USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 945 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 142 SER OG : rot 149:sc= -1.6 USER MOD Set 1.2: A 144 ASN : amide:sc= 0.073 K(o=-1.5,f=0.79) USER MOD Set 2.1: A 119 HIS : no HD1:sc= 1.22 K(o=3.1,f=-8.2!) USER MOD Set 2.2: A 131 HIS : no HD1:sc= 1.45 K(o=3.1,f=-13!) USER MOD Set 2.3: A 133 SER OG : rot -144:sc= -0.561 USER MOD Set 2.4: A 141 SER OG : rot -170:sc= 0.974 USER MOD Set 3.1: A 47 GLN : amide:sc= 0.0709 K(o=0.5,f=-4.2!) USER MOD Set 3.2: A 79 GLN : amide:sc= 0.432 K(o=0.5,f=-1.5) USER MOD Set 4.1: A 48 TYR OH : rot 166:sc= 0.385 USER MOD Set 4.2: A 52 LYS NZ :NH3+ -115:sc= 1.52 (180deg=-0.00517) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot -31:sc= 1.09 USER MOD Single : A 45 MET CE :methyl -174:sc= -0.135 (180deg=-0.274) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 40:sc= 0.716 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0395 USER MOD Single : A 63 LYS NZ :NH3+ 155:sc= 0.926 (180deg=-0.0569) USER MOD Single : A 64 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0292) USER MOD Single : A 68 CYS SG : rot 180:sc= -0.382 USER MOD Single : A 69 SER OG : rot -28:sc= 1.21 USER MOD Single : A 73 GLN : amide:sc= -3.52! K(o=-3.5!,f=-1.3) USER MOD Single : A 75 THR OG1 : rot 75:sc= 0.281 USER MOD Single : A 87 SER OG : rot 1:sc= 0.104 USER MOD Single : A 88 THR OG1 : rot 178:sc= -0.651 USER MOD Single : A 89 TYR OH : rot 80:sc= 0.0238 USER MOD Single : A 91 GLN : amide:sc= -0.202 K(o=-0.2,f=-6.6!) USER MOD Single : A 92 GLN : amide:sc= -1.16 K(o=-1.2,f=-2.8!) USER MOD Single : A 94 MET CE :methyl 143:sc= -0.324 (180deg=-1.59) USER MOD Single : A 96 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0427) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -0.316 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0527 X(o=-0.053,f=0) USER MOD Single : A 105 THR OG1 : rot -84:sc= 0.739 USER MOD Single : A 123 TYR OH : rot 180:sc= 0.994 USER MOD Single : A 126 ASN : amide:sc= -0.284 X(o=-0.28,f=-0.033) USER MOD Single : A 127 ASN : amide:sc= 0.163 K(o=0.16,f=-4.7!) USER MOD Single : A 128 GLN : amide:sc= -0.846 K(o=-0.85,f=0) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 143 MET CE :methyl -113:sc= -1.72 (180deg=-2.31) USER MOD Single : A 147 TYR OH : rot 180:sc= 0.543 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 TYR OH : rot 180:sc= -0.11 USER MOD Single : A 153 ASN : amide:sc= -2.85! X(o=-2.9!,f=-3) USER MOD ----------------------------------------------------------------- ATOM 50 N ASP A 39 -10.356 -14.137 2.582 1.00 31.34 N ATOM 51 CA ASP A 39 -9.898 -13.217 1.542 1.00 21.03 C ATOM 52 C ASP A 39 -9.013 -12.106 2.123 1.00 22.14 C ATOM 53 O ASP A 39 -9.511 -11.184 2.771 1.00 64.14 O ATOM 54 CB ASP A 39 -11.095 -12.589 0.821 1.00 72.42 C ATOM 55 CG ASP A 39 -12.024 -13.627 0.226 1.00 51.34 C ATOM 56 OD1 ASP A 39 -11.751 -14.098 -0.899 1.00 23.15 O ATOM 57 OD2 ASP A 39 -13.033 -13.968 0.877 1.00 34.35 O ATOM 0 HA ASP A 39 -9.305 -13.795 0.833 1.00 21.03 H new ATOM 0 HB2 ASP A 39 -11.652 -11.967 1.522 1.00 72.42 H new ATOM 0 HB3 ASP A 39 -10.734 -11.932 0.029 1.00 72.42 H new ATOM 62 N VAL A 40 -7.704 -12.202 1.894 1.00 43.42 N ATOM 63 CA VAL A 40 -6.771 -11.133 2.273 1.00 24.12 C ATOM 64 C VAL A 40 -7.292 -9.772 1.785 1.00 55.02 C ATOM 65 O VAL A 40 -7.250 -8.772 2.503 1.00 32.33 O ATOM 66 CB VAL A 40 -5.358 -11.397 1.681 1.00 11.35 C ATOM 67 CG1 VAL A 40 -4.400 -10.242 1.978 1.00 3.14 C ATOM 68 CG2 VAL A 40 -4.791 -12.715 2.206 1.00 35.10 C ATOM 0 H VAL A 40 -7.263 -13.007 1.449 1.00 43.42 H new ATOM 0 HA VAL A 40 -6.697 -11.119 3.360 1.00 24.12 H new ATOM 0 HB VAL A 40 -5.462 -11.470 0.598 1.00 11.35 H new ATOM 0 HG11 VAL A 40 -3.422 -10.461 1.549 1.00 3.14 H new ATOM 0 HG12 VAL A 40 -4.791 -9.323 1.540 1.00 3.14 H new ATOM 0 HG13 VAL A 40 -4.304 -10.117 3.057 1.00 3.14 H new ATOM 0 HG21 VAL A 40 -3.802 -12.881 1.780 1.00 35.10 H new ATOM 0 HG22 VAL A 40 -4.715 -12.671 3.292 1.00 35.10 H new ATOM 0 HG23 VAL A 40 -5.451 -13.534 1.921 1.00 35.10 H new ATOM 78 N LYS A 41 -7.821 -9.771 0.562 1.00 50.31 N ATOM 79 CA LYS A 41 -8.404 -8.576 -0.057 1.00 3.23 C ATOM 80 C LYS A 41 -9.526 -7.966 0.803 1.00 24.33 C ATOM 81 O LYS A 41 -9.567 -6.756 1.012 1.00 0.41 O ATOM 82 CB LYS A 41 -8.947 -8.944 -1.447 1.00 52.43 C ATOM 83 CG LYS A 41 -9.512 -7.769 -2.241 1.00 33.15 C ATOM 84 CD LYS A 41 -10.006 -8.219 -3.612 1.00 74.12 C ATOM 85 CE LYS A 41 -10.661 -7.084 -4.390 1.00 1.51 C ATOM 86 NZ LYS A 41 -11.223 -7.551 -5.688 1.00 72.25 N ATOM 0 H LYS A 41 -7.859 -10.600 -0.031 1.00 50.31 H new ATOM 0 HA LYS A 41 -7.621 -7.823 -0.144 1.00 3.23 H new ATOM 0 HB2 LYS A 41 -8.146 -9.404 -2.025 1.00 52.43 H new ATOM 0 HB3 LYS A 41 -9.728 -9.695 -1.330 1.00 52.43 H new ATOM 0 HG2 LYS A 41 -10.333 -7.313 -1.687 1.00 33.15 H new ATOM 0 HG3 LYS A 41 -8.744 -7.004 -2.361 1.00 33.15 H new ATOM 0 HD2 LYS A 41 -9.168 -8.614 -4.186 1.00 74.12 H new ATOM 0 HD3 LYS A 41 -10.721 -9.033 -3.489 1.00 74.12 H new ATOM 0 HE2 LYS A 41 -11.456 -6.643 -3.788 1.00 1.51 H new ATOM 0 HE3 LYS A 41 -9.927 -6.299 -4.574 1.00 1.51 H new ATOM 0 HZ1 LYS A 41 -11.659 -6.749 -6.186 1.00 72.25 H new ATOM 0 HZ2 LYS A 41 -10.461 -7.949 -6.273 1.00 72.25 H new ATOM 0 HZ3 LYS A 41 -11.942 -8.282 -5.512 1.00 72.25 H new ATOM 100 N SER A 42 -10.427 -8.808 1.315 1.00 71.31 N ATOM 101 CA SER A 42 -11.579 -8.323 2.097 1.00 60.14 C ATOM 102 C SER A 42 -11.132 -7.659 3.405 1.00 42.23 C ATOM 103 O SER A 42 -11.714 -6.661 3.833 1.00 63.23 O ATOM 104 CB SER A 42 -12.556 -9.467 2.413 1.00 72.22 C ATOM 105 OG SER A 42 -11.996 -10.388 3.338 1.00 15.34 O ATOM 0 H SER A 42 -10.387 -9.821 1.206 1.00 71.31 H new ATOM 0 HA SER A 42 -12.087 -7.579 1.483 1.00 60.14 H new ATOM 0 HB2 SER A 42 -13.480 -9.056 2.821 1.00 72.22 H new ATOM 0 HB3 SER A 42 -12.818 -9.988 1.492 1.00 72.22 H new ATOM 0 HG SER A 42 -11.024 -10.419 3.220 1.00 15.34 H new ATOM 111 N ARG A 43 -10.098 -8.213 4.040 1.00 54.15 N ATOM 112 CA ARG A 43 -9.558 -7.634 5.278 1.00 41.22 C ATOM 113 C ARG A 43 -8.820 -6.312 4.998 1.00 25.42 C ATOM 114 O ARG A 43 -8.910 -5.361 5.775 1.00 72.44 O ATOM 115 CB ARG A 43 -8.629 -8.632 5.989 1.00 75.35 C ATOM 116 CG ARG A 43 -9.286 -9.980 6.278 1.00 14.33 C ATOM 117 CD ARG A 43 -8.497 -10.796 7.298 1.00 4.10 C ATOM 118 NE ARG A 43 -8.615 -10.252 8.653 1.00 3.12 N ATOM 119 CZ ARG A 43 -8.162 -10.839 9.731 1.00 34.04 C ATOM 120 NH1 ARG A 43 -7.517 -11.963 9.655 1.00 33.55 N ATOM 121 NH2 ARG A 43 -8.357 -10.292 10.886 1.00 72.40 N ATOM 0 H ARG A 43 -9.618 -9.056 3.723 1.00 54.15 H new ATOM 0 HA ARG A 43 -10.398 -7.418 5.938 1.00 41.22 H new ATOM 0 HB2 ARG A 43 -7.744 -8.793 5.374 1.00 75.35 H new ATOM 0 HB3 ARG A 43 -8.289 -8.194 6.928 1.00 75.35 H new ATOM 0 HG2 ARG A 43 -10.298 -9.817 6.649 1.00 14.33 H new ATOM 0 HG3 ARG A 43 -9.374 -10.546 5.351 1.00 14.33 H new ATOM 0 HD2 ARG A 43 -8.853 -11.826 7.290 1.00 4.10 H new ATOM 0 HD3 ARG A 43 -7.447 -10.819 7.008 1.00 4.10 H new ATOM 0 HE ARG A 43 -9.083 -9.353 8.764 1.00 3.12 H new ATOM 0 HH11 ARG A 43 -7.358 -12.399 8.747 1.00 33.55 H new ATOM 0 HH12 ARG A 43 -7.169 -12.410 10.503 1.00 33.55 H new ATOM 0 HH21 ARG A 43 -8.861 -9.408 10.953 1.00 72.40 H new ATOM 0 HH22 ARG A 43 -8.006 -10.744 11.730 1.00 72.40 H new ATOM 135 N ILE A 44 -8.102 -6.250 3.876 1.00 44.54 N ATOM 136 CA ILE A 44 -7.457 -5.005 3.442 1.00 4.23 C ATOM 137 C ILE A 44 -8.508 -3.913 3.161 1.00 10.04 C ATOM 138 O ILE A 44 -8.371 -2.769 3.599 1.00 61.50 O ATOM 139 CB ILE A 44 -6.589 -5.226 2.174 1.00 42.50 C ATOM 140 CG1 ILE A 44 -5.480 -6.257 2.451 1.00 10.31 C ATOM 141 CG2 ILE A 44 -5.987 -3.905 1.690 1.00 11.05 C ATOM 142 CD1 ILE A 44 -4.686 -6.645 1.218 1.00 63.31 C ATOM 0 H ILE A 44 -7.951 -7.042 3.252 1.00 44.54 H new ATOM 0 HA ILE A 44 -6.808 -4.679 4.255 1.00 4.23 H new ATOM 0 HB ILE A 44 -7.232 -5.615 1.385 1.00 42.50 H new ATOM 0 HG12 ILE A 44 -4.798 -5.852 3.199 1.00 10.31 H new ATOM 0 HG13 ILE A 44 -5.928 -7.153 2.880 1.00 10.31 H new ATOM 0 HG21 ILE A 44 -5.383 -4.085 0.801 1.00 11.05 H new ATOM 0 HG22 ILE A 44 -6.788 -3.206 1.449 1.00 11.05 H new ATOM 0 HG23 ILE A 44 -5.360 -3.482 2.475 1.00 11.05 H new ATOM 0 HD11 ILE A 44 -3.923 -7.374 1.491 1.00 63.31 H new ATOM 0 HD12 ILE A 44 -5.356 -7.081 0.476 1.00 63.31 H new ATOM 0 HD13 ILE A 44 -4.208 -5.759 0.800 1.00 63.31 H new ATOM 154 N MET A 45 -9.566 -4.282 2.439 1.00 25.51 N ATOM 155 CA MET A 45 -10.663 -3.354 2.140 1.00 14.34 C ATOM 156 C MET A 45 -11.449 -2.989 3.413 1.00 2.30 C ATOM 157 O MET A 45 -12.008 -1.893 3.520 1.00 1.31 O ATOM 158 CB MET A 45 -11.599 -3.958 1.086 1.00 52.55 C ATOM 159 CG MET A 45 -10.909 -4.276 -0.240 1.00 22.14 C ATOM 160 SD MET A 45 -10.129 -2.834 -0.998 1.00 2.22 S ATOM 161 CE MET A 45 -11.550 -1.794 -1.322 1.00 54.31 C ATOM 0 H MET A 45 -9.689 -5.216 2.049 1.00 25.51 H new ATOM 0 HA MET A 45 -10.229 -2.437 1.741 1.00 14.34 H new ATOM 0 HB2 MET A 45 -12.039 -4.872 1.485 1.00 52.55 H new ATOM 0 HB3 MET A 45 -12.419 -3.264 0.901 1.00 52.55 H new ATOM 0 HG2 MET A 45 -10.154 -5.045 -0.074 1.00 22.14 H new ATOM 0 HG3 MET A 45 -11.641 -4.692 -0.933 1.00 22.14 H new ATOM 0 HE1 MET A 45 -11.237 -0.915 -1.885 1.00 54.31 H new ATOM 0 HE2 MET A 45 -12.285 -2.353 -1.901 1.00 54.31 H new ATOM 0 HE3 MET A 45 -11.994 -1.480 -0.377 1.00 54.31 H new ATOM 171 N ASP A 46 -11.490 -3.916 4.374 1.00 13.14 N ATOM 172 CA ASP A 46 -12.091 -3.656 5.687 1.00 62.04 C ATOM 173 C ASP A 46 -11.388 -2.470 6.367 1.00 54.42 C ATOM 174 O ASP A 46 -12.037 -1.573 6.913 1.00 43.33 O ATOM 175 CB ASP A 46 -11.986 -4.918 6.558 1.00 10.23 C ATOM 176 CG ASP A 46 -12.606 -4.748 7.935 1.00 24.35 C ATOM 177 OD1 ASP A 46 -13.849 -4.782 8.040 1.00 55.41 O ATOM 178 OD2 ASP A 46 -11.856 -4.580 8.919 1.00 64.05 O ATOM 0 H ASP A 46 -11.113 -4.858 4.267 1.00 13.14 H new ATOM 0 HA ASP A 46 -13.143 -3.401 5.559 1.00 62.04 H new ATOM 0 HB2 ASP A 46 -12.475 -5.747 6.046 1.00 10.23 H new ATOM 0 HB3 ASP A 46 -10.936 -5.188 6.670 1.00 10.23 H new ATOM 183 N GLN A 47 -10.060 -2.479 6.305 1.00 45.21 N ATOM 184 CA GLN A 47 -9.240 -1.377 6.814 1.00 73.42 C ATOM 185 C GLN A 47 -9.475 -0.088 6.006 1.00 52.44 C ATOM 186 O GLN A 47 -9.673 0.990 6.568 1.00 21.03 O ATOM 187 CB GLN A 47 -7.754 -1.764 6.750 1.00 3.00 C ATOM 188 CG GLN A 47 -6.811 -0.731 7.362 1.00 50.32 C ATOM 189 CD GLN A 47 -6.839 -0.721 8.880 1.00 65.34 C ATOM 190 OE1 GLN A 47 -7.847 -1.034 9.504 1.00 71.45 O ATOM 191 NE2 GLN A 47 -5.729 -0.360 9.487 1.00 35.31 N ATOM 0 H GLN A 47 -9.521 -3.246 5.903 1.00 45.21 H new ATOM 0 HA GLN A 47 -9.528 -1.188 7.848 1.00 73.42 H new ATOM 0 HB2 GLN A 47 -7.615 -2.715 7.264 1.00 3.00 H new ATOM 0 HB3 GLN A 47 -7.476 -1.921 5.708 1.00 3.00 H new ATOM 0 HG2 GLN A 47 -5.794 -0.932 7.025 1.00 50.32 H new ATOM 0 HG3 GLN A 47 -7.079 0.259 6.994 1.00 50.32 H new ATOM 0 HE21 GLN A 47 -4.907 -0.105 8.939 1.00 35.31 H new ATOM 0 HE22 GLN A 47 -5.690 -0.335 10.506 1.00 35.31 H new ATOM 200 N TYR A 48 -9.461 -0.214 4.678 1.00 31.42 N ATOM 201 CA TYR A 48 -9.665 0.928 3.775 1.00 1.33 C ATOM 202 C TYR A 48 -10.963 1.695 4.093 1.00 3.33 C ATOM 203 O TYR A 48 -10.991 2.925 4.040 1.00 24.42 O ATOM 204 CB TYR A 48 -9.674 0.444 2.315 1.00 44.44 C ATOM 205 CG TYR A 48 -10.039 1.517 1.298 1.00 14.43 C ATOM 206 CD1 TYR A 48 -9.321 2.709 1.211 1.00 1.13 C ATOM 207 CD2 TYR A 48 -11.110 1.337 0.427 1.00 20.31 C ATOM 208 CE1 TYR A 48 -9.661 3.682 