F 3 -7.448 -4.251 -21.394 1.00 0.00 H new ATOM 0 HA GLN F 3 -6.460 -3.101 -23.687 1.00 0.00 H new ATOM 0 HB2 GLN F 3 -7.425 -2.154 -21.332 1.00 0.00 H new ATOM 0 HB3 GLN F 3 -5.731 -1.780 -21.082 1.00 0.00 H new ATOM 0 HG2 GLN F 3 -5.787 -0.073 -22.606 1.00 0.00 H new ATOM 0 HG3 GLN F 3 -6.552 -1.083 -23.817 1.00 0.00 H new ATOM 0 HE21 GLN F 3 -8.967 -1.286 -23.759 1.00 0.00 H new ATOM 0 HE22 GLN F 3 -9.917 -0.031 -22.956 1.00 0.00 H new ATOM 50 N ALA F 4 -3.982 -3.488 -21.539 1.00 0.00 N ATOM 51 CA ALA F 4 -2.502 -3.611 -21.465 1.00 0.00 C ATOM 52 C ALA F 4 -1.857 -2.587 -22.395 1.00 0.00 C ATOM 53 O ALA F 4 -1.512 -2.882 -23.521 1.00 0.00 O ATOM 54 CB ALA F 4 -2.086 -5.014 -21.886 1.00 0.00 C ATOM 0 H ALA F 4 -4.464 -3.538 -20.642 1.00 0.00 H new ATOM 0 HA ALA F 4 -2.174 -3.428 -20.442 1.00 0.00 H new ATOM 0 HB1 ALA F 4 -1.001 -5.104 -21.832 1.00 0.00 H new ATOM 0 HB2 ALA F 4 -2.544 -5.745 -21.220 1.00 0.00 H new ATOM 0 HB3 ALA F 4 -2.414 -5.199 -22.909 1.00 0.00 H new ATOM 60 N GLU F 5 -1.692 -1.387 -21.924 1.00 0.00 N ATOM 61 CA GLU F 5 -1.070 -0.327 -22.766 1.00 0.00 C ATOM 62 C GLU F 5 -0.649 0.846 -21.878 1.00 0.00 C ATOM 63 O GLU F 5 0.373 1.466 -22.095 1.00 0.00 O ATOM 64 CB GLU F 5 -2.083 0.164 -23.804 1.00 0.00 C ATOM 65 CG GLU F 5 -2.181 -0.852 -24.943 1.00 0.00 C ATOM 66 CD GLU F 5 -2.770 -0.175 -26.181 1.00 0.00 C ATOM 67 OE1 GLU F 5 -2.007 0.413 -26.930 1.00 0.00 O ATOM 68 OE2 GLU F 5 -3.974 -0.255 -26.360 1.00 0.00 O ATOM 0 H GLU F 5 -1.962 -1.090 -20.986 1.00 0.00 H new ATOM 0 HA GLU F 5 -0.196 -0.735 -23.274 1.00 0.00 H new ATOM 0 HB2 GLU F 5 -3.059 0.300 -23.339 1.00 0.00 H new ATOM 0 HB3 GLU F 5 -1.778 1.135 -24.194 1.00 0.00 H new ATOM 0 HG2 GLU F 5 -1.194 -1.255 -25.171 1.00 0.00 H new ATOM 0 HG3 GLU F 5 -2.807 -1.692 -24.642 1.00 0.00 H new ATOM 75 N GLU F 6 -1.432 1.158 -20.880 1.00 0.00 N ATOM 76 CA GLU F 6 -1.075 2.293 -19.984 1.00 0.00 C ATOM 77 C GLU F 6 -1.318 1.901 -18.526 1.00 0.00 C ATOM 78 O GLU F 6 -0.582 2.291 -17.639 1.00 0.00 O ATOM 79 CB GLU F 6 -1.937 3.509 -20.334 1.00 0.00 C ATOM 80 CG GLU F 6 -2.160 3.557 -21.846 1.00 0.00 C ATOM 81 CD GLU F 6 -0.849 3.920 -22.545 1.00 0.00 C ATOM 82 OE1 GLU F 6 0.033 4.432 -21.875 1.00 0.00 O ATOM 83 OE2 GLU F 6 -0.748 3.679 -23.737 1.00 0.00 O ATOM 0 H GLU F 6 -2.301 0.677 -20.648 1.00 0.00 H new ATOM 0 HA GLU F 6 -0.022 2.539 -20.119 1.00 0.00 H new ATOM 0 HB2 GLU F 6 -2.894 3.451 -19.816 1.00 0.00 H new ATOM 0 HB3 GLU F 6 -1.448 4.424 -19.998 1.00 0.00 H new ATOM 0 HG2 GLU F 6 -2.519 2.591 -22.202 1.00 0.00 H new ATOM 0 HG3 GLU F 6 -2.928 4.291 -22.088 1.00 0.00 H new ATOM 90 N TRP F 7 -2.341 1.137 -18.265 1.00 0.00 N ATOM 91 CA TRP F 7 -2.624 0.729 -16.860 1.00 0.00 C ATOM 92 C TRP F 7 -2.183 -0.720 -16.641 1.00 0.00 C ATOM 93 O TRP F 7 -2.365 -1.267 -15.578 1.00 0.00 O ATOM 94 CB TRP F 7 -4.123 0.861 -16.573 1.00 0.00 C ATOM 95 CG TRP F 7 -4.903 0.067 -17.570 1.00 0.00 C ATOM 96 CD1 TRP F 7 -5.495 0.574 -18.675 1.00 0.00 C ATOM 97 CD2 TRP F 7 -5.191 -1.360 -17.570 1.00 0.00 C ATOM 98 NE1 TRP F 7 -6.128 -0.451 -19.354 1.00 0.00 N ATOM 99 CE2 TRP F 7 -5.967 -1.663 -18.712 1.00 0.00 C ATOM 100 CE3 TRP F 7 -4.857 -2.410 -16.698 1.00 0.00 C ATOM 101 CZ2 TRP F 7 -6.396 -2.965 -18.981 1.00 0.00 C ATOM 102 CZ3 TRP F 7 -5.286 -3.720 -16.964 1.00 0.00 C ATOM 103 CH2 TRP F 7 -6.054 -3.998 -18.104 1.00 0.00 C ATOM 0 H TRP F 7 -2.993 0.777 -18.962 1.00 0.00 H new ATOM 0 HA TRP F 7 -2.070 1.379 -16.182 1.00 0.00 H new ATOM 0 HB2 TRP F 7 -4.341 0.510 -15.564 1.00 0.00 H new ATOM 0 HB3 TRP F 7 -4.420 1.909 -16.617 1.00 0.00 H new ATOM 0 HD1 TRP F 7 -5.476 1.610 -18.978 1.00 0.00 H new ATOM 0 HE1 TRP F 7 -6.649 -0.327 -20.222 1.00 0.00 H new ATOM 0 HE3 TRP F 7 -4.266 -2.208 -15.817 1.00 0.00 H new ATOM 0 HZ2 TRP F 7 -6.988 -3.172 -19.860 1.00 0.00 H new ATOM 0 HZ3 TRP F 7 -5.023 -4.519 -16.286 1.00 0.00 H new ATOM 0 HH2 TRP F 7 -6.380 -5.008 -18.304 1.00 0.00 H new ATOM 114 N TYR F 8 -1.606 -1.341 -17.639 1.00 0.00 N ATOM 115 CA TYR F 8 -1.147 -2.756 -17.490 1.00 0.00 C ATOM 116 C TYR F 8 -0.049 -3.031 -18.514 1.00 0.00 C ATOM 117 O TYR F 8 -0.205 -2.791 -19.695 1.00 0.00 O ATOM 118 CB TYR F 8 -2.351 -3.684 -17.680 1.00 0.00 C ATOM 119 CG TYR F 8 -1.945 -5.114 -17.964 1.00 0.00 C ATOM 120 CD1 TYR F 8 -1.259 -5.453 -19.138 1.00 0.00 C ATOM 121 CD2 TYR F 8 -2.297 -6.115 -17.051 1.00 0.00 C ATOM 122 CE1 TYR F 8 -0.918 -6.787 -19.389 1.00 0.00 C ATOM 123 CE2 TYR F 8 -1.960 -7.447 -17.305 1.00 0.00 C ATOM 124 CZ TYR F 8 -1.270 -7.784 -18.472 1.00 0.00 C ATOM 125 OH TYR F 8 -0.938 -9.100 -18.722 1.00 0.00 O ATOM 0 H TYR F 8 -1.432 -0.927 -18.555 1.00 0.00 H new ATOM 0 HA TYR F 8 -0.733 -2.934 -16.498 1.00 0.00 H new ATOM 0 HB2 TYR F 8 -2.970 -3.657 -16.784 1.00 0.00 H new ATOM 0 HB3 TYR F 8 -2.964 -3.314 -18.502 1.00 0.00 H new ATOM 0 HD1 TYR F 8 -0.993 -4.685 -19.849 1.00 0.00 H new ATOM 0 HD2 TYR F 8 -2.830 -5.857 -16.148 1.00 0.00 H new ATOM 0 HE1 TYR F 8 -0.383 -7.047 -20.290 1.00 0.00 H new ATOM 0 HE2 TYR F 8 -2.233 -8.217 -16.598 1.00 0.00 H new ATOM 0 HH TYR F 8 -1.378 -9.679 -18.065 1.00 0.00 H new ATOM 135 N PHE F 9 1.078 -3.505 -18.055 1.00 0.00 N ATOM 136 CA PHE F 9 2.214 -3.776 -18.977 1.00 0.00 C ATOM 137 C PHE F 9 2.289 -5.275 -19.276 1.00 0.00 C ATOM 138 O PHE F 9 2.677 -5.683 -20.353 1.00 0.00 O ATOM 139 CB PHE F 9 3.517 -3.321 -18.313 1.00 0.00 C ATOM 140 CG PHE F 9 3.701 -1.831 -18.508 1.00 0.00 C ATOM 141 CD1 PHE F 9 2.583 -0.985 -18.564 1.00 0.00 C ATOM 142 CD2 PHE F 9 4.989 -1.292 -18.633 1.00 0.00 C ATOM 143 CE1 PHE F 9 2.755 0.392 -18.743 1.00 0.00 C ATOM 144 CE2 PHE F 9 5.159 0.085 -18.812 1.00 0.00 C ATOM 145 CZ PHE F 9 4.042 0.927 -18.869 1.00 0.00 C ATOM 0 H PHE F 9 1.260 -3.717 -17.074 1.00 0.00 H new ATOM 0 HA PHE F 9 2.066 -3.232 -19.910 1.00 0.00 H new ATOM 0 HB2 PHE F 9 3.495 -3.558 -17.249 1.00 0.00 H new ATOM 0 HB3 PHE F 9 4.362 -3.860 -18.742 1.00 0.00 H new ATOM 0 HD1 PHE F 9 1.589 -1.397 -18.469 1.00 0.00 H new ATOM 0 HD2 PHE F 9 5.851 -1.941 -18.591 1.00 0.00 H new ATOM 0 HE1 PHE F 9 1.894 1.043 -18.784 1.00 0.00 H new ATOM 0 HE2 PHE F 9 6.152 0.499 -18.906 1.00 0.00 H new ATOM 0 HZ PHE F 9 4.174 1.990 -19.010 1.00 0.00 H new ATOM 155 N GLY F 10 1.929 -6.097 -18.330 1.00 0.00 N ATOM 156 CA GLY F 10 1.988 -7.569 -18.559 1.00 0.00 C ATOM 157 C GLY F 10 2.452 -8.256 -17.278 1.00 0.00 C ATOM 158 O GLY F 10 1.858 -8.111 -16.228 1.00 0.00 O ATOM 0 H GLY F 10 1.596 -5.814 -17.408 1.00 0.00 H new ATOM 0 HA2 GLY F 10 1.007 -7.943 -18.852 1.00 0.00 H new ATOM 0 HA3 GLY F 10 2.673 -7.795 -19.376 1.00 0.00 H new ATOM 162 N LYS F 11 3.518 -8.997 -17.358 1.00 0.00 N ATOM 163 CA LYS F 11 4.042 -9.690 -16.151 1.00 0.00 C ATOM 164 C LYS F 11 5.274 -8.932 -15.671 1.00 0.00 C ATOM 165 O LYS F 11 6.389 -9.408 -15.755 1.00 0.00 O ATOM 166 CB LYS F 11 4.413 -11.127 -16.512 1.00 0.00 C ATOM 167 CG LYS F 11 3.425 -11.650 -17.557 1.00 0.00 C ATOM 168 CD LYS F 11 2.911 -13.027 -17.132 1.00 0.00 C ATOM 169 CE LYS F 11 2.866 -13.953 -18.349 1.00 0.00 C ATOM 170 NZ LYS F 11 4.191 -14.613 -18.521 1.00 0.00 N ATOM 0 H LYS F 11 4.053 -9.154 -18.212 1.00 0.00 H new ATOM 0 HA LYS F 11 3.290 -9.714 -15.362 1.00 0.00 H new ATOM 0 HB2 LYS F 11 5.430 -11.166 -16.903 1.00 0.00 H new ATOM 0 HB3 LYS F 11 4.389 -11.757 -15.623 1.00 0.00 H new ATOM 0 HG2 LYS F 11 2.591 -10.956 -17.663 1.00 0.00 H new ATOM 0 HG3 LYS F 11 3.911 -11.716 -18.531 1.00 0.00 H new ATOM 0 HD2 LYS F 11 3.561 -13.449 -16.365 1.00 0.00 H new ATOM 0 HD3 LYS F 11 1.917 -12.937 -16.694 1.00 0.00 H new ATOM 0 HE2 LYS F 11 2.088 -14.705 -18.219 1.00 0.00 H new ATOM 0 HE3 LYS F 11 2.613 -13.384 -19.243 1.00 0.00 H new ATOM 0 HZ1 LYS F 11 4.160 -15.243 -19.348 1.00 0.00 H new ATOM 0 HZ2 LYS F 11 4.924 -13.889 -18.664 1.00 0.00 H new ATOM 0 HZ3 LYS F 11 4.415 -15.169 -17.671 1.00 0.00 H new ATOM 184 N LEU F 12 5.075 -7.738 -15.194 1.00 0.00 N ATOM 185 CA LEU F 12 6.219 -6.909 -14.733 1.00 0.00 C ATOM 186 C LEU F 12 6.294 -6.916 -13.205 1.00 0.00 C ATOM 187 O LEU F 12 5.359 -7.296 -12.528 1.00 0.00 O ATOM 188 CB LEU F 12 6.008 -5.481 -15.232 1.00 0.00 C ATOM 189 CG LEU F 12 7.278 -4.669 -15.024 1.00 0.00 C ATOM 190 CD1 LEU F 12 8.414 -5.278 -15.849 1.00 0.00 C ATOM 191 CD2 LEU F 12 7.031 -3.229 -15.465 1.00 0.00 C ATOM 0 H LEU F 12 4.160 -7.297 -15.103 1.00 0.00 H new ATOM 0 HA LEU F 12 7.152 -7.314 -15.126 1.00 0.00 H new ATOM 0 HB2 LEU F 12 5.741 -5.491 -16.289 1.00 0.00 H new ATOM 0 HB3 LEU F 12 5.178 -5.018 -14.698 1.00 0.00 H new ATOM 0 HG LEU F 12 7.556 -4.682 -13.970 1.00 0.00 H new ATOM 0 HD11 LEU F 12 9.324 -4.697 -15.700 1.00 0.00 H new ATOM 0 HD12 LEU F 12 8.584 -6.306 -15.530 1.00 0.00 H new ATOM 0 HD13 LEU F 12 8.144 -5.265 -16.905 1.00 0.00 H new ATOM 0 HD21 LEU F 12 7.938 -2.643 -15.318 1.00 0.00 H new ATOM 0 HD22 LEU F 12 6.756 -3.214 -16.520 1.00 0.00 H new ATOM 0 HD23 LEU F 12 6.222 -2.801 -14.873 1.00 0.00 H new ATOM 203 N GLY F 13 7.405 -6.497 -12.656 1.00 0.00 N ATOM 204 CA GLY F 13 7.543 -6.477 -11.175 1.00 0.00 C ATOM 205 C GLY F 13 7.562 -5.029 -10.683 1.00 0.00 C ATOM 206 O GLY F 13 7.122 -4.125 -11.364 1.00 0.00 O ATOM 0 H GLY F 13 8.221 -6.168 -13.172 1.00 0.00 H new ATOM 0 HA2 GLY F 13 6.716 -7.018 -10.715 1.00 0.00 H new ATOM 0 HA3 GLY F 13 8.460 -6.985 -10.878 1.00 0.00 H new ATOM 210 N ARG F 14 8.066 -4.804 -9.502 1.00 0.00 N ATOM 211 CA ARG F 14 8.111 -3.415 -8.959 1.00 0.00 C ATOM 212 C ARG F 14 9.427 -2.740 -9.352 1.00 0.00 C ATOM 213 O ARG F 14 9.535 -1.529 -9.366 1.00 0.00 O ATOM 214 CB ARG F 14 8.014 -3.467 -7.435 1.00 0.00 C ATOM 215 CG ARG F 14 8.942 -4.561 -6.901 1.00 0.00 C ATOM 216 CD ARG F 14 9.781 -3.999 -5.752 1.00 0.00 C ATOM 217 NE ARG F 14 9.777 -4.964 -4.617 1.00 0.00 N ATOM 218 CZ ARG F 14 10.725 -4.921 -3.721 1.00 0.00 C ATOM 219 NH1 ARG F 14 11.000 -3.798 -3.116 1.00 0.00 N ATOM 220 NH2 ARG F 14 11.397 -6.001 -3.429 1.00 0.00 N ATOM 0 H ARG F 14 8.450 -5.522 -8.887 1.00 0.00 H new ATOM 0 HA ARG F 14 7.277 -2.845 -9.369 1.00 0.00 H new ATOM 0 HB2 ARG F 14 8.289 -2.502 -7.009 1.00 0.00 H new ATOM 0 HB3 ARG F 14 6.986 -3.667 -7.132 1.00 0.00 H new ATOM 0 HG2 ARG F 14 8.357 -5.413 -6.556 1.00 0.00 H new ATOM 0 HG3 ARG F 14 9.592 -4.923 -7.698 1.00 0.00 H new ATOM 0 HD2 ARG F 14 10.803 -3.819 -6.087 1.00 0.00 H new ATOM 0 HD3 ARG F 14 9.378 -3.039 -5.429 1.00 0.00 H new ATOM 0 HE ARG F 14 9.034 -5.658 -4.540 1.00 0.00 H new ATOM 0 HH11 ARG F 14 10.474 -2.954 -3.343 1.00 0.00 H new ATOM 0 HH12 ARG F 14 11.741 -3.764 -2.416 1.00 0.00 H new ATOM 0 HH21 ARG F 14 11.181 -6.879 -3.901 1.00 0.00 H new ATOM 0 HH22 ARG F 14 12.138 -5.967 -2.729 1.00 0.00 H new ATOM 234 N LYS F 15 10.428 -3.512 -9.668 1.00 0.00 N ATOM 235 CA LYS F 15 11.729 -2.922 -10.050 1.00 0.00 C ATOM 236 C LYS F 15 11.593 -2.283 -11.423 1.00 0.00 C ATOM 237 O LYS F 15 12.085 -1.199 -11.674 1.00 0.00 O ATOM 238 CB LYS F 15 12.797 -4.016 -10.096 1.00 0.00 C ATOM 239 CG LYS F 15 14.137 -3.440 -9.635 1.00 0.00 C ATOM 240 CD LYS F 15 14.683 -4.282 -8.478 1.00 0.00 C ATOM 241 CE LYS F 15 15.851 -5.135 -8.977 1.00 0.00 C ATOM 242 NZ LYS F 15 16.983 -5.039 -8.013 1.00 0.00 N ATOM 0 H LYS F 15 10.395 -4.531 -9.677 1.00 0.00 H new ATOM 0 HA LYS F 15 12.023 -2.169 -9.318 1.00 0.00 H new ATOM 0 HB2 LYS F 15 12.507 -4.849 -9.455 1.00 0.00 H new ATOM 0 HB3 LYS F 15 12.887 -4.409 -11.109 1.00 0.00 H new ATOM 0 HG2 LYS F 15 14.847 -3.435 -10.462 1.00 0.00 H new ATOM 0 HG3 LYS F 15 14.010 -2.405 -9.318 1.00 0.00 H new ATOM 0 HD2 LYS F 15 15.013 -3.634 -7.666 1.00 0.00 H new ATOM 0 HD3 LYS F 15 13.897 -4.921 -8.076 1.00 0.00 H new ATOM 0 HE2 LYS F 15 15.537 -6.173 -9.084 1.00 0.00 H new ATOM 0 HE3 LYS F 15 16.169 -4.795 -9.963 1.00 0.00 H new ATOM 0 HZ1 LYS F 15 17.777 -5.619 -8.352 1.00 0.00 H new ATOM 0 HZ2 LYS F 15 17.287 -4.048 -7.932 1.00 0.00 H new ATOM 0 HZ3 LYS F 15 16.676 -5.384 -7.081 1.00 0.00 H new ATOM 256 N ASP F 16 10.918 -2.942 -12.316 1.00 0.00 N ATOM 257 CA ASP F 16 10.745 -2.373 -13.655 1.00 0.00 C ATOM 258 C ASP F 16 9.670 -1.300 -13.587 1.00 0.00 C ATOM 259 O ASP F 16 9.820 -0.217 -14.108 1.00 0.00 O ATOM 260 CB ASP F 16 10.310 -3.468 -14.616 1.00 0.00 C ATOM 261 CG ASP F 16 10.603 -3.039 -16.054 1.00 0.00 C ATOM 262 OD1 ASP F 16 10.635 -1.845 -16.301 1.00 0.00 O ATOM 263 OD2 ASP F 16 10.791 -3.912 -16.885 1.00 0.00 O ATOM 0 H ASP F 16 10.481 -3.852 -12.167 1.00 0.00 H new ATOM 0 HA ASP F 16 11.683 -1.941 -14.005 1.00 0.00 H new ATOM 0 HB2 ASP F 16 10.837 -4.395 -14.389 1.00 0.00 H new ATOM 0 HB3 ASP F 16 9.245 -3.668 -14.496 1.00 0.00 H new ATOM 268 N ALA F 17 8.585 -1.602 -12.936 1.00 0.00 N ATOM 269 CA ALA F 17 7.490 -0.607 -12.818 1.00 0.00 C ATOM 270 C ALA F 17 8.090 0.757 -12.500 1.00 0.00 C ATOM 271 O ALA F 17 7.746 1.754 -13.103 1.00 0.00 O ATOM 272 CB ALA F 17 6.530 -1.029 -11.708 1.00 0.00 C ATOM 0 H ALA F 17 8.410 -2.497 -12.480 1.00 0.00 H new ATOM 0 HA ALA F 17 6.939 -0.551 -13.757 1.00 0.00 H new ATOM 0 HB1 ALA F 17 5.727 -0.297 -11.624 1.00 0.00 H new ATOM 0 HB2 ALA F 17 6.107 -2.005 -11.944 1.00 0.00 H new ATOM 0 HB3 ALA F 17 7.070 -1.086 -10.763 1.00 0.00 H new ATOM 278 N GLU F 18 9.000 0.810 -11.571 1.00 0.00 N ATOM 279 CA GLU F 18 9.634 2.113 -11.234 1.00 0.00 C ATOM 280 C GLU F 18 10.504 2.554 -12.413 1.00 0.00 C ATOM 281 O GLU F 18 10.557 3.717 -12.758 1.00 0.00 O ATOM 282 CB GLU F 18 10.504 1.956 -9.984 1.00 0.00 C ATOM 283 CG GLU F 18 11.504 0.819 -10.194 1.00 0.00 C ATOM 284 CD GLU F 18 12.490 0.784 -9.026 1.00 0.00 C ATOM 285 OE1 GLU F 18 12.118 0.286 -7.977 1.00 0.00 O ATOM 286 OE2 GLU F 18 13.602 1.256 -9.200 1.00 0.00 O ATOM 0 H GLU F 18 9.332 0.010 -11.032 1.00 0.00 H new ATOM 0 HA GLU F 18 8.865 2.860 -11.039 1.00 0.00 H new ATOM 0 HB2 GLU F 18 11.034 2.886 -9.778 1.00 0.00 H new ATOM 0 HB3 GLU F 18 9.878 1.747 -9.117 1.00 0.00 H new ATOM 0 HG2 GLU F 18 10.978 -0.133 -10.268 1.00 0.00 H new ATOM 0 HG3 GLU F 18 12.040 0.961 -11.132 1.00 0.00 H new ATOM 293 N ARG F 19 11.185 1.631 -13.037 1.00 0.00 N ATOM 294 CA ARG F 19 12.049 1.995 -14.197 1.00 0.00 C ATOM 295 C ARG F 19 11.191 2.541 -15.343 1.00 0.00 C ATOM 296 O ARG F 19 11.184 3.724 -15.614 1.00 0.00 O ATOM 297 CB ARG F 19 12.805 0.754 -14.676 1.00 0.00 C ATOM 298 CG ARG F 19 14.276 1.109 -14.906 1.00 0.00 C ATOM 299 CD ARG F 19 15.141 0.404 -13.860 1.00 0.00 C ATOM 300 NE ARG F 19 15.769 1.419 -12.968 1.00 0.00 N ATOM 301 CZ ARG F 19 17.061 1.420 -12.790 1.00 0.00 C ATOM 302 NH1 ARG F 19 17.861 1.226 -13.804 1.00 0.00 N ATOM 303 NH2 ARG F 19 17.555 1.615 -11.598 1.00 0.00 N ATOM 0 H ARG F 19 11.180 0.640 -12.794 1.00 0.00 H new ATOM 0 HA ARG F 19 12.758 2.763 -13.886 1.00 0.00 H new ATOM 0 HB2 ARG F 19 12.724 -0.042 -13.936 1.00 0.00 H new ATOM 0 HB3 ARG F 19 12.362 0.379 -15.599 1.00 0.00 H new ATOM 0 HG2 ARG F 19 14.581 0.808 -15.908 1.00 0.00 H new ATOM 0 HG3 ARG F 19 14.415 2.188 -14.841 1.00 0.00 H new ATOM 0 HD2 ARG F 19 14.532 -0.284 -13.273 1.00 0.00 H new ATOM 0 HD3 ARG F 19 15.911 -0.191 -14.351 1.00 0.00 H new ATOM 0 HE ARG F 19 15.189 2.113 -12.497 1.00 0.00 H new ATOM 0 HH11 ARG F 19 17.475 1.074 -14.736 1.00 0.00 H new ATOM 0 HH12 ARG F 19 18.871 1.227 -13.664 1.00 0.00 H new ATOM 0 HH21 ARG F 19 16.931 1.767 -10.806 1.00 0.00 H new ATOM 0 HH22 ARG F 19 18.565 1.616 -11.459 1.00 0.00 H new ATOM 317 N GLN F 20 10.481 1.683 -16.022 1.00 0.00 N ATOM 318 CA GLN F 20 9.628 2.131 -17.164 1.00 0.00 C ATOM 319 C GLN F 20 8.940 3.459 -16.831 1.00 0.00 C ATOM 320 O GLN F 20 9.047 4.421 -17.565 1.00 0.00 O ATOM 321 CB GLN F 20 8.568 1.064 -17.453 1.00 0.00 C ATOM 322 CG GLN F 20 9.232 -0.153 -18.099 1.00 0.00 C ATOM 323 CD GLN F 20 8.944 -0.155 -19.601 1.00 0.00 C ATOM 324 OE1 GLN F 20 9.912 0.096 -20.439 1.00 0.00 O flip ATOM 325 NE2 GLN F 20 7.826 -0.388 -20.016 1.00 0.00 N flip ATOM 0 H GLN F 20 10.454 0.681 -15.834 1.00 0.00 H new ATOM 0 HA GLN F 20 10.259 2.275 -18.041 1.00 0.00 H new ATOM 0 HB2 GLN F 20 8.070 0.772 -16.529 1.00 0.00 H new ATOM 0 HB3 GLN F 20 7.802 1.467 -18.115 1.00 0.00 H new ATOM 0 HG2 GLN F 20 10.308 -0.129 -17.924 1.00 0.00 H new ATOM 0 HG3 GLN F 20 8.856 -1.070 -17.645 1.00 0.00 H new ATOM 0 HE21 GLN F 20 7.069 -0.584 -19.361 1.00 0.00 H new ATOM 0 HE22 GLN F 20 7.644 -0.387 -21.020 1.00 0.00 H new ATOM 334 N LEU F 21 8.227 3.521 -15.740 1.00 0.00 N ATOM 335 CA LEU F 21 7.528 4.789 -15.379 1.00 0.00 C ATOM 336 C LEU F 21 8.513 5.957 -15.424 1.00 0.00 C ATOM 337 O LEU F 21 8.410 6.839 -16.254 1.00 0.00 O ATOM 338 CB LEU F 21 6.946 4.669 -13.969 1.00 0.00 C ATOM 339 CG LEU F 21 5.444 4.961 -14.005 1.00 0.00 C ATOM 340 CD1 LEU F 21 4.787 4.143 -15.119 1.00 0.00 C ATOM 341 CD2 LEU F 21 4.822 4.578 -12.661 1.00 0.00 C ATOM 0 H LEU F 21 8.098 2.751 -15.084 1.00 0.00 H new ATOM 0 HA LEU F 21 6.724 4.969 -16.093 1.00 0.00 H new ATOM 0 HB2 LEU F 21 7.122 3.668 -13.576 1.00 0.00 H new ATOM 0 HB3 LEU F 21 7.446 5.367 -13.298 1.00 0.00 H new ATOM 0 HG LEU F 21 5.286 6.023 -14.195 1.00 0.00 H new ATOM 0 HD11 LEU F 21 3.718 4.353 -15.142 1.00 0.00 H new ATOM 0 HD12 LEU F 21 5.231 4.412 -16.078 1.00 0.00 H new ATOM 0 HD13 LEU F 21 4.944 3.081 -14.932 1.00 0.00 H new ATOM 0 HD21 LEU F 21 3.752 4.785 -12.683 1.00 0.00 H new ATOM 0 HD22 LEU F 21 4.983 3.516 -12.475 1.00 0.00 H new ATOM 0 HD23 LEU F 21 5.288 5.160 -11.866 1.00 0.00 H new ATOM 353 N LEU F 22 9.461 5.975 -14.532 1.00 0.00 N ATOM 354 CA LEU F 22 10.451 7.091 -14.512 1.00 0.00 C ATOM 355 C LEU F 22 11.026 7.307 -15.915 1.00 0.00 C ATOM 356 O LEU F 22 11.547 8.362 -16.225 1.00 0.00 O ATOM 357 CB LEU F 22 11.586 6.750 -13.543 1.00 0.00 C ATOM 358 CG LEU F 22 11.029 6.615 -12.122 1.00 0.00 C ATOM 359 CD1 LEU F 22 12.182 6.657 -11.118 1.00 0.00 C ATOM 360 CD2 LEU F 22 10.062 7.766 -11.835 1.00 0.00 C ATOM 0 H LEU F 22 9.595 5.264 -13.813 1.00 0.00 H new ATOM 0 HA LEU F 22 9.952 8.004 -14.186 1.00 0.00 H new ATOM 0 HB2 LEU F 22 12.068 5.820 -13.845 1.00 0.00 H new ATOM 0 HB3 LEU F 22 12.349 7.528 -13.573 1.00 0.00 H new ATOM 0 HG LEU F 22 10.499 5.667 -12.031 1.00 0.00 H new ATOM 0 HD11 LEU F 22 11.787 6.561 -10.106 1.00 0.00 H new ATOM 0 HD12 LEU F 22 12.869 5.835 -11.319 1.00 0.00 H new ATOM 0 HD13 LEU F 22 12.712 7.605 -11.212 1.00 0.00 H new ATOM 0 HD21 LEU F 22 9.668 7.667 -10.824 1.00 0.00 H new ATOM 0 HD22 LEU F 22 10.589 8.716 -11.927 1.00 0.00 H new ATOM 0 HD23 LEU F 22 9.239 7.737 -12.549 1.00 0.00 H new ATOM 372 N SER F 23 10.939 6.323 -16.767 1.00 0.00 N ATOM 373 CA SER F 23 11.484 6.481 -18.146 1.00 0.00 C ATOM 374 C SER F 23 10.686 7.553 -18.890 1.00 0.00 C ATOM 375 O SER F 23 9.511 7.747 -18.647 1.00 0.00 O ATOM 376 CB SER F 23 11.374 5.151 -18.893 1.00 0.00 C ATOM 377 OG SER F 23 12.641 4.805 -19.432 1.00 0.00 O ATOM 0 H SER F 23 10.515 5.417 -16.569 1.00 0.00 H new ATOM 0 HA SER F 23 12.531 6.781 -18.091 1.00 0.00 H new ATOM 0 HB2 SER F 23 11.029 4.369 -18.217 1.00 0.00 H new ATOM 0 HB3 SER F 23 10.636 5.230 -19.692 1.00 0.00 H new ATOM 0 HG SER F 23 12.572 3.952 -19.909 1.00 0.00 H new ATOM 383 N PHE F 24 11.313 8.251 -19.797 1.00 0.00 N ATOM 384 CA PHE F 24 10.590 9.309 -20.557 1.00 0.00 C ATOM 385 C PHE F 24 9.219 8.781 -20.986 1.00 0.00 C ATOM 386 O PHE F 24 9.088 8.113 -21.992 1.00 0.00 O ATOM 387 CB PHE F 24 11.400 9.691 -21.797 1.00 0.00 C ATOM 388 CG PHE F 24 12.125 10.991 -21.544 1.00 0.00 C ATOM 389 CD1 PHE F 24 11.426 12.203 -21.591 1.00 0.00 C ATOM 390 CD2 PHE F 24 13.497 10.985 -21.262 1.00 0.00 C ATOM 391 CE1 PHE F 24 12.098 13.409 -21.357 1.00 0.00 C ATOM 392 CE2 PHE F 24 14.168 12.190 -21.028 1.00 0.00 C ATOM 393 CZ PHE F 24 13.469 13.402 -21.075 1.00 0.00 C ATOM 0 H PHE F 24 12.296 8.134 -20.045 1.00 0.00 H new ATOM 0 HA PHE F 24 10.460 10.187 -19.924 1.00 0.00 H new ATOM 0 HB2 PHE F 24 12.115 8.903 -22.034 1.00 0.00 H new ATOM 0 HB3 PHE F 24 10.740 9.792 -22.659 1.00 0.00 H new ATOM 0 HD1 PHE F 24 10.368 12.208 -21.808 1.00 0.00 H new ATOM 0 HD2 PHE F 24 14.037 10.050 -21.225 1.00 0.00 H new ATOM 0 HE1 PHE F 24 11.559 14.344 -21.394 1.00 0.00 H new ATOM 0 HE2 PHE F 24 15.226 12.185 -20.811 1.00 0.00 H new ATOM 0 HZ PHE F 24 13.988 14.332 -20.894 1.00 0.00 H new ATOM 403 N GLY F 25 8.197 9.074 -20.229 1.00 0.00 N ATOM 404 CA GLY F 25 6.837 8.589 -20.593 1.00 0.00 C ATOM 405 C GLY F 25 5.789 9.568 -20.064 1.00 0.00 C ATOM 406 O GLY F 25 5.249 10.373 -20.797 1.00 0.00 O ATOM 0 H GLY F 25 8.246 9.628 -19.374 1.00 0.00 H new ATOM 0 HA2 GLY F 25 6.750 8.496 -21.676 1.00 0.00 H new ATOM 0 HA3 GLY F 25 6.668 7.597 -20.173 1.00 0.00 H new ATOM 410 N ASN F 26 5.497 9.503 -18.797 1.00 0.00 N ATOM 411 CA ASN F 26 4.484 10.428 -18.215 1.00 0.00 C ATOM 412 C ASN F 26 4.892 10.800 -16.786 1.00 0.00 C ATOM 413 O ASN F 26 5.596 10.057 -16.131 1.00 0.00 O ATOM 414 CB ASN F 26 3.118 9.738 -18.192 1.00 0.00 C ATOM 415 CG ASN F 26 2.640 9.506 -19.626 1.00 0.00 C ATOM 416 OD1 ASN F 26 2.938 8.489 -20.221 1.00 0.00 O ATOM 417 ND2 ASN F 26 1.906 10.413 -20.211 1.00 0.00 N ATOM 0 H ASN F 26 5.916 8.848 -18.137 1.00 0.00 H new ATOM 0 HA ASN F 26 4.426 11.331 -18.822 1.00 0.00 H new ATOM 0 HB2 ASN F 26 3.187 8.788 -17.662 1.00 0.00 H new ATOM 0 HB3 ASN F 26 2.397 10.352 -17.652 1.00 0.00 H new ATOM 0 HD21 ASN F 26 1.583 10.268 -21.167 1.00 0.00 H new ATOM 0 HD22 ASN F 26 1.656 11.267 -19.712 1.00 0.00 H new ATOM 424 N PRO F 27 4.433 11.944 -16.347 1.00 0.00 N ATOM 425 CA PRO F 27 4.729 12.452 -14.996 1.00 0.00 C ATOM 426 C PRO F 27 3.855 11.745 -13.957 1.00 0.00 C ATOM 427 O PRO F 27 3.194 10.768 -14.249 1.00 0.00 O ATOM 428 CB PRO F 27 4.375 13.938 -15.086 1.00 0.00 C ATOM 429 CG PRO F 27 3.383 14.080 -16.267 1.00 0.00 C ATOM 430 CD PRO F 27 3.578 12.837 -17.157 1.00 0.00 C ATOM 0 HA PRO F 27 5.761 12.283 -14.690 1.00 0.00 H new ATOM 0 HB2 PRO F 27 3.925 14.287 -14.157 1.00 0.00 H new ATOM 0 HB3 PRO F 27 5.268 14.541 -15.254 1.00 0.00 H new ATOM 0 HG2 PRO F 27 2.356 14.141 -15.906 1.00 0.00 H new ATOM 0 HG3 PRO F 27 3.578 14.993 -16.829 1.00 0.00 H new ATOM 0 HD2 PRO F 27 2.625 12.366 -17.398 1.00 0.00 H new ATOM 0 HD3 PRO F 27 4.054 13.095 -18.103 1.00 0.00 H new ATOM 438 N ARG F 28 3.848 12.229 -12.746 1.00 0.00 N ATOM 439 CA ARG F 28 3.017 11.582 -11.690 1.00 0.00 C ATOM 440 C ARG F 28 1.627 11.280 -12.252 1.00 0.00 C ATOM 441 O ARG F 28 1.196 11.876 -13.219 1.00 0.00 O ATOM 442 CB ARG F 28 2.890 12.525 -10.492 1.00 0.00 C ATOM 443 CG ARG F 28 2.153 13.796 -10.919 1.00 0.00 C ATOM 444 CD ARG F 28 2.195 14.817 -9.781 1.00 0.00 C ATOM 445 NE ARG F 28 2.354 16.186 -10.347 1.00 0.00 N ATOM 446 CZ ARG F 28 1.514 17.129 -10.019 1.00 0.00 C ATOM 447 NH1 ARG F 28 1.667 17.778 -8.896 1.00 0.00 N ATOM 448 NH2 ARG F 28 0.521 17.423 -10.812 1.00 0.00 N ATOM 0 H ARG F 28 4.381 13.044 -12.441 1.00 0.00 H new ATOM 0 HA ARG F 28 3.490 10.653 -11.371 1.00 0.00 H new ATOM 0 HB2 ARG F 28 2.349 12.033 -9.684 1.00 0.00 H new ATOM 0 HB3 ARG F 28 3.878 12.777 -10.107 1.00 0.00 H new ATOM 0 HG2 ARG F 28 2.615 14.214 -11.814 1.00 0.00 H new ATOM 0 HG3 ARG F 28 1.119 13.562 -11.174 1.00 0.00 H new ATOM 0 HD2 ARG F 28 1.279 14.759 -9.193 1.00 0.00 H new ATOM 0 HD3 ARG F 28 3.022 14.592 -9.107 1.00 0.00 H new ATOM 0 HE ARG F 28 3.119 16.386 -10.991 1.00 0.00 H new ATOM 0 HH11 ARG F 28 2.443 17.548 -8.276 1.00 0.00 H new ATOM 0 HH12 ARG F 28 1.010 18.515 -8.639 1.00 0.00 H new ATOM 0 HH21 ARG F 28 0.401 16.916 -11.689 1.00 0.00 H new ATOM 0 HH22 ARG F 28 -0.136 18.160 -10.555 1.00 0.00 H new ATOM 462 N GLY F 29 0.919 10.360 -11.654 1.00 0.00 N ATOM 463 CA GLY F 29 -0.442 10.025 -12.158 1.00 