0.288 1.00 30.01 C ATOM 209 CE2 TYR A 48 -11.454 2.306 -0.494 1.00 25.24 C ATOM 210 CZ TYR A 48 -10.728 3.475 -0.562 1.00 43.12 C ATOM 211 OH TYR A 48 -11.081 4.448 -1.474 1.00 73.11 O ATOM 0 H TYR A 48 -9.310 -1.101 4.198 1.00 31.42 H new ATOM 0 HA TYR A 48 -8.837 1.621 3.925 1.00 1.33 H new ATOM 0 HB2 TYR A 48 -8.688 0.049 2.070 1.00 44.44 H new ATOM 0 HB3 TYR A 48 -10.380 -0.381 2.223 1.00 44.44 H new ATOM 0 HD1 TYR A 48 -8.486 2.876 1.875 1.00 1.13 H new ATOM 0 HD2 TYR A 48 -11.682 0.422 0.473 1.00 20.31 H new ATOM 0 HE1 TYR A 48 -9.094 4.599 0.233 1.00 30.01 H new ATOM 0 HE2 TYR A 48 -12.290 2.148 -1.159 1.00 25.24 H new ATOM 0 HH TYR A 48 -11.691 4.067 -2.139 1.00 73.11 H new ATOM 221 N ALA A 49 -12.029 0.967 4.431 1.00 22.33 N ATOM 222 CA ALA A 49 -13.316 1.592 4.778 1.00 34.41 C ATOM 223 C ALA A 49 -13.199 2.492 6.021 1.00 53.33 C ATOM 224 O ALA A 49 -13.971 3.441 6.191 1.00 44.43 O ATOM 225 CB ALA A 49 -14.382 0.524 4.988 1.00 51.43 C ATOM 0 H ALA A 49 -12.031 -0.052 4.473 1.00 22.33 H new ATOM 0 HA ALA A 49 -13.611 2.228 3.943 1.00 34.41 H new ATOM 0 HB1 ALA A 49 -15.329 1.000 5.244 1.00 51.43 H new ATOM 0 HB2 ALA A 49 -14.503 -0.055 4.072 1.00 51.43 H new ATOM 0 HB3 ALA A 49 -14.078 -0.139 5.798 1.00 51.43 H new ATOM 231 N ASP A 50 -12.231 2.190 6.883 1.00 62.43 N ATOM 232 CA ASP A 50 -11.976 2.987 8.088 1.00 71.35 C ATOM 233 C ASP A 50 -11.181 4.265 7.750 1.00 44.23 C ATOM 234 O ASP A 50 -11.378 5.319 8.356 1.00 73.12 O ATOM 235 CB ASP A 50 -11.208 2.136 9.111 1.00 11.35 C ATOM 236 CG ASP A 50 -10.962 2.850 10.431 1.00 71.14 C ATOM 237 OD1 ASP A 50 -11.867 3.568 10.911 1.00 1.41 O ATOM 238 OD2 ASP A 50 -9.871 2.676 11.017 1.00 32.42 O ATOM 0 H ASP A 50 -11.604 1.393 6.771 1.00 62.43 H new ATOM 0 HA ASP A 50 -12.932 3.292 8.514 1.00 71.35 H new ATOM 0 HB2 ASP A 50 -11.766 1.219 9.301 1.00 11.35 H new ATOM 0 HB3 ASP A 50 -10.250 1.843 8.682 1.00 11.35 H new ATOM 243 N TRP A 51 -10.297 4.163 6.761 1.00 64.05 N ATOM 244 CA TRP A 51 -9.418 5.277 6.374 1.00 62.33 C ATOM 245 C TRP A 51 -9.944 6.041 5.146 1.00 61.41 C ATOM 246 O TRP A 51 -9.191 6.733 4.455 1.00 41.52 O ATOM 247 CB TRP A 51 -8.006 4.740 6.128 1.00 32.10 C ATOM 248 CG TRP A 51 -7.369 4.219 7.385 1.00 42.33 C ATOM 249 CD1 TRP A 51 -7.513 2.973 7.930 1.00 34.34 C ATOM 250 CD2 TRP A 51 -6.504 4.945 8.262 1.00 64.33 C ATOM 251 NE1 TRP A 51 -6.789 2.885 9.095 1.00 52.23 N ATOM 252 CE2 TRP A 51 -6.160 4.082 9.319 1.00 73.04 C ATOM 253 CE3 TRP A 51 -5.986 6.243 8.254 1.00 34.23 C ATOM 254 CZ2 TRP A 51 -5.324 4.478 10.357 1.00 63.40 C ATOM 255 CZ3 TRP A 51 -5.156 6.633 9.286 1.00 3.43 C ATOM 256 CH2 TRP A 51 -4.831 5.753 10.324 1.00 31.23 C ATOM 0 H TRP A 51 -10.166 3.317 6.206 1.00 64.05 H new ATOM 0 HA TRP A 51 -9.398 5.997 7.192 1.00 62.33 H new ATOM 0 HB2 TRP A 51 -8.047 3.942 5.386 1.00 32.10 H new ATOM 0 HB3 TRP A 51 -7.386 5.533 5.710 1.00 32.10 H new ATOM 0 HD1 TRP A 51 -8.107 2.176 7.508 1.00 34.34 H new ATOM 0 HE1 TRP A 51 -6.729 2.063 9.695 1.00 52.23 H new ATOM 0 HE3 TRP A 51 -6.230 6.928 7.456 1.00 34.23 H new ATOM 0 HZ2 TRP A 51 -5.073 3.802 11.161 1.00 63.40 H new ATOM 0 HZ3 TRP A 51 -4.751 7.634 9.292 1.00 3.43 H new ATOM 0 HH2 TRP A 51 -4.177 6.088 11.116 1.00 31.23 H new ATOM 267 N LYS A 52 -11.245 5.941 4.904 1.00 12.12 N ATOM 268 CA LYS A 52 -11.891 6.657 3.800 1.00 54.22 C ATOM 269 C LYS A 52 -11.817 8.182 3.980 1.00 63.45 C ATOM 270 O LYS A 52 -12.311 8.731 4.968 1.00 52.32 O ATOM 271 CB LYS A 52 -13.358 6.220 3.672 1.00 25.44 C ATOM 272 CG LYS A 52 -13.527 4.804 3.136 1.00 73.24 C ATOM 273 CD LYS A 52 -13.018 4.682 1.701 1.00 71.21 C ATOM 274 CE LYS A 52 -13.798 5.571 0.739 1.00 63.34 C ATOM 275 NZ LYS A 52 -13.203 5.582 -0.624 1.00 41.52 N ATOM 0 H LYS A 52 -11.881 5.368 5.459 1.00 12.12 H new ATOM 0 HA LYS A 52 -11.351 6.403 2.888 1.00 54.22 H new ATOM 0 HB2 LYS A 52 -13.836 6.289 4.649 1.00 25.44 H new ATOM 0 HB3 LYS A 52 -13.879 6.914 3.013 1.00 25.44 H new ATOM 0 HG2 LYS A 52 -12.987 4.105 3.775 1.00 73.24 H new ATOM 0 HG3 LYS A 52 -14.579 4.523 3.175 1.00 73.24 H new ATOM 0 HD2 LYS A 52 -11.962 4.951 1.667 1.00 71.21 H new ATOM 0 HD3 LYS A 52 -13.093 3.644 1.377 1.00 71.21 H new ATOM 0 HE2 LYS A 52 -14.829 5.223 0.681 1.00 63.34 H new ATOM 0 HE3 LYS A 52 -13.827 6.588 1.129 1.00 63.34 H new ATOM 0 HZ1 LYS A 52 -12.852 6.537 -0.842 1.00 41.52 H new ATOM 0 HZ2 LYS A 52 -12.414 4.906 -0.664 1.00 41.52 H new ATOM 0 HZ3 LYS A 52 -13.926 5.311 -1.321 1.00 41.52 H new ATOM 289 N GLY A 53 -11.191 8.858 3.016 1.00 44.43 N ATOM 290 CA GLY A 53 -11.128 10.316 3.030 1.00 23.40 C ATOM 291 C GLY A 53 -10.111 10.896 4.011 1.00 21.30 C ATOM 292 O GLY A 53 -10.216 12.062 4.397 1.00 61.31 O ATOM 0 H GLY A 53 -10.724 8.421 2.222 1.00 44.43 H new ATOM 0 HA2 GLY A 53 -10.887 10.666 2.026 1.00 23.40 H new ATOM 0 HA3 GLY A 53 -12.115 10.708 3.276 1.00 23.40 H new ATOM 296 N VAL A 54 -9.129 10.098 4.425 1.00 53.24 N ATOM 297 CA VAL A 54 -8.069 10.589 5.315 1.00 64.24 C ATOM 298 C VAL A 54 -6.957 11.291 4.514 1.00 61.14 C ATOM 299 O VAL A 54 -6.465 10.764 3.514 1.00 42.53 O ATOM 300 CB VAL A 54 -7.459 9.444 6.162 1.00 62.22 C ATOM 301 CG1 VAL A 54 -6.296 9.951 7.018 1.00 32.15 C ATOM 302 CG2 VAL A 54 -8.532 8.793 7.036 1.00 74.45 C ATOM 0 H VAL A 54 -9.042 9.116 4.163 1.00 53.24 H new ATOM 0 HA VAL A 54 -8.529 11.310 5.991 1.00 64.24 H new ATOM 0 HB VAL A 54 -7.067 8.690 5.479 1.00 62.22 H new ATOM 0 HG11 VAL A 54 -5.887 9.126 7.602 1.00 32.15 H new ATOM 0 HG12 VAL A 54 -5.519 10.358 6.371 1.00 32.15 H new ATOM 0 HG13 VAL A 54 -6.653 10.730 7.691 1.00 32.15 H new ATOM 0 HG21 VAL A 54 -8.085 7.991 7.624 1.00 74.45 H new ATOM 0 HG22 VAL A 54 -8.958 9.540 7.706 1.00 74.45 H new ATOM 0 HG23 VAL A 54 -9.318 8.383 6.402 1.00 74.45 H new ATOM 312 N ARG A 55 -6.578 12.487 4.964 1.00 51.24 N ATOM 313 CA ARG A 55 -5.559 13.296 4.281 1.00 14.12 C ATOM 314 C ARG A 55 -4.128 12.796 4.555 1.00 40.52 C ATOM 315 O ARG A 55 -3.882 12.044 5.502 1.00 21.41 O ATOM 316 CB ARG A 55 -5.702 14.769 4.688 1.00 5.10 C ATOM 317 CG ARG A 55 -5.662 15.012 6.195 1.00 11.24 C ATOM 318 CD ARG A 55 -5.874 16.484 6.523 1.00 51.24 C ATOM 319 NE ARG A 55 -5.913 16.740 7.961 1.00 41.22 N ATOM 320 CZ ARG A 55 -6.170 17.910 8.482 1.00 12.05 C ATOM 321 NH1 ARG A 55 -6.415 18.929 7.720 1.00 12.31 N ATOM 322 NH2 ARG A 55 -6.189 18.060 9.767 1.00 25.44 N ATOM 0 H ARG A 55 -6.962 12.922 5.803 1.00 51.24 H new ATOM 0 HA ARG A 55 -5.727 13.196 3.209 1.00 14.12 H new ATOM 0 HB2 ARG A 55 -4.903 15.343 4.218 1.00 5.10 H new ATOM 0 HB3 ARG A 55 -6.644 15.153 4.295 1.00 5.10 H new ATOM 0 HG2 ARG A 55 -6.432 14.414 6.683 1.00 11.24 H new ATOM 0 HG3 ARG A 55 -4.702 14.683 6.593 1.00 11.24 H new ATOM 0 HD2 ARG A 55 -5.072 17.071 6.075 1.00 51.24 H new ATOM 0 HD3 ARG A 55 -6.807 16.822 6.072 1.00 51.24 H new ATOM 0 HE ARG A 55 -5.729 15.961 8.594 1.00 41.22 H new ATOM 0 HH11 ARG A 55 -6.408 18.821 6.706 1.00 12.31 H new ATOM 0 HH12 ARG A 55 -6.615 19.839 8.134 1.00 12.31 H new ATOM 0 HH21 ARG A 55 -6.003 17.263 10.376 1.00 25.44 H new ATOM 0 HH22 ARG A 55 -6.390 18.975 10.171 1.00 25.44 H new ATOM 336 N TYR A 56 -3.186 13.241 3.724 1.00 64.25 N ATOM 337 CA TYR A 56 -1.801 12.761 3.782 1.00 42.21 C ATOM 338 C TYR A 56 -0.926 13.601 4.736 1.00 30.32 C ATOM 339 O TYR A 56 -1.047 14.828 4.811 1.00 31.44 O ATOM 340 CB TYR A 56 -1.199 12.770 2.368 1.00 74.33 C ATOM 341 CG TYR A 56 0.174 12.127 2.255 1.00 75.33 C ATOM 342 CD1 TYR A 56 1.334 12.860 2.486 1.00 33.35 C ATOM 343 CD2 TYR A 56 0.309 10.785 1.909 1.00 74.11 C ATOM 344 CE1 TYR A 56 2.583 12.279 2.374 1.00 52.44 C ATOM 345 CE2 TYR A 56 1.554 10.198 1.797 1.00 13.24 C ATOM 346 CZ TYR A 56 2.686 10.950 2.031 1.00 64.02 C ATOM 347 OH TYR A 56 3.930 10.366 1.922 1.00 43.43 O ATOM 0 H TYR A 56 -3.356 13.937 2.998 1.00 64.25 H new ATOM 0 HA TYR A 56 -1.818 11.745 4.177 1.00 42.21 H new ATOM 0 HB2 TYR A 56 -1.883 12.254 1.694 1.00 74.33 H new ATOM 0 HB3 TYR A 56 -1.131 13.802 2.024 1.00 74.33 H new ATOM 0 HD1 TYR A 56 1.257 13.902 2.758 1.00 33.35 H new ATOM 0 HD2 TYR A 56 -0.575 10.193 1.725 1.00 74.11 H new ATOM 0 HE1 TYR A 56 3.473 12.864 2.554 1.00 52.44 H new ATOM 0 HE2 TYR A 56 1.641 9.156 1.528 1.00 13.24 H new ATOM 0 HH TYR A 56 3.828 9.423 1.674 1.00 43.43 H new ATOM 357 N ARG A 57 -0.041 12.917 5.455 1.00 71.23 N ATOM 358 CA ARG A 57 0.929 13.558 6.349 1.00 61.34 C ATOM 359 C ARG A 57 2.343 13.034 6.070 1.00 23.34 C ATOM 360 O ARG A 57 2.556 11.831 5.997 1.00 2.54 O ATOM 361 CB ARG A 57 0.555 13.289 7.812 1.00 51.43 C ATOM 362 CG ARG A 57 1.642 13.661 8.817 1.00 1.11 C ATOM 363 CD ARG A 57 1.215 13.368 10.252 1.00 1.22 C ATOM 364 NE ARG A 57 2.280 13.657 11.212 1.00 73.43 N ATOM 365 CZ ARG A 57 2.354 13.140 12.411 1.00 41.45 C ATOM 366 NH1 ARG A 57 1.442 12.324 12.839 1.00 43.42 N ATOM 367 NH2 ARG A 57 3.349 13.439 13.176 1.00 0.21 N ATOM 0 H ARG A 57 0.027 11.899 5.437 1.00 71.23 H new ATOM 0 HA ARG A 57 0.910 14.632 6.166 1.00 61.34 H new ATOM 0 HB2 ARG A 57 -0.351 13.846 8.052 1.00 51.43 H new ATOM 0 HB3 ARG A 57 0.318 12.231 7.926 1.00 51.43 H new ATOM 0 HG2 ARG A 57 2.552 13.107 8.589 1.00 1.11 H new ATOM 0 HG3 ARG A 57 1.881 14.720 8.718 1.00 1.11 H new ATOM 0 HD2 ARG A 57 0.335 13.963 10.497 1.00 1.22 H new ATOM 0 HD3 ARG A 57 0.925 12.321 10.337 1.00 1.22 H new ATOM 0 HE ARG A 57 3.014 14.305 10.927 1.00 73.43 H new ATOM 0 HH11 ARG A 57 0.655 12.078 12.238 1.00 43.42 H new ATOM 0 HH12 ARG A 57 1.512 11.928 13.776 1.00 43.42 H new ATOM 0 HH21 ARG A 57 4.073 14.076 12.845 1.00 0.21 H new ATOM 0 HH22 ARG A 57 3.411 13.038 14.112 1.00 0.21 H new ATOM 381 N LEU A 58 3.309 13.931 5.923 1.00 60.43 N ATOM 382 CA LEU A 58 4.688 13.523 5.636 1.00 52.23 C ATOM 383 C LEU A 58 5.385 12.977 6.895 1.00 1.21 C ATOM 384 O LEU A 58 5.929 13.737 7.699 1.00 5.52 O ATOM 385 CB LEU A 58 5.494 14.690 5.041 1.00 32.20 C ATOM 386 CG LEU A 58 5.091 15.119 3.615 1.00 45.22 C ATOM 387 CD1 LEU A 58 3.683 15.712 3.583 1.00 53.24 C ATOM 388 CD2 LEU A 58 6.102 16.109 3.050 1.00 32.23 C ATOM 0 H LEU A 58 3.171 14.939 5.996 1.00 60.43 H new ATOM 0 HA LEU A 58 4.645 12.721 4.899 1.00 52.23 H new ATOM 0 HB2 LEU A 58 5.395 15.551 5.702 1.00 32.20 H new ATOM 0 HB3 LEU A 58 6.548 14.414 5.034 1.00 32.20 H new ATOM 0 HG LEU A 58 5.087 14.226 2.989 1.00 45.22 H new ATOM 0 HD11 LEU A 58 3.434 16.003 2.562 1.00 53.24 H new ATOM 0 HD12 LEU A 58 2.967 14.969 3.934 1.00 53.24 H new ATOM 0 HD13 LEU A 58 3.642 16.588 4.230 1.00 53.24 H new ATOM 0 HD21 LEU A 58 5.802 16.401 2.044 1.00 32.23 H new ATOM 0 HD22 LEU A 58 6.142 16.992 3.687 1.00 32.23 H new ATOM 0 HD23 LEU A 58 7.087 15.643 3.014 1.00 32.23 H new ATOM 400 N GLY A 59 5.332 11.656 7.071 1.00 42.30 N ATOM 401 CA GLY A 59 6.000 11.014 8.200 1.00 42.03 C ATOM 402 C GLY A 59 5.190 11.070 9.491 1.00 60.14 C ATOM 403 O GLY A 59 5.529 11.810 10.417 1.00 71.35 O ATOM 0 H GLY A 59 4.837 11.015 6.451 1.00 42.30 H new ATOM 0 HA2 GLY A 59 6.201 9.972 7.950 1.00 42.03 H new ATOM 0 HA3 GLY A 59 6.965 11.494 8.363 1.00 42.03 H new ATOM 407 N GLY A 60 4.111 10.298 9.554 1.00 25.23 N ATOM 408 CA GLY A 60 3.302 10.240 10.765 1.00 22.33 C ATOM 409 C GLY A 60 2.019 9.439 10.591 1.00 4.03 C ATOM 410 O GLY A 60 1.346 9.544 9.565 1.00 22.42 O ATOM 0 H GLY A 60 3.779 9.710 8.790 1.00 25.23 H new ATOM 0 HA2 GLY A 60 3.892 9.798 11.568 1.00 22.33 H new ATOM 0 HA3 GLY A 60 3.050 11.254 11.075 1.00 22.33 H new ATOM 414 N SER A 61 1.662 8.651 11.606 1.00 14.01 N ATOM 415 CA SER A 61 0.486 7.771 11.522 1.00 70.21 C ATOM 416 C SER A 61 -0.660 8.227 12.440 1.00 33.42 C ATOM 417 O SER A 61 -0.640 7.994 13.650 1.00 41.35 O ATOM 418 CB SER A 61 0.870 6.324 11.861 1.00 1.13 C ATOM 419 OG SER A 61 1.379 6.209 13.186 1.00 53.13 O ATOM 0 H SER A 61 2.164 8.601 12.492 1.00 14.01 H new ATOM 0 HA SER A 61 0.129 7.827 10.494 1.00 70.21 H new ATOM 0 HB2 SER A 61 -0.003 5.681 11.750 1.00 1.13 H new ATOM 0 HB3 SER A 61 1.619 5.971 11.152 1.00 1.13 H new ATOM 0 HG SER A 61 0.859 6.783 13.787 1.00 53.13 H new ATOM 425 N THR A 62 -1.657 8.882 11.851 1.00 42.10 N ATOM 426 CA THR A 62 -2.892 9.245 12.565 1.00 73.33 C ATOM 427 C THR A 62 -4.073 9.365 11.599 1.00 73.10 C ATOM 428 O THR A 62 -3.899 9.694 10.426 1.00 51.22 O ATOM 429 CB THR A 62 -2.757 10.566 13.367 1.00 41.12 C ATOM 430 OG1 THR A 62 -4.053 11.001 13.823 1.00 35.34 O ATOM 431 CG2 THR A 62 -2.110 11.666 12.533 1.00 15.23 C ATOM 0 H THR A 62 -1.639 9.177 10.875 1.00 42.10 H new ATOM 0 HA THR A 62 -3.075 8.437 13.274 1.00 73.33 H new ATOM 0 HB THR A 62 -2.113 10.369 14.224 1.00 41.12 H new ATOM 0 HG1 THR A 62 -3.959 11.834 14.330 1.00 35.34 H new ATOM 0 HG21 THR A 62 -2.032 12.576 13.128 1.00 15.23 H new ATOM 0 HG22 THR A 62 -1.114 11.349 12.223 1.00 15.23 H new ATOM 0 HG23 THR A 62 -2.720 11.860 11.651 1.00 15.23 H new ATOM 439 N LYS A 63 -5.279 9.111 12.103 1.00 72.11 N ATOM 440 CA LYS A 63 -6.484 9.110 11.265 1.00 1.42 C ATOM 441 C LYS A 63 -6.860 10.531 10.800 1.00 70.52 C ATOM 442 O LYS A 63 -7.775 10.715 10.000 1.00 20.52 O ATOM 443 CB LYS A 63 -7.648 8.443 12.020 1.00 40.13 C ATOM 444 CG LYS A 63 -8.876 8.150 11.153 1.00 24.25 C ATOM 445 CD LYS A 63 -9.815 7.141 11.814 1.00 72.32 C ATOM 446 CE LYS A 63 -9.132 5.787 12.017 1.00 2.53 C ATOM 447 NZ LYS A 63 -10.036 4.788 12.645 1.00 44.43 N ATOM 0 H LYS A 63 -5.451 8.903 13.087 1.00 72.11 H new ATOM 0 HA LYS A 63 -6.272 8.531 10.366 1.00 1.42 H new ATOM 0 HB2 LYS A 63 -7.295 7.509 12.456 1.00 40.13 H new ATOM 0 HB3 LYS A 63 -7.947 9.088 12.846 1.00 40.13 H new ATOM 0 HG2 LYS A 63 -9.416 9.078 10.963 1.00 24.25 H new ATOM 0 HG3 LYS A 63 -8.553 7.765 10.185 1.00 24.25 H new ATOM 0 HD2 LYS A 63 -10.148 7.529 12.776 1.00 72.32 H new ATOM 0 HD3 LYS A 63 -10.704 7.012 11.197 1.00 72.32 H new ATOM 0 HE2 LYS A 63 -8.788 5.408 11.055 1.00 2.53 H new ATOM 0 HE3 LYS A 63 -8.249 5.918 12.642 1.00 2.53 H new ATOM 0 HZ1 LYS A 63 -9.724 3.829 12.390 1.00 44.43 H new ATOM 0 HZ2 LYS A 63 -10.009 4.897 13.679 1.00 44.43 H new ATOM 0 HZ3 LYS A 63 -11.008 4.938 12.306 1.00 44.43 H new ATOM 461 N LYS A 64 -6.137 11.535 11.301 1.00 5.34 N ATOM 462 CA LYS A 64 -6.325 12.922 10.857 1.00 51.34 C ATOM 463 C LYS A 64 -5.162 13.383 9.954 1.00 22.10 C ATOM 464 O LYS A 64 -4.991 14.579 9.699 1.00 74.20 O ATOM 465 CB LYS A 64 -6.457 13.855 12.072 1.00 33.03 C ATOM 466 CG LYS A 64 -7.593 13.475 13.023 1.00 40.55 C ATOM 467 CD LYS A 64 -8.918 13.302 12.279 1.00 35.21 C ATOM 468 CE LYS A 64 -10.067 12.953 13.219 1.00 63.42 C ATOM 469 NZ LYS A 64 -10.428 14.086 14.113 1.00 13.32 N ATOM 0 H LYS A 64 -5.417 11.416 12.013 1.00 5.34 H new ATOM 0 HA LYS A 64 -7.243 12.967 10.272 1.00 51.34 H new ATOM 0 HB2 LYS A 64 -5.517 13.852 12.624 1.00 33.03 H new ATOM 0 HB3 LYS A 64 -6.616 14.874 11.720 1.00 33.03 H new ATOM 0 HG2 LYS A 64 -7.341 12.548 13.539 1.00 40.55 H new ATOM 0 HG3 LYS A 64 -7.702 14.245 13.786 1.00 40.55 H new ATOM 0 HD2 LYS A 64 -9.155 14.222 11.745 1.00 35.21 H new ATOM 0 HD3 LYS A 64 -8.812 12.517 11.530 1.00 35.21 H new ATOM 0 HE2 LYS A 64 -10.939 12.664 12.632 1.00 63.42 H new ATOM 0 HE3 LYS A 64 -9.789 12.090 13.824 1.00 63.42 H new ATOM 0 HZ1 LYS A 64 -11.276 13.839 14.661 1.00 13.32 H new ATOM 0 HZ2 LYS A 64 -9.640 14.280 14.763 1.00 13.32 H new ATOM 0 HZ3 LYS A 64 -10.621 14.932 13.540 1.00 13.32 H new ATOM 483 N GLY A 65 -4.378 12.422 9.469 1.00 4.03 N ATOM 484 CA GLY A 65 -3.241 12.719 8.600 1.00 43.12 C ATOM 485 C GLY A 65 -2.191 11.613 8.628 1.00 73.22 C ATOM 486 O GLY A 65 -1.472 11.463 9.615 1.00 33.24 O ATOM 0 H GLY A 65 -4.510 11.429 9.664 1.00 4.03 H new ATOM 0 HA2 GLY A 65 -3.593 12.857 7.578 1.00 43.12 H new ATOM 0 HA3 GLY A 65 -2.785 13.659 8.910 1.00 43.12 H new ATOM 490 N ILE A 66 -2.083 10.844 7.545 1.00 63.52 N ATOM 491 CA ILE A 66 -1.179 9.685 7.516 1.00 45.24 C ATOM 492 C ILE A 66 -0.425 9.576 6.172 1.00 15.33 C ATOM 493 O ILE A 66 -0.912 10.040 5.142 1.00 65.03 O ATOM 494 CB ILE A 66 -1.973 8.379 7.788 1.00 11.23 C ATOM 495 CG1 ILE A 66 -1.026 7.192 8.014 1.00 71.31 C ATOM 496 CG2 ILE A 66 -2.947 8.084 6.643 1.00 70.11 C ATOM 497 CD1 ILE A 66 -1.733 5.941 8.479 1.00 43.54 C ATOM 0 H ILE A 66 -2.603 10.997 6.681 1.00 63.52 H new ATOM 0 HA ILE A 66 -0.437 9.829 8.301 1.00 45.24 H new ATOM 0 HB ILE A 66 -2.552 8.525 8.700 1.00 11.23 H new ATOM 0 HG12 ILE A 66 -0.496 6.977 7.086 1.00 71.31 H new ATOM 0 HG13 ILE A 66 -0.275 7.472 8.752 1.00 71.31 H new ATOM 0 HG21 ILE A 66 -3.492 7.164 6.856 1.00 70.11 H new ATOM 0 HG22 ILE A 66 -3.653 8.909 6.544 1.00 70.11 H new ATOM 0 HG23 ILE A 66 -2.391 7.969 5.713 1.00 70.11 H new ATOM 0 HD11 ILE A 66 -1.005 5.142 8.619 1.00 43.54 H new ATOM 0 HD12 ILE A 66 -2.240 6.139 9.423 1.00 43.54 H new ATOM 0 HD13 ILE A 66 -2.465 5.637 7.731 1.00 43.54 H new ATOM 509 N ASP A 67 0.777 8.991 6.192 1.00 50.41 N ATOM 510 CA ASP A 67 1.566 8.805 4.965 1.00 35.54 C ATOM 511 C ASP A 67 1.358 7.408 4.343 1.00 25.22 C ATOM 512 O ASP A 67 0.593 6.587 4.857 1.00 63.43 O ATOM 513 CB ASP A 67 3.057 9.040 5.248 1.00 71.01 C ATOM 514 CG ASP A 67 3.620 8.042 6.236 1.00 21.34 C ATOM 515 OD1 ASP A 67 3.460 8.253 7.454 1.00 20.43 O ATOM 516 OD2 ASP A 67 4.218 7.045 5.793 1.00 61.21 O ATOM 0 H ASP A 67 1.225 8.639 7.038 1.00 50.41 H new ATOM 0 HA ASP A 67 1.214 9.540 4.242 1.00 35.54 H new ATOM 0 HB2 ASP A 67 3.616 8.978 4.314 1.00 71.01 H new ATOM 0 HB3 ASP A 67 3.196 10.049 5.636 1.00 71.01 H new ATOM 521 N CYS A 68 2.054 7.152 3.234 1.00 0.33 N ATOM 522 CA CYS A 68 1.931 5.884 2.500 1.00 31.31 C ATOM 523 C CYS A 68 2.391 4.682 3.346 1.00 22.30 C ATOM 524 O CYS A 68 1.633 3.729 3.548 1.00 5.22 O ATOM 525 CB CYS A 68 2.741 5.946 1.197 1.00 21.03 C ATOM 526 SG CYS A 68 4.506 6.260 1.435 1.00 45.11 S ATOM 0 H CYS A 68 2.714 7.809 2.819 1.00 0.33 H new ATOM 0 HA CYS A 68 0.875 5.742 2.268 1.00 31.31 H new ATOM 0 HB2 CYS A 68 2.620 5.004 0.662 1.00 21.03 H new ATOM 0 HB3 CYS A 68 2.327 6.729 0.562 1.00 21.03 H new ATOM 0 HG CYS A 68 5.101 6.292 0.279 1.00 45.11 H new ATOM 532 N SER A 69 3.631 4.734 3.844 1.00 11.22 N ATOM 533 CA SER A 69 4.183 3.635 4.659 1.00 62.53 C ATOM 534 C SER A 69 3.431 3.511 5.990 1.00 21.53 C ATOM 535 O SER A 69 3.326 2.420 6.558 1.00 21.22 O ATOM 536 CB SER A 69 5.688 3.822 4.924 1.00 21.41 C ATOM 537 OG SER A 69 5.951 4.906 5.802 1.00 61.01 O ATOM 0 H SER A 69 4.270 5.516 3.701 1.00 11.22 H new ATOM 0 HA SER A 69 4.051 2.716 4.088 1.00 62.53 H new ATOM 0 HB2 SER A 69 6.096 2.905 5.350 1.00 21.41 H new ATOM 0 HB3 SER A 69 6.203 3.991 3.978 1.00 21.41 H new ATOM 0 HG SER A 69 5.242 5.577 5.715 1.00 61.01 H new ATOM 543 N GLY A 70 2.907 4.633 6.472 1.00 31.42 N ATOM 544 CA GLY A 70 2.085 4.639 7.671 1.00 54.40 C ATOM 545 C GLY A 70 0.766 3.896 7.487 1.00 44.45 C ATOM 546 O GLY A 70 0.355 3.120 8.354 1.00 72.10 O ATOM 0 H GLY A 70 3.039 5.551 6.047 1.00 31.42 H new ATOM 0 HA2 GLY A 70 2.642 4.184 8.490 1.00 54.40 H new ATOM 0 HA3 GLY A 70 1.879 5.670 7.960 1.00 54.40 H new ATOM 550 N PHE A 71 0.095 4.136 6.360 1.00 50.13 N ATOM 551 CA PHE A 71 -1.167 3.453 6.052 1.00 70.50 C ATOM 552 C PHE A 71 -0.965 1.935 5.936 1.00 11.54 C ATOM 553 O PHE A 71 -1.665 1.149 6.582 1.00 44.23 O ATOM 554 CB PHE A 71 -1.777 4.008 4.752 1.00 42.00 C ATOM 555 CG PHE A 71 -3.028 3.285 4.316 1.00 32.15 C ATOM 556 CD1 PHE A 71 -4.211 3.423 5.029 1.00 5.14 C ATOM 557 CD2 PHE A 71 -3.019 2.462 3.196 1.00 75.41 C ATOM 558 CE1 PHE A 71 -5.356 2.756 4.633 1.00 54.13 C ATOM 559 CE2 PHE A 71 -4.160 1.797 2.797 1.00 42.52 C ATOM 560 CZ PHE A 71 -5.331 1.942 3.516 1.00 72.41 C ATOM 0 H PHE A 71 0.401 4.796 5.645 1.00 50.13 H new ATOM 0 HA PHE A 71 -1.857 3.641 6.875 1.00 70.50 H new ATOM 0 HB2 PHE A 71 -2.007 5.064 4.890 1.00 42.00 H new ATOM 0 HB3 PHE A 71 -1.035 3.945 3.956 1.00 42.00 H new ATOM 0 HD1 PHE A 71 -4.238 4.058 5.902 1.00 5.14 H new ATOM 0 HD2 PHE A 71 -2.107 2.341 2.631 1.00 75.41 H new ATOM 0 HE1 PHE A 71 -6.270 2.871 5.197 1.00 54.13 H new ATOM 0 HE2 PHE A 71 -4.138 1.163 1.923 1.00 42.52 H new ATOM 0 HZ PHE A 71 -6.225 1.421 3.206 1.00 72.41 H new ATOM 570 N VAL A 72 0.004 1.527 5.119 1.00 33.14 N ATOM 571 CA VAL A 72 0.263 0.104 4.890 1.00 42.14 C ATOM 572 C VAL A 72 0.689 -0.626 6.182 1.00 14.31 C ATOM 573 O VAL A 72 0.175 -1.709 6.479 1.00 32.02 O ATOM 574 CB VAL A 72 1.320 -0.109 3.771 1.00 3.20 C ATOM 575 CG1 VAL A 72 2.612 0.628 4.086 1.00 1.40 C ATOM 576 CG2 VAL A 72 1.589 -1.594 3.542 1.00 14.20 C ATOM 0 H VAL A 72 0.621 2.157 4.606 1.00 33.14 H new ATOM 0 HA VAL A 72 -0.679 -0.333 4.560 1.00 42.14 H new ATOM 0 HB VAL A 72 0.910 0.307 2.850 1.00 3.20 H new ATOM 0 HG11 VAL A 72 3.332 0.460 3.285 1.00 1.40 H new ATOM 0 HG12 VAL A 72 2.410 1.695 4.174 1.00 1.40 H new ATOM 0 HG13 VAL A 72 3.022 0.258 5.026 1.00 1.40 H new ATOM 0 HG21 VAL A 72 2.332 -1.712 2.754 1.00 14.20 H new ATOM 0 HG22 VAL A 72 1.962 -2.042 4.463 1.00 14.20 H new ATOM 0 HG23 VAL A 72 0.665 -2.090 3.246 1.00 14.20 H new ATOM 586 N GLN A 73 1.592 -0.027 6.975 1.00 35.23 N ATOM 587 CA GLN A 73 2.054 -0.671 8.217 1.00 55.24 C ATOM 588 C GLN A 73 0.887 -0.934 9.181 1.00 3.42 C ATOM 589 O GLN A 73 0.723 -2.055 9.669 1.00 71.02 O ATOM 590 CB GLN A 73 3.152 0.149 8.929 1.00 23.33 C ATOM 591 CG GLN A 73 2.699 1.505 9.459 1.00 21.14 C ATOM 592 CD GLN A 73 3.683 2.126 10.443 1.00 71.22 C ATOM 593 OE1 GLN A 73 4.371 1.429 11.180 1.00 50.03 O ATOM 594 NE2 GLN A 73 3.757 3.443 10.463 1.00 24.24 N ATOM 0 H GLN A 73 2.010 0.884 6.785 1.00 35.23 H new ATOM 0 HA GLN A 73 2.488 -1.626 7.923 1.00 55.24 H new ATOM 0 HB2 GLN A 73 3.542 -0.438 9.761 1.00 23.33 H new ATOM 0 HB3 GLN A 73 3.977 0.304 8.234 1.00 23.33 H new ATOM 0 HG2 GLN A 73 2.556 2.186 8.620 1.00 21.14 H new ATOM 0 HG3 GLN A 73 1.731 1.392 9.946 1.00 21.14 H new ATOM 0 HE21 GLN A 73 3.171 3.996 9.837 1.00 24.24 H new ATOM 0 HE22 GLN A 73 4.400 3.908 11.104 1.00 24.24 H new ATOM 603 N ARG A 74 0.062 0.089 9.439 1.00 44.44 N ATOM 604 CA ARG A 74 -1.079 -0.061 10.349 1.00 74.32 C ATOM 605 C ARG A 74 -2.050 -1.137 9.846 1.00 24.41 C ATOM 606 O ARG A 74 -2.552 -1.949 10.621 1.00 50.45 O ATOM 607 CB ARG A 74 -1.831 1.261 10.531 1.00 45.22 C ATOM 608 CG ARG A 74 -0.989 2.398 11.109 1.00 25.33 C ATOM 609 CD ARG A 74 -1.853 3.597 11.512 1.00 5.13 C ATOM 610 NE ARG A 74 -2.432 3.456 12.854 1.00 4.34 N ATOM 611 CZ ARG A 74 -3.557 2.841 13.124 1.00 5.30 C ATOM 612 NH1 ARG A 74 -4.243 2.268 12.194 1.00 62.11 N ATOM 613 NH2 ARG A 74 -4.002 2.803 14.336 1.00 22.22 N ATOM 0 H ARG A 74 0.162 1.020 9.035 1.00 44.44 H new ATOM 0 HA ARG A 74 -0.676 -0.368 11.314 1.00 74.32 H new ATOM 0 HB2 ARG A 74 -2.227 1.575 9.565 1.00 45.22 H new ATOM 0 HB3 ARG A 74 -2.686 1.090 11.186 1.00 45.22 H new ATOM 0 HG2 ARG A 74 -0.439 2.038 11.978 1.00 25.33 H new ATOM 0 HG3 ARG A 74 -0.250 2.714 10.373 1.00 25.33 H new ATOM 0 HD2 ARG A 74 -1.248 4.503 11.476 1.00 5.13 H new ATOM 0 HD3 ARG A 74 -2.656 3.720 10.786 1.00 5.13 H new ATOM 0 HE ARG A 74 -1.920 3.868 13.634 