0.00 C ATOM 464 C GLY F 29 -0.344 8.881 -13.170 1.00 0.00 C ATOM 465 O GLY F 29 -1.303 8.545 -13.835 1.00 0.00 O ATOM 0 H GLY F 29 1.224 9.827 -10.840 1.00 0.00 H new ATOM 0 HA2 GLY F 29 -1.088 9.737 -11.329 1.00 0.00 H new ATOM 0 HA3 GLY F 29 -0.894 10.900 -12.625 1.00 0.00 H new ATOM 469 N THR F 30 0.807 8.277 -13.289 1.00 0.00 N ATOM 470 CA THR F 30 0.960 7.153 -14.258 1.00 0.00 C ATOM 471 C THR F 30 0.832 5.823 -13.513 1.00 0.00 C ATOM 472 O THR F 30 1.789 5.310 -12.972 1.00 0.00 O ATOM 473 CB THR F 30 2.336 7.237 -14.923 1.00 0.00 C ATOM 474 OG1 THR F 30 2.678 8.600 -15.131 1.00 0.00 O ATOM 475 CG2 THR F 30 2.303 6.506 -16.267 1.00 0.00 C ATOM 0 H THR F 30 1.646 8.512 -12.759 1.00 0.00 H new ATOM 0 HA THR F 30 0.185 7.219 -15.021 1.00 0.00 H new ATOM 0 HB THR F 30 3.080 6.770 -14.277 1.00 0.00 H new ATOM 0 HG1 THR F 30 3.044 8.975 -14.303 1.00 0.00 H new ATOM 0 HG21 THR F 30 3.284 6.567 -16.739 1.00 0.00 H new ATOM 0 HG22 THR F 30 2.042 5.460 -16.106 1.00 0.00 H new ATOM 0 HG23 THR F 30 1.559 6.970 -16.915 1.00 0.00 H new ATOM 483 N PHE F 31 -0.347 5.265 -13.473 1.00 0.00 N ATOM 484 CA PHE F 31 -0.534 3.976 -12.750 1.00 0.00 C ATOM 485 C PHE F 31 -0.598 2.815 -13.744 1.00 0.00 C ATOM 486 O PHE F 31 -1.537 2.688 -14.504 1.00 0.00 O ATOM 487 CB PHE F 31 -1.835 4.024 -11.947 1.00 0.00 C ATOM 488 CG PHE F 31 -2.054 5.421 -11.418 1.00 0.00 C ATOM 489 CD1 PHE F 31 -0.958 6.217 -11.063 1.00 0.00 C ATOM 490 CD2 PHE F 31 -3.354 5.921 -11.283 1.00 0.00 C ATOM 491 CE1 PHE F 31 -1.163 7.512 -10.573 1.00 0.00 C ATOM 492 CE2 PHE F 31 -3.559 7.215 -10.792 1.00 0.00 C ATOM 493 CZ PHE F 31 -2.463 8.011 -10.437 1.00 0.00 C ATOM 0 H PHE F 31 -1.187 5.645 -13.909 1.00 0.00 H new ATOM 0 HA PHE F 31 0.311 3.824 -12.078 1.00 0.00 H new ATOM 0 HB2 PHE F 31 -2.674 3.727 -12.577 1.00 0.00 H new ATOM 0 HB3 PHE F 31 -1.790 3.315 -11.121 1.00 0.00 H new ATOM 0 HD1 PHE F 31 0.046 5.832 -11.167 1.00 0.00 H new ATOM 0 HD2 PHE F 31 -4.199 5.308 -11.558 1.00 0.00 H new ATOM 0 HE1 PHE F 31 -0.318 8.126 -10.300 1.00 0.00 H new ATOM 0 HE2 PHE F 31 -4.563 7.600 -10.687 1.00 0.00 H new ATOM 0 HZ PHE F 31 -2.621 9.010 -10.058 1.00 0.00 H new ATOM 503 N LEU F 32 0.388 1.959 -13.732 1.00 0.00 N ATOM 504 CA LEU F 32 0.374 0.797 -14.664 1.00 0.00 C ATOM 505 C LEU F 32 0.136 -0.484 -13.860 1.00 0.00 C ATOM 506 O LEU F 32 0.267 -0.503 -12.652 1.00 0.00 O ATOM 507 CB LEU F 32 1.715 0.706 -15.403 1.00 0.00 C ATOM 508 CG LEU F 32 2.842 0.457 -14.397 1.00 0.00 C ATOM 509 CD1 LEU F 32 2.878 -1.028 -14.027 1.00 0.00 C ATOM 510 CD2 LEU F 32 4.185 0.856 -15.017 1.00 0.00 C ATOM 0 H LEU F 32 1.201 2.015 -13.118 1.00 0.00 H new ATOM 0 HA LEU F 32 -0.423 0.924 -15.396 1.00 0.00 H new ATOM 0 HB2 LEU F 32 1.684 -0.100 -16.136 1.00 0.00 H new ATOM 0 HB3 LEU F 32 1.902 1.629 -15.952 1.00 0.00 H new ATOM 0 HG LEU F 32 2.663 1.054 -13.503 1.00 0.00 H new ATOM 0 HD11 LEU F 32 3.680 -1.205 -13.311 1.00 0.00 H new ATOM 0 HD12 LEU F 32 1.925 -1.315 -13.583 1.00 0.00 H new ATOM 0 HD13 LEU F 32 3.054 -1.622 -14.924 1.00 0.00 H new ATOM 0 HD21 LEU F 32 4.985 0.678 -14.298 1.00 0.00 H new ATOM 0 HD22 LEU F 32 4.363 0.262 -15.913 1.00 0.00 H new ATOM 0 HD23 LEU F 32 4.164 1.913 -15.281 1.00 0.00 H new ATOM 522 N ILE F 33 -0.210 -1.553 -14.519 1.00 0.00 N ATOM 523 CA ILE F 33 -0.454 -2.837 -13.793 1.00 0.00 C ATOM 524 C ILE F 33 0.682 -3.809 -14.117 1.00 0.00 C ATOM 525 O ILE F 33 1.503 -3.554 -14.976 1.00 0.00 O ATOM 526 CB ILE F 33 -1.819 -3.424 -14.214 1.00 0.00 C ATOM 527 CG1 ILE F 33 -2.928 -2.758 -13.397 1.00 0.00 C ATOM 528 CG2 ILE F 33 -1.865 -4.935 -13.968 1.00 0.00 C ATOM 529 CD1 ILE F 33 -4.270 -3.418 -13.726 1.00 0.00 C ATOM 0 H ILE F 33 -0.335 -1.597 -15.530 1.00 0.00 H new ATOM 0 HA ILE F 33 -0.478 -2.663 -12.717 1.00 0.00 H new ATOM 0 HB ILE F 33 -1.961 -3.236 -15.278 1.00 0.00 H new ATOM 0 HG12 ILE F 33 -2.716 -2.851 -12.332 1.00 0.00 H new ATOM 0 HG13 ILE F 33 -2.970 -1.692 -13.621 1.00 0.00 H new ATOM 0 HG21 ILE F 33 -2.837 -5.324 -14.273 1.00 0.00 H new ATOM 0 HG22 ILE F 33 -1.081 -5.422 -14.548 1.00 0.00 H new ATOM 0 HG23 ILE F 33 -1.710 -5.136 -12.908 1.00 0.00 H new ATOM 0 HD11 ILE F 33 -5.061 -2.944 -13.144 1.00 0.00 H new ATOM 0 HD12 ILE F 33 -4.482 -3.302 -14.789 1.00 0.00 H new ATOM 0 HD13 ILE F 33 -4.224 -4.479 -13.479 1.00 0.00 H new ATOM 541 N ARG F 34 0.746 -4.911 -13.431 1.00 0.00 N ATOM 542 CA ARG F 34 1.840 -5.891 -13.689 1.00 0.00 C ATOM 543 C ARG F 34 1.766 -7.029 -12.667 1.00 0.00 C ATOM 544 O ARG F 34 1.488 -6.816 -11.504 1.00 0.00 O ATOM 545 CB ARG F 34 3.188 -5.184 -13.561 1.00 0.00 C ATOM 546 CG ARG F 34 3.226 -4.393 -12.252 1.00 0.00 C ATOM 547 CD ARG F 34 4.232 -5.035 -11.296 1.00 0.00 C ATOM 548 NE ARG F 34 4.485 -4.118 -10.151 1.00 0.00 N ATOM 549 CZ ARG F 34 4.796 -4.604 -8.980 1.00 0.00 C ATOM 550 NH1 ARG F 34 5.164 -5.851 -8.870 1.00 0.00 N ATOM 551 NH2 ARG F 34 4.738 -3.844 -7.921 1.00 0.00 N ATOM 0 H ARG F 34 0.088 -5.179 -12.700 1.00 0.00 H new ATOM 0 HA ARG F 34 1.731 -6.301 -14.693 1.00 0.00 H new ATOM 0 HB2 ARG F 34 3.997 -5.914 -13.581 1.00 0.00 H new ATOM 0 HB3 ARG F 34 3.342 -4.515 -14.408 1.00 0.00 H new ATOM 0 HG2 ARG F 34 3.505 -3.358 -12.448 1.00 0.00 H new ATOM 0 HG3 ARG F 34 2.236 -4.375 -11.797 1.00 0.00 H new ATOM 0 HD2 ARG F 34 3.848 -5.989 -10.934 1.00 0.00 H new ATOM 0 HD3 ARG F 34 5.164 -5.245 -11.820 1.00 0.00 H new ATOM 0 HE ARG F 34 4.415 -3.109 -10.282 1.00 0.00 H new ATOM 0 HH11 ARG F 34 5.208 -6.445 -9.698 1.00 0.00 H new ATOM 0 HH12 ARG F 34 5.407 -6.232 -7.956 1.00 0.00 H new ATOM 0 HH21 ARG F 34 4.450 -2.870 -8.008 1.00 0.00 H new ATOM 0 HH22 ARG F 34 4.981 -4.224 -7.006 1.00 0.00 H new ATOM 565 N GLU F 35 2.004 -8.236 -13.096 1.00 0.00 N ATOM 566 CA GLU F 35 1.941 -9.397 -12.161 1.00 0.00 C ATOM 567 C GLU F 35 2.801 -9.134 -10.920 1.00 0.00 C ATOM 568 O GLU F 35 3.922 -8.675 -11.017 1.00 0.00 O ATOM 569 CB GLU F 35 2.461 -10.640 -12.878 1.00 0.00 C ATOM 570 CG GLU F 35 1.286 -11.387 -13.507 1.00 0.00 C ATOM 571 CD GLU F 35 1.704 -12.825 -13.821 1.00 0.00 C ATOM 572 OE1 GLU F 35 2.862 -13.146 -13.604 1.00 0.00 O ATOM 573 OE2 GLU F 35 0.860 -13.581 -14.273 1.00 0.00 O ATOM 0 H GLU F 35 2.241 -8.471 -14.060 1.00 0.00 H new ATOM 0 HA GLU F 35 0.908 -9.545 -11.847 1.00 0.00 H new ATOM 0 HB2 GLU F 35 3.180 -10.357 -13.646 1.00 0.00 H new ATOM 0 HB3 GLU F 35 2.984 -11.288 -12.175 1.00 0.00 H new ATOM 0 HG2 GLU F 35 0.434 -11.385 -12.827 1.00 0.00 H new ATOM 0 HG3 GLU F 35 0.967 -10.882 -14.419 1.00 0.00 H new ATOM 580 N SER F 36 2.286 -9.431 -9.755 1.00 0.00 N ATOM 581 CA SER F 36 3.067 -9.211 -8.513 1.00 0.00 C ATOM 582 C SER F 36 3.818 -10.493 -8.151 1.00 0.00 C ATOM 583 O SER F 36 3.244 -11.561 -8.078 1.00 0.00 O ATOM 584 CB SER F 36 2.109 -8.861 -7.378 1.00 0.00 C ATOM 585 OG SER F 36 1.489 -7.615 -7.648 1.00 0.00 O ATOM 0 H SER F 36 1.353 -9.818 -9.615 1.00 0.00 H new ATOM 0 HA SER F 36 3.778 -8.399 -8.667 1.00 0.00 H new ATOM 0 HB2 SER F 36 1.354 -9.640 -7.273 1.00 0.00 H new ATOM 0 HB3 SER F 36 2.650 -8.812 -6.433 1.00 0.00 H new ATOM 0 HG SER F 36 0.528 -7.682 -7.469 1.00 0.00 H new ATOM 591 N GLU F 37 5.094 -10.393 -7.908 1.00 0.00 N ATOM 592 CA GLU F 37 5.877 -11.604 -7.534 1.00 0.00 C ATOM 593 C GLU F 37 5.858 -11.755 -6.016 1.00 0.00 C ATOM 594 O GLU F 37 6.663 -12.457 -5.436 1.00 0.00 O ATOM 595 CB GLU F 37 7.317 -11.431 -7.988 1.00 0.00 C ATOM 596 CG GLU F 37 7.389 -11.498 -9.515 1.00 0.00 C ATOM 597 CD GLU F 37 8.688 -12.188 -9.934 1.00 0.00 C ATOM 598 OE1 GLU F 37 9.625 -12.170 -9.153 1.00 0.00 O ATOM 599 OE2 GLU F 37 8.724 -12.723 -11.031 1.00 0.00 O ATOM 0 H GLU F 37 5.629 -9.526 -7.952 1.00 0.00 H new ATOM 0 HA GLU F 37 5.442 -12.484 -8.007 1.00 0.00 H new ATOM 0 HB2 GLU F 37 7.706 -10.475 -7.638 1.00 0.00 H new ATOM 0 HB3 GLU F 37 7.942 -12.209 -7.551 1.00 0.00 H new ATOM 0 HG2 GLU F 37 6.531 -12.045 -9.907 1.00 0.00 H new ATOM 0 HG3 GLU F 37 7.346 -10.494 -9.936 1.00 0.00 H new ATOM 606 N THR F 38 4.942 -11.097 -5.372 1.00 0.00 N ATOM 607 CA THR F 38 4.855 -11.183 -3.890 1.00 0.00 C ATOM 608 C THR F 38 3.976 -12.369 -3.523 1.00 0.00 C ATOM 609 O THR F 38 4.247 -13.113 -2.602 1.00 0.00 O ATOM 610 CB THR F 38 4.226 -9.893 -3.349 1.00 0.00 C ATOM 611 OG1 THR F 38 4.537 -9.756 -1.971 1.00 0.00 O ATOM 612 CG2 THR F 38 2.703 -9.933 -3.531 1.00 0.00 C ATOM 0 H THR F 38 4.243 -10.498 -5.811 1.00 0.00 H new ATOM 0 HA THR F 38 5.848 -11.310 -3.460 1.00 0.00 H new ATOM 0 HB THR F 38 4.627 -9.043 -3.900 1.00 0.00 H new ATOM 0 HG1 THR F 38 4.137 -8.931 -1.626 1.00 0.00 H new ATOM 0 HG21 THR F 38 2.266 -9.013 -3.144 1.00 0.00 H new ATOM 0 HG22 THR F 38 2.466 -10.030 -4.590 1.00 0.00 H new ATOM 0 HG23 THR F 38 2.294 -10.785 -2.988 1.00 0.00 H new ATOM 620 N THR F 39 2.917 -12.534 -4.251 1.00 0.00 N ATOM 621 CA THR F 39 1.985 -13.652 -3.984 1.00 0.00 C ATOM 622 C THR F 39 2.237 -14.747 -5.025 1.00 0.00 C ATOM 623 O THR F 39 2.983 -14.548 -5.962 1.00 0.00 O ATOM 624 CB THR F 39 0.553 -13.112 -4.087 1.00 0.00 C ATOM 625 OG1 THR F 39 0.217 -12.445 -2.879 1.00 0.00 O ATOM 626 CG2 THR F 39 -0.430 -14.251 -4.326 1.00 0.00 C ATOM 0 H THR F 39 2.654 -11.933 -5.032 1.00 0.00 H new ATOM 0 HA THR F 39 2.134 -14.073 -2.990 1.00 0.00 H new ATOM 0 HB THR F 39 0.496 -12.418 -4.925 1.00 0.00 H new ATOM 0 HG1 THR F 39 -0.697 -12.097 -2.941 1.00 0.00 H new ATOM 0 HG21 THR F 39 -1.441 -13.850 -4.397 1.00 0.00 H new ATOM 0 HG22 THR F 39 -0.176 -14.762 -5.255 1.00 0.00 H new ATOM 0 HG23 THR F 39 -0.377 -14.957 -3.498 1.00 0.00 H new ATOM 634 N LYS F 40 1.633 -15.898 -4.864 1.00 0.00 N ATOM 635 CA LYS F 40 1.842 -17.007 -5.844 1.00 0.00 C ATOM 636 C LYS F 40 1.934 -16.422 -7.252 1.00 0.00 C ATOM 637 O LYS F 40 2.626 -16.930 -8.112 1.00 0.00 O ATOM 638 CB LYS F 40 0.657 -17.968 -5.777 1.00 0.00 C ATOM 639 CG LYS F 40 0.251 -18.179 -4.320 1.00 0.00 C ATOM 640 CD LYS F 40 -0.622 -19.430 -4.207 1.00 0.00 C ATOM 641 CE LYS F 40 -1.850 -19.279 -5.107 1.00 0.00 C ATOM 642 NZ LYS F 40 -1.985 -20.486 -5.971 1.00 0.00 N ATOM 0 H LYS F 40 1.002 -16.118 -4.093 1.00 0.00 H new ATOM 0 HA LYS F 40 2.762 -17.540 -5.605 1.00 0.00 H new ATOM 0 HB2 LYS F 40 -0.182 -17.566 -6.345 1.00 0.00 H new ATOM 0 HB3 LYS F 40 0.923 -18.922 -6.233 1.00 0.00 H new ATOM 0 HG2 LYS F 40 1.139 -18.285 -3.696 1.00 0.00 H new ATOM 0 HG3 LYS F 40 -0.294 -17.309 -3.954 1.00 0.00 H new ATOM 0 HD2 LYS F 40 -0.051 -20.312 -4.498 1.00 0.00 H new ATOM 0 HD3 LYS F 40 -0.932 -19.578 -3.173 1.00 0.00 H new ATOM 0 HE2 LYS F 40 -2.746 -19.152 -4.499 1.00 0.00 H new ATOM 0 HE3 LYS F 40 -1.754 -18.386 -5.724 1.00 0.00 H new ATOM 0 HZ1 LYS F 40 -2.820 -20.383 -6.583 1.00 0.00 H new ATOM 0 HZ2 LYS F 40 -1.134 -20.588 -6.560 1.00 0.00 H new ATOM 0 HZ3 LYS F 40 -2.095 -21.330 -5.374 1.00 0.00 H new ATOM 656 N GLY F 41 1.239 -15.348 -7.475 1.00 0.00 N ATOM 657 CA GLY F 41 1.261 -14.690 -8.801 1.00 0.00 C ATOM 658 C GLY F 41 0.030 -13.791 -8.924 1.00 0.00 C ATOM 659 O GLY F 41 -0.766 -13.923 -9.831 1.00 0.00 O ATOM 0 H GLY F 41 0.647 -14.892 -6.781 1.00 0.00 H new ATOM 0 HA2 GLY F 41 2.171 -14.102 -8.916 1.00 0.00 H new ATOM 0 HA3 GLY F 41 1.263 -15.438 -9.594 1.00 0.00 H new ATOM 663 N ALA F 42 -0.117 -12.873 -8.012 1.00 0.00 N ATOM 664 CA ALA F 42 -1.277 -11.946 -8.052 1.00 0.00 C ATOM 665 C ALA F 42 -0.994 -10.876 -9.086 1.00 0.00 C ATOM 666 O ALA F 42 -0.196 -11.065 -9.981 1.00 0.00 O ATOM 667 CB ALA F 42 -1.426 -11.279 -6.687 1.00 0.00 C ATOM 0 H ALA F 42 0.525 -12.725 -7.233 1.00 0.00 H new ATOM 0 HA ALA F 42 -2.188 -12.490 -8.302 1.00 0.00 H new ATOM 0 HB1 ALA F 42 -2.275 -10.596 -6.706 1.00 0.00 H new ATOM 0 HB2 ALA F 42 -1.591 -12.041 -5.926 1.00 0.00 H new ATOM 0 HB3 ALA F 42 -0.518 -10.722 -6.453 1.00 0.00 H new ATOM 673 N TYR F 43 -1.624 -9.752 -8.969 1.00 0.00 N ATOM 674 CA TYR F 43 -1.352 -8.675 -9.947 1.00 0.00 C ATOM 675 C TYR F 43 -0.975 -7.396 -9.204 1.00 0.00 C ATOM 676 O TYR F 43 -0.800 -7.402 -8.002 1.00 0.00 O ATOM 677 CB TYR F 43 -2.567 -8.444 -10.842 1.00 0.00 C ATOM 678 CG TYR F 43 -2.161 -8.784 -12.251 1.00 0.00 C ATOM 679 CD1 TYR F 43 -0.996 -8.223 -12.781 1.00 0.00 C ATOM 680 CD2 TYR F 43 -2.923 -9.676 -13.015 1.00 0.00 C ATOM 681 CE1 TYR F 43 -0.590 -8.548 -14.079 1.00 0.00 C ATOM 682 CE2 TYR F 43 -2.515 -10.007 -14.313 1.00 0.00 C ATOM 683 CZ TYR F 43 -1.349 -9.442 -14.845 1.00 0.00 C ATOM 684 OH TYR F 43 -0.944 -9.772 -16.122 1.00 0.00 O ATOM 0 H TYR F 43 -2.309 -9.532 -8.247 1.00 0.00 H new ATOM 0 HA TYR F 43 -0.520 -8.972 -10.585 1.00 0.00 H new ATOM 0 HB2 TYR F 43 -3.403 -9.067 -10.523 1.00 0.00 H new ATOM 0 HB3 TYR F 43 -2.899 -7.408 -10.778 1.00 0.00 H new ATOM 0 HD1 TYR F 43 -0.409 -7.538 -12.188 1.00 0.00 H new ATOM 0 HD2 TYR F 43 -3.824 -10.108 -12.604 1.00 0.00 H new ATOM 0 HE1 TYR F 43 0.308 -8.110 -14.490 1.00 0.00 H new ATOM 0 HE2 TYR F 43 -3.099 -10.697 -14.903 1.00 0.00 H new ATOM 0 HH TYR F 43 -0.772 -8.953 -16.632 1.00 0.00 H new ATOM 694 N SER F 44 -0.817 -6.306 -9.902 1.00 0.00 N ATOM 695 CA SER F 44 -0.418 -5.050 -9.213 1.00 0.00 C ATOM 696 C SER F 44 -0.776 -3.830 -10.048 1.00 0.00 C ATOM 697 O SER F 44 -1.201 -3.925 -11.183 1.00 0.00 O ATOM 698 CB SER F 44 1.086 -5.063 -8.998 1.00 0.00 C ATOM 699 OG SER F 44 1.564 -3.729 -8.894 1.00 0.00 O ATOM 0 H SER F 44 -0.946 -6.231 -10.911 1.00 0.00 H new ATOM 0 HA SER F 44 -0.949 -4.994 -8.263 1.00 0.00 H new ATOM 0 HB2 SER F 44 1.329 -5.619 -8.092 1.00 0.00 H new ATOM 0 HB3 SER F 44 1.578 -5.573 -9.827 1.00 0.00 H new ATOM 0 HG SER F 44 1.954 -3.454 -9.750 1.00 0.00 H new ATOM 705 N LEU F 45 -0.582 -2.681 -9.475 1.00 0.00 N ATOM 706 CA LEU F 45 -0.879 -1.412 -10.192 1.00 0.00 C ATOM 707 C LEU F 45 0.192 -0.383 -9.862 1.00 0.00 C ATOM 708 O LEU F 45 -0.020 0.515 -9.071 1.00 0.00 O ATOM 709 CB LEU F 45 -2.221 -0.854 -9.737 1.00 0.00 C ATOM 710 CG LEU F 45 -3.029 -0.396 -10.948 1.00 0.00 C ATOM 711 CD1 LEU F 45 -4.070 0.618 -10.491 1.00 0.00 C ATOM 712 CD2 LEU F 45 -2.116 0.265 -11.987 1.00 0.00 C ATOM 0 H LEU F 45 -0.225 -2.563 -8.527 1.00 0.00 H new ATOM 0 HA LEU F 45 -0.903 -1.615 -11.263 1.00 0.00 H new ATOM 0 HB2 LEU F 45 -2.774 -1.615 -9.187 1.00 0.00 H new ATOM 0 HB3 LEU F 45 -2.065 -0.018 -9.055 1.00 0.00 H new ATOM 0 HG LEU F 45 -3.510 -1.263 -11.401 1.00 0.00 H new ATOM 0 HD11 LEU F 45 -4.653 0.952 -11.349 1.00 0.00 H new ATOM 0 HD12 LEU F 45 -4.733 0.155 -9.760 1.00 0.00 H new ATOM 0 HD13 LEU F 45 -3.570 1.473 -10.037 1.00 0.00 H new ATOM 0 HD21 LEU F 45 -2.711 0.585 -12.843 1.00 0.00 H new ATOM 0 HD22 LEU F 45 -1.626 1.131 -11.542 1.00 0.00 H new ATOM 0 HD23 LEU F 45 -1.362 -0.450 -12.316 1.00 0.00 H new ATOM 724 N SER F 46 1.336 -0.491 -10.457 1.00 0.00 N ATOM 725 CA SER F 46 2.395 0.499 -10.155 1.00 0.00 C ATOM 726 C SER F 46 1.855 1.897 -10.405 1.00 0.00 C ATOM 727 O SER F 46 0.828 2.087 -11.024 1.00 0.00 O ATOM 728 CB SER F 46 3.617 0.276 -11.039 1.00 0.00 C ATOM 729 OG SER F 46 4.471 1.406 -10.957 1.00 0.00 O ATOM 0 H SER F 46 1.584 -1.213 -11.133 1.00 0.00 H new ATOM 0 HA SER F 46 2.691 0.383 -9.112 1.00 0.00 H new ATOM 0 HB2 SER F 46 4.150 -0.620 -10.722 1.00 0.00 H new ATOM 0 HB3 SER F 46 3.308 0.114 -12.072 1.00 0.00 H new ATOM 0 HG SER F 46 4.945 1.520 -11.807 1.00 0.00 H new ATOM 735 N ILE F 47 2.554 2.865 -9.924 1.00 0.00 N ATOM 736 CA ILE F 47 2.122 4.278 -10.114 1.00 0.00 C ATOM 737 C ILE F 47 3.335 5.205 -10.011 1.00 0.00 C ATOM 738 O ILE F 47 4.240 4.975 -9.238 1.00 0.00 O ATOM 739 CB ILE F 47 1.085 4.651 -9.044 1.00 0.00 C ATOM 740 CG1 ILE F 47 1.788 5.016 -7.732 1.00 0.00 C ATOM 741 CG2 ILE F 47 0.153 3.463 -8.801 1.00 0.00 C ATOM 742 CD1 ILE F 47 0.748 5.477 -6.708 1.00 0.00 C ATOM 0 H ILE F 47 3.420 2.747 -9.398 1.00 0.00 H new ATOM 0 HA ILE F 47 1.671 4.388 -11.100 1.00 0.00 H new ATOM 0 HB ILE F 47 0.510 5.508 -9.393 1.00 0.00 H new ATOM 0 HG12 ILE F 47 2.335 4.155 -7.348 1.00 0.00 H new ATOM 0 HG13 ILE F 47 2.518 5.806 -7.906 1.00 0.00 H new ATOM 0 HG21 ILE F 47 -0.583 3.727 -8.042 1.00 0.00 H new ATOM 0 HG22 ILE F 47 -0.359 3.206 -9.729 1.00 0.00 H new ATOM 0 HG23 ILE F 47 0.736 2.607 -8.459 1.00 0.00 H new ATOM 0 HD11 ILE F 47 1.247 5.737 -5.774 1.00 0.00 H new ATOM 0 HD12 ILE F 47 0.221 6.350 -7.093 1.00 0.00 H new ATOM 0 HD13 ILE F 47 0.035 4.673 -6.527 1.00 0.00 H new ATOM 754 N ARG F 48 3.353 6.254 -10.784 1.00 0.00 N ATOM 755 CA ARG F 48 4.500 7.202 -10.727 1.00 0.00 C ATOM 756 C ARG F 48 4.083 8.431 -9.922 1.00 0.00 C ATOM 757 O ARG F 48 3.045 9.013 -10.163 1.00 0.00 O ATOM 758 CB ARG F 48 4.887 7.626 -12.145 1.00 0.00 C ATOM 759 CG ARG F 48 6.403 7.512 -12.316 1.00 0.00 C ATOM 760 CD ARG F 48 7.031 8.905 -12.236 1.00 0.00 C ATOM 761 NE ARG F 48 7.571 9.284 -13.572 1.00 0.00 N ATOM 762 CZ ARG F 48 8.039 10.487 -13.770 1.00 0.00 C ATOM 763 NH1 ARG F 48 7.761 11.442 -12.925 1.00 0.00 N ATOM 764 NH2 ARG F 48 8.784 10.734 -14.812 1.00 0.00 N ATOM 0 H ARG F 48 2.623 6.496 -11.453 1.00 0.00 H new ATOM 0 HA ARG F 48 5.355 6.720 -10.253 1.00 0.00 H new ATOM 0 HB2 ARG F 48 4.380 6.996 -12.876 1.00 0.00 H new ATOM 0 HB3 ARG F 48 4.566 8.651 -12.330 1.00 0.00 H new ATOM 0 HG2 ARG F 48 6.820 6.868 -11.541 1.00 0.00 H new ATOM 0 HG3 ARG F 48 6.638 7.050 -13.275 1.00 0.00 H new ATOM 0 HD2 ARG F 48 6.287 9.633 -11.913 1.00 0.00 H new ATOM 0 HD3 ARG F 48 7.829 8.914 -11.494 1.00 0.00 H new ATOM 0 HE ARG F 48 7.575 8.604 -14.332 1.00 0.00 H new ATOM 0 HH11 ARG F 48 7.178 11.249 -12.110 1.00 0.00 H new ATOM 0 HH12 ARG F 48 8.126 12.382 -13.079 1.00 0.00 H new ATOM 0 HH21 ARG F 48 9.001 9.987 -15.472 1.00 0.00 H new ATOM 0 HH22 ARG F 48 9.149 11.674 -14.966 1.00 0.00 H new ATOM 778 N ASP F 49 4.870 8.828 -8.960 1.00 0.00 N ATOM 779 CA ASP F 49 4.482 10.017 -8.150 1.00 0.00 C ATOM 780 C ASP F 49 5.725 10.809 -7.727 1.00 0.00 C ATOM 781 O ASP F 49 6.067 10.865 -6.562 1.00 0.00 O ATOM 782 CB ASP F 49 3.729 9.553 -6.902 1.00 0.00 C ATOM 783 CG ASP F 49 3.502 10.747 -5.971 1.00 0.00 C ATOM 784 OD1 ASP F 49 2.601 11.522 -6.244 1.00 0.00 O ATOM 785 OD2 ASP F 49 4.232 10.864 -5.001 1.00 0.00 O ATOM 0 H ASP F 49 5.753 8.388 -8.702 1.00 0.00 H new ATOM 0 HA ASP F 49 3.844 10.662 -8.754 1.00 0.00 H new ATOM 0 HB2 ASP F 49 2.773 9.111 -7.184 1.00 0.00 H new ATOM 0 HB3 ASP F 49 4.299 8.779 -6.387 1.00 0.00 H new ATOM 790 N TRP F 50 6.391 11.440 -8.657 1.00 0.00 N ATOM 791 CA TRP F 50 7.593 12.246 -8.292 1.00 0.00 C ATOM 792 C TRP F 50 7.149 13.376 -7.352 1.00 0.00 C ATOM 793 O TRP F 50 5.973 13.645 -7.211 1.00 0.00 O ATOM 794 CB TRP F 50 8.221 12.819 -9.573 1.00 0.00 C ATOM 795 CG TRP F 50 9.101 13.978 -9.236 1.00 0.00 C ATOM 796 CD1 TRP F 50 10.450 13.953 -9.179 1.00 0.00 C ATOM 797 CD2 TRP F 50 8.708 15.334 -8.922 1.00 0.00 C ATOM 798 NE1 TRP F 50 10.906 15.209 -8.818 1.00 0.00 N ATOM 799 CE2 TRP F 50 9.865 16.099 -8.662 1.00 0.00 C ATOM 800 CE3 TRP F 50 7.463 15.959 -8.835 1.00 0.00 C ATOM 801 CZ2 TRP F 50 9.786 17.449 -8.327 1.00 0.00 C ATOM 802 CZ3 TRP F 50 7.371 17.319 -8.502 1.00 0.00 C ATOM 803 CH2 TRP F 50 8.533 18.064 -8.249 1.00 0.00 C ATOM 0 H TRP F 50 6.156 11.433 -9.650 1.00 0.00 H new ATOM 0 HA TRP F 50 8.337 11.630 -7.787 1.00 0.00 H new ATOM 0 HB2 TRP F 50 8.800 12.048 -10.081 1.00 0.00 H new ATOM 0 HB3 TRP F 50 7.438 13.135 -10.262 1.00 0.00 H new ATOM 0 HD1 TRP F 50 11.072 13.093 -9.382 1.00 0.00 H new ATOM 0 HE1 TRP F 50 11.889 15.446 -8.684 1.00 0.00 H new ATOM 0 HE3 TRP F 50 6.564 15.392 -9.025 1.00 0.00 H new ATOM 0 HZ2 TRP F 50 10.684 18.015 -8.129 1.00 0.00 H new ATOM 0 HZ3 TRP F 50 6.403 17.794 -8.440 1.00 0.00 H new ATOM 0 HH2 TRP F 50 8.459 19.111 -7.994 1.00 0.00 H new ATOM 814 N ASP F 51 8.072 14.028 -6.699 1.00 0.00 N ATOM 815 CA ASP F 51 7.684 15.124 -5.763 1.00 0.00 C ATOM 816 C ASP F 51 8.742 16.233 -5.783 1.00 0.00 C ATOM 817 O ASP F 51 9.892 16.003 -6.101 1.00 0.00 O ATOM 818 CB ASP F 51 7.565 14.557 -4.346 1.00 0.00 C ATOM 819 CG ASP F 51 6.271 15.059 -3.702 1.00 0.00 C ATOM 820 OD1 ASP F 51 5.607 15.879 -4.315 1.00 0.00 O ATOM 821 OD2 ASP F 51 5.966 14.614 -2.608 1.00 0.00 O ATOM 0 H ASP F 51 9.074 13.851 -6.772 1.00 0.00 H new ATOM 0 HA ASP F 51 6.727 15.542 -6.076 1.00 0.00 H new ATOM 0 HB2 ASP F 51 7.569 13.467 -4.377 1.00 0.00 H new ATOM 0 HB3 ASP F 51 8.424 14.862 -3.748 1.00 0.00 H new ATOM 826 N ASP F 52 8.357 17.435 -5.443 1.00 0.00 N ATOM 827 CA ASP F 52 9.331 18.567 -5.441 1.00 0.00 C ATOM 828 C ASP F 52 10.083 18.611 -4.109 1.00 0.00 C ATOM 829 O ASP F 52 10.313 19.669 -3.557 1.00 0.00 O ATOM 830 CB ASP F 52 8.571 19.886 -5.640 1.00 0.00 C ATOM 831 CG ASP F 52 7.878 20.291 -4.336 1.00 0.00 C ATOM 832 OD1 ASP F 52 6.880 19.673 -4.003 1.00 0.00 O ATOM 833 OD2 ASP F 52 8.359 21.210 -3.694 1.00 0.00 O ATOM 0 H ASP F 52 7.407 17.683 -5.166 1.00 0.00 H new ATOM 0 HA ASP F 52 10.048 18.425 -6.250 1.00 0.00 H new ATOM 0 HB2 ASP F 52 9.261 20.669 -5.954 1.00 0.00 H new ATOM 0 HB3 ASP F 52 7.833 19.774 -6.434 1.00 0.00 H new ATOM 838 N MET F 53 10.473 17.483 -3.584 1.00 0.00 N ATOM 839 CA MET F 53 11.207 17.494 -2.294 1.00 0.00 C ATOM 840 C MET F 53 11.949 16.173 -2.090 1.00 0.00 C ATOM 841 O MET F 53 12.271 15.804 -0.978 1.00 0.00 O ATOM 842 CB MET F 53 10.222 17.715 -1.142 1.00 0.00 C ATOM 843 CG MET F 53 9.419 16.435 -0.895 1.00 0.00 C ATOM 844 SD MET F 53 7.657 16.779 -1.118 1.00 0.00 S ATOM 845 CE MET F 53 7.762 17.343 -2.833 1.00 0.00 C ATOM 0 H MET F 53 10.315 16.561 -3.991 1.00 0.00 H new ATOM 0 HA MET F 53 11.935 18.305 -2.312 1.00 0.00 H new ATOM 0 HB2 MET F 53 10.762 17.997 -0.238 1.00 0.00 H new ATOM 0 HB3 MET F 53 9.548 18.538 -1.380 1.00 0.00 H new ATOM 0 HG2 MET F 53 9.738 15.653 -1.584 1.00 0.00 H new ATOM 0 HG3 MET F 53 9.604 16.065 0.114 1.00 0.00 H new ATOM 0 HE1 MET F 53 6.761 17.394 -3.261 1.00 0.00 H new ATOM 0 HE2 MET F 53 8.220 18.331 -2.864 1.00 0.00 H new ATOM 0 HE3 MET F 53 8.368 16.644 -3.409 1.00 0.00 H new ATOM 855 N LYS F 54 12.231 15.453 -3.141 1.00 0.00 N ATOM 856 CA LYS F 54 12.954 14.169 -2.965 1.00 0.00 C ATOM 857 C LYS F 54 13.342 13.570 -4.319 1.00 0.00 C ATOM 858 O LYS F 54 14.334 12.876 -4.431 1.00 0.00 O ATOM 859 CB LYS F 54 12.062 13.181 -2.209 1.00 0.00 C ATOM 860 CG LYS F 54 10.659 13.191 -2.818 1.00 0.00 C ATOM 861 CD LYS F 54 9.635 12.817 -1.745 1.00 0.00 C ATOM 862 CE LYS F 54 8.905 11.538 -2.161 1.00 0.00 C ATOM 863 NZ LYS F 54 7.998 11.105 -1.060 1.00 0.00 N ATOM 0 H LYS F 54 11.994 15.697 -4.103 1.00 0.00 H new ATOM 0 HA LYS F 54 13.864 14.360 -2.397 1.00 0.00 H new ATOM 0 HB2 LYS F 54 12.486 12.178 -2.262 1.00 0.00 H new ATOM 0 HB3 LYS F 54 12.014 13.452 -1.154 1.00 0.00 H new ATOM 0 HG2 LYS F 54 10.434 14.178 -3.223 1.00 0.00 H new ATOM 0 HG3 LYS F 54 10.606 12.486 -3.648 1.00 0.00 H new ATOM 0 HD2 LYS F 54 10.134 12.669 -0.787 1.00 0.00 H new ATOM 0 HD3 LYS F 54 8.920 13.629 -1.610 1.00 0.00 H new ATOM 0 HE2 LYS F 54 8.332 11.713 -3.072 1.00 0.00 H new ATOM 0 HE3 LYS F 54 9.625 10.751 -2.384 1.00 0.00 H new ATOM 0 HZ1 LYS F 54 7.501 10.236 -1.341 1.00 0.00 H new ATOM 0 HZ2 LYS F 54 8.556 10.922 -0.202 1.00 0.00 H new ATOM 0 HZ3 LYS F 54 7.303 11.854 -0.868 1.00 0.00 H new ATOM 877 N GLY F 55 12.577 13.809 -5.346 1.00 0.00 N ATOM 878 CA GLY F 55 12.917 13.232 -6.660 1.00 0.00 C ATOM 879 C GLY F 55 11.732 12.418 -7.158 1.00 0.00 C ATOM 880 O GLY F 55 10.641 12.511 -6.634 1.00 0.00 O ATOM 0 H GLY F 55 11.732 14.380 -5.325 1.00 0.00 H new ATOM 0 HA2 GLY F 55 13.156 14.024 -7.370 1.00 0.00 H new ATOM 0 HA3 GLY F 55 13.801 12.600 -6.578 1.00 0.00 H new ATOM 884 N ASP F 56 11.927 11.626 -8.166 1.00 0.00 N ATOM 885 CA ASP F 56 10.797 10.821 -8.691 1.00 0.00 C ATOM 886 C ASP F 56 10.575 9.612 -7.783 1.00 0.00 C ATOM 887 O ASP F 56 11.368 9.329 -6.907 1.00 0.00 O ATOM 888 CB ASP F 56 11.129 10.348 -10.106 1.00 0.00 C ATOM 889 CG ASP F 56 12.579 9.864 -10.158 1.00 0.00 C ATOM 890 OD1 ASP F 56 13.060 9.385 -9.145 1.00 0.00 O ATOM 891 OD2 ASP F 56 13.184 9.981 -11.212 1.00 0.00 O ATOM 0 H ASP F 56 12.817 11.500 -8.649 1.00 0.00 H new ATOM 0 HA ASP F 56 9.891 11.427 -8.715 1.00 0.00 H new ATOM 0 HB2 ASP F 56 10.455 9.543 -10.398 1.00 0.00 H new ATOM 0 HB3 ASP F 56 10.981 11.161 -10.816 1.00 0.00 H new ATOM 896 N HIS F 57 9.507 8.895 -7.986 1.00 0.00 N ATOM 897 CA HIS F 57 9.234 7.703 -7.139 1.00 0.00 C ATOM 898 C HIS F 57 8.174 6.849 -7.826 1.00 0.00 C ATOM 899 O HIS F 57 7.676 7.192 -8.880 1.00 0.00 O ATOM 900 CB HIS F 57 8.721 8.149 -5.768 1.00 0.00 C ATOM 901 CG HIS F 57 9.875 8.637 -4.934 1.00 0.00 C ATOM 902 ND1 HIS F 57 10.218 9.977 -4.859 1.00 0.00 N ATOM 903 CD2 HIS F 57 10.773 7.974 -4.135 1.00 0.00 C ATOM 904 CE1 HIS F 57 11.282 10.078 -4.041 1.00 0.00 C ATOM 905 NE2 HIS F 57 11.662 8.886 -3.573 1.00 0.00 N ATOM 0 H HIS F 57 8.809 9.084 -8.705 1.00 0.00 H new ATOM 0 HA HIS F 57 10.150 7.127 -7.005 1.00 0.00 H new ATOM 0 HB2 HIS F 57 7.982 8.942 -5.885 1.00 0.00 H new ATOM 0 HB3 HIS F 57 8.222 7.319 -5.267 1.00 0.00 H new ATOM 0 HD1 HIS F 57 9.750 10.747 -5.337 1.00 0.00 H new ATOM 0 HD2 HIS F 57 10.788 6.907 -3.968 1.00 0.00 H new ATOM 0 HE1 HIS F 57 11.769 11.009 -3.793 1.00 0.00 H new ATOM 913 N VAL F 58 7.822 5.740 -7.246 1.00 0.00 N ATOM 914 CA VAL F 58 6.797 4.877 -7.882 1.00 0.00 C ATOM 915 C VAL F 58 6.171 3.952 -6.835 1.00 0.00 C ATOM 916 O VAL F 58 6.836 3.139 -6.224 1.00 0.00 O ATOM 917 CB VAL F 58 7.463 4.066 -9.007 1.00 0.00 C ATOM 918 CG1 VAL F 58 6.827 2.677 -9.137 1.00 0.00 C ATOM 919 CG2 VAL F 58 7.282 4.815 -10.321 1.00 0.00 C ATOM 0 H VAL F 58 8.198 5.395 -6.363 1.00 0.00 H new ATOM 0 HA VAL F 58 6.001 5.489 -8.307 1.00 0.00 H new ATOM 0 HB VAL F 58 8.520 3.943 -8.771 1.00 0.00 H new ATOM 0 HG11 VAL F 58 7.317 2.126 -9.940 1.00 0.00 H new ATOM 0 HG12 VAL F 58 6.945 2.134 -8.199 1.00 0.00 H new ATOM 0 HG13 VAL F 58 5.766 2.782 -9.365 1.00 0.00 H new ATOM 0 HG21 VAL F 58 7.750 4.251 -11.128 1.00 0.00 H new ATOM 0 HG22 VAL F 58 6.219 4.933 -10.529 1.00 0.00 H new ATOM 0 HG23 VAL F 58 7.748 5.797 -10.247 1.00 0.00 H new ATOM 929 N LYS F 59 4.886 4.063 -6.648 1.00 0.00 N ATOM 930 CA LYS F 59 4.190 3.187 -5.668 1.00 0.00 C ATOM 931 C LYS F 59 3.534 2.047 -6.441 1.00 0.00 C ATOM 932 O LYS F 59 3.775 1.876 -7.615 1.00 0.00 O ATOM 933 CB LYS F 59 3.119 3.992 -4.928 1.00 0.00 C ATOM 934 CG LYS F 59 3.394 3.944 -3.424 1.00 0.00 C ATOM 935 CD LYS F 59 3.149 2.526 -2.905 1.00 0.00 C ATOM 936 CE LYS F 59 3.257 2.514 -1.378 1.00 0.00 C ATOM 937 NZ LYS F 59 4.485 3.248 -0.962 1.00 0.00 N ATOM 0 H LYS F 59 4.285 4.727 -7.136 1.00 0.00 H new ATOM 0 HA LYS F 59 4.898 2.794 -4.938 1.00 0.00 H new ATOM 0 HB2 LYS F 59 3.120 5.025 -5.276 1.00 0.00 H new ATOM 0 HB3 LYS F 59 2.131 3.585 -5.141 1.00 0.00 H new ATOM 0 HG2 LYS F 59 4.422 4.244 -3.222 1.00 0.00 H new ATOM 0 HG3 LYS F 59 2.748 4.650 -2.903 1.00 0.00 H new ATOM 0 HD2 LYS F 59 2.162 2.180 -3.213 1.00 0.00 H new ATOM 0 HD3 LYS F 59 3.877 1.839 -3.337 1.00 0.00 H new ATOM 0 HE2 LYS F 59 2.375 2.979 -0.937 1.00 0.00 H new ATOM 0 HE3 LYS F 59 3.293 1.487 -1.013 1.00 0.00 H new ATOM 0 HZ1 LYS F 59 4.767 2.941 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS F 59 5.254 3.046 -1.633 1.00 0.00 H new ATOM 0 HZ3 LYS F 59 4.292 4.270 -0.953 1.00 0.00 H new ATOM 951 N HIS F 60 2.716 1.259 -5.811 1.00 0.00 N ATOM 952 CA HIS F 60 2.067 0.144 -6.557 1.00 0.00 C ATOM 953 C HIS F 60 0.826 -0.338 -5.818 1.00 0.00 C ATOM 954 O HIS F 60 0.755 -0.300 -4.606 1.00 0.00 O ATOM 955 CB HIS F 60 3.031 -1.037 -6.695 1.00 0.00 C ATOM 956 CG HIS F 60 4.441 -0.550 -6.887 1.00 0.00 C ATOM 957 ND1 HIS F 60 5.067 -0.574 -8.123 1.00 0.00 N ATOM 958 CD2 HIS F 60 5.363 -0.031 -6.012 1.00 0.00 C ATOM 959 CE1 HIS F 60 6.309 -0.085 -7.960 1.00 0.00 C ATOM 960 NE2 HIS F 60 6.543 0.263 -6.691 1.00 0.00 N ATOM 0 H HIS F 60 2.468 1.333 -4.824 1.00 0.00 H new ATOM 0 HA HIS F 60 1.792 0.518 -7.543 1.00 0.00 H new ATOM 0 HB2 HIS F 60 2.975 -1.665 -5.806 1.00 0.00 H new ATOM 0 HB3 HIS F 60 2.736 -1.657 -7.542 1.00 0.00 H new ATOM 0 HD2 HIS F 60 5.198 0.126 -4.956 1.00 0.00 H new ATOM 0 HE1 HIS F 60 7.030 0.014 -8.758 1.00 0.00 H new ATOM 0 HE2 HIS F 60 7.400 0.658 -6.304 1.00 0.00 H new ATOM 968 N TYR F 61 -0.144 -0.820 -6.543 1.00 0.00 N ATOM 969 CA TYR F 61 -1.372 -1.342 -5.876 1.00 0.00 C ATOM 970 C TYR F 61 -1.498 -2.836 -6.181 1.00 0.00 C ATOM 971 O TYR F 61 -2.014 -3.232 -7.209 1.00 0.00 O ATOM 972 CB TYR F 61 -2.613 -0.601 -6.382 1.00 0.00 C ATOM 973 CG TYR F 61 -2.625 0.794 -5.814 1.00 0.00 C ATOM 974 CD1 TYR F 61 -1.709 1.748 -6.272 1.00 0.00 C ATOM 975 CD2 TYR F 61 -3.550 1.130 -4.821 1.00 0.00 C ATOM 976 CE1 TYR F 61 -1.720 3.041 -5.736 1.00 0.00 C ATOM 977 CE2 TYR F 61 -3.563 2.421 -4.287 1.00 0.00 C ATOM 978 CZ TYR F 61 -2.649 3.379 -4.744 1.00 0.00 C ATOM 979 OH TYR F 61 -2.660 4.652 -4.213 1.00 0.00 O ATOM 0 H TYR F 61 -0.142 -0.876 -7.561 1.00 0.00 H new ATOM 0 HA TYR F 61 -1.295 -1.185 -4.800 1.00 0.00 H new ATOM 0 HB2 TYR F 61 -2.609 -0.563 -7.471 1.00 0.00 H new ATOM 0 HB3 TYR F 61 -3.516 -1.135 -6.085 1.00 0.00 H new ATOM 0 HD1 TYR F 61 -0.994 1.487 -7.038 1.00 0.00 H new ATOM 0 HD2 TYR F 61 -4.254 0.392 -4.467 1.00 0.00 H new ATOM 0 HE1 TYR F 61 -1.013 3.778 -6.087 1.00 0.00 H new ATOM 0 HE2 TYR F 61 -4.279 2.681 -3.521 1.00 0.00 H new ATOM 0 HH TYR F 61 -3.028 4.625 -3.305 1.00 0.00 H new ATOM 989 N LYS F 62 -1.016 -3.667 -5.297 1.00 0.00 N ATOM 990 CA LYS F 62 -1.090 -5.136 -5.527 1.00 0.00 C ATOM 991 C LYS F 62 -2.544 -5.550 -5.748 1.00 0.00 C ATOM 992 O LYS F 62 -3.353 -5.541 -4.842 1.00 0.00 O ATOM 993 CB LYS F 62 -0.521 -5.867 -4.311 1.00 0.00 C ATOM 994 CG LYS F 62 -0.283 -7.336 -4.655 1.00 0.00 C ATOM 995 CD LYS F 62 -1.401 -8.186 -4.056 1.00 0.00 C ATOM 996 CE LYS F 62 -1.271 -8.192 -2.530 1.00 0.00 C ATOM 997 NZ LYS F 62 -2.605 -7.927 -1.918 1.00 0.00 N ATOM 0 H LYS F 62 -0.572 -3.389 -4.422 1.00 0.00 H new ATOM 0 HA LYS F 62 -0.508 -5.397 -6.411 1.00 0.00 H new ATOM 0 HB2 LYS F 62 0.414 -5.401 -4.000 1.00 0.00 H new ATOM 0 HB3 LYS F 62 -1.212 -5.788 -3.472 1.00 0.00 H new ATOM 0 HG2 LYS F 62 -0.252 -7.467 -5.737 1.00 0.00 H new ATOM 0 HG3 LYS F 62 0.683 -7.660 -4.267 1.00 0.00 H new ATOM 0 HD2 LYS F 62 -2.373 -7.787 -4.348 1.00 0.00 H new ATOM 0 HD3 LYS F 62 -1.345 -9.204 -4.441 1.00 0.00 H new ATOM 0 HE2 LYS F 62 -0.888 -9.154 -2.190 1.00 0.00 H new ATOM 0 HE3 LYS F 62 -0.556 -7.434 -2.212 1.00 0.00 H new ATOM 0 HZ1 LYS F 62 -2.498 -7.257 -1.130 1.00 0.00 H new ATOM 0 HZ2 LYS F 62 -3.241 -7.521 -2.634 1.00 0.00 H new ATOM 0 HZ3 LYS F 62 -3.007 -8.818 -1.563 1.00 0.00 H new ATOM 1011 N ILE F 63 -2.876 -5.908 -6.954 1.00 0.00 N ATOM 1012 CA ILE F 63 -4.269 -6.322 -7.261 1.00 0.00 C ATOM 1013 C ILE F 63 -4.492 -7.769 -6.812 1.00 0.00 C ATOM 1014 O ILE F 63 -3.600 -8.593 -6.857 1.00 0.00 O ATOM 1015 CB ILE F 63 -4.504 -6.206 -8.773 1.00 0.00 C ATOM 1016 CG1 ILE F 63 -4.740 -4.739 -9.138 1.00 0.00 C ATOM 1017 CG2 ILE F 63 -5.727 -7.033 -9.179 1.00 0.00 C ATOM 1018 CD1 ILE F 63 -3.599 -4.246 -10.030 1.00 0.00 C ATOM 0 H ILE F 63 -2.235 -5.932 -7.747 1.00 0.00 H new ATOM 0 HA ILE F 63 -4.968 -5.676 -6.730 1.00 0.00 H new ATOM 0 HB ILE F 63 -3.628 -6.582 -9.301 1.00 0.00 H new ATOM 0 HG12 ILE F 63 -5.693 -4.631 -9.655 1.00 0.00 H new ATOM 0 HG13 ILE F 63 -4.797 -4.133 -8.234 1.00 0.00 H new ATOM 0 HG21 ILE F 63 -5.886 -6.944 -10.254 1.00 0.00 H new ATOM 0 HG22 ILE F 63 -5.561 -8.079 -8.922 1.00 0.00 H new ATOM 0 HG23 ILE F 63 -6.607 -6.665 -8.651 1.00 0.00 H new ATOM 0 HD11 ILE F 63 -3.766 -3.201 -10.291 1.00 0.00 H new ATOM 0 HD12 ILE F 63 -2.653 -4.340 -9.496 1.00 0.00 H new ATOM 0 HD13 ILE F 63 -3.563 -4.845 -10.940 1.00 0.00 H new ATOM 1030 N ARG F 64 -5.685 -8.077 -6.390 1.00 0.00 N ATOM 1031 CA ARG F 64 -6.001 -9.456 -5.944 1.00 0.00 C ATOM 1032 C ARG F 64 -7.235 -9.942 -6.699 1.00 0.00 C ATOM 1033 O ARG F 64 -8.258 -9.288 -6.717 1.00 0.00 O ATOM 1034 CB ARG F 64 -6.295 -9.454 -4.441 1.00 0.00 C ATOM 1035 CG ARG F 64 -5.024 -9.101 -3.667 1.00 0.00 C ATOM 1036 CD ARG F 64 -3.858 -9.924 -4.209 1.00 0.00 C ATOM 1037 NE ARG F 64 -3.002 -10.388 -3.080 1.00 0.00 N ATOM 1038 CZ ARG F 64 -3.551 -10.890 -2.007 1.00 0.00 C ATOM 1039 NH1 ARG F 64 -4.746 -11.412 -2.069 1.00 0.00 N ATOM 1040 NH2 ARG F 64 -2.905 -10.873 -0.874 1.00 0.00 N ATOM 0 H ARG F 64 -6.464 -7.421 -6.335 1.00 0.00 H new ATOM 0 HA ARG F 64 -5.155 -10.114 -6.144 1.00 0.00 H new ATOM 0 HB2 ARG F 64 -7.081 -8.734 -4.216 1.00 0.00 H new ATOM 0 HB3 ARG F 64 -6.661 -10.433 -4.131 1.00 0.00 H new ATOM 0 HG2 ARG F 64 -4.809 -8.037 -3.764 1.00 0.00 H new ATOM 0 HG3 ARG F 64 -5.164 -9.302 -2.605 1.00 0.00 H new ATOM 0 HD2 ARG F 64 -4.234 -10.780 -4.769 1.00 0.00 H new ATOM 0 HD3 ARG F 64 -3.268 -9.324 -4.902 1.00 0.00 H new ATOM 0 HE ARG F 64 -1.987 -10.313 -3.146 1.00 0.00 H new ATOM 0 HH11 ARG F 64 -5.250 -11.428 -2.955 1.00 0.00 H new ATOM 0 HH12 ARG F 64 -5.175 -11.804 -1.231 1.00 0.00 H new ATOM 0 HH21 ARG F 64 -1.970 -10.467 -0.826 1.00 0.00 H new ATOM 0 HH22 ARG F 64 -3.334 -11.265 -0.036 1.00 0.00 H new ATOM 1054 N LYS F 65 -7.152 -11.080 -7.326 1.00 0.00 N ATOM 1055 CA LYS F 65 -8.329 -11.588 -8.075 1.00 0.00 C ATOM 1056 C LYS F 65 -8.964 -12.738 -7.301 1.00 0.00 C ATOM 1057 O LYS F 65 -8.333 -13.737 -7.018 1.00 0.00 O ATOM 1058 CB LYS F 65 -7.888 -12.079 -9.456 1.00 0.00 C ATOM 1059 CG LYS F 65 -9.029 -12.861 -10.109 1.00 0.00 C ATOM 1060 CD LYS F 65 -8.606 -13.310 -11.509 1.00 0.00 C ATOM 1061 CE LYS F 65 -8.225 -14.792 -11.476 1.00 0.00 C ATOM 1062 NZ LYS F 65 -9.462 -15.623 -11.496 1.00 0.00 N ATOM 0 H LYS F 65 -6.325 -11.676 -7.352 1.00 0.00 H new ATOM 0 HA LYS F 65 -9.057 -10.785 -8.195 1.00 0.00 H new ATOM 0 HB2 LYS F 65 -7.609 -11.232 -10.082 1.00 0.00 H new ATOM 0 HB3 LYS F 65 -7.005 -12.712 -9.364 1.00 0.00 H new ATOM 0 HG2 LYS F 65 -9.285 -13.728 -9.500 1.00 0.00 H new ATOM 0 HG3 LYS F 65 -9.922 -12.239 -10.170 1.00 0.00 H new ATOM 0 HD2 LYS F 65 -9.420 -13.148 -12.216 1.00 0.00 H new ATOM 0 HD3 LYS F 65 -7.761 -12.714 -11.854 1.00 0.00 H new ATOM 0 HE2 LYS F 65 -7.596 -15.036 -12.332 1.00 0.00 H new ATOM 0 HE3 LYS F 65 -7.643 -15.009 -10.581 1.00 0.00 H new ATOM 0 HZ1 LYS F 65 -9.204 -16.630 -11.474 1.00 0.00 H new ATOM 0 HZ2 LYS F 65 -10.046 -15.397 -10.666 1.00 0.00 H new ATOM 0 HZ3 LYS F 65 -10.001 -15.423 -12.363 1.00 0.00 H new ATOM 1076 N LEU F 66 -10.211 -12.602 -6.957 1.00 0.00 N ATOM 1077 CA LEU F 66 -10.892 -13.686 -6.200 1.00 0.00 C ATOM 1078 C LEU F 66 -11.055 -14.903 -7.100 1.00 0.00 C ATOM 1079 O LEU F 66 -11.361 -14.788 -8.269 1.00 0.00 O ATOM 1080 CB LEU F 66 -12.285 -13.220 -5.751 1.00 0.00 C ATOM 1081 CG LEU F 66 -12.191 -12.234 -4.576 1.00 0.00 C ATOM 1082 CD1 LEU F 66 -11.050 -12.625 -3.637 1.00 0.00 C ATOM 1083 CD2 LEU F 66 -11.946 -10.824 -5.109 1.00 0.00 C ATOM 0 H LEU F 66 -10.789 -11.788 -7.167 1.00 0.00 H new ATOM 0 HA LEU F 66 -10.291 -13.938 -5.326 1.00 0.00 H new ATOM 0 HB2 LEU F 66 -12.799 -12.745 -6.587 1.00 0.00 H new ATOM 0 HB3 LEU F 66 -12.883 -14.083 -5.458 1.00 0.00 H new ATOM 0 HG LEU F 66 -13.129 -12.263 -4.022 1.00 0.00 H new ATOM 0 HD11 LEU F 66 -10.999 -11.915 -2.811 1.00 0.00 H new ATOM 0 HD12 LEU F 66 -11.229 -13.626 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU F 66 -10.108 -12.613 -4.185 1.00 0.00 H new ATOM 0 HD21 LEU F 66 -11.880 -10.126 -4.274 1.00 0.00 H new ATOM 0 HD22 LEU F 66 -11.013 -10.805 -5.673 1.00 0.00 H new ATOM 0 HD23 LEU F 66 -12.770 -10.533 -5.761 1.00 0.00 H new ATOM 1095 N ASP F 67 -10.877 -16.071 -6.557 1.00 0.00 N ATOM 1096 CA ASP F 67 -11.059 -17.294 -7.375 1.00 0.00 C ATOM 1097 C ASP F 67 -12.552 -17.451 -7.637 1.00 0.00 C ATOM 1098 O ASP F 67 -12.974 -18.147 -8.538 1.00 0.00 O ATOM 1099 CB ASP F 67 -10.546 -18.505 -6.605 1.00 0.00 C ATOM 1100 CG ASP F 67 -9.255 -19.015 -7.250 1.00 0.00 C ATOM 1101 OD1 ASP F 67 -8.264 -18.306 -7.185 1.00 0.00 O ATOM 1102 OD2 ASP F 67 -9.280 -20.105 -7.797 1.00 0.00 O ATOM 0 H ASP F 67 -10.614 -16.230 -5.584 1.00 0.00 H new ATOM 0 HA ASP F 67 -10.508 -17.217 -8.312 1.00 0.00 H new ATOM 0 HB2 ASP F 67 -10.363 -18.236 -5.565 1.00 0.00 H new ATOM 0 HB3 ASP F 67 -11.299 -19.293 -6.603 1.00 0.00 H new ATOM 1107 N ASN F 68 -13.352 -16.781 -6.852 1.00 0.00 N ATOM 1108 CA ASN F 68 -14.820 -16.850 -7.040 1.00 0.00 C ATOM 1109 C ASN F 68 -15.192 -15.921 -8.191 1.00 0.00 C ATOM 1110 O ASN F 68 -16.297 -15.945 -8.697 1.00 0.00 O ATOM 1111 CB ASN F 68 -15.520 -16.369 -5.767 1.00 0.00 C ATOM 1112 CG ASN F 68 -14.646 -16.646 -4.539 1.00 0.00 C ATOM 1113 OD1 ASN F 68 -13.833 -17.667 -4.537 1.00 0.00 O flip ATOM 1114 ND2 ASN F 68 -14.705 -15.921 -3.566 1.00 0.00 N flip ATOM 0 H ASN F 68 -13.044 -16.185 -6.084 1.00 0.00 H new ATOM 0 HA ASN F 68 -15.126 -17.874 -7.255 1.00 0.00 H new ATOM 0 HB2 ASN F 68 -15.728 -15.301 -5.840 1.00 0.00 H new ATOM 0 HB3 ASN F 68 -16.480 -16.874 -5.659 1.00 0.00 H new ATOM 0 HD21 ASN F 68 -15.339 -15.122 -3.563 1.00 0.00 H new ATOM 0 HD22 ASN F 68 -14.121 -16.111 -2.752 1.00 0.00 H new ATOM 1121 N GLY F 69 -14.271 -15.091 -8.597 1.00 0.00 N ATOM 1122 CA GLY F 69 -14.551 -14.146 -9.699 1.00 0.00 C ATOM 1123 C GLY F 69 -14.762 -12.747 -9.116 1.00 0.00 C ATOM 1124 O GLY F 69 -15.875 -12.326 -8.875 1.00 0.00 O ATOM 0 H GLY F 69 -13.331 -15.031 -8.205 1.00 0.00 H new ATOM 0 HA2 GLY F 69 -13.722 -14.137 -10.407 1.00 0.00 H new ATOM 0 HA3 GLY F 69 -15.437 -14.462 -10.249 1.00 0.00 H new ATOM 1128 N GLY F 70 -13.700 -12.026 -8.882 1.00 0.00 N ATOM 1129 CA GLY F 70 -13.836 -10.666 -8.312 1.00 0.00 C ATOM 1130 C GLY F 70 -12.497 -9.928 -8.402 1.00 0.00 C ATOM 1131 O GLY F 70 -11.689 -9.981 -7.502 1.00 0.00 O ATOM 0 H GLY F 70 -12.742 -12.326 -9.064 1.00 0.00 H new ATOM 0 HA2 GLY F 70 -14.604 -10.111 -8.851 1.00 0.00 H new ATOM 0 HA3 GLY F 70 -14.158 -10.728 -7.272 1.00 0.00 H new ATOM 1135 N TYR F 71 -12.266 -9.217 -9.470 1.00 0.00 N ATOM 1136 CA TYR F 71 -10.991 -8.455 -9.594 1.00 0.00 C ATOM 1137 C TYR F 71 -11.102 -7.241 -8.683 1.00 0.00 C ATOM 1138 O TYR F 71 -12.011 -6.447 -8.810 1.00 0.00 O ATOM 1139 CB TYR F 71 -10.793 -8.004 -11.042 1.00 0.00 C ATOM 1140 CG TYR F 71 -10.023 -9.062 -11.799 1.00 0.00 C ATOM 1141 CD1 TYR F 71 -8.670 -9.284 -11.513 1.00 0.00 C ATOM 1142 CD2 TYR F 71 -10.662 -9.816 -12.788 1.00 0.00 C ATOM 1143 CE1 TYR F 71 -7.957 -10.260 -12.216 1.00 0.00 C ATOM 1144 CE2 TYR F 71 -9.949 -10.794 -13.492 1.00 0.00 C ATOM 1145 CZ TYR F 71 -8.596 -11.017 -13.206 1.00 0.00 C ATOM 1146 OH TYR F 71 -7.893 -11.980 -13.900 1.00 0.00 O ATOM 0 H TYR F 71 -12.903 -9.130 -10.262 1.00 0.00 H new ATOM 0 HA TYR F 71 -10.140 -9.074 -9.312 1.00 0.00 H new ATOM 0 HB2 TYR F 71 -11.759 -7.833 -11.516 1.00 0.00 H new ATOM 0 HB3 TYR F 71 -10.253 -7.057 -11.069 1.00 0.00 H new ATOM 0 HD1 TYR F 71 -8.177 -8.701 -10.749 1.00 0.00 H new ATOM 0 HD2 TYR F 71 -11.705 -9.644 -13.009 1.00 0.00 H new ATOM 0 HE1 TYR F 71 -6.914 -10.430 -11.996 1.00 0.00 H new ATOM 0 HE2 TYR F 71 -10.442 -11.377 -14.256 1.00 0.00 H new ATOM 0 HH TYR F 71 -8.485 -12.413 -14.549 1.00 0.00 H new ATOM 1156 N TYR F 72 -10.224 -7.108 -7.735 1.00 0.00 N ATOM 1157 CA TYR F 72 -10.346 -5.965 -6.799 1.00 0.00 C ATOM 1158 C TYR F 72 -8.983 -5.576 -6.219 1.00 0.00 C ATOM 1159 O TYR F 72 -8.303 -6.385 -5.620 1.00 0.00 O ATOM 1160 CB TYR F 72 -11.259 -6.407 -5.654 1.00 0.00 C ATOM 1161 CG TYR F 72 -10.494 -7.334 -4.731 1.00 0.00 C ATOM 1162 CD1 TYR F 72 -10.186 -8.637 -5.140 1.00 0.00 C ATOM 1163 CD2 TYR F 72 -10.069 -6.877 -3.481 1.00 0.00 C ATOM 1164 CE1 TYR F 72 -9.460 -9.482 -4.297 1.00 0.00 C ATOM 1165 CE2 TYR F 72 -9.339 -7.717 -2.638 1.00 0.00 C ATOM 1166 CZ TYR F 72 -9.034 -9.023 -3.044 1.00 0.00 C ATOM 1167 OH TYR F 72 -8.313 -9.855 -2.212 1.00 0.00 O ATOM 0 H TYR F 72 -9.436 -7.734 -7.569 1.00 0.00 H new ATOM 0 HA TYR F 72 -10.748 -5.102 -7.330 1.00 0.00 H new ATOM 0 HB2 TYR F 72 -11.615 -5.538 -5.101 1.00 0.00 H new ATOM 0 HB3 TYR F 72 -12.138 -6.915 -6.050 1.00 0.00 H new ATOM 0 HD1 TYR F 72 -10.510 -8.989 -6.108 1.00 0.00 H new ATOM 0 HD2 TYR F 72 -10.306 -5.871 -3.166 1.00 0.00 H new ATOM 0 HE1 TYR F 72 -9.227 -10.489 -4.611 1.00 0.00 H new ATOM 0 HE2 TYR F 72 -9.009 -7.360 -1.673 1.00 0.00 H new ATOM 0 HH TYR F 72 -8.096 -9.380 -1.383 1.00 0.00 H new ATOM 1177 N ILE F 73 -8.598 -4.337 -6.330 1.00 0.00 N ATOM 1178 CA ILE F 73 -7.313 -3.928 -5.707 1.00 0.00 C ATOM 1179 C ILE F 73 -7.622 -3.622 -4.244 1.00 0.00 C ATOM 1180 O ILE F 73 -6.777 -3.707 -3.376 1.00 0.00 O ATOM 1181 CB ILE F 73 -6.742 -2.687 -6.402 1.00 0.00 C ATOM 1182 CG1 ILE F 73 -7.034 -2.761 -7.904 1.00 0.00 C ATOM 1183 CG2 ILE F 73 -5.235 -2.632 -6.177 1.00 0.00 C ATOM 1184 CD1 ILE F 73 -6.347 -1.594 -8.617 1.00 0.00 C ATOM 0 H ILE F 73 -9.109 -3.601 -6.817 1.00 0.00 H new ATOM 0 HA ILE F 73 -6.567 -4.717 -5.799 1.00 0.00 H new ATOM 0 HB ILE F 73 -7.205 -1.791 -5.988 1.00 0.00 H new ATOM 0 HG12 ILE F 73 -6.677 -3.708 -8.308 1.00 0.00 H new ATOM 0 HG13 ILE F 73 -8.109 -2.725 -8.078 1.00 0.00 H new ATOM 0 HG21 ILE F 73 -4.825 -1.750 -6.670 1.00 0.00 H new ATOM 0 HG22 ILE F 73 -5.028 -2.579 -5.108 1.00 0.00 H new ATOM 0 HG23 ILE F 73 -4.772 -3.528 -6.592 1.00 0.00 H new ATOM 0 HD11 ILE F 73 -6.555 -1.647 -9.686 1.00 0.00 H new ATOM 0 HD12 ILE F 73 -6.725 -0.652 -8.220 1.00 0.00 H new ATOM 0 HD13 ILE F 73 -5.271 -1.651 -8.454 1.00 0.00 H new ATOM 1196 N THR F 74 -8.861 -3.307 -3.976 1.00 0.00 N ATOM 1197 CA THR F 74 -9.303 -3.034 -2.585 1.00 0.00 C ATOM 1198 C THR F 74 -10.630 -3.759 -2.382 1.00 0.00 C ATOM 1199 O THR F 74 -11.426 -3.876 -3.289 1.00 0.00 O ATOM 1200 CB THR F 74 -9.475 -1.527 -2.353 1.00 0.00 C ATOM 1201 OG1 THR F 74 -10.667 -1.288 -1.625 1.00 0.00 O ATOM 1202 CG2 THR F 74 -9.540 -0.787 -3.692 1.00 0.00 C ATOM 0 H THR F 74 -9.596 -3.227 -4.678 1.00 0.00 H new ATOM 0 HA THR F 74 -8.557 -3.386 -1.873 1.00 0.00 H new ATOM 0 HB THR F 74 -8.619 -1.161 -1.785 1.00 0.00 H new ATOM 0 HG1 THR F 74 -10.473 -0.703 -0.863 1.00 0.00 H new ATOM 0 HG21 THR F 74 -9.662 0.281 -3.512 1.00 0.00 H new ATOM 0 HG22 THR F 74 -8.618 -0.958 -4.247 1.00 0.00 H new ATOM 0 HG23 THR F 74 -10.386 -1.156 -4.271 1.00 0.00 H new ATOM 1210 N THR F 75 -10.857 -4.282 -1.216 1.00 0.00 N ATOM 1211 CA THR F 75 -12.121 -5.047 -0.966 1.00 0.00 C ATOM 1212 C THR F 75 -13.350 -4.143 -1.102 1.00 0.00 C ATOM 1213 O THR F 75 -14.473 -4.602 -1.046 1.00 0.00 O ATOM 1214 CB THR F 75 -12.073 -5.646 0.438 1.00 0.00 C ATOM 1215 OG1 THR F 75 -11.759 -4.628 1.378 1.00 0.00 O ATOM 1216 CG2 THR F 75 -10.999 -6.732 0.474 1.00 0.00 C ATOM 0 H THR F 75 -10.225 -4.217 -0.418 1.00 0.00 H new ATOM 0 HA THR F 75 -12.202 -5.840 -1.709 1.00 0.00 H new ATOM 0 HB THR F 75 -13.041 -6.078 0.692 1.00 0.00 H new ATOM 0 HG1 THR F 75 -11.730 -5.012 2.279 1.00 0.00 H new ATOM 0 HG21 THR F 75 -10.955 -7.167 1.472 1.00 0.00 H new ATOM 0 HG22 THR F 75 -11.243 -7.509 -0.250 1.00 0.00 H new ATOM 0 HG23 THR F 75 -10.032 -6.295 0.226 1.00 0.00 H new ATOM 1224 N ARG F 76 -13.155 -2.871 -1.285 1.00 0.00 N ATOM 1225 CA ARG F 76 -14.320 -1.957 -1.425 1.00 0.00 C ATOM 1226 C ARG F 76 -14.857 -2.011 -2.860 1.00 0.00 C ATOM 1227 O ARG F 76 -15.884 -1.435 -3.161 1.00 0.00 O ATOM 1228 CB ARG F 76 -13.885 -0.527 -1.099 1.00 0.00 C ATOM 1229 CG ARG F 76 -15.041 0.435 -1.381 1.00 0.00 C ATOM 1230 CD ARG F 76 -14.654 1.846 -0.933 1.00 0.00 C ATOM 1231 NE ARG F 76 -15.854 2.728 -0.973 1.00 0.00 N ATOM 1232 CZ ARG F 76 -15.935 3.677 -1.865 1.00 0.00 C ATOM 1233 NH1 ARG F 76 -15.990 3.379 -3.135 1.00 0.00 N ATOM 1234 NH2 ARG F 76 -15.962 4.926 -1.487 1.00 0.00 N ATOM 0 H ARG F 76 -12.240 -2.423 -1.344 1.00 0.00 H new ATOM 0 HA ARG F 76 -15.105 -2.269 -0.737 1.00 0.00 H new ATOM 0 HB2 ARG F 76 -13.586 -0.456 -0.053 1.00 0.00 H new ATOM 0 HB3 ARG F 76 -13.016 -0.254 -1.698 1.00 0.00 H new ATOM 0 HG2 ARG F 76 -15.279 0.432 -2.445 1.00 0.00 H new ATOM 0 HG3 ARG F 76 -15.937 0.108 -0.854 1.00 0.00 H new ATOM 0 HD2 ARG F 76 -14.243 1.819 0.076 1.00 0.00 H new ATOM 0 HD3 ARG F 76 -13.875 2.244 -1.583 1.00 0.00 H new ATOM 0 HE ARG F 76 -16.611 2.590 -0.304 1.00 0.00 H new ATOM 0 HH11 ARG F 76 -15.970 2.403 -3.431 1.00 0.00 H new ATOM 0 HH12 ARG F 76 -16.053 4.122 -3.831 1.00 0.00 H new ATOM 0 HH21 ARG F 76 -15.920 5.160 -0.495 1.00 0.00 H new ATOM 0 HH22 ARG F 76 -16.025 5.668 -2.184 1.00 0.00 H new ATOM 1248 N ALA F 77 -14.179 -2.687 -3.754 1.00 0.00 N ATOM 1249 CA ALA F 77 -14.685 -2.742 -5.158 1.00 0.00 C ATOM 1250 C ALA F 77 -14.056 -3.911 -5.932 1.00 0.00 C ATOM 1251 O ALA F 77 -12.862 -3.957 -6.153 1.00 0.00 O ATOM 1252 CB ALA F 77 -14.340 -1.430 -5.864 1.00 0.00 C ATOM 0 H ALA F 77 -13.312 -3.195 -3.577 1.00 0.00 H new ATOM 0 HA ALA F 77 -15.764 -2.891 -5.130 1.00 0.00 H new ATOM 0 HB1 ALA F 77 -14.706 -1.462 -6.890 1.00 0.00 H new ATOM 0 HB2 ALA F 77 -14.809 -0.599 -5.337 1.00 0.00 H new ATOM 0 HB3 ALA F 77 -13.259 -1.293 -5.869 1.00 0.00 H new ATOM 1258 N GLN F 78 -14.868 -4.841 -6.366 1.00 0.00 N ATOM 1259 CA GLN F 78 -14.367 -5.997 -7.146 1.00 0.00 C ATOM 1260 C GLN F 78 -15.036 -5.982 -8.525 1.00 0.00 C ATOM 1261 O GLN F 78 -15.961 -5.231 -8.762 1.00 0.00 O ATOM 1262 CB GLN F 78 -14.747 -7.287 -6.428 1.00 0.00 C ATOM 1263 CG GLN F 78 -14.117 -7.306 -5.031 1.00 0.00 C ATOM 1264 CD GLN F 78 -15.209 -7.253 -3.964 1.00 0.00 C ATOM 1265 OE1 GLN F 78 -16.344 -7.609 -4.215 1.00 0.00 O ATOM 1266 NE2 GLN F 78 -14.909 -6.817 -2.770 1.00 0.00 N ATOM 0 H GLN F 78 -15.875 -4.842 -6.206 1.00 0.00 H new ATOM 0 HA GLN F 78 -13.284 -5.937 -7.249 1.00 0.00 H new ATOM 0 HB2 GLN F 78 -15.831 -7.365 -6.349 1.00 0.00 H new ATOM 0 HB3 GLN F 78 -14.406 -8.148 -7.003 1.00 0.00 H new ATOM 0 HG2 GLN F 78 -13.518 -8.208 -4.906 1.00 0.00 H new ATOM 0 HG3 GLN F 78 -13.443 -6.457 -4.916 1.00 0.00 H new ATOM 0 HE21 GLN F 78 -13.956 -6.519 -2.560 1.00 0.00 H new ATOM 0 HE22 GLN F 78 -15.627 -6.775 -2.047 1.00 0.00 H new ATOM 1275 N PHE F 79 -14.585 -6.799 -9.439 1.00 0.00 N ATOM 1276 CA PHE F 79 -15.211 -6.815 -10.795 1.00 0.00 C ATOM 1277 C PHE F 79 -15.143 -8.226 -11.373 1.00 0.00 C ATOM 1278 O PHE F 79 -14.918 -9.183 -10.666 1.00 0.00 O ATOM 1279 CB PHE F 79 -14.468 -5.839 -11.708 1.00 0.00 C ATOM 1280 CG PHE F 79 -14.797 -4.434 -11.274 1.00 0.00 C ATOM 1281 CD1 PHE F 79 -14.173 -3.891 -10.149 1.00 0.00 C ATOM 1282 CD2 PHE F 79 -15.737 -3.682 -11.987 1.00 0.00 C ATOM 1283 CE1 PHE F 79 -14.485 -2.596 -9.733 1.00 0.00 C ATOM 1284 CE2 PHE F 79 -16.053 -2.384 -11.570 1.00 0.00 C ATOM 1285 CZ PHE F 79 -15.426 -1.840 -10.442 1.00 0.00 C ATOM 0 H PHE F 79 -13.814 -7.454 -9.307 1.00 0.00 H new ATOM 0 HA PHE F 79 -16.255 -6.512 -10.720 1.00 0.00 H new ATOM 0 HB2 PHE F 79 -13.393 -6.011 -11.652 1.00 0.00 H new ATOM 0 HB3 PHE F 79 -14.761 -5.993 -12.746 1.00 0.00 H new ATOM 0 HD1 PHE F 79 -13.448 -4.474 -9.600 1.00 0.00 H new ATOM 0 HD2 PHE F 79 -16.218 -4.103 -12.858 1.00 0.00 H new ATOM 0 HE1 PHE F 79 -14.000 -2.177 -8.864 1.00 0.00 H new ATOM 0 HE2 PHE F 79 -16.780 -1.802 -12.118 1.00 0.00 H new ATOM 0 HZ PHE F 79 -15.668 -0.838 -10.119 1.00 0.00 H new ATOM 1295 N GLU F 80 -15.346 -8.370 -12.647 1.00 0.00 N ATOM 1296 CA GLU F 80 -15.291 -9.732 -13.241 1.00 0.00 C ATOM 1297 C GLU F 80 -14.004 -9.888 -14.057 1.00 0.00 C ATOM 1298 O GLU F 80 -13.402 -10.943 -14.071 1.00 0.00 O ATOM 1299 CB GLU F 80 -16.518 -9.968 -14.126 1.00 0.00 C ATOM 1300 CG GLU F 80 -16.335 -9.269 -15.470 1.00 0.00 C ATOM 1301 CD GLU F 80 -17.617 -9.418 -16.293 1.00 0.00 C ATOM 1302 OE1 GLU F 80 -18.569 -8.713 -16.004 1.00 0.00 O ATOM 1303 OE2 GLU F 80 -17.623 -10.236 -17.199 1.00 0.00 O ATOM 0 H GLU F 80 -15.546 -7.612 -13.300 1.00 0.00 H new ATOM 0 HA GLU F 80 -15.293 -10.473 -12.442 1.00 0.00 H new ATOM 0 HB2 GLU F 80 -16.665 -11.037 -14.280 1.00 0.00 H new ATOM 0 HB3 GLU F 80 -17.412 -9.591 -13.630 1.00 0.00 H new ATOM 0 HG2 GLU F 80 -16.107 -8.214 -15.317 1.00 0.00 H new ATOM 0 HG3 GLU F 80 -15.491 -9.702 -16.007 1.00 0.00 H new ATOM 1310 N THR F 81 -13.560 -8.856 -14.733 1.00 0.00 N ATOM 1311 CA THR F 81 -12.304 -8.995 -15.521 1.00 0.00 C ATOM 1312 C THR F 81 -11.349 -7.852 -15.178 1.00 0.00 C ATOM 1313 O THR F 81 -11.680 -6.944 -14.437 1.00 0.00 O ATOM 1314 CB THR F 81 -12.608 -8.979 -17.021 1.00 0.00 C ATOM 1315 OG1 THR F 81 -11.503 -8.433 -17.723 1.00 0.00 O ATOM 1316 CG2 THR F 81 -13.826 -8.116 -17.310 1.00 0.00 C ATOM 0 H THR F 81 -14.007 -7.940 -14.771 1.00 0.00 H new ATOM 0 HA THR F 81 -11.838 -9.947 -15.268 1.00 0.00 H new ATOM 0 HB THR F 81 -12.800 -10.003 -17.342 1.00 0.00 H new ATOM 0 HG1 THR F 81 -11.697 -8.425 -18.683 1.00 0.00 H new ATOM 0 HG21 THR F 81 -14.027 -8.117 -18.381 1.00 0.00 H new ATOM 0 HG22 THR F 81 -14.690 -8.516 -16.779 1.00 0.00 H new ATOM 0 HG23 THR F 81 -13.636 -7.096 -16.977 1.00 0.00 H new ATOM 1324 N LEU F 82 -10.166 -7.890 -15.718 1.00 0.00 N ATOM 1325 CA LEU F 82 -9.180 -6.813 -15.431 1.00 0.00 C ATOM 1326 C LEU F 82 -9.471 -5.629 -16.343 1.00 0.00 C ATOM 1327 O LEU F 82 -9.246 -4.491 -15.991 1.00 0.00 O ATOM 1328 CB LEU F 82 -7.761 -7.329 -15.679 1.00 0.00 C ATOM 1329 CG LEU F 82 -7.162 -7.808 -14.353 1.00 0.00 C ATOM 1330 CD1 LEU F 82 -6.090 -8.863 -14.624 1.00 0.00 C ATOM 1331 CD2 LEU F 82 -6.531 -6.623 -13.619 1.00 0.00 C ATOM 0 H LEU F 82 -9.837 -8.622 -16.348 1.00 0.00 H new ATOM 0 HA LEU F 82 -9.260 -6.503 -14.389 1.00 0.00 H new ATOM 0 HB2 LEU F 82 -7.779 -8.146 -16.400 1.00 0.00 H new ATOM 0 HB3 LEU F 82 -7.143 -6.539 -16.107 1.00 0.00 H new ATOM 0 HG LEU F 82 -7.951 -8.241 -13.738 1.00 0.00 H new ATOM 0 HD11 LEU F 82 -5.666 -9.202 -13.679 1.00 0.00 H new ATOM 0 HD12 LEU F 82 -6.536 -9.710 -15.146 1.00 0.00 H new ATOM 0 HD13 LEU F 82 -5.302 -8.431 -15.241 1.00 0.00 H new ATOM 0 HD21 LEU F 82 -6.105 -6.964 -12.676 1.00 0.00 H new ATOM 0 HD22 LEU F 82 -5.744 -6.190 -14.237 1.00 0.00 H new ATOM 0 HD23 LEU F 82 -7.294 -5.870 -13.421 1.00 0.00 H new ATOM 1343 N GLN F 83 -9.992 -5.892 -17.507 1.00 0.00 N ATOM 1344 CA GLN F 83 -10.325 -4.782 -18.432 1.00 0.00 C ATOM 1345 C GLN F 83 -11.595 -4.102 -17.922 1.00 0.00 C ATOM 1346 O GLN F 83 -11.816 -2.923 -18.132 1.00 0.00 O ATOM 1347 CB GLN F 83 -10.566 -5.338 -19.837 1.00 0.00 C ATOM 1348 CG GLN F 83 -10.618 -4.185 -20.841 1.00 0.00 C ATOM 1349 CD GLN F 83 -11.212 -4.683 -22.160 1.00 0.00 C ATOM 1350 OE1 GLN F 83 -11.658 -5.809 -22.252 1.00 0.00 O ATOM 1351 NE2 GLN F 83 -11.238 -3.884 -23.192 1.00 0.00 N ATOM 0 H GLN F 83 -10.201 -6.828 -17.856 1.00 0.00 H new ATOM 0 HA GLN F 83 -9.505 -4.066 -18.474 1.00 0.00 H new ATOM 0 HB2 GLN F 83 -9.770 -6.033 -20.106 1.00 0.00 H new ATOM 0 HB3 GLN F 83 -11.500 -5.899 -19.862 1.00 0.00 H new ATOM 0 HG2 GLN F 83 -11.222 -3.369 -20.443 1.00 0.00 H new ATOM 0 HG3 GLN F 83 -9.616 -3.788 -21.008 1.00 0.00 H new ATOM 0 HE21 GLN F 83 -10.863 -2.938 -23.114 1.00 0.00 H new ATOM 0 HE22 GLN F 83 -11.633 -4.205 -24.076 1.00 0.00 H new ATOM 1360 N GLN F 84 -12.431 -4.839 -17.240 1.00 0.00 N ATOM 1361 CA GLN F 84 -13.682 -4.240 -16.709 1.00 0.00 C ATOM 1362 C GLN F 84 -13.372 -3.450 -15.442 1.00 0.00 C ATOM 1363 O GLN F 84 -14.015 -2.466 -15.145 1.00 0.00 O ATOM 1364 CB GLN F 84 -14.706 -5.334 -16.428 1.00 0.00 C ATOM 1365 CG GLN F 84 -15.402 -5.674 -17.750 1.00 0.00 C ATOM 1366 CD GLN F 84 -16.324 -6.872 -17.568 1.00 0.00 C ATOM 1367 OE1 GLN F 84 -17.086 -6.934 -16.624 1.00 0.00 O ATOM 1368 NE2 GLN F 84 -16.296 -7.828 -18.454 1.00 0.00 N ATOM 0 H GLN F 84 -12.299 -5.828 -17.030 1.00 0.00 H new ATOM 0 HA GLN F 84 -14.103 -3.561 -17.450 1.00 0.00 H new ATOM 0 HB2 GLN F 84 -14.218 -6.217 -16.015 1.00 0.00 H new ATOM 0 HB3 GLN F 84 -15.433 -4.996 -15.689 1.00 0.00 H new ATOM 0 HG2 GLN F 84 -15.975 -4.815 -18.099 1.00 0.00 H new ATOM 0 HG3 GLN F 84 -14.657 -5.892 -18.515 1.00 0.00 H new ATOM 0 HE21 GLN F 84 -15.655 -7.772 -19.245 1.00 0.00 H new ATOM 0 HE22 GLN F 84 -16.916 -8.632 -18.356 1.00 0.00 H new ATOM 1377 N LEU F 85 -12.373 -3.850 -14.706 1.00 0.00 N ATOM 1378 CA LEU F 85 -12.016 -3.079 -13.483 1.00 0.00 C ATOM 1379 C LEU F 85 -11.211 -1.864 -13.913 1.00 0.00 C ATOM 1380 O LEU F 85 -11.330 -0.811 -13.350 1.00 0.00 O ATOM 1381 CB LEU F 85 -11.231 -3.968 -12.504 1.00 0.00 C ATOM 1382 CG LEU F 85 -9.726 -3.738 -12.649 1.00 0.00 C ATOM 1383 CD1 LEU F 85 -9.256 -2.759 -11.574 1.00 0.00 C ATOM 1384 CD2 LEU F 85 -9.001 -5.064 -12.502 1.00 0.00 C ATOM 0 H LEU F 85 -11.794 -4.668 -14.895 1.00 0.00 H new ATOM 0 HA LEU F 85 -12.912 -2.747 -12.959 1.00 0.00 H new ATOM 0 HB2 LEU F 85 -11.540 -3.751 -11.481 1.00 0.00 H new ATOM 0 HB3 LEU F 85 -11.463 -5.016 -12.692 1.00 0.00 H new ATOM 0 HG LEU F 85 -9.508 -3.318 -13.631 1.00 0.00 H new ATOM 0 HD11 LEU F 85 -8.183 -2.594 -11.676 1.00 0.00 H new ATOM 0 HD12 LEU F 85 -9.782 -1.811 -11.690 1.00 0.00 H new ATOM 0 HD13 LEU F 85 -9.467 -3.172 -10.588 1.00 0.00 H new ATOM 0 HD21 LEU F 85 -7.928 -4.905 -12.605 1.00 0.00 H new ATOM 0 HD22 LEU F 85 -9.213 -5.488 -11.520 1.00 0.00 H new ATOM 0 HD23 LEU F 85 -9.341 -5.753 -13.275 1.00 0.00 H new ATOM 1396 N VAL F 86 -10.421 -1.979 -14.931 1.00 0.00 N ATOM 1397 CA VAL F 86 -9.690 -0.781 -15.381 1.00 0.00 C ATOM 1398 C VAL F 86 -10.747 0.134 -15.986 1.00 0.00 C ATOM 1399 O VAL F 86 -10.596 1.337 -16.077 1.00 0.00 O ATOM 1400 CB VAL F 86 -8.643 -1.156 -16.428 1.00 0.00 C ATOM 1401 CG1 VAL F 86 -7.702 -2.212 -15.848 1.00 0.00 C ATOM 1402 CG2 VAL F 86 -9.342 -1.718 -17.664 1.00 0.00 C ATOM 0 H VAL F 86 -10.252 -2.834 -15.462 1.00 0.00 H new ATOM 0 HA VAL F 86 -9.158 -0.298 -14.561 1.00 0.00 H new ATOM 0 HB VAL F 86 -8.069 -0.272 -16.706 1.00 0.00 H new ATOM 0 HG11 VAL F 86 -6.954 -2.481 -16.593 1.00 0.00 H new ATOM 0 HG12 VAL F 86 -7.206 -1.811 -14.964 1.00 0.00 H new ATOM 0 HG13 VAL F 86 -8.275 -3.098 -15.572 1.00 0.00 H new ATOM 0 HG21 VAL F 86 -8.597 -1.986 -18.413 1.00 0.00 H new ATOM 0 HG22 VAL F 86 -9.914 -2.604 -17.387 1.00 0.00 H new ATOM 0 HG23 VAL F 86 -10.015 -0.965 -18.075 1.00 0.00 H new ATOM 1412 N GLN F 87 -11.838 -0.464 -16.386 1.00 0.00 N ATOM 1413 CA GLN F 87 -12.959 0.298 -16.980 1.00 0.00 C ATOM 1414 C GLN F 87 -13.695 1.078 -15.897 1.00 0.00 C ATOM 1415 O GLN F 87 -14.049 2.228 -16.070 1.00 0.00 O ATOM 1416 CB GLN F 87 -13.939 -0.687 -17.601 1.00 0.00 C ATOM 1417 CG GLN F 87 -15.006 0.082 -18.374 1.00 0.00 C ATOM 1418 CD GLN F 87 -15.548 -0.791 -19.507 1.00 0.00 C ATOM 1419 OE1 GLN F 87 -15.603 -2.085 -19.348 1.00 0.00 O flip ATOM 1420 NE2 GLN F 87 -15.925 -0.291 -20.548 1.00 0.00 N flip ATOM 0 H GLN F 87 -11.996 -1.470 -16.322 1.00 0.00 H new ATOM 0 HA GLN F 87 -12.567 0.988 -17.727 1.00 0.00 H new ATOM 0 HB2 GLN F 87 -13.412 -1.370 -18.267 1.00 0.00 H new ATOM 0 HB3 GLN F 87 -14.403 -1.294 -16.824 1.00 0.00 H new ATOM 0 HG2 GLN F 87 -15.816 0.372 -17.705 1.00 0.00 H new ATOM 0 HG3 GLN F 87 -14.584 1.001 -18.780 1.00 0.00 H new ATOM 0 HE21 GLN F 87 -15.882 0.720 -20.673 1.00 0.00 H new ATOM 0 HE22 GLN F 87 -16.284 -0.883 -21.297 1.00 0.00 H new ATOM 1429 N HIS F 88 -13.939 0.450 -14.785 1.00 0.00 N ATOM 1430 CA HIS F 88 -14.664 1.127 -13.689 1.00 0.00 C ATOM 1431 C HIS F 88 -13.730 2.131 -13.041 1.00 0.00 C ATOM 1432 O HIS F 88 -14.107 3.234 -12.697 1.00 0.00 O ATOM 1433 CB HIS F 88 -15.091 0.089 -12.658 1.00 0.00 C ATOM 1434 CG HIS F 88 -16.249 0.618 -11.857 1.00 0.00 C ATOM 1435 ND1 HIS F 88 -17.566 0.325 -12.178 1.00 0.00 N ATOM 1436 CD2 HIS F 88 -16.304 1.422 -10.746 1.00 0.00 C ATOM 1437 CE1 HIS F 88 -18.350 0.944 -11.277 1.00 0.00 C ATOM 1438 NE2 HIS F 88 -17.631 1.627 -10.381 1.00 0.00 N ATOM 0 H HIS F 88 -13.663 -0.512 -14.590 1.00 0.00 H new ATOM 0 HA HIS F 88 -15.546 1.637 -14.076 1.00 0.00 H new ATOM 0 HB2 HIS F 88 -15.374 -0.838 -13.157 1.00 0.00 H new ATOM 0 HB3 HIS F 88 -14.257 -0.146 -11.997 1.00 0.00 H new ATOM 0 HD2 HIS F 88 -15.447 1.833 -10.233 1.00 0.00 H new ATOM 0 HE1 HIS F 88 -19.429 0.895 -11.278 1.00 0.00 H new ATOM 0 HE2 HIS F 88 -17.980 2.180 -9.598 1.00 0.00 H new ATOM 1446 N TYR F 89 -12.504 1.747 -12.885 1.00 0.00 N ATOM 1447 CA TYR F 89 -11.512 2.654 -12.274 1.00 0.00 C ATOM 1448 C TYR F 89 -11.202 3.776 -13.265 1.00 0.00 C ATOM 1449 O TYR F 89 -10.673 4.805 -12.910 1.00 0.00 O ATOM 1450 CB TYR F 89 -10.234 1.877 -11.958 1.00 0.00 C ATOM 1451 CG TYR F 89 -10.449 0.995 -10.753 1.00 0.00 C ATOM 1452 CD1 TYR F 89 -11.446 0.017 -10.779 1.00 0.00 C ATOM 1453 CD2 TYR F 89 -9.642 1.141 -9.616 1.00 0.00 C ATOM 1454 CE1 TYR F 89 -11.643 -0.815 -9.682 1.00 0.00 C ATOM 1455 CE2 TYR F 89 -9.838 0.303 -8.511 1.00 0.00 C ATOM 1456 CZ TYR F 89 -10.839 -0.676 -8.544 1.00 0.00 C ATOM 1457 OH TYR F 89 -11.034 -1.502 -7.455 1.00 0.00 O ATOM 0 H TYR F 89 -12.143 0.833 -13.158 1.00 0.00 H new ATOM 0 HA TYR F 89 -11.909 3.074 -11.350 1.00 0.00 H new ATOM 0 HB2 TYR F 89 -9.947 1.270 -12.816 1.00 0.00 H new ATOM 0 HB3 TYR F 89 -9.415 2.571 -11.769 1.00 0.00 H new ATOM 0 HD1 TYR F 89 -12.067 -0.094 -11.656 1.00 0.00 H new ATOM 0 HD2 TYR F 89 -8.871 1.897 -9.592 1.00 0.00 H new ATOM 0 HE1 TYR F 89 -12.416 -1.568 -9.708 1.00 0.00 H new ATOM 0 HE2 TYR F 89 -9.217 0.412 -7.634 1.00 0.00 H new ATOM 0 HH TYR F 89 -10.391 -1.273 -6.751 1.00 0.00 H new ATOM 1467 N SER F 90 -11.537 3.581 -14.512 1.00 0.00 N ATOM 1468 CA SER F 90 -11.274 4.629 -15.526 1.00 0.00 C ATOM 1469 C SER F 90 -12.105 5.865 -15.190 1.00 0.00 C ATOM 1470 O SER F 90 -11.662 6.986 -15.335 1.00 0.00 O ATOM 1471 CB SER F 90 -11.662 4.111 -16.913 1.00 0.00 C ATOM 1472 OG SER F 90 -10.525 4.137 -17.763 1.00 0.00 O ATOM 0 H SER F 90 -11.983 2.736 -14.868 1.00 0.00 H new ATOM 0 HA SER F 90 -10.215 4.886 -15.524 1.00 0.00 H new ATOM 0 HB2 SER F 90 -12.050 3.095 -16.838 1.00 0.00 H new ATOM 0 HB3 SER F 90 -12.458 4.726 -17.333 1.00 0.00 H new ATOM 0 HG SER F 90 -10.773 3.804 -18.651 1.00 0.00 H new ATOM 1478 N GLU F 91 -13.307 5.662 -14.732 1.00 0.00 N ATOM 1479 CA GLU F 91 -14.173 6.815 -14.372 1.00 0.00 C ATOM 1480 C GLU F 91 -14.084 7.054 -12.865 1.00 0.00 C ATOM 1481 O GLU F 91 -14.536 8.061 -12.359 1.00 0.00 O ATOM 1482 CB GLU F 91 -15.622 6.506 -14.758 1.00 0.00 C ATOM 1483 CG GLU F 91 -15.656 5.877 -16.152 1.00 0.00 C ATOM 1484 CD GLU F 91 -16.785 6.510 -16.968 1.00 0.00 C ATOM 1485 OE1 GLU F 91 -16.590 7.611 -17.457 1.00 0.00 O ATOM 1486 OE2 GLU F 91 -17.823 5.883 -17.092 1.00 0.00 O ATOM 0 H GLU F 91 -13.728 4.744 -14.591 1.00 0.00 H new ATOM 0 HA GLU F 91 -13.842 7.706 -14.905 1.00 0.00 H new ATOM 0 HB2 GLU F 91 -16.066 5.827 -14.030 1.00 0.00 H new ATOM 0 HB3 GLU F 91 -16.216 7.420 -14.745 1.00 0.00 H new ATOM 0 HG2 GLU F 91 -14.701 6.028 -16.654 1.00 0.00 H new ATOM 0 HG3 GLU F 91 -15.808 4.801 -16.074 1.00 0.00 H new ATOM 1493 N ARG F 92 -13.501 6.135 -12.140 1.00 0.00 N ATOM 1494 CA ARG F 92 -13.387 6.320 -10.662 1.00 0.00 C ATOM 1495 C ARG F 92 -11.988 5.909 -10.201 1.00 0.00 C ATOM 1496 O ARG F 92 -11.395 4.989 -10.726 1.00 0.00 O ATOM 1497 CB ARG F 92 -14.428 5.460 -9.940 1.00 0.00 C ATOM 1498 CG ARG F 92 -15.608 5.169 -10.873 1.00 0.00 C ATOM 1499 CD ARG F 92 -16.889 5.031 -10.048 1.00 0.00 C ATOM 1500 NE ARG F 92 -18.062 4.948 -10.963 1.00 0.00 N ATOM 1501 CZ ARG