1.00 4.34 H new ATOM 0 HH11 ARG A 74 -3.912 2.289 11.229 1.00 62.11 H new ATOM 0 HH12 ARG A 74 -5.117 1.794 12.423 1.00 62.11 H new ATOM 0 HH21 ARG A 74 -3.477 3.253 15.086 1.00 22.22 H new ATOM 0 HH22 ARG A 74 -4.878 2.323 14.543 1.00 22.22 H new ATOM 627 N THR A 75 -2.293 -1.141 8.537 1.00 73.31 N ATOM 628 CA THR A 75 -3.196 -2.118 7.915 1.00 62.33 C ATOM 629 C THR A 75 -2.787 -3.556 8.254 1.00 74.13 C ATOM 630 O THR A 75 -3.595 -4.344 8.743 1.00 62.55 O ATOM 631 CB THR A 75 -3.246 -1.947 6.373 1.00 11.11 C ATOM 632 OG1 THR A 75 -3.761 -0.648 6.044 1.00 34.42 O ATOM 633 CG2 THR A 75 -4.109 -3.023 5.715 1.00 44.25 C ATOM 0 H THR A 75 -1.878 -0.479 7.882 1.00 73.31 H new ATOM 0 HA THR A 75 -4.189 -1.928 8.323 1.00 62.33 H new ATOM 0 HB THR A 75 -2.230 -2.050 5.993 1.00 11.11 H new ATOM 0 HG1 THR A 75 -3.073 0.029 6.213 1.00 34.42 H new ATOM 0 HG21 THR A 75 -4.120 -2.871 4.636 1.00 44.25 H new ATOM 0 HG22 THR A 75 -3.697 -4.007 5.938 1.00 44.25 H new ATOM 0 HG23 THR A 75 -5.126 -2.960 6.101 1.00 44.25 H new ATOM 641 N PHE A 76 -1.524 -3.887 8.020 1.00 14.22 N ATOM 642 CA PHE A 76 -1.030 -5.240 8.291 1.00 23.44 C ATOM 643 C PHE A 76 -0.894 -5.527 9.798 1.00 62.42 C ATOM 644 O PHE A 76 -1.185 -6.634 10.243 1.00 30.42 O ATOM 645 CB PHE A 76 0.307 -5.480 7.578 1.00 12.42 C ATOM 646 CG PHE A 76 0.165 -5.649 6.084 1.00 43.10 C ATOM 647 CD1 PHE A 76 0.131 -4.547 5.243 1.00 50.15 C ATOM 648 CD2 PHE A 76 0.056 -6.915 5.524 1.00 23.13 C ATOM 649 CE1 PHE A 76 -0.007 -4.702 3.877 1.00 75.24 C ATOM 650 CE2 PHE A 76 -0.084 -7.074 4.158 1.00 13.43 C ATOM 651 CZ PHE A 76 -0.118 -5.967 3.335 1.00 2.44 C ATOM 0 H PHE A 76 -0.824 -3.246 7.646 1.00 14.22 H new ATOM 0 HA PHE A 76 -1.774 -5.933 7.898 1.00 23.44 H new ATOM 0 HB2 PHE A 76 0.974 -4.642 7.780 1.00 12.42 H new ATOM 0 HB3 PHE A 76 0.778 -6.370 7.994 1.00 12.42 H new ATOM 0 HD1 PHE A 76 0.213 -3.555 5.661 1.00 50.15 H new ATOM 0 HD2 PHE A 76 0.081 -7.785 6.163 1.00 23.13 H new ATOM 0 HE1 PHE A 76 -0.028 -3.835 3.234 1.00 75.24 H new ATOM 0 HE2 PHE A 76 -0.167 -8.064 3.735 1.00 13.43 H new ATOM 0 HZ PHE A 76 -0.231 -6.090 2.268 1.00 2.44 H new ATOM 661 N ARG A 77 -0.465 -4.541 10.586 1.00 1.44 N ATOM 662 CA ARG A 77 -0.251 -4.761 12.026 1.00 54.31 C ATOM 663 C ARG A 77 -1.575 -4.814 12.818 1.00 51.31 C ATOM 664 O ARG A 77 -1.611 -5.337 13.931 1.00 33.42 O ATOM 665 CB ARG A 77 0.709 -3.698 12.602 1.00 2.21 C ATOM 666 CG ARG A 77 0.162 -2.269 12.631 1.00 11.32 C ATOM 667 CD ARG A 77 -0.579 -1.953 13.927 1.00 41.25 C ATOM 668 NE ARG A 77 0.259 -2.165 15.106 1.00 63.45 N ATOM 669 CZ ARG A 77 -0.189 -2.176 16.332 1.00 64.33 C ATOM 670 NH1 ARG A 77 -1.439 -1.952 16.579 1.00 21.44 N ATOM 671 NH2 ARG A 77 0.628 -2.390 17.310 1.00 51.12 N ATOM 0 H ARG A 77 -0.260 -3.595 10.264 1.00 1.44 H new ATOM 0 HA ARG A 77 0.214 -5.741 12.138 1.00 54.31 H new ATOM 0 HB2 ARG A 77 0.977 -3.987 13.618 1.00 2.21 H new ATOM 0 HB3 ARG A 77 1.628 -3.706 12.015 1.00 2.21 H new ATOM 0 HG2 ARG A 77 0.985 -1.566 12.506 1.00 11.32 H new ATOM 0 HG3 ARG A 77 -0.512 -2.124 11.786 1.00 11.32 H new ATOM 0 HD2 ARG A 77 -0.919 -0.918 13.906 1.00 41.25 H new ATOM 0 HD3 ARG A 77 -1.468 -2.579 13.998 1.00 41.25 H new ATOM 0 HE ARG A 77 1.258 -2.314 14.961 1.00 63.45 H new ATOM 0 HH11 ARG A 77 -2.085 -1.765 15.812 1.00 21.44 H new ATOM 0 HH12 ARG A 77 -1.779 -1.963 17.541 1.00 21.44 H new ATOM 0 HH21 ARG A 77 1.618 -2.549 17.122 1.00 51.12 H new ATOM 0 HH22 ARG A 77 0.283 -2.400 18.270 1.00 51.12 H new ATOM 685 N GLU A 78 -2.655 -4.271 12.253 1.00 35.13 N ATOM 686 CA GLU A 78 -3.977 -4.342 12.899 1.00 1.43 C ATOM 687 C GLU A 78 -4.818 -5.504 12.338 1.00 51.24 C ATOM 688 O GLU A 78 -5.365 -6.306 13.094 1.00 12.41 O ATOM 689 CB GLU A 78 -4.742 -3.016 12.753 1.00 73.02 C ATOM 690 CG GLU A 78 -4.038 -1.827 13.405 1.00 52.50 C ATOM 691 CD GLU A 78 -4.868 -0.546 13.393 1.00 54.13 C ATOM 692 OE1 GLU A 78 -5.419 -0.192 12.329 1.00 1.31 O ATOM 693 OE2 GLU A 78 -4.942 0.132 14.442 1.00 30.11 O ATOM 0 H GLU A 78 -2.647 -3.781 11.359 1.00 35.13 H new ATOM 0 HA GLU A 78 -3.804 -4.526 13.959 1.00 1.43 H new ATOM 0 HB2 GLU A 78 -4.887 -2.805 11.694 1.00 73.02 H new ATOM 0 HB3 GLU A 78 -5.732 -3.127 13.194 1.00 73.02 H new ATOM 0 HG2 GLU A 78 -3.792 -2.081 14.436 1.00 52.50 H new ATOM 0 HG3 GLU A 78 -3.096 -1.645 12.888 1.00 52.50 H new ATOM 700 N GLN A 79 -4.915 -5.594 11.012 1.00 40.23 N ATOM 701 CA GLN A 79 -5.701 -6.654 10.360 1.00 22.41 C ATOM 702 C GLN A 79 -5.026 -8.036 10.482 1.00 63.33 C ATOM 703 O GLN A 79 -5.682 -9.032 10.787 1.00 11.44 O ATOM 704 CB GLN A 79 -5.919 -6.313 8.873 1.00 25.53 C ATOM 705 CG GLN A 79 -6.775 -5.068 8.631 1.00 31.30 C ATOM 706 CD GLN A 79 -8.248 -5.287 8.943 1.00 45.00 C ATOM 707 OE1 GLN A 79 -8.765 -6.394 8.821 1.00 1.21 O ATOM 708 NE2 GLN A 79 -8.938 -4.233 9.338 1.00 42.10 N ATOM 0 H GLN A 79 -4.462 -4.949 10.365 1.00 40.23 H new ATOM 0 HA GLN A 79 -6.662 -6.707 10.872 1.00 22.41 H new ATOM 0 HB2 GLN A 79 -4.948 -6.170 8.399 1.00 25.53 H new ATOM 0 HB3 GLN A 79 -6.390 -7.165 8.382 1.00 25.53 H new ATOM 0 HG2 GLN A 79 -6.397 -4.250 9.244 1.00 31.30 H new ATOM 0 HG3 GLN A 79 -6.672 -4.760 7.590 1.00 31.30 H new ATOM 0 HE21 GLN A 79 -8.478 -3.327 9.429 1.00 42.10 H new ATOM 0 HE22 GLN A 79 -9.931 -4.325 9.552 1.00 42.10 H new ATOM 717 N PHE A 80 -3.715 -8.091 10.240 1.00 72.20 N ATOM 718 CA PHE A 80 -2.982 -9.370 10.226 1.00 23.32 C ATOM 719 C PHE A 80 -2.025 -9.520 11.426 1.00 33.01 C ATOM 720 O PHE A 80 -1.516 -10.610 11.686 1.00 5.03 O ATOM 721 CB PHE A 80 -2.196 -9.505 8.913 1.00 24.51 C ATOM 722 CG PHE A 80 -3.064 -9.421 7.680 1.00 24.11 C ATOM 723 CD1 PHE A 80 -3.723 -10.545 7.197 1.00 15.12 C ATOM 724 CD2 PHE A 80 -3.228 -8.216 7.009 1.00 32.11 C ATOM 725 CE1 PHE A 80 -4.524 -10.466 6.073 1.00 31.43 C ATOM 726 CE2 PHE A 80 -4.026 -8.134 5.884 1.00 32.22 C ATOM 727 CZ PHE A 80 -4.676 -9.260 5.417 1.00 54.10 C ATOM 0 H PHE A 80 -3.137 -7.272 10.051 1.00 72.20 H new ATOM 0 HA PHE A 80 -3.723 -10.166 10.304 1.00 23.32 H new ATOM 0 HB2 PHE A 80 -1.440 -8.721 8.869 1.00 24.51 H new ATOM 0 HB3 PHE A 80 -1.668 -10.458 8.911 1.00 24.51 H new ATOM 0 HD1 PHE A 80 -3.608 -11.491 7.705 1.00 15.12 H new ATOM 0 HD2 PHE A 80 -2.725 -7.332 7.371 1.00 32.11 H new ATOM 0 HE1 PHE A 80 -5.031 -11.347 5.708 1.00 31.43 H new ATOM 0 HE2 PHE A 80 -4.141 -7.191 5.370 1.00 32.22 H new ATOM 0 HZ PHE A 80 -5.303 -9.197 4.540 1.00 54.10 H new ATOM 737 N GLY A 81 -1.781 -8.427 12.146 1.00 15.31 N ATOM 738 CA GLY A 81 -0.859 -8.460 13.284 1.00 0.34 C ATOM 739 C GLY A 81 0.609 -8.577 12.871 1.00 0.53 C ATOM 740 O GLY A 81 1.419 -9.178 13.577 1.00 53.13 O ATOM 0 H GLY A 81 -2.203 -7.516 11.966 1.00 15.31 H new ATOM 0 HA2 GLY A 81 -0.991 -7.555 13.876 1.00 0.34 H new ATOM 0 HA3 GLY A 81 -1.116 -9.302 13.927 1.00 0.34 H new ATOM 744 N LEU A 82 0.950 -7.996 11.724 1.00 12.03 N ATOM 745 CA LEU A 82 2.315 -8.058 11.181 1.00 24.22 C ATOM 746 C LEU A 82 3.157 -6.845 11.623 1.00 34.33 C ATOM 747 O LEU A 82 2.755 -5.698 11.431 1.00 3.12 O ATOM 748 CB LEU A 82 2.241 -8.126 9.652 1.00 43.42 C ATOM 749 CG LEU A 82 3.586 -8.261 8.922 1.00 25.23 C ATOM 750 CD1 LEU A 82 4.289 -9.559 9.310 1.00 64.15 C ATOM 751 CD2 LEU A 82 3.377 -8.195 7.412 1.00 72.42 C ATOM 0 H LEU A 82 0.296 -7.471 11.143 1.00 12.03 H new ATOM 0 HA LEU A 82 2.805 -8.951 11.570 1.00 24.22 H new ATOM 0 HB2 LEU A 82 1.612 -8.972 9.375 1.00 43.42 H new ATOM 0 HB3 LEU A 82 1.742 -7.227 9.291 1.00 43.42 H new ATOM 0 HG LEU A 82 4.224 -7.430 9.223 1.00 25.23 H new ATOM 0 HD11 LEU A 82 5.239 -9.631 8.780 1.00 64.15 H new ATOM 0 HD12 LEU A 82 4.472 -9.567 10.385 1.00 64.15 H new ATOM 0 HD13 LEU A 82 3.659 -10.408 9.043 1.00 64.15 H new ATOM 0 HD21 LEU A 82 4.338 -8.292 6.907 1.00 72.42 H new ATOM 0 HD22 LEU A 82 2.720 -9.007 7.100 1.00 72.42 H new ATOM 0 HD23 LEU A 82 2.924 -7.239 7.149 1.00 72.42 H new ATOM 763 N GLU A 83 4.334 -7.103 12.197 1.00 1.32 N ATOM 764 CA GLU A 83 5.189 -6.030 12.737 1.00 22.21 C ATOM 765 C GLU A 83 5.914 -5.226 11.634 1.00 72.23 C ATOM 766 O GLU A 83 7.094 -5.446 11.351 1.00 13.00 O ATOM 767 CB GLU A 83 6.211 -6.605 13.737 1.00 72.41 C ATOM 768 CG GLU A 83 7.094 -7.716 13.167 1.00 73.51 C ATOM 769 CD GLU A 83 8.186 -8.155 14.130 1.00 71.50 C ATOM 770 OE1 GLU A 83 7.930 -9.048 14.965 1.00 1.31 O ATOM 771 OE2 GLU A 83 9.307 -7.610 14.058 1.00 32.12 O ATOM 0 H GLU A 83 4.721 -8.041 12.302 1.00 1.32 H new ATOM 0 HA GLU A 83 4.527 -5.334 13.253 1.00 22.21 H new ATOM 0 HB2 GLU A 83 6.849 -5.796 14.092 1.00 72.41 H new ATOM 0 HB3 GLU A 83 5.675 -6.992 14.604 1.00 72.41 H new ATOM 0 HG2 GLU A 83 6.472 -8.575 12.915 1.00 73.51 H new ATOM 0 HG3 GLU A 83 7.551 -7.370 12.240 1.00 73.51 H new ATOM 778 N LEU A 84 5.204 -4.288 11.011 1.00 64.24 N ATOM 779 CA LEU A 84 5.804 -3.420 9.988 1.00 32.44 C ATOM 780 C LEU A 84 6.268 -2.075 10.580 1.00 3.10 C ATOM 781 O LEU A 84 5.619 -1.518 11.468 1.00 44.31 O ATOM 782 CB LEU A 84 4.815 -3.173 8.838 1.00 70.54 C ATOM 783 CG LEU A 84 4.492 -4.399 7.967 1.00 0.51 C ATOM 784 CD1 LEU A 84 3.545 -4.019 6.833 1.00 55.55 C ATOM 785 CD2 LEU A 84 5.774 -5.023 7.414 1.00 33.22 C ATOM 0 H LEU A 84 4.217 -4.106 11.192 1.00 64.24 H new ATOM 0 HA LEU A 84 6.681 -3.938 9.600 1.00 32.44 H new ATOM 0 HB2 LEU A 84 3.884 -2.792 9.258 1.00 70.54 H new ATOM 0 HB3 LEU A 84 5.219 -2.390 8.197 1.00 70.54 H new ATOM 0 HG LEU A 84 3.995 -5.140 8.593 1.00 0.51 H new ATOM 0 HD11 LEU A 84 3.329 -4.900 6.229 1.00 55.55 H new ATOM 0 HD12 LEU A 84 2.617 -3.628 7.250 1.00 55.55 H new ATOM 0 HD13 LEU A 84 4.012 -3.257 6.209 1.00 55.55 H new ATOM 0 HD21 LEU A 84 5.522 -5.888 6.801 1.00 33.22 H new ATOM 0 HD22 LEU A 84 6.303 -4.289 6.806 1.00 33.22 H new ATOM 0 HD23 LEU A 84 6.412 -5.337 8.240 1.00 33.22 H new ATOM 797 N PRO A 85 7.417 -1.551 10.094 1.00 53.51 N ATOM 798 CA PRO A 85 7.966 -0.261 10.541 1.00 52.20 C ATOM 799 C PRO A 85 7.320 0.954 9.844 1.00 24.35 C ATOM 800 O PRO A 85 6.393 0.811 9.048 1.00 63.13 O ATOM 801 CB PRO A 85 9.442 -0.386 10.159 1.00 33.40 C ATOM 802 CG PRO A 85 9.426 -1.216 8.922 1.00 1.41 C ATOM 803 CD PRO A 85 8.284 -2.189 9.084 1.00 23.04 C ATOM 0 HA PRO A 85 7.784 -0.081 11.600 1.00 52.20 H new ATOM 0 HB2 PRO A 85 9.891 0.590 9.978 1.00 33.40 H new ATOM 0 HB3 PRO A 85 10.020 -0.862 10.951 1.00 33.40 H new ATOM 0 HG2 PRO A 85 9.286 -0.594 8.038 1.00 1.41 H new ATOM 0 HG3 PRO A 85 10.372 -1.743 8.794 1.00 1.41 H new ATOM 0 HD2 PRO A 85 7.755 -2.345 8.144 1.00 23.04 H new ATOM 0 HD3 PRO A 85 8.635 -3.165 9.418 1.00 23.04 H new ATOM 811 N ARG A 86 7.854 2.149 10.111 1.00 72.22 N ATOM 812 CA ARG A 86 7.204 3.404 9.690 1.00 3.42 C ATOM 813 C ARG A 86 7.900 4.084 8.493 1.00 31.34 C ATOM 814 O ARG A 86 7.718 5.280 8.257 1.00 75.45 O ATOM 815 CB ARG A 86 7.086 4.388 10.877 1.00 64.44 C ATOM 816 CG ARG A 86 8.408 4.828 11.527 1.00 23.42 C ATOM 817 CD ARG A 86 9.016 3.757 12.439 1.00 34.22 C ATOM 818 NE ARG A 86 8.021 3.135 13.318 1.00 1.22 N ATOM 819 CZ ARG A 86 8.084 1.900 13.751 1.00 12.11 C ATOM 820 NH1 ARG A 86 9.088 1.139 13.451 1.00 30.50 N ATOM 821 NH2 ARG A 86 7.149 1.425 14.501 1.00 21.21 N ATOM 0 H ARG A 86 8.731 2.279 10.615 1.00 72.22 H new ATOM 0 HA ARG A 86 6.206 3.127 9.351 1.00 3.42 H new ATOM 0 HB2 ARG A 86 6.560 5.279 10.533 1.00 64.44 H new ATOM 0 HB3 ARG A 86 6.464 3.927 11.644 1.00 64.44 H new ATOM 0 HG2 ARG A 86 9.124 5.080 10.745 1.00 23.42 H new ATOM 0 HG3 ARG A 86 8.237 5.735 12.106 1.00 23.42 H new ATOM 0 HD2 ARG A 86 9.486 2.988 11.827 1.00 34.22 H new ATOM 0 HD3 ARG A 86 9.802 4.206 13.046 1.00 34.22 H new ATOM 0 HE ARG A 86 7.226 3.702 13.612 1.00 1.22 H new ATOM 0 HH11 ARG A 86 9.845 1.499 12.870 1.00 30.50 H new ATOM 0 HH12 ARG A 86 9.122 0.180 13.796 1.00 30.50 H new ATOM 0 HH21 ARG A 86 6.356 2.011 14.760 1.00 21.21 H new ATOM 0 HH22 ARG A 86 7.203 0.463 14.835 1.00 21.21 H new ATOM 835 N SER A 87 8.681 3.322 7.729 1.00 73.03 N ATOM 836 CA SER A 87 9.282 3.832 6.482 1.00 61.33 C ATOM 837 C SER A 87 9.283 2.765 5.380 1.00 35.42 C ATOM 838 O SER A 87 9.680 1.619 5.607 1.00 4.43 O ATOM 839 CB SER A 87 10.717 4.333 6.717 1.00 52.51 C ATOM 840 OG SER A 87 10.736 5.507 7.520 1.00 15.23 O ATOM 0 H SER A 87 8.916 2.353 7.944 1.00 73.03 H new ATOM 0 HA SER A 87 8.666 4.670 6.155 1.00 61.33 H new ATOM 0 HB2 SER A 87 11.302 3.551 7.201 1.00 52.51 H new ATOM 0 HB3 SER A 87 11.193 4.539 5.758 1.00 52.51 H new ATOM 0 HG SER A 87 9.820 5.745 7.773 1.00 15.23 H new ATOM 846 N THR A 88 8.847 3.155 4.181 1.00 4.43 N ATOM 847 CA THR A 88 8.795 2.248 3.023 1.00 41.24 C ATOM 848 C THR A 88 10.138 1.540 2.788 1.00 0.32 C ATOM 849 O THR A 88 10.181 0.334 2.549 1.00 41.23 O ATOM 850 CB THR A 88 8.417 3.010 1.729 1.00 4.33 C ATOM 851 OG1 THR A 88 7.202 3.746 1.920 1.00 5.24 O ATOM 852 CG2 THR A 88 8.253 2.050 0.556 1.00 11.20 C ATOM 0 H THR A 88 8.521 4.101 3.981 1.00 4.43 H new ATOM 0 HA THR A 88 8.032 1.505 3.255 1.00 41.24 H new ATOM 0 HB THR A 88 9.227 3.703 1.502 1.00 4.33 H new ATOM 0 HG1 THR A 88 6.995 4.252 1.107 1.00 5.24 H new ATOM 0 HG21 THR A 88 7.988 2.612 -0.340 1.00 11.20 H new ATOM 0 HG22 THR A 88 9.190 1.519 0.387 1.00 11.20 H new ATOM 0 HG23 THR A 88 7.464 1.332 0.781 1.00 11.20 H new ATOM 860 N TYR A 89 11.229 2.305 2.881 1.00 32.34 N ATOM 861 CA TYR A 89 12.584 1.786 2.629 1.00 52.32 C ATOM 862 C TYR A 89 12.945 0.614 3.556 1.00 11.50 C ATOM 863 O TYR A 89 13.896 -0.120 3.297 1.00 12.42 O ATOM 864 CB TYR A 89 13.610 2.917 2.785 1.00 33.24 C ATOM 865 CG TYR A 89 13.355 4.090 1.861 1.00 1.31 C ATOM 866 CD1 TYR A 89 13.863 4.106 0.566 1.00 31.30 C ATOM 867 CD2 TYR A 89 12.600 5.179 2.283 1.00 44.34 C ATOM 868 CE1 TYR A 89 13.626 5.173 -0.279 1.00 62.33 C ATOM 869 CE2 TYR A 89 12.358 6.247 1.444 1.00 63.05 C ATOM 870 CZ TYR A 89 12.872 6.240 0.164 1.00 51.13 C ATOM 871 OH TYR A 89 12.631 7.306 -0.675 1.00 33.32 O ATOM 0 H TYR A 89 11.203 3.294 3.131 1.00 32.34 H new ATOM 0 HA TYR A 89 12.604 1.405 1.608 1.00 52.32 H new ATOM 0 HB2 TYR A 89 13.600 3.268 3.817 1.00 33.24 H new ATOM 0 HB3 TYR A 89 14.608 2.522 2.593 1.00 33.24 H new ATOM 0 HD1 TYR A 89 14.452 3.271 0.216 1.00 31.30 H new ATOM 0 HD2 TYR A 89 12.196 5.189 3.285 1.00 44.34 H new ATOM 0 HE1 TYR A 89 14.029 5.172 -1.281 1.00 62.33 H new ATOM 0 HE2 TYR A 89 11.769 7.084 1.788 1.00 63.05 H new ATOM 0 HH TYR A 89 11.904 7.079 -1.292 1.00 33.32 H new ATOM 881 N GLU A 90 12.196 0.458 4.640 1.00 3.42 N ATOM 882 CA GLU A 90 12.375 -0.675 5.550 1.00 70.12 C ATOM 883 C GLU A 90 11.449 -1.835 5.153 1.00 61.41 C ATOM 884 O GLU A 90 11.896 -2.964 4.947 1.00 65.33 O ATOM 885 CB GLU A 90 12.070 -0.244 6.992 1.00 15.24 C ATOM 886 CG GLU A 90 12.871 0.962 7.476 1.00 20.20 C ATOM 887 CD GLU A 90 12.442 1.417 8.863 1.00 1.44 C ATOM 888 OE1 GLU A 90 11.465 2.189 8.966 1.00 22.15 O ATOM 889 OE2 GLU A 90 13.067 0.992 9.859 1.00 44.23 O ATOM 0 H GLU A 90 11.455 1.103 4.915 1.00 3.42 H new ATOM 0 HA GLU A 90 13.410 -1.011 5.484 1.00 70.12 H new ATOM 0 HB2 GLU A 90 11.008 -0.014 7.072 1.00 15.24 H new ATOM 0 HB3 GLU A 90 12.265 -1.085 7.658 1.00 15.24 H new ATOM 0 HG2 GLU A 90 13.931 0.710 7.490 1.00 20.20 H new ATOM 0 HG3 GLU A 90 12.748 1.784 6.771 1.00 20.20 H new ATOM 896 N GLN A 91 10.153 -1.533 5.029 1.00 34.32 N ATOM 897 CA GLN A 91 9.133 -2.542 4.701 1.00 11.42 C ATOM 898 C GLN A 91 9.468 -3.315 3.415 1.00 3.23 C ATOM 899 O GLN A 91 9.373 -4.543 3.377 1.00 4.11 O ATOM 900 CB GLN A 91 7.756 -1.877 4.552 1.00 60.20 C ATOM 901 CG GLN A 91 7.213 -1.270 5.842 1.00 11.03 C ATOM 902 CD GLN A 91 5.849 -0.618 5.662 1.00 33.44 C ATOM 903 OE1 GLN A 91 5.075 -1.011 4.800 1.00 55.03 O ATOM 904 NE2 GLN A 91 5.543 0.373 6.476 1.00 64.32 N ATOM 0 H GLN A 91 9.780 -0.591 5.151 1.00 34.32 H new ATOM 0 HA GLN A 91 9.116 -3.256 5.525 1.00 11.42 H new ATOM 0 HB2 GLN A 91 7.822 -1.095 3.795 1.00 60.20 H new ATOM 0 HB3 GLN A 91 7.045 -2.617 4.184 1.00 60.20 H new ATOM 0 HG2 GLN A 91 7.141 -2.048 6.601 1.00 11.03 H new ATOM 0 HG3 GLN A 91 7.919 -0.527 6.213 1.00 11.03 H new ATOM 0 HE21 GLN A 91 6.212 0.676 7.184 1.00 64.32 H new ATOM 0 HE22 GLN A 91 4.638 0.836 6.398 1.00 64.32 H new ATOM 913 N GLN A 92 9.865 -2.590 2.371 1.00 52.11 N ATOM 914 CA GLN A 92 10.165 -3.199 1.068 1.00 30.41 C ATOM 915 C GLN A 92 11.187 -4.345 1.175 1.00 35.32 C ATOM 916 O GLN A 92 11.107 -5.325 0.434 1.00 54.34 O ATOM 917 CB GLN A 92 10.673 -2.132 0.081 1.00 50.32 C ATOM 918 CG GLN A 92 11.886 -1.347 0.577 1.00 61.52 C ATOM 919 CD GLN A 92 12.360 -0.291 -0.415 1.00 22.24 C ATOM 920 OE1 GLN A 92 11.879 0.836 -0.419 1.00 50.23 O ATOM 921 NE2 GLN A 92 13.325 -0.638 -1.243 1.00 61.43 N ATOM 0 H GLN A 92 9.988 -1.578 2.398 1.00 52.11 H new ATOM 0 HA GLN A 92 9.234 -3.627 0.696 1.00 30.41 H new ATOM 0 HB2 GLN A 92 10.929 -2.617 -0.861 1.00 50.32 H new ATOM 0 HB3 GLN A 92 9.863 -1.433 -0.130 1.00 50.32 H new ATOM 0 HG2 GLN A 92 11.637 -0.864 1.522 1.00 61.52 H new ATOM 0 HG3 GLN A 92 12.703 -2.040 0.779 1.00 61.52 H new ATOM 0 HE21 GLN A 92 13.705 -1.584 -1.215 1.00 61.43 H new ATOM 0 HE22 GLN A 92 13.692 0.040 -1.911 1.00 61.43 H new ATOM 930 N GLU A 93 12.137 -4.229 2.101 1.00 42.45 N ATOM 931 CA GLU A 93 13.215 -5.221 2.227 1.00 52.22 C ATOM 932 C GLU A 93 13.064 -6.121 3.467 1.00 33.53 C ATOM 933 O GLU A 93 13.978 -6.868 3.811 1.00 1.23 O ATOM 934 CB GLU A 93 14.580 -4.517 2.223 1.00 13.30 C ATOM 935 CG GLU A 93 14.679 -3.326 3.167 1.00 34.15 C ATOM 936 CD GLU A 93 15.966 -2.540 2.967 1.00 52.21 C ATOM 937 OE1 GLU A 93 16.146 -1.957 1.876 1.00 44.54 O ATOM 938 OE2 GLU A 93 16.804 -2.502 3.894 1.00 60.20 O ATOM 0 H GLU A 93 12.187 -3.464 2.774 1.00 42.45 H new ATOM 0 HA GLU A 93 13.146 -5.882 1.363 1.00 52.22 H new ATOM 0 HB2 GLU A 93 15.349 -5.242 2.491 1.00 13.30 H new ATOM 0 HB3 GLU A 93 14.798 -4.180 1.209 1.00 13.30 H new ATOM 0 HG2 GLU A 93 13.825 -2.668 3.009 1.00 34.15 H new ATOM 0 HG3 GLU A 93 14.625 -3.676 4.198 1.00 34.15 H new ATOM 945 N MET A 94 11.909 -6.063 4.132 1.00 34.25 N ATOM 946 CA MET A 94 11.612 -7.000 5.228 1.00 53.15 C ATOM 947 C MET A 94 11.160 -8.362 4.681 1.00 61.21 C ATOM 948 O MET A 94 11.372 -9.400 5.308 1.00 73.43 O ATOM 949 CB MET A 94 10.535 -6.438 6.167 1.00 40.24 C ATOM 950 CG MET A 94 10.993 -5.249 6.998 1.00 65.02 C ATOM 951 SD MET A 94 9.764 -4.751 8.220 1.00 75.33 S ATOM 952 CE MET A 94 9.598 -6.258 9.175 1.00 23.52 C ATOM 0 H MET A 94 11.169 -5.388 3.938 1.00 34.25 H new ATOM 0 HA MET A 94 12.533 -7.134 5.795 1.00 53.15 H new ATOM 0 HB2 MET A 94 9.670 -6.141 5.574 1.00 40.24 H new ATOM 0 HB3 MET A 94 10.204 -7.231 6.838 1.00 40.24 H new ATOM 0 HG2 MET A 94 11.924 -5.501 7.505 1.00 65.02 H new ATOM 0 HG3 MET A 94 11.207 -4.408 6.338 1.00 65.02 H new ATOM 0 HE1 MET A 94 9.461 -6.009 10.227 1.00 23.52 H new ATOM 0 HE2 MET A 94 8.734 -6.820 8.820 1.00 23.52 H new ATOM 0 HE3 MET A 94 10.497 -6.863 9.059 1.00 23.52 H new ATOM 962 N GLY A 95 10.527 -8.345 3.510 1.00 60.54 N ATOM 963 CA GLY A 95 10.085 -9.579 2.867 1.00 74.40 C ATOM 964 C GLY A 95 10.908 -9.925 1.630 1.00 40.54 C ATOM 965 O GLY A 95 12.139 -9.878 1.660 1.00 41.45 O ATOM 0 H GLY A 95 10.310 -7.495 2.990 1.00 60.54 H new ATOM 0 HA2 GLY A 95 10.148 -10.399 3.582 1.00 74.40 H new ATOM 0 HA3 GLY A 95 9.036 -9.482 2.585 1.00 74.40 H new ATOM 969 N LYS A 96 10.231 -10.277 0.539 1.00 32.31 N ATOM 970 CA LYS A 96 10.901 -10.592 -0.732 1.00 1.01 C ATOM 971 C LYS A 96 10.320 -9.773 -1.894 1.00 65.32 C ATOM 972 O LYS A 96 9.331 -9.059 -1.729 1.00 22.54 O ATOM 973 CB LYS A 96 10.796 -12.095 -1.042 1.00 45.20 C ATOM 974 CG LYS A 96 11.666 -12.981 -0.150 1.00 10.03 C ATOM 975 CD LYS A 96 13.149 -12.628 -0.284 1.00 5.53 C ATOM 976 CE LYS A 96 14.045 -13.617 0.456 1.00 13.45 C ATOM 977 NZ LYS A 96 13.722 -13.700 1.904 1.00 10.33 N ATOM 0 H LYS A 96 9.214 -10.353 0.505 1.00 32.31 H new ATOM 0 HA LYS A 96 11.952 -10.324 -0.622 1.00 1.01 H new ATOM 0 HB2 LYS A 96 9.756 -12.404 -0.938 1.00 45.20 H new ATOM 0 HB3 LYS A 96 11.075 -12.260 -2.083 1.00 45.20 H new ATOM 0 HG2 LYS A 96 11.357 -12.868 0.889 1.00 10.03 H new ATOM 0 HG3 LYS A 96 11.514 -14.027 -0.416 1.00 10.03 H new ATOM 0 HD2 LYS A 96 13.423 -12.611 -1.339 1.00 5.53 H new ATOM 0 HD3 LYS A 96 13.319 -11.624 0.106 1.00 5.53 H new ATOM 0 HE2 LYS A 96 13.941 -14.604 0.006 1.00 13.45 H new ATOM 0 HE3 LYS A 96 15.087 -13.320 0.335 1.00 13.45 H new ATOM 0 HZ1 LYS A 96 14.420 -14.305 2.381 1.00 10.33 H new ATOM 0 HZ2 LYS A 96 13.747 -12.747 2.320 1.00 10.33 H new ATOM 0 HZ3 LYS A 96 12.772 -14.106 2.025 1.00 10.33 H new ATOM 991 N SER A 97 10.936 -9.889 -3.070 1.00 61.32 N ATOM 992 CA SER A 97 10.532 -9.099 -4.247 1.00 10.33 C ATOM 993 C SER A 97 9.797 -9.949 -5.292 1.00 32.42 C ATOM 994 O SER A 97 9.875 -11.178 -5.287 1.00 44.21 O ATOM 995 CB SER A 97 11.760 -8.443 -4.897 1.00 71.54 C ATOM 996 OG SER A 97 12.701 -9.415 -5.328 1.00 52.34 O ATOM 0 H SER A 97 11.718 -10.521 -3.239 1.00 61.32 H new ATOM 0 HA SER A 97 9.844 -8.331 -3.893 1.00 10.33 H new ATOM 0 HB2 SER A 97 11.444 -7.839 -5.747 1.00 71.54 H new ATOM 0 HB3 SER A 97 12.233 -7.768 -4.184 1.00 71.54 H new ATOM 0 HG SER A 97 13.470 -8.967 -5.739 1.00 52.34 H new ATOM 1002 N VAL A 98 9.074 -9.269 -6.183 1.00 72.33 N ATOM 1003 CA VAL A 98 8.360 -9.923 -7.289 1.00 40.12 C ATOM 1004 C VAL A 98 8.289 -9.021 -8.530 1.00 14.11 C ATOM 1005 O VAL A 98 8.459 -7.804 -8.442 1.00 73.31 O ATOM 1006 CB VAL A 98 6.911 -10.343 -6.895 1.00 63.15 C ATOM 1007 CG1 VAL A 98 6.878 -11.786 -6.411 1.00 0.24 C ATOM 1008 CG2 VAL A 98 6.333 -9.408 -5.831 1.00 71.10 C ATOM 0 H VAL A 98 8.965 -8.255 -6.162 1.00 72.33 H new ATOM 0 HA VAL A 98 8.935 -10.819 -7.521 1.00 40.12 H new ATOM 0 HB VAL A 98 6.290 -10.264 -7.787 1.00 63.15 H new ATOM 0 HG11 VAL A 98 5.857 -12.056 -6.142 1.00 0.24 H new ATOM 0 HG12 VAL A 98 7.230 -12.444 -7.205 1.00 0.24 H new ATOM 0 HG13 VAL A 98 7.523 -11.892 -5.539 1.00 0.24 H new ATOM 0 HG21 VAL A 98 5.322 -9.727 -5.577 1.00 71.10 H new ATOM 0 HG22 VAL A 98 6.959 -9.441 -4.939 1.00 71.10 H new ATOM 0 HG23 VAL A 98 6.306 -8.389 -6.218 1.00 71.10 H new ATOM 1018 N SER A 99 8.045 -9.637 -9.686 1.00 73.43 N ATOM 1019 CA SER A 99 7.878 -8.902 -10.950 1.00 41.15 C ATOM 1020 C SER A 99 6.396 -8.650 -11.261 1.00 40.30 C ATOM 1021 O SER A 99 5.507 -9.176 -10.589 1.00 32.23 O ATOM 1022 CB SER A 99 8.523 -9.682 -12.106 1.00 64.42 C ATOM 1023 OG SER A 99 8.287 -9.050 -13.357 1.00 14.13 O ATOM 0 H SER A 99 7.957 -10.649 -9.778 1.00 73.43 H new ATOM 0 HA SER A 99 8.373 -7.937 -10.840 1.00 41.15 H new ATOM 0 HB2 SER A 99 9.596 -9.765 -11.936 1.00 64.42 H new ATOM 0 HB3 SER A 99 8.125 -10.696 -12.129 1.00 64.42 H new ATOM 0 HG SER A 99 8.711 -9.570 -14.071 1.00 14.13 H new ATOM 1029 N ARG A 100 6.146 -7.870 -12.312 1.00 30.23 N ATOM 1030 CA ARG A 100 4.787 -7.465 -12.707 1.00 5.11 C ATOM 1031 C ARG A 100 3.806 -8.651 -12.835 1.00 15.43 C ATOM 1032 O ARG A 100 2.612 -8.507 -12.559 1.00 75.21 O ATOM 1033 CB ARG A 100 4.859 -6.697 -14.036 1.00 24.42 