F 92 -18.645 6.040 -11.377 1.00 0.00 C ATOM 1502 NH1 ARG F 92 -19.010 6.950 -10.517 1.00 0.00 N ATOM 1503 NH2 ARG F 92 -18.861 6.220 -12.650 1.00 0.00 N ATOM 0 H ARG F 92 -13.101 5.270 -12.504 1.00 0.00 H new ATOM 0 HA ARG F 92 -13.561 7.369 -10.424 1.00 0.00 H new ATOM 0 HB2 ARG F 92 -13.974 4.525 -9.612 1.00 0.00 H new ATOM 0 HB3 ARG F 92 -14.780 5.975 -9.046 1.00 0.00 H new ATOM 0 HG2 ARG F 92 -15.717 5.973 -11.601 1.00 0.00 H new ATOM 0 HG3 ARG F 92 -15.424 4.253 -11.435 1.00 0.00 H new ATOM 0 HD2 ARG F 92 -16.838 4.139 -9.423 1.00 0.00 H new ATOM 0 HD3 ARG F 92 -16.996 5.884 -9.378 1.00 0.00 H new ATOM 0 HE ARG F 92 -18.409 4.038 -11.266 1.00 0.00 H new ATOM 0 HH11 ARG F 92 -18.840 6.808 -9.521 1.00 0.00 H new ATOM 0 HH12 ARG F 92 -19.466 7.803 -10.840 1.00 0.00 H new ATOM 0 HH21 ARG F 92 -18.574 5.508 -13.322 1.00 0.00 H new ATOM 0 HH22 ARG F 92 -19.317 7.073 -12.974 1.00 0.00 H new ATOM 1517 N ALA F 93 -11.457 6.580 -9.220 1.00 0.00 N ATOM 1518 CA ALA F 93 -10.097 6.224 -8.726 1.00 0.00 C ATOM 1519 C ALA F 93 -10.190 4.996 -7.819 1.00 0.00 C ATOM 1520 O ALA F 93 -9.237 4.260 -7.659 1.00 0.00 O ATOM 1521 CB ALA F 93 -9.516 7.399 -7.936 1.00 0.00 C ATOM 0 H ALA F 93 -11.904 7.360 -8.738 1.00 0.00 H new ATOM 0 HA ALA F 93 -9.449 6.002 -9.574 1.00 0.00 H new ATOM 0 HB1 ALA F 93 -8.521 7.138 -7.575 1.00 0.00 H new ATOM 0 HB2 ALA F 93 -9.450 8.274 -8.582 1.00 0.00 H new ATOM 0 HB3 ALA F 93 -10.163 7.622 -7.088 1.00 0.00 H new ATOM 1527 N ALA F 94 -11.330 4.782 -7.218 1.00 0.00 N ATOM 1528 CA ALA F 94 -11.502 3.612 -6.311 1.00 0.00 C ATOM 1529 C ALA F 94 -10.928 3.952 -4.937 1.00 0.00 C ATOM 1530 O ALA F 94 -11.089 3.212 -3.986 1.00 0.00 O ATOM 1531 CB ALA F 94 -10.781 2.391 -6.887 1.00 0.00 C ATOM 0 H ALA F 94 -12.155 5.373 -7.318 1.00 0.00 H new ATOM 0 HA ALA F 94 -12.563 3.381 -6.217 1.00 0.00 H new ATOM 0 HB1 ALA F 94 -10.912 1.541 -6.217 1.00 0.00 H new ATOM 0 HB2 ALA F 94 -11.198 2.150 -7.865 1.00 0.00 H new ATOM 0 HB3 ALA F 94 -9.718 2.611 -6.990 1.00 0.00 H new ATOM 1537 N GLY F 95 -10.269 5.073 -4.817 1.00 0.00 N ATOM 1538 CA GLY F 95 -9.703 5.459 -3.498 1.00 0.00 C ATOM 1539 C GLY F 95 -8.172 5.436 -3.551 1.00 0.00 C ATOM 1540 O GLY F 95 -7.510 5.811 -2.603 1.00 0.00 O ATOM 0 H GLY F 95 -10.100 5.735 -5.575 1.00 0.00 H new ATOM 0 HA2 GLY F 95 -10.050 6.455 -3.223 1.00 0.00 H new ATOM 0 HA3 GLY F 95 -10.058 4.774 -2.728 1.00 0.00 H new ATOM 1544 N LEU F 96 -7.598 4.997 -4.639 1.00 0.00 N ATOM 1545 CA LEU F 96 -6.109 4.958 -4.717 1.00 0.00 C ATOM 1546 C LEU F 96 -5.588 6.259 -5.339 1.00 0.00 C ATOM 1547 O LEU F 96 -6.278 7.257 -5.380 1.00 0.00 O ATOM 1548 CB LEU F 96 -5.669 3.755 -5.557 1.00 0.00 C ATOM 1549 CG LEU F 96 -6.591 3.595 -6.757 1.00 0.00 C ATOM 1550 CD1 LEU F 96 -5.770 3.225 -7.989 1.00 0.00 C ATOM 1551 CD2 LEU F 96 -7.585 2.474 -6.455 1.00 0.00 C ATOM 0 H LEU F 96 -8.090 4.667 -5.469 1.00 0.00 H new ATOM 0 HA LEU F 96 -5.696 4.859 -3.713 1.00 0.00 H new ATOM 0 HB2 LEU F 96 -4.641 3.892 -5.893 1.00 0.00 H new ATOM 0 HB3 LEU F 96 -5.688 2.850 -4.950 1.00 0.00 H new ATOM 0 HG LEU F 96 -7.120 4.529 -6.949 1.00 0.00 H new ATOM 0 HD11 LEU F 96 -6.433 3.111 -8.847 1.00 0.00 H new ATOM 0 HD12 LEU F 96 -5.045 4.013 -8.193 1.00 0.00 H new ATOM 0 HD13 LEU F 96 -5.246 2.287 -7.808 1.00 0.00 H new ATOM 0 HD21 LEU F 96 -8.256 2.344 -7.304 1.00 0.00 H new ATOM 0 HD22 LEU F 96 -7.043 1.546 -6.275 1.00 0.00 H new ATOM 0 HD23 LEU F 96 -8.166 2.732 -5.570 1.00 0.00 H new ATOM 1563 N SER F 97 -4.370 6.255 -5.811 1.00 0.00 N ATOM 1564 CA SER F 97 -3.792 7.488 -6.418 1.00 0.00 C ATOM 1565 C SER F 97 -4.835 8.167 -7.298 1.00 0.00 C ATOM 1566 O SER F 97 -5.127 9.336 -7.145 1.00 0.00 O ATOM 1567 CB SER F 97 -2.575 7.114 -7.266 1.00 0.00 C ATOM 1568 OG SER F 97 -1.763 8.263 -7.459 1.00 0.00 O ATOM 0 H SER F 97 -3.748 5.447 -5.802 1.00 0.00 H new ATOM 0 HA SER F 97 -3.490 8.173 -5.626 1.00 0.00 H new ATOM 0 HB2 SER F 97 -2.002 6.329 -6.773 1.00 0.00 H new ATOM 0 HB3 SER F 97 -2.897 6.717 -8.229 1.00 0.00 H new ATOM 0 HG SER F 97 -1.647 8.424 -8.419 1.00 0.00 H new ATOM 1574 N SER F 98 -5.400 7.444 -8.218 1.00 0.00 N ATOM 1575 CA SER F 98 -6.426 8.049 -9.108 1.00 0.00 C ATOM 1576 C SER F 98 -6.828 7.046 -10.189 1.00 0.00 C ATOM 1577 O SER F 98 -6.081 6.153 -10.527 1.00 0.00 O ATOM 1578 CB SER F 98 -5.854 9.307 -9.765 1.00 0.00 C ATOM 1579 OG SER F 98 -6.361 9.423 -11.087 1.00 0.00 O ATOM 0 H SER F 98 -5.197 6.460 -8.393 1.00 0.00 H new ATOM 0 HA SER F 98 -7.304 8.313 -8.518 1.00 0.00 H new ATOM 0 HB2 SER F 98 -6.122 10.188 -9.183 1.00 0.00 H new ATOM 0 HB3 SER F 98 -4.765 9.257 -9.785 1.00 0.00 H new ATOM 0 HG SER F 98 -5.996 10.229 -11.508 1.00 0.00 H new ATOM 1585 N ARG F 99 -8.014 7.200 -10.716 1.00 0.00 N ATOM 1586 CA ARG F 99 -8.530 6.281 -11.779 1.00 0.00 C ATOM 1587 C ARG F 99 -7.396 5.756 -12.669 1.00 0.00 C ATOM 1588 O ARG F 99 -7.117 6.310 -13.713 1.00 0.00 O ATOM 1589 CB ARG F 99 -9.526 7.053 -12.648 1.00 0.00 C ATOM 1590 CG ARG F 99 -8.978 8.454 -12.929 1.00 0.00 C ATOM 1591 CD ARG F 99 -10.093 9.332 -13.498 1.00 0.00 C ATOM 1592 NE ARG F 99 -9.505 10.584 -14.053 1.00 0.00 N ATOM 1593 CZ ARG F 99 -9.526 11.683 -13.349 1.00 0.00 C ATOM 1594 NH1 ARG F 99 -9.222 11.650 -12.080 1.00 0.00 N ATOM 1595 NH2 ARG F 99 -9.850 12.814 -13.913 1.00 0.00 N ATOM 0 H ARG F 99 -8.663 7.941 -10.449 1.00 0.00 H new ATOM 0 HA ARG F 99 -9.007 5.427 -11.297 1.00 0.00 H new ATOM 0 HB2 ARG F 99 -9.695 6.522 -13.585 1.00 0.00 H new ATOM 0 HB3 ARG F 99 -10.489 7.122 -12.142 1.00 0.00 H new ATOM 0 HG2 ARG F 99 -8.586 8.894 -12.012 1.00 0.00 H new ATOM 0 HG3 ARG F 99 -8.149 8.397 -13.635 1.00 0.00 H new ATOM 0 HD2 ARG F 99 -10.632 8.794 -14.278 1.00 0.00 H new ATOM 0 HD3 ARG F 99 -10.816 9.572 -12.718 1.00 0.00 H new ATOM 0 HE ARG F 99 -9.086 10.582 -14.983 1.00 0.00 H new ATOM 0 HH11 ARG F 99 -8.968 10.766 -11.639 1.00 0.00 H new ATOM 0 HH12 ARG F 99 -9.238 12.508 -11.529 1.00 0.00 H new ATOM 0 HH21 ARG F 99 -10.087 12.840 -14.905 1.00 0.00 H new ATOM 0 HH22 ARG F 99 -9.866 13.672 -13.362 1.00 0.00 H new ATOM 1609 N LEU F 100 -6.767 4.673 -12.270 1.00 0.00 N ATOM 1610 CA LEU F 100 -5.660 4.071 -13.082 1.00 0.00 C ATOM 1611 C LEU F 100 -4.861 5.174 -13.798 1.00 0.00 C ATOM 1612 O LEU F 100 -4.862 6.316 -13.382 1.00 0.00 O ATOM 1613 CB LEU F 100 -6.232 3.071 -14.112 1.00 0.00 C ATOM 1614 CG LEU F 100 -7.756 3.208 -14.249 1.00 0.00 C ATOM 1615 CD1 LEU F 100 -8.071 4.033 -15.496 1.00 0.00 C ATOM 1616 CD2 LEU F 100 -8.381 1.819 -14.387 1.00 0.00 C ATOM 0 H LEU F 100 -6.977 4.175 -11.405 1.00 0.00 H new ATOM 0 HA LEU F 100 -4.989 3.535 -12.411 1.00 0.00 H new ATOM 0 HB2 LEU F 100 -5.763 3.238 -15.081 1.00 0.00 H new ATOM 0 HB3 LEU F 100 -5.984 2.054 -13.809 1.00 0.00 H new ATOM 0 HG LEU F 100 -8.163 3.702 -13.367 1.00 0.00 H new ATOM 0 HD11 LEU F 100 -9.151 4.135 -15.601 1.00 0.00 H new ATOM 0 HD12 LEU F 100 -7.620 5.021 -15.402 1.00 0.00 H new ATOM 0 HD13 LEU F 100 -7.667 3.532 -16.375 1.00 0.00 H new ATOM 0 HD21 LEU F 100 -9.462 1.915 -14.484 1.00 0.00 H new ATOM 0 HD22 LEU F 100 -7.979 1.326 -15.272 1.00 0.00 H new ATOM 0 HD23 LEU F 100 -8.147 1.225 -13.503 1.00 0.00 H new ATOM 1628 N VAL F 101 -4.167 4.849 -14.859 1.00 0.00 N ATOM 1629 CA VAL F 101 -3.377 5.890 -15.572 1.00 0.00 C ATOM 1630 C VAL F 101 -4.269 7.099 -15.863 1.00 0.00 C ATOM 1631 O VAL F 101 -5.459 6.971 -16.072 1.00 0.00 O ATOM 1632 CB VAL F 101 -2.850 5.318 -16.888 1.00 0.00 C ATOM 1633 CG1 VAL F 101 -1.529 4.591 -16.633 1.00 0.00 C ATOM 1634 CG2 VAL F 101 -3.870 4.335 -17.468 1.00 0.00 C ATOM 0 H VAL F 101 -4.115 3.912 -15.259 1.00 0.00 H new ATOM 0 HA VAL F 101 -2.538 6.199 -14.948 1.00 0.00 H new ATOM 0 HB VAL F 101 -2.689 6.130 -17.597 1.00 0.00 H new ATOM 0 HG11 VAL F 101 -1.152 4.182 -17.570 1.00 0.00 H new ATOM 0 HG12 VAL F 101 -0.801 5.292 -16.224 1.00 0.00 H new ATOM 0 HG13 VAL F 101 -1.691 3.780 -15.923 1.00 0.00 H new ATOM 0 HG21 VAL F 101 -3.491 3.929 -18.406 1.00 0.00 H new ATOM 0 HG22 VAL F 101 -4.035 3.522 -16.761 1.00 0.00 H new ATOM 0 HG23 VAL F 101 -4.811 4.853 -17.651 1.00 0.00 H new ATOM 1644 N VAL F 102 -3.703 8.275 -15.875 1.00 0.00 N ATOM 1645 CA VAL F 102 -4.516 9.492 -16.150 1.00 0.00 C ATOM 1646 C VAL F 102 -4.722 9.668 -17.665 1.00 0.00 C ATOM 1647 O VAL F 102 -5.822 9.950 -18.096 1.00 0.00 O ATOM 1648 CB VAL F 102 -3.814 10.726 -15.568 1.00 0.00 C ATOM 1649 CG1 VAL F 102 -4.442 11.997 -16.144 1.00 0.00 C ATOM 1650 CG2 VAL F 102 -3.974 10.726 -14.046 1.00 0.00 C ATOM 0 H VAL F 102 -2.712 8.445 -15.706 1.00 0.00 H new ATOM 0 HA VAL F 102 -5.492 9.378 -15.678 1.00 0.00 H new ATOM 0 HB VAL F 102 -2.756 10.697 -15.828 1.00 0.00 H new ATOM 0 HG11 VAL F 102 -3.941 12.871 -15.728 1.00 0.00 H new ATOM 0 HG12 VAL F 102 -4.333 11.998 -17.229 1.00 0.00 H new ATOM 0 HG13 VAL F 102 -5.501 12.029 -15.886 1.00 0.00 H new ATOM 0 HG21 VAL F 102 -3.477 11.601 -13.628 1.00 0.00 H new ATOM 0 HG22 VAL F 102 -5.033 10.755 -13.792 1.00 0.00 H new ATOM 0 HG23 VAL F 102 -3.526 9.822 -13.633 1.00 0.00 H new ATOM 1797 N GLU P 205 -0.449 -0.411 -1.461 1.00 0.00 N ATOM 1798 CA GLU P 205 -1.429 0.604 -0.984 1.00 0.00 C ATOM 1799 C GLU P 205 -2.824 -0.022 -0.924 1.00 0.00 C ATOM 1800 O GLU P 205 -3.290 -0.614 -1.877 1.00 0.00 O ATOM 1801 CB GLU P 205 -1.444 1.790 -1.950 1.00 0.00 C ATOM 1802 CG GLU P 205 -0.652 2.952 -1.347 1.00 0.00 C ATOM 1803 CD GLU P 205 -1.592 4.130 -1.085 1.00 0.00 C ATOM 1804 OE1 GLU P 205 -2.633 4.183 -1.719 1.00 0.00 O ATOM 1805 OE2 GLU P 205 -1.255 4.958 -0.256 1.00 0.00 O ATOM 0 HA GLU P 205 -1.142 0.947 0.010 1.00 0.00 H new ATOM 0 HB2 GLU P 205 -1.010 1.499 -2.907 1.00 0.00 H new ATOM 0 HB3 GLU P 205 -2.471 2.099 -2.146 1.00 0.00 H new ATOM 0 HG2 GLU P 205 -0.177 2.638 -0.417 1.00 0.00 H new ATOM 0 HG3 GLU P 205 0.145 3.254 -2.026 1.00 0.00 H new ATOM 1812 N GLU P 206 -3.493 0.102 0.189 1.00 0.00 N ATOM 1813 CA GLU P 206 -4.856 -0.487 0.308 1.00 0.00 C ATOM 1814 C GLU P 206 -5.879 0.629 0.520 1.00 0.00 C ATOM 1815 O GLU P 206 -5.811 1.374 1.478 1.00 0.00 O ATOM 1816 CB GLU P 206 -4.895 -1.447 1.500 1.00 0.00 C ATOM 1817 CG GLU P 206 -4.291 -2.792 1.093 1.00 0.00 C ATOM 1818 CD GLU P 206 -5.195 -3.926 1.582 1.00 0.00 C ATOM 1819 OE1 GLU P 206 -6.362 -3.665 1.824 1.00 0.00 O ATOM 1820 OE2 GLU P 206 -4.704 -5.037 1.706 1.00 0.00 O ATOM 0 H GLU P 206 -3.155 0.586 1.021 1.00 0.00 H new ATOM 0 HA GLU P 206 -5.096 -1.031 -0.606 1.00 0.00 H new ATOM 0 HB2 GLU P 206 -4.340 -1.026 2.338 1.00 0.00 H new ATOM 0 HB3 GLU P 206 -5.923 -1.585 1.836 1.00 0.00 H new ATOM 0 HG2 GLU P 206 -4.182 -2.841 0.010 1.00 0.00 H new ATOM 0 HG3 GLU P 206 -3.293 -2.899 1.519 1.00 0.00 H new ATOM 1827 N ILE P 207 -6.829 0.752 -0.367 1.00 0.00 N ATOM 1828 CA ILE P 207 -7.856 1.821 -0.214 1.00 0.00 C ATOM 1829 C ILE P 207 -8.709 1.530 1.027 1.00 0.00 C ATOM 1830 O ILE P 207 -9.052 0.393 1.284 1.00 0.00 O ATOM 1831 CB ILE P 207 -8.750 1.845 -1.458 1.00 0.00 C ATOM 1832 CG1 ILE P 207 -7.960 2.417 -2.639 1.00 0.00 C ATOM 1833 CG2 ILE P 207 -9.976 2.722 -1.198 1.00 0.00 C ATOM 1834 CD1 ILE P 207 -7.617 1.293 -3.619 1.00 0.00 C ATOM 0 H ILE P 207 -6.938 0.159 -1.190 1.00 0.00 H new ATOM 0 HA ILE P 207 -7.367 2.788 -0.100 1.00 0.00 H new ATOM 0 HB ILE P 207 -9.075 0.830 -1.688 1.00 0.00 H new ATOM 0 HG12 ILE P 207 -8.545 3.186 -3.143 1.00 0.00 H new ATOM 0 HG13 ILE P 207 -7.047 2.893 -2.282 1.00 0.00 H new ATOM 0 HG21 ILE P 207 -10.608 2.736 -2.086 1.00 0.00 H new ATOM 0 HG22 ILE P 207 -10.540 2.319 -0.357 1.00 0.00 H new ATOM 0 HG23 ILE P 207 -9.654 3.737 -0.966 1.00 0.00 H new ATOM 0 HD11 ILE P 207 -7.055 1.701 -4.459 1.00 0.00 H new ATOM 0 HD12 ILE P 207 -7.015 0.539 -3.112 1.00 0.00 H new ATOM 0 HD13 ILE P 207 -8.537 0.837 -3.986 1.00 0.00 H new