C ATOM 1034 CG ARG A 100 3.510 -6.244 -14.590 1.00 14.01 C ATOM 1035 CD ARG A 100 2.771 -5.334 -13.615 1.00 13.14 C ATOM 1036 NE ARG A 100 1.477 -4.906 -14.143 1.00 10.22 N ATOM 1037 CZ ARG A 100 0.360 -5.560 -13.975 1.00 51.51 C ATOM 1038 NH1 ARG A 100 0.344 -6.696 -13.348 1.00 24.24 N ATOM 1039 NH2 ARG A 100 -0.743 -5.088 -14.456 1.00 24.45 N ATOM 0 H ARG A 100 6.877 -7.498 -12.918 1.00 30.23 H new ATOM 0 HA ARG A 100 4.395 -6.830 -11.913 1.00 5.11 H new ATOM 0 HB2 ARG A 100 5.492 -5.820 -13.899 1.00 24.42 H new ATOM 0 HB3 ARG A 100 5.347 -7.329 -14.778 1.00 24.42 H new ATOM 0 HG2 ARG A 100 3.663 -5.718 -15.532 1.00 14.01 H new ATOM 0 HG3 ARG A 100 2.895 -7.117 -14.808 1.00 14.01 H new ATOM 0 HD2 ARG A 100 2.622 -5.858 -12.671 1.00 13.14 H new ATOM 0 HD3 ARG A 100 3.383 -4.458 -13.401 1.00 13.14 H new ATOM 0 HE ARG A 100 1.445 -4.038 -14.678 1.00 10.22 H new ATOM 0 HH11 ARG A 100 1.211 -7.088 -12.980 1.00 24.24 H new ATOM 0 HH12 ARG A 100 -0.535 -7.197 -13.223 1.00 24.24 H new ATOM 0 HH21 ARG A 100 -0.740 -4.205 -14.967 1.00 24.45 H new ATOM 0 HH22 ARG A 100 -1.616 -5.599 -14.325 1.00 24.45 H new ATOM 1053 N SER A 101 4.306 -9.811 -13.253 1.00 43.01 N ATOM 1054 CA SER A 101 3.449 -10.990 -13.493 1.00 14.11 C ATOM 1055 C SER A 101 3.139 -11.774 -12.206 1.00 12.25 C ATOM 1056 O SER A 101 2.145 -12.494 -12.138 1.00 0.00 O ATOM 1057 CB SER A 101 4.110 -11.931 -14.513 1.00 70.25 C ATOM 1058 OG SER A 101 4.374 -11.264 -15.741 1.00 25.35 O ATOM 0 H SER A 101 5.297 -9.969 -13.435 1.00 43.01 H new ATOM 0 HA SER A 101 2.505 -10.612 -13.885 1.00 14.11 H new ATOM 0 HB2 SER A 101 5.041 -12.320 -14.101 1.00 70.25 H new ATOM 0 HB3 SER A 101 3.460 -12.787 -14.695 1.00 70.25 H new ATOM 0 HG SER A 101 4.796 -11.888 -16.368 1.00 25.35 H new ATOM 1064 N ASN A 102 3.977 -11.629 -11.181 1.00 74.30 N ATOM 1065 CA ASN A 102 3.839 -12.431 -9.951 1.00 11.24 C ATOM 1066 C ASN A 102 3.068 -11.684 -8.849 1.00 53.55 C ATOM 1067 O ASN A 102 3.080 -12.094 -7.686 1.00 33.31 O ATOM 1068 CB ASN A 102 5.224 -12.835 -9.436 1.00 44.13 C ATOM 1069 CG ASN A 102 5.971 -13.719 -10.418 1.00 34.10 C ATOM 1070 OD1 ASN A 102 5.853 -14.939 -10.391 1.00 50.42 O ATOM 1071 ND2 ASN A 102 6.748 -13.110 -11.290 1.00 3.13 N ATOM 0 H ASN A 102 4.756 -10.970 -11.170 1.00 74.30 H new ATOM 0 HA ASN A 102 3.262 -13.320 -10.205 1.00 11.24 H new ATOM 0 HB2 ASN A 102 5.811 -11.938 -9.239 1.00 44.13 H new ATOM 0 HB3 ASN A 102 5.117 -13.360 -8.487 1.00 44.13 H new ATOM 0 HD21 ASN A 102 7.275 -13.656 -11.972 1.00 3.13 H new ATOM 0 HD22 ASN A 102 6.822 -12.093 -11.284 1.00 3.13 H new ATOM 1078 N LEU A 103 2.390 -10.605 -9.222 1.00 13.10 N ATOM 1079 CA LEU A 103 1.616 -9.805 -8.266 1.00 42.20 C ATOM 1080 C LEU A 103 0.373 -10.560 -7.756 1.00 41.53 C ATOM 1081 O LEU A 103 -0.430 -11.063 -8.547 1.00 71.24 O ATOM 1082 CB LEU A 103 1.182 -8.485 -8.922 1.00 65.24 C ATOM 1083 CG LEU A 103 2.330 -7.556 -9.346 1.00 41.34 C ATOM 1084 CD1 LEU A 103 1.800 -6.349 -10.113 1.00 71.25 C ATOM 1085 CD2 LEU A 103 3.134 -7.110 -8.131 1.00 52.21 C ATOM 0 H LEU A 103 2.357 -10.259 -10.181 1.00 13.10 H new ATOM 0 HA LEU A 103 2.259 -9.603 -7.410 1.00 42.20 H new ATOM 0 HB2 LEU A 103 0.579 -8.716 -9.800 1.00 65.24 H new ATOM 0 HB3 LEU A 103 0.538 -7.947 -8.226 1.00 65.24 H new ATOM 0 HG LEU A 103 2.990 -8.114 -10.010 1.00 41.34 H new ATOM 0 HD11 LEU A 103 2.632 -5.707 -10.402 1.00 71.25 H new ATOM 0 HD12 LEU A 103 1.276 -6.687 -11.007 1.00 71.25 H new ATOM 0 HD13 LEU A 103 1.113 -5.789 -9.479 1.00 71.25 H new ATOM 0 HD21 LEU A 103 3.943 -6.453 -8.451 1.00 52.21 H new ATOM 0 HD22 LEU A 103 2.483 -6.574 -7.440 1.00 52.21 H new ATOM 0 HD23 LEU A 103 3.553 -7.983 -7.631 1.00 52.21 H new ATOM 1097 N ARG A 104 0.226 -10.636 -6.432 1.00 72.54 N ATOM 1098 CA ARG A 104 -0.960 -11.235 -5.809 1.00 55.11 C ATOM 1099 C ARG A 104 -1.627 -10.251 -4.834 1.00 64.41 C ATOM 1100 O ARG A 104 -1.226 -9.092 -4.725 1.00 24.45 O ATOM 1101 CB ARG A 104 -0.582 -12.507 -5.039 1.00 2.41 C ATOM 1102 CG ARG A 104 0.067 -13.600 -5.878 1.00 20.14 C ATOM 1103 CD ARG A 104 0.354 -14.841 -5.036 1.00 10.12 C ATOM 1104 NE ARG A 104 -0.870 -15.413 -4.461 1.00 52.05 N ATOM 1105 CZ ARG A 104 -1.251 -15.260 -3.217 1.00 4.02 C ATOM 1106 NH1 ARG A 104 -0.553 -14.538 -2.395 1.00 45.21 N ATOM 1107 NH2 ARG A 104 -2.344 -15.818 -2.809 1.00 71.51 N ATOM 0 H ARG A 104 0.916 -10.289 -5.766 1.00 72.54 H new ATOM 0 HA ARG A 104 -1.658 -11.481 -6.609 1.00 55.11 H new ATOM 0 HB2 ARG A 104 0.100 -12.236 -4.233 1.00 2.41 H new ATOM 0 HB3 ARG A 104 -1.481 -12.912 -4.574 1.00 2.41 H new ATOM 0 HG2 ARG A 104 -0.589 -13.863 -6.708 1.00 20.14 H new ATOM 0 HG3 ARG A 104 0.995 -13.228 -6.311 1.00 20.14 H new ATOM 0 HD2 ARG A 104 0.849 -15.591 -5.653 1.00 10.12 H new ATOM 0 HD3 ARG A 104 1.045 -14.582 -4.233 1.00 10.12 H new ATOM 0 HE ARG A 104 -1.466 -15.969 -5.074 1.00 52.05 H new ATOM 0 HH11 ARG A 104 0.302 -14.083 -2.715 1.00 45.21 H new ATOM 0 HH12 ARG A 104 -0.859 -14.426 -1.429 1.00 45.21 H new ATOM 0 HH21 ARG A 104 -2.905 -16.374 -3.455 1.00 71.51 H new ATOM 0 HH22 ARG A 104 -2.645 -15.702 -1.841 1.00 71.51 H new ATOM 1121 N THR A 105 -2.649 -10.725 -4.127 1.00 70.31 N ATOM 1122 CA THR A 105 -3.322 -9.918 -3.105 1.00 21.24 C ATOM 1123 C THR A 105 -2.480 -9.830 -1.825 1.00 34.03 C ATOM 1124 O THR A 105 -2.360 -10.804 -1.076 1.00 24.32 O ATOM 1125 CB THR A 105 -4.715 -10.493 -2.753 1.00 72.50 C ATOM 1126 OG1 THR A 105 -5.518 -10.606 -3.941 1.00 0.32 O ATOM 1127 CG2 THR A 105 -5.428 -9.608 -1.739 1.00 30.43 C ATOM 0 H THR A 105 -3.032 -11.664 -4.241 1.00 70.31 H new ATOM 0 HA THR A 105 -3.446 -8.920 -3.525 1.00 21.24 H new ATOM 0 HB THR A 105 -4.572 -11.481 -2.315 1.00 72.50 H new ATOM 0 HG1 THR A 105 -5.948 -9.745 -4.129 1.00 0.32 H new ATOM 0 HG21 THR A 105 -6.405 -10.033 -1.508 1.00 30.43 H new ATOM 0 HG22 THR A 105 -4.834 -9.548 -0.827 1.00 30.43 H new ATOM 0 HG23 THR A 105 -5.557 -8.609 -2.155 1.00 30.43 H new ATOM 1135 N GLY A 106 -1.892 -8.661 -1.582 1.00 44.10 N ATOM 1136 CA GLY A 106 -1.057 -8.464 -0.400 1.00 65.32 C ATOM 1137 C GLY A 106 0.336 -7.945 -0.738 1.00 34.34 C ATOM 1138 O GLY A 106 1.034 -7.407 0.127 1.00 14.55 O ATOM 0 H GLY A 106 -1.977 -7.841 -2.183 1.00 44.10 H new ATOM 0 HA2 GLY A 106 -1.548 -7.761 0.272 1.00 65.32 H new ATOM 0 HA3 GLY A 106 -0.967 -9.408 0.137 1.00 65.32 H new ATOM 1142 N ASP A 107 0.752 -8.121 -1.993 1.00 23.22 N ATOM 1143 CA ASP A 107 2.057 -7.639 -2.453 1.00 53.44 C ATOM 1144 C ASP A 107 2.122 -6.098 -2.470 1.00 50.33 C ATOM 1145 O ASP A 107 1.201 -5.421 -2.934 1.00 33.45 O ATOM 1146 CB ASP A 107 2.373 -8.204 -3.845 1.00 64.24 C ATOM 1147 CG ASP A 107 2.518 -9.719 -3.831 1.00 61.14 C ATOM 1148 OD1 ASP A 107 1.486 -10.417 -3.785 1.00 14.33 O ATOM 1149 OD2 ASP A 107 3.662 -10.217 -3.870 1.00 60.34 O ATOM 0 H ASP A 107 0.204 -8.595 -2.711 1.00 23.22 H new ATOM 0 HA ASP A 107 2.809 -7.992 -1.747 1.00 53.44 H new ATOM 0 HB2 ASP A 107 1.580 -7.923 -4.538 1.00 64.24 H new ATOM 0 HB3 ASP A 107 3.295 -7.756 -4.217 1.00 64.24 H new ATOM 1154 N LEU A 108 3.215 -5.555 -1.953 1.00 44.11 N ATOM 1155 CA LEU A 108 3.424 -4.109 -1.897 1.00 25.03 C ATOM 1156 C LEU A 108 4.168 -3.609 -3.147 1.00 43.41 C ATOM 1157 O LEU A 108 5.294 -4.022 -3.421 1.00 32.51 O ATOM 1158 CB LEU A 108 4.216 -3.754 -0.631 1.00 23.33 C ATOM 1159 CG LEU A 108 3.604 -4.252 0.692 1.00 41.10 C ATOM 1160 CD1 LEU A 108 4.443 -3.795 1.886 1.00 34.14 C ATOM 1161 CD2 LEU A 108 2.155 -3.782 0.827 1.00 31.44 C ATOM 0 H LEU A 108 3.982 -6.100 -1.560 1.00 44.11 H new ATOM 0 HA LEU A 108 2.451 -3.618 -1.867 1.00 25.03 H new ATOM 0 HB2 LEU A 108 5.221 -4.165 -0.724 1.00 23.33 H new ATOM 0 HB3 LEU A 108 4.319 -2.670 -0.579 1.00 23.33 H new ATOM 0 HG LEU A 108 3.606 -5.342 0.680 1.00 41.10 H new ATOM 0 HD11 LEU A 108 3.991 -4.159 2.809 1.00 34.14 H new ATOM 0 HD12 LEU A 108 5.453 -4.194 1.795 1.00 34.14 H new ATOM 0 HD13 LEU A 108 4.484 -2.706 1.907 1.00 34.14 H new ATOM 0 HD21 LEU A 108 1.741 -4.144 1.768 1.00 31.44 H new ATOM 0 HD22 LEU A 108 2.123 -2.693 0.812 1.00 31.44 H new ATOM 0 HD23 LEU A 108 1.567 -4.174 -0.003 1.00 31.44 H new ATOM 1173 N VAL A 109 3.539 -2.709 -3.897 1.00 4.24 N ATOM 1174 CA VAL A 109 4.126 -2.185 -5.140 1.00 72.33 C ATOM 1175 C VAL A 109 4.849 -0.847 -4.904 1.00 0.23 C ATOM 1176 O VAL A 109 4.334 0.038 -4.220 1.00 53.42 O ATOM 1177 CB VAL A 109 3.051 -2.012 -6.248 1.00 53.13 C ATOM 1178 CG1 VAL A 109 2.541 -3.373 -6.723 1.00 72.30 C ATOM 1179 CG2 VAL A 109 1.891 -1.146 -5.753 1.00 40.21 C ATOM 0 H VAL A 109 2.622 -2.323 -3.671 1.00 4.24 H new ATOM 0 HA VAL A 109 4.857 -2.920 -5.476 1.00 72.33 H new ATOM 0 HB VAL A 109 3.516 -1.505 -7.093 1.00 53.13 H new ATOM 0 HG11 VAL A 109 1.789 -3.229 -7.499 1.00 72.30 H new ATOM 0 HG12 VAL A 109 3.372 -3.952 -7.126 1.00 72.30 H new ATOM 0 HG13 VAL A 109 2.098 -3.909 -5.883 1.00 72.30 H new ATOM 0 HG21 VAL A 109 1.152 -1.040 -6.547 1.00 40.21 H new ATOM 0 HG22 VAL A 109 1.428 -1.619 -4.887 1.00 40.21 H new ATOM 0 HG23 VAL A 109 2.266 -0.162 -5.472 1.00 40.21 H new ATOM 1189 N LEU A 110 6.056 -0.717 -5.466 1.00 42.21 N ATOM 1190 CA LEU A 110 6.880 0.491 -5.295 1.00 61.40 C ATOM 1191 C LEU A 110 6.911 1.351 -6.569 1.00 12.24 C ATOM 1192 O LEU A 110 7.256 0.869 -7.651 1.00 34.31 O ATOM 1193 CB LEU A 110 8.315 0.098 -4.913 1.00 51.42 C ATOM 1194 CG LEU A 110 8.443 -0.748 -3.636 1.00 33.32 C ATOM 1195 CD1 LEU A 110 9.887 -1.185 -3.427 1.00 24.10 C ATOM 1196 CD2 LEU A 110 7.933 0.021 -2.418 1.00 14.11 C ATOM 0 H LEU A 110 6.488 -1.436 -6.046 1.00 42.21 H new ATOM 0 HA LEU A 110 6.428 1.082 -4.499 1.00 61.40 H new ATOM 0 HB2 LEU A 110 8.756 -0.455 -5.742 1.00 51.42 H new ATOM 0 HB3 LEU A 110 8.903 1.007 -4.788 1.00 51.42 H new ATOM 0 HG LEU A 110 7.826 -1.639 -3.756 1.00 33.32 H new ATOM 0 HD11 LEU A 110 9.958 -1.783 -2.518 1.00 24.10 H new ATOM 0 HD12 LEU A 110 10.214 -1.780 -4.280 1.00 24.10 H new ATOM 0 HD13 LEU A 110 10.523 -0.305 -3.333 1.00 24.10 H new ATOM 0 HD21 LEU A 110 8.034 -0.599 -1.527 1.00 14.11 H new ATOM 0 HD22 LEU A 110 8.516 0.933 -2.293 1.00 14.11 H new ATOM 0 HD23 LEU A 110 6.884 0.278 -2.563 1.00 14.11 H new ATOM 1208 N PHE A 111 6.563 2.628 -6.427 1.00 70.23 N ATOM 1209 CA PHE A 111 6.616 3.586 -7.538 1.00 1.44 C ATOM 1210 C PHE A 111 7.660 4.681 -7.272 1.00 54.41 C ATOM 1211 O PHE A 111 7.746 5.206 -6.160 1.00 5.32 O ATOM 1212 CB PHE A 111 5.243 4.236 -7.753 1.00 31.52 C ATOM 1213 CG PHE A 111 4.142 3.250 -8.041 1.00 54.32 C ATOM 1214 CD1 PHE A 111 3.973 2.731 -9.317 1.00 53.30 C ATOM 1215 CD2 PHE A 111 3.276 2.842 -7.037 1.00 35.22 C ATOM 1216 CE1 PHE A 111 2.966 1.824 -9.584 1.00 13.42 C ATOM 1217 CE2 PHE A 111 2.268 1.937 -7.301 1.00 61.24 C ATOM 1218 CZ PHE A 111 2.113 1.427 -8.575 1.00 44.23 C ATOM 0 H PHE A 111 6.238 3.029 -5.547 1.00 70.23 H new ATOM 0 HA PHE A 111 6.901 3.036 -8.435 1.00 1.44 H new ATOM 0 HB2 PHE A 111 4.980 4.810 -6.865 1.00 31.52 H new ATOM 0 HB3 PHE A 111 5.311 4.942 -8.581 1.00 31.52 H new ATOM 0 HD1 PHE A 111 4.637 3.040 -10.111 1.00 53.30 H new ATOM 0 HD2 PHE A 111 3.392 3.237 -6.038 1.00 35.22 H new ATOM 0 HE1 PHE A 111 2.847 1.426 -10.581 1.00 13.42 H new ATOM 0 HE2 PHE A 111 1.600 1.627 -6.511 1.00 61.24 H new ATOM 0 HZ PHE A 111 1.325 0.718 -8.781 1.00 44.23 H new ATOM 1228 N ARG A 112 8.447 5.025 -8.293 1.00 52.21 N ATOM 1229 CA ARG A 112 9.447 6.095 -8.172 1.00 24.40 C ATOM 1230 C ARG A 112 8.787 7.478 -8.288 1.00 1.41 C ATOM 1231 O ARG A 112 8.859 8.135 -9.328 1.00 53.22 O ATOM 1232 CB ARG A 112 10.535 5.934 -9.243 1.00 73.34 C ATOM 1233 CG ARG A 112 11.307 4.624 -9.140 1.00 12.01 C ATOM 1234 CD ARG A 112 12.354 4.483 -10.241 1.00 55.33 C ATOM 1235 NE ARG A 112 13.352 5.551 -10.196 1.00 44.41 N ATOM 1236 CZ ARG A 112 14.493 5.513 -10.830 1.00 24.03 C ATOM 1237 NH1 ARG A 112 14.828 4.468 -11.521 1.00 22.31 N ATOM 1238 NH2 ARG A 112 15.302 6.520 -10.766 1.00 52.22 N ATOM 0 H ARG A 112 8.414 4.582 -9.211 1.00 52.21 H new ATOM 0 HA ARG A 112 9.909 6.018 -7.188 1.00 24.40 H new ATOM 0 HB2 ARG A 112 10.074 5.997 -10.229 1.00 73.34 H new ATOM 0 HB3 ARG A 112 11.235 6.765 -9.165 1.00 73.34 H new ATOM 0 HG2 ARG A 112 11.796 4.568 -8.167 1.00 12.01 H new ATOM 0 HG3 ARG A 112 10.610 3.788 -9.195 1.00 12.01 H new ATOM 0 HD2 ARG A 112 12.852 3.518 -10.144 1.00 55.33 H new ATOM 0 HD3 ARG A 112 11.860 4.491 -11.213 1.00 55.33 H new ATOM 0 HE ARG A 112 13.144 6.377 -9.635 1.00 44.41 H new ATOM 0 HH11 ARG A 112 14.198 3.667 -11.572 1.00 22.31 H new ATOM 0 HH12 ARG A 112 15.721 4.447 -12.013 1.00 22.31 H new ATOM 0 HH21 ARG A 112 15.049 7.344 -10.220 1.00 52.22 H new ATOM 0 HH22 ARG A 112 16.193 6.490 -11.261 1.00 52.22 H new ATOM 1252 N ALA A 113 8.151 7.913 -7.207 1.00 35.15 N ATOM 1253 CA ALA A 113 7.356 9.147 -7.211 1.00 5.33 C ATOM 1254 C ALA A 113 8.178 10.369 -6.764 1.00 64.13 C ATOM 1255 O ALA A 113 8.717 10.393 -5.663 1.00 55.42 O ATOM 1256 CB ALA A 113 6.143 8.974 -6.307 1.00 40.33 C ATOM 0 H ALA A 113 8.167 7.430 -6.309 1.00 35.15 H new ATOM 0 HA ALA A 113 7.034 9.332 -8.236 1.00 5.33 H new ATOM 0 HB1 ALA A 113 5.553 9.891 -6.310 1.00 40.33 H new ATOM 0 HB2 ALA A 113 5.532 8.148 -6.672 1.00 40.33 H new ATOM 0 HB3 ALA A 113 6.474 8.759 -5.291 1.00 40.33 H new ATOM 1301 N ARG A 118 10.061 6.360 -2.771 1.00 41.04 N ATOM 1302 CA ARG A 118 9.537 4.995 -2.893 1.00 20.44 C ATOM 1303 C ARG A 118 8.081 4.937 -2.405 1.00 62.43 C ATOM 1304 O ARG A 118 7.815 4.735 -1.217 1.00 33.23 O ATOM 1305 CB ARG A 118 10.408 4.002 -2.107 1.00 41.02 C ATOM 1306 CG ARG A 118 11.782 3.754 -2.727 1.00 0.51 C ATOM 1307 CD ARG A 118 11.695 2.944 -4.018 1.00 24.54 C ATOM 1308 NE ARG A 118 13.007 2.756 -4.638 1.00 42.53 N ATOM 1309 CZ ARG A 118 13.446 1.621 -5.127 1.00 61.53 C ATOM 1310 NH1 ARG A 118 12.736 0.540 -5.035 1.00 34.32 N ATOM 1311 NH2 ARG A 118 14.606 1.575 -5.700 1.00 62.33 N ATOM 0 HA ARG A 118 9.564 4.711 -3.945 1.00 20.44 H new ATOM 0 HB2 ARG A 118 10.541 4.376 -1.092 1.00 41.02 H new ATOM 0 HB3 ARG A 118 9.879 3.052 -2.030 1.00 41.02 H new ATOM 0 HG2 ARG A 118 12.264 4.710 -2.932 1.00 0.51 H new ATOM 0 HG3 ARG A 118 12.412 3.226 -2.011 1.00 0.51 H new ATOM 0 HD2 ARG A 118 11.252 1.971 -3.806 1.00 24.54 H new ATOM 0 HD3 ARG A 118 11.032 3.450 -4.719 1.00 24.54 H new ATOM 0 HE ARG A 118 13.625 3.566 -4.694 1.00 42.53 H new ATOM 0 HH11 ARG A 118 11.824 0.566 -4.578 1.00 34.32 H new ATOM 0 HH12 ARG A 118 13.089 -0.336 -5.420 1.00 34.32 H new ATOM 0 HH21 ARG A 118 15.174 2.419 -5.770 1.00 62.33 H new ATOM 0 HH22 ARG A 118 14.952 0.695 -6.082 1.00 62.33 H new ATOM 1325 N HIS A 119 7.145 5.143 -3.326 1.00 43.33 N ATOM 1326 CA HIS A 119 5.716 5.148 -2.993 1.00 41.22 C ATOM 1327 C HIS A 119 5.158 3.718 -2.977 1.00 0.54 C ATOM 1328 O HIS A 119 5.186 3.023 -3.992 1.00 2.13 O ATOM 1329 CB HIS A 119 4.950 6.009 -4.008 1.00 32.21 C ATOM 1330 CG HIS A 119 3.499 6.182 -3.680 1.00 21.21 C ATOM 1331 ND1 HIS A 119 3.069 7.181 -2.839 1.00 20.13 N ATOM 1332 CD2 HIS A 119 2.426 5.466 -4.098 1.00 35.43 C ATOM 1333 CE1 HIS A 119 1.758 7.053 -2.765 1.00 72.14 C ATOM 1334 NE2 HIS A 119 1.324 6.029 -3.509 1.00 60.43 N ATOM 0 H HIS A 119 7.346 5.309 -4.312 1.00 43.33 H new ATOM 0 HA HIS A 119 5.589 5.573 -1.997 1.00 41.22 H new ATOM 0 HB2 HIS A 119 5.420 6.991 -4.065 1.00 32.21 H new ATOM 0 HB3 HIS A 119 5.038 5.555 -4.995 1.00 32.21 H new ATOM 0 HD2 HIS A 119 2.438 4.617 -4.765 1.00 35.43 H new ATOM 0 HE1 HIS A 119 1.116 7.694 -2.178 1.00 72.14 H new ATOM 0 HE2 HIS A 119 0.356 5.725 -3.617 1.00 60.43 H new ATOM 1342 N VAL A 120 4.656 3.283 -1.823 1.00 11.02 N ATOM 1343 CA VAL A 120 4.185 1.903 -1.658 1.00 72.41 C ATOM 1344 C VAL A 120 2.649 1.805 -1.644 1.00 12.31 C ATOM 1345 O VAL A 120 1.961 2.616 -1.019 1.00 51.33 O ATOM 1346 CB VAL A 120 4.756 1.273 -0.360 1.00 61.14 C ATOM 1347 CG1 VAL A 120 4.296 2.047 0.873 1.00 31.11 C ATOM 1348 CG2 VAL A 120 4.371 -0.200 -0.248 1.00 42.13 C ATOM 0 H VAL A 120 4.564 3.862 -0.988 1.00 11.02 H new ATOM 0 HA VAL A 120 4.549 1.348 -2.522 1.00 72.41 H new ATOM 0 HB VAL A 120 5.843 1.334 -0.412 1.00 61.14 H new ATOM 0 HG11 VAL A 120 4.710 1.584 1.769 1.00 31.11 H new ATOM 0 HG12 VAL A 120 4.641 3.079 0.805 1.00 31.11 H new ATOM 0 HG13 VAL A 120 3.207 2.031 0.927 1.00 31.11 H new ATOM 0 HG21 VAL A 120 4.785 -0.615 0.671 1.00 42.13 H new ATOM 0 HG22 VAL A 120 3.285 -0.292 -0.231 1.00 42.13 H new ATOM 0 HG23 VAL A 120 4.768 -0.746 -1.104 1.00 42.13 H new ATOM 1358 N GLY A 121 2.122 0.805 -2.346 1.00 51.10 N ATOM 1359 CA GLY A 121 0.685 0.544 -2.344 1.00 75.31 C ATOM 1360 C GLY A 121 0.355 -0.931 -2.135 1.00 53.24 C ATOM 1361 O GLY A 121 1.108 -1.808 -2.561 1.00 61.40 O ATOM 0 H GLY A 121 2.667 0.163 -2.922 1.00 51.10 H new ATOM 0 HA2 GLY A 121 0.214 1.133 -1.557 1.00 75.31 H new ATOM 0 HA3 GLY A 121 0.258 0.877 -3.290 1.00 75.31 H new ATOM 1365 N ILE A 122 -0.772 -1.210 -1.488 1.00 21.10 N ATOM 1366 CA ILE A 122 -1.183 -2.592 -1.211 1.00 72.13 C ATOM 1367 C ILE A 122 -1.996 -3.171 -2.381 1.00 72.13 C ATOM 1368 O ILE A 122 -3.132 -2.757 -2.625 1.00 13.35 O ATOM 1369 CB ILE A 122 -2.034 -2.680 0.082 1.00 35.32 C ATOM 1370 CG1 ILE A 122 -1.339 -1.948 1.244 1.00 53.14 C ATOM 1371 CG2 ILE A 122 -2.296 -4.141 0.447 1.00 13.32 C ATOM 1372 CD1 ILE A 122 -2.149 -1.933 2.527 1.00 11.35 C ATOM 0 H ILE A 122 -1.420 -0.502 -1.144 1.00 21.10 H new ATOM 0 HA ILE A 122 -0.270 -3.173 -1.079 1.00 72.13 H new ATOM 0 HB ILE A 122 -2.991 -2.191 -0.102 1.00 35.32 H new ATOM 0 HG12 ILE A 122 -0.377 -2.423 1.438 1.00 53.14 H new ATOM 0 HG13 ILE A 122 -1.132 -0.921 0.943 1.00 53.14 H new ATOM 0 HG21 ILE A 122 -2.895 -4.187 1.357 1.00 13.32 H new ATOM 0 HG22 ILE A 122 -2.834 -4.628 -0.366 1.00 13.32 H new ATOM 0 HG23 ILE A 122 -1.347 -4.651 0.611 1.00 13.32 H new ATOM 0 HD11 ILE A 122 -1.596 -1.400 3.300 1.00 11.35 H new ATOM 0 HD12 ILE A 122 -3.101 -1.431 2.351 1.00 11.35 H new ATOM 0 HD13 ILE A 122 -2.333 -2.957 2.853 1.00 11.35 H new ATOM 1384 N TYR A 123 -1.410 -4.125 -3.101 1.00 33.23 N ATOM 1385 CA TYR A 123 -2.063 -4.743 -4.262 1.00 50.25 C ATOM 1386 C TYR A 123 -3.274 -5.594 -3.832 1.00 74.11 C ATOM 1387 O TYR A 123 -3.116 -6.649 -3.219 1.00 5.02 O ATOM 1388 CB TYR A 123 -1.037 -5.606 -5.015 1.00 71.13 C ATOM 1389 CG TYR A 123 -1.401 -5.919 -6.454 1.00 3.52 C ATOM 1390 CD1 TYR A 123 -1.041 -5.052 -7.478 1.00 32.42 C ATOM 1391 CD2 TYR A 123 -2.075 -7.088 -6.793 1.00 4.03 C ATOM 1392 CE1 TYR A 123 -1.345 -5.336 -8.794 1.00 54.44 C ATOM 1393 CE2 TYR A 123 -2.376 -7.381 -8.108 1.00 21.44 C ATOM 1394 CZ TYR A 123 -2.010 -6.502 -9.103 1.00 4.45 C ATOM 1395 OH TYR A 123 -2.295 -6.796 -10.416 1.00 63.44 O ATOM 0 H TYR A 123 -0.479 -4.491 -2.902 1.00 33.23 H new ATOM 0 HA TYR A 123 -2.433 -3.957 -4.920 1.00 50.25 H new ATOM 0 HB2 TYR A 123 -0.074 -5.095 -5.002 1.00 71.13 H new ATOM 0 HB3 TYR A 123 -0.907 -6.544 -4.476 1.00 71.13 H new ATOM 0 HD1 TYR A 123 -0.514 -4.140 -7.240 1.00 32.42 H new ATOM 0 HD2 TYR A 123 -2.367 -7.777 -6.015 1.00 4.03 H new ATOM 0 HE1 TYR A 123 -1.063 -4.648 -9.577 1.00 54.44 H new ATOM 0 HE2 TYR A 123 -2.896 -8.295 -8.355 1.00 21.44 H new ATOM 0 HH TYR A 123 -2.766 -7.654 -10.464 1.00 63.44 H new ATOM 1405 N ILE A 124 -4.487 -5.124 -4.144 1.00 22.03 N ATOM 1406 CA ILE A 124 -5.710 -5.832 -3.740 1.00 51.41 C ATOM 1407 C ILE A 124 -6.097 -6.933 -4.740 1.00 52.35 C ATOM 1408 O ILE A 124 -6.651 -7.964 -4.351 1.00 12.42 O ATOM 1409 CB ILE A 124 -6.911 -4.866 -3.547 1.00 73.35 C ATOM 1410 CG1 ILE A 124 -7.265 -4.148 -4.863 1.00 35.44 C ATOM 1411 CG2 ILE A 124 -6.602 -3.850 -2.448 1.00 64.25 C ATOM 1412 CD1 ILE A 124 -8.455 -3.214 -4.757 1.00 60.01 C ATOM 0 H ILE A 124 -4.649 -4.265 -4.670 1.00 22.03 H new ATOM 0 HA ILE A 124 -5.479 -6.295 -2.781 1.00 51.41 H new ATOM 0 HB ILE A 124 -7.776 -5.457 -3.246 1.00 73.35 H new ATOM 0 HG12 ILE A 124 -6.398 -3.578 -5.198 1.00 35.44 H new ATOM 0 HG13 ILE A 124 -7.471 -4.896 -5.629 1.00 35.44 H new ATOM 0 HG21 ILE A 124 -7.452 -3.179 -2.323 1.00 64.25 H new ATOM 0 HG22 ILE A 124 -6.412 -4.374 -1.511 1.00 64.25 H new ATOM 0 HG23 ILE A 124 -5.721 -3.271 -2.725 1.00 64.25 H new ATOM 0 HD11 ILE A 124 -8.639 -2.748 -5.725 1.00 60.01 H new ATOM 0 HD12 ILE A 124 -9.336 -3.780 -4.453 1.00 60.01 H new ATOM 0 HD13 ILE A 124 -8.247 -2.442 -4.016 1.00 60.01 H new ATOM 1424 N GLY A 125 -5.804 -6.718 -6.023 1.00 21.11 N ATOM 1425 CA GLY A 125 -6.103 -7.729 -7.037 1.00 45.33 C ATOM 1426 C GLY A 125 -6.422 -7.145 -8.414 1.00 41.12 C ATOM 1427 O GLY A 125 -7.218 -6.210 -8.531 1.00 13.44 O ATOM 0 H GLY A 125 -5.367 -5.868 -6.380 1.00 21.11 H new ATOM 0 HA2 GLY A 125 -5.251 -8.403 -7.127 1.00 45.33 H new ATOM 0 HA3 GLY A 125 -6.950 -8.328 -6.701 1.00 45.33 H new ATOM 1431 N ASN A 126 -5.800 -7.714 -9.451 1.00 63.42 N ATOM 1432 CA ASN A 126 -6.032 -7.310 -10.848 1.00 31.22 C ATOM 1433 C ASN A 126 -5.797 -5.803 -11.080 1.00 2.41 C ATOM 1434 O ASN A 126 -6.742 -5.015 -11.140 1.00 74.54 O ATOM 1435 CB ASN A 126 -7.443 -7.716 -11.303 1.00 41.24 C ATOM 1436 CG ASN A 126 -7.684 -7.421 -12.776 1.00 52.30 C ATOM 1437 OD1 ASN A 126 -7.376 -8.231 -13.640 1.00 61.51 O ATOM 1438 ND2 ASN A 126 -8.240 -6.264 -13.073 1.00 55.32 N ATOM 0 H ASN A 126 -5.121 -8.468 -9.349 1.00 63.42 H new ATOM 0 HA ASN A 126 -5.297 -7.840 -11.455 1.00 31.22 H new ATOM 0 HB2 ASN A 126 -7.589 -8.781 -11.120 1.00 41.24 H new ATOM 0 HB3 ASN A 126 -8.182 -7.185 -10.703 1.00 41.24 H new ATOM 0 HD21 ASN A 126 -8.425 -6.022 -14.046 1.00 55.32 H new ATOM 0 HD22 ASN A 126 -8.485 -5.610 -12.329 1.00 55.32 H new ATOM 1445 N ASN A 127 -4.520 -5.419 -11.183 1.00 54.33 N ATOM 1446 CA ASN A 127 -4.106 -4.032 -11.488 1.00 35.35 C ATOM 1447 C ASN A 127 -4.370 -3.038 -10.340 1.00 45.34 C ATOM 1448 O ASN A 127 -3.540 -2.176 -10.070 1.00 20.14 O ATOM 1449 CB ASN A 127 -4.782 -3.531 -12.770 1.00 13.21 C ATOM 1450 CG ASN A 127 -4.452 -4.381 -13.981 1.00 64.23 C ATOM 1451 OD1 ASN A 127 -3.373 -4.953 -14.085 1.00 5.44 O ATOM 1452 ND2 ASN A 127 -5.386 -4.473 -14.906 1.00 72.51 N ATOM 0 H ASN A 127 -3.736 -6.059 -11.058 1.00 54.33 H new ATOM 0 HA ASN A 127 -3.026 -4.073 -11.627 1.00 35.35 H new ATOM 0 HB2 ASN A 127 -5.862 -3.519 -12.624 1.00 13.21 H new ATOM 0 HB3 ASN A 127 -4.474 -2.503 -12.959 1.00 13.21 H new ATOM 0 HD21 ASN A 127 -5.222 -5.034 -15.742 1.00 72.51 H new ATOM 0 HD22 ASN A 127 -6.273 -3.983 -14.786 1.00 72.51 H new ATOM 1459 N GLN A 128 -5.516 -3.150 -9.676 1.00 61.11 N ATOM 1460 CA GLN A 128 -5.922 -2.168 -8.668 1.00 2.25 C ATOM 1461 C GLN A 128 -5.253 -2.407 -7.307 1.00 72.21 C ATOM 1462 O GLN A 128 -5.001 -3.547 -6.900 1.00 64.44 O ATOM 1463 CB GLN A 128 -7.449 -2.168 -8.527 1.00 51.03 C ATOM 1464 CG GLN A 128 -8.168 -1.774 -9.815 1.00 30.32 C ATOM 1465 CD GLN A 128 -9.681 -1.739 -9.683 1.00 74.12 C ATOM 1466 OE1 GLN A 128 -10.403 -2.016 -10.633 1.00 1.23 O ATOM 1467 NE2 GLN A 128 -10.178 -1.387 -8.513 1.00 65.00 N ATOM 0 H GLN A 128 -6.182 -3.910 -9.815 1.00 61.11 H new ATOM 0 HA GLN A 128 -5.587 -1.189 -9.012 1.00 2.25 H new ATOM 0 HB2 GLN A 128 -7.780 -3.161 -8.222 1.00 51.03 H new ATOM 0 HB3 GLN A 128 -7.735 -1.479 -7.733 1.00 51.03 H new ATOM 0 HG2 GLN A 128 -7.817 -0.792 -10.131 1.00 30.32 H new ATOM 0 HG3 GLN A 128 -7.897 -2.478 -10.602 1.00 30.32 H new ATOM 0 HE21 GLN A 128 -9.552 -1.162 -7.740 1.00 65.00 H new ATOM 0 HE22 GLN A 128 -11.188 -1.340 -8.381 1.00 65.00 H new ATOM 1476 N PHE A 129 -4.977 -1.309 -6.607 1.00 44.34 N ATOM 1477 CA PHE A 129 -4.313 -1.343 -5.300 1.00 1.14 C ATOM 1478 C PHE A 129 -4.703 -0.125 -4.448 1.00 54.33 C ATOM 1479 O PHE A 129 -5.073 0.924 -4.981 1.00 50.42 O ATOM 1480 CB PHE A 129 -2.784 -1.397 -5.483 1.00 23.02 C ATOM 1481 CG PHE A 129 -2.247 -0.379 -6.459 1.00 50.22 C ATOM 1482 CD1 PHE A 129 -1.898 0.900 -6.043 1.00 5.25 C ATOM 1483 CD2 PHE A 129 -2.105 -0.702 -7.800 1.00 2.45 C ATOM 1484 CE1 PHE A 129 -1.415 1.828 -6.947 1.00 4.13 C ATOM 1485 CE2 PHE A 129 -1.625 0.221 -8.706 1.00 1.31 C ATOM 1486 CZ PHE A 129 -1.282 1.489 -8.280 1.00 73.13 C ATOM 0 H PHE A 129 -5.206 -0.368 -6.928 1.00 44.34 H new ATOM 0 HA PHE A 129 -4.641 -2.241 -4.776 1.00 1.14 H new ATOM 0 HB2 PHE A 129 -2.307 -1.244 -4.515 1.00 23.02 H new ATOM 0 HB3 PHE A 129 -2.504 -2.394 -5.823 1.00 23.02 H new ATOM 0 HD1 PHE A 129 -2.005 1.172 -5.003 1.00 5.25 H new ATOM 0 HD2 PHE A 129 -2.374 -1.691 -8.140 1.00 2.45 H new ATOM 0 HE1 PHE A 129 -1.142 2.818 -6.611 1.00 4.13 H new ATOM 0 HE2 PHE A 129 -1.518 -0.048 -9.747 1.00 1.31 H new ATOM 0 HZ PHE A 129 -0.910 2.215 -8.988 1.00 73.13 H new ATOM 1496 N VAL A 130 -4.619 -0.271 -3.125 1.00 53.54 N ATOM 1497 CA VAL A 130 -4.951 0.824 -2.197 1.00 63.15 C ATOM 1498 C VAL A 130 -3.680 1.492 -1.643 1.00 12.13 C ATOM 1499 O VAL A 130 -2.702 0.819 -1.321 1.00 73.14 O ATOM 1500 CB VAL A 130 -5.834 0.321 -1.019 1.00 53.15 C ATOM 1501 CG1 VAL A 130 -5.122 -0.764 -0.215 1.00 72.50 C ATOM 1502 CG2 VAL A 130 -6.255 1.484 -0.119 1.00 73.25 C ATOM 0 H VAL A 130 -4.325 -1.134 -2.667 1.00 53.54 H new ATOM 0 HA VAL A 130 -5.516 1.563 -2.766 1.00 63.15 H new ATOM 0 HB VAL A 130 -6.735 -0.122 -1.444 1.00 53.15 H new ATOM 0 HG11 VAL A 130 -5.766 -1.094 0.601 1.00 72.50 H new ATOM 0 HG12 VAL A 130 -4.897 -1.610 -0.865 1.00 72.50 H new ATOM 0 HG13 VAL A 130 -4.194 -0.364 0.194 1.00 72.50 H new ATOM 0 HG21 VAL A 130 -6.871 1.108 0.697 1.00 73.25 H new ATOM 0 HG22 VAL A 130 -5.368 1.968 0.290 1.00 73.25 H new ATOM 0 HG23 VAL A 130 -6.826 2.207 -0.702 1.00 73.25 H new ATOM 1512 N HIS A 131 -3.700 2.820 -1.533 1.00 23.31 N ATOM 1513 CA HIS A 131 -2.528 3.575 -1.071 1.00 72.21 C ATOM 1514 C HIS A 131 -2.914 4.977 -0.574 1.00 1.33 C ATOM 1515 O HIS A 131 -4.075 5.375 -0.640 1.00 55.14 O ATOM 1516 CB HIS A 131 -1.501 3.693 -2.206 1.00 22.34 C ATOM 1517 CG HIS A 131 -2.011 4.427 -3.411 1.00 5.31 C ATOM 1518 ND1 HIS A 131 -1.459 5.621 -3.810 1.00 10.51 N ATOM 1519 CD2 HIS A 131 -3.007 4.096 -4.272 1.00 40.52 C ATOM 1520 CE1 HIS A 131 -2.120 5.983 -4.894 1.00 14.22 C ATOM 1521 NE2 HIS A 131 -3.064 5.092 -5.209 1.00 23.20 N ATOM 0 H HIS A 131 -4.511 3.397 -1.756 1.00 23.31 H new ATOM 0 HA HIS A 131 -2.092 3.030 -0.234 1.00 72.21 H new ATOM 0 HB2 HIS A 131 -0.615 4.204 -1.830 1.00 22.34 H new ATOM 0 HB3 HIS A 131 -1.189 2.693 -2.507 1.00 22.34 H new ATOM 0 HD2 HIS A 131 -3.633 3.217 -4.226 1.00 40.52 H new ATOM 0 HE1 HIS A 131 -1.923 6.885 -5.455 1.00 14.22 H new ATOM 0 HE2 HIS A 131 -3.707 5.144 -5.999 1.00 23.20 H new ATOM 1529 N ALA A 132 -1.926 5.717 -0.077 1.00 73.41 N ATOM 1530 CA ALA A 132 -2.143 7.086 0.403 1.00 43.04 C ATOM 1531 C ALA A 132 -1.366 8.107 -0.444 1.00 15.03 C ATOM 1532 O ALA A 132 -0.149 8.244 -0.313 1.00 30.44 O ATOM 1533 CB ALA A 132 -1.745 7.201 1.873 1.00 12.12 C ATOM 0 H ALA A 132 -0.962 5.393 0.005 1.00 73.41 H new ATOM 0 HA ALA A 132 -3.205 7.311 0.305 1.00 43.04 H new ATOM 0 HB1 ALA A 132 -1.911 8.222 2.216 1.00 12.12 H new ATOM 0 HB2 ALA A 132 -2.348 6.516 2.468 1.00 12.12 H new ATOM 0 HB3 ALA A 132 -0.691 6.948 1.985 1.00 12.12 H new ATOM 1539 N SER A 133 -2.074 8.811 -1.322 1.00 62.31 N ATOM 1540 CA SER A 133 -1.458 9.831 -2.181 1.00 41.54 C ATOM 1541 C SER A 133 -1.280 11.161 -1.434 1.00 34.30 C ATOM 1542 O SER A 133 -2.081 11.511 -0.569 1.00 70.42 O ATOM 1543 CB SER A 133 -2.306 10.053 -3.439 1.00 55.51 C ATOM 1544 OG SER A 133 -2.382 8.875 -4.225 1.00 32.51 O ATOM 0 H SER A 133 -3.078 8.697 -1.462 1.00 62.31 H new ATOM 0 HA SER A 133 -0.472 9.467 -2.470 1.00 41.54 H new ATOM 0 HB2 SER A 133 -3.310 10.367 -3.153 1.00 55.51 H new ATOM 0 HB3 SER A 133 -1.877 10.861 -4.032 1.00 55.51 H new ATOM 0 HG SER A 133 -2.385 9.115 -5.175 1.00 32.51 H new ATOM 1550 N THR A 134 -0.242 11.911 -1.806 1.00 3.51 N ATOM 1551 CA THR A 134 0.111 13.169 -1.124 1.00 32.02 C ATOM 1552 C THR A 134 -1.052 14.182 -1.089 1.00 74.44 C ATOM 1553 O THR A 134 -1.301 14.819 -0.061 1.00 44.22 O ATOM 1554 CB THR A 134 1.338 13.843 -1.787 1.00 24.11 C ATOM 1555 OG1 THR A 134 1.073 14.095 -3.174 1.00 51.31 O ATOM 1556 CG2 THR A 134 2.585 12.972 -1.658 1.00 0.24 C ATOM 0 H THR A 134 0.377 11.672 -2.581 1.00 3.51 H new ATOM 0 HA THR A 134 0.349 12.887 -0.098 1.00 32.02 H new ATOM 0 HB THR A 134 1.520 14.786 -1.271 1.00 24.11 H new ATOM 0 HG1 THR A 134 1.854 14.523 -3.584 1.00 51.31 H new ATOM 0 HG21 THR A 134 3.429 13.472 -2.133 1.00 0.24 H new ATOM 0 HG22 THR A 134 2.807 12.808 -0.603 1.00 0.24 H new ATOM 0 HG23 THR A 134 2.411 12.013 -2.145 1.00 0.24 H new ATOM 1564 N SER A 135 -1.752 14.341 -2.209 1.00 40.14 N ATOM 1565 CA SER A 135 -2.867 15.302 -2.296 1.00 60.55 C ATOM 1566 C SER A 135 -4.235 14.616 -2.154 1.00 41.13 C ATOM 1567 O SER A 135 -5.124 15.127 -1.475 1.00 2.04 O ATOM 1568 CB SER A 135 -2.807 16.072 -3.623 1.00 63.02 C ATOM 1569 OG SER A 135 -1.646 16.892 -3.689 1.00 71.41 O ATOM 0 H SER A 135 -1.574 13.823 -3.070 1.00 40.14 H new ATOM 0 HA SER A 135 -2.756 15.998 -1.464 1.00 60.55 H new ATOM 0 HB2 SER A 135 -2.806 15.368 -4.455 1.00 63.02 H new ATOM 0 HB3 SER A 135 -3.699 16.690 -3.729 1.00 63.02 H new ATOM 0 HG SER A 135 -1.631 17.370 -4.544 1.00 71.41 H new ATOM 1575 N SER A 136 -4.401 13.463 -2.796 1.00 1.34 N ATOM 1576 CA SER A 136 -5.694 12.752 -2.785 1.00 0.22 C ATOM 1577 C SER A 136 -5.958 12.016 -1.463 1.00 12.51 C ATOM 1578 O SER A 136 -7.112 11.786 -1.093 1.00 51.02 O ATOM 1579 CB SER A 136 -5.763 11.752 -3.946 1.00 31.44 C ATOM 1580 OG SER A 136 -5.637 12.407 -5.198 1.00 24.24 O ATOM 0 H SER A 136 -3.667 12.997 -3.329 1.00 1.34 H new ATOM 0 HA SER A 136 -6.466 13.513 -2.898 1.00 0.22 H new ATOM 0 HB2 SER A 136 -4.970 11.012 -3.839 1.00 31.44 H new ATOM 0 HB3 SER A 136 -6.710 11.213 -3.909 1.00 31.44 H new ATOM 0 HG SER A 136 -5.683 11.745 -5.919 1.00 24.24 H new ATOM 1586 N GLY A 137 -4.893 11.650 -0.754 1.00 24.41 N ATOM 1587 CA GLY A 137 -5.038 10.883 0.482 1.00 72.10 C ATOM 1588 C GLY A 137 -5.232 9.388 0.233 1.00 14.34 C ATOM 1589 O GLY A 137 -4.777 8.859 -0.785 1.00 60.42 O ATOM 0 H GLY A 137 -3.930 11.869 -1.010 1.00 24.41 H new ATOM 0 HA2 GLY A 137 -4.154 11.031 1.102 1.00 72.10 H new ATOM 0 HA3 GLY A 137 -5.890 11.266 1.044 1.00 72.10 H new ATOM 1593 N VAL A 138 -5.906 8.708 1.159 1.00 4.31 N ATOM 1594 CA VAL A 138 -6.167 7.265 1.035 1.00 74.13 C ATOM 1595 C VAL A 138 -7.134 6.959 -0.127 1.00 14.11 C ATOM 1596 O VAL A 138 -8.349 7.150 -0.010 1.00 3.22 O ATOM 1597 CB VAL A 138 -6.747 6.689 2.357 1.00 73.20 C ATOM 1598 CG1 VAL A 138 -6.977 5.182 2.246 1.00 72.21 C ATOM 1599 CG2 VAL A 138 -5.830 7.011 3.538 1.00 10.24 C ATOM 0 H VAL A 138 -6.284 9.130 2.007 1.00 4.31 H new ATOM 0 HA VAL A 138 -5.211 6.787 0.824 1.00 74.13 H new ATOM 0 HB VAL A 138 -7.712 7.164 2.534 1.00 73.20 H new ATOM 0 HG11 VAL A 138 -7.383 4.806 3.185 1.00 72.21 H new ATOM 0 HG12 VAL A 138 -7.681 4.980 1.439 1.00 72.21 H new ATOM 0 HG13 VAL A 138 -6.031 4.684 2.035 1.00 72.21 H new ATOM 0 HG21 VAL A 138 -6.256 6.598 4.452 1.00 10.24 H new ATOM 0 HG22 VAL A 138 -4.847 6.573 3.365 1.00 10.24 H new ATOM 0 HG23 VAL A 138 -5.733 8.092 3.639 1.00 10.24 H new ATOM 1609 N ILE A 139 -6.586 6.485 -1.250 1.00 60.43 N ATOM 1610 CA ILE A 139 -7.380 6.225 -2.462 1.00 12.45 C ATOM 1611 C ILE A 139 -7.022 4.880 -3.126 1.00 64.14 C ATOM 1612 O ILE A 139 -6.151 4.141 -2.660 1.00 70.32 O ATOM 1613 CB ILE A 139 -7.184 7.347 -3.516 1.00 34.15 C ATOM 1614 CG1 ILE A 139 -5.708 7.414 -3.963 1.00 62.00 C ATOM 1615 CG2 ILE A 139 -7.649 8.698 -2.969 1.00 41.23 C ATOM 1616 CD1 ILE A 139 -5.449 8.382 -5.099 1.00 53.13 C ATOM 0 H ILE A 139 -5.593 6.272 -1.348 1.00 60.43 H new ATOM 0 HA ILE A 139 -8.418 6.193 -2.131 1.00 12.45 H new ATOM 0 HB ILE A 139 -7.796 7.110 -4.386 1.00 34.15 H new ATOM 0 HG12 ILE A 139 -5.094 7.700 -3.109 1.00 62.00 H new ATOM 0 HG13 ILE A 139 -5.386 6.418 -4.268 1.00 62.00 H new ATOM 0 HG21 ILE A 139 -7.501 9.468 -3.727 1.00 41.23 H new ATOM 0 HG22 ILE A 139 -8.706 8.641 -2.711 1.00 41.23 H new ATOM 0 HG23 ILE A 139 -7.071 8.949 -2.079 1.00 41.23 H new ATOM 0 HD11 ILE A 139 -4.389 8.370 -5.353 1.00 53.13 H new ATOM 0 HD12 ILE A 139 -6.034 8.086 -5.970 1.00 53.13 H new ATOM 0 HD13 ILE A 139 -5.737 9.388 -4.793 1.00 53.13 H new ATOM 1628 N ILE A 140 -7.715 4.580 -4.228 1.00 4.14 N ATOM 1629 CA ILE A 140 -7.439 3.391 -5.045 1.00 42.22 C ATOM 1630 C ILE A 140 -6.887 3.793 -6.427 1.00 53.15 C ATOM 1631 O ILE A 140 -7.402 4.716 -7.062 1.00 65.42 O ATOM 1632 CB ILE A 140 -8.728 2.549 -5.264 1.00 1.21 C ATOM 1633 CG1 ILE A 140 -9.397 2.193 -3.924 1.00 30.04 C ATOM 1634 CG2 ILE A 140 -8.419 1.280 -6.063 1.00 41.03 C ATOM 1635 CD1 ILE A 140 -8.567 1.294 -3.033 1.00 60.21 C ATOM 0 H ILE A 140 -8.482 5.152 -4.580 1.00 4.14 H new ATOM 0 HA ILE A 140 -6.700 2.798 -4.506 1.00 42.22 H new ATOM 0 HB ILE A 140 -9.427 3.157 -5.838 1.00 1.21 H new ATOM 0 HG12 ILE A 140 -9.618 3.115 -3.386 1.00 30.04 H new ATOM 0 HG13 ILE A 140 -10.351 1.705 -4.126 1.00 30.04 H new ATOM 0 HG21 ILE A 140 -9.335 0.707 -6.204 1.00 41.03 H new ATOM 0 HG22 ILE A 140 -8.009 1.553 -7.035 1.00 41.03 H new ATOM 0 HG23 ILE A 140 -7.693 0.676 -5.519 1.00 41.03 H new ATOM 0 HD11 ILE A 140 -9.112 1.093 -2.111 1.00 60.21 H new ATOM 0 HD12 ILE A 140 -8.367 0.355 -3.549 1.00 60.21 H new ATOM 0 HD13 ILE A 140 -7.624 1.786 -2.797 1.00 60.21 H new ATOM 1647 N SER A 141 -5.844 3.102 -6.886 1.00 12.33 N ATOM 1648 CA SER A 141 -5.296 3.317 -8.244 1.00 41.42 C ATOM 1649 C SER A 141 -5.088 1.981 -8.968 1.00 71.03 C ATOM 1650 O SER A 141 -5.300 0.916 -8.386 1.00 45.21 O ATOM 1651 CB SER A 141 -3.971 4.094 -8.195 1.00 44.54 C ATOM 1652 OG SER A 141 -4.162 5.421 -7.725 1.00 73.41 O ATOM 0 H SER A 141 -5.356 2.388 -6.346 1.00 12.33 H new ATOM 0 HA SER A 141 -6.024 3.910 -8.798 1.00 41.42 H new ATOM 0 HB2 SER A 141 -3.267 3.574 -7.545 1.00 44.54 H new ATOM 0 HB3 SER A 141 -3.526 4.120 -9.190 1.00 44.54 H new ATOM 0 HG SER A 141 -3.337 5.934 -7.851 1.00 73.41 H new ATOM 1658 N SER A 142 -4.672 2.031 -10.236 1.00 11.54 N ATOM 1659 CA SER A 142 -4.492 0.803 -11.031 1.00 0.24 C ATOM 1660 C SER A 142 -3.205 0.821 -11.871 1.00 54.21 C ATOM 1661 O SER A 142 -2.793 1.860 -12.391 1.00 44.35 O ATOM 1662 CB SER A 142 -5.695 0.580 -11.951 1.00 74.23 C ATOM 1663 OG SER A 142 -5.557 -0.630 -12.681 1.00 55.12 O ATOM 0 H SER A 142 -4.455 2.894 -10.734 1.00 11.54 H new ATOM 0 HA SER A 142 -4.409 -0.017 -10.318 1.00 0.24 H new ATOM 0 HB2 SER A 142 -6.610 0.550 -11.359 1.00 74.23 H new ATOM 0 HB3 SER A 142 -5.790 1.418 -12.642 1.00 74.23 H new ATOM 0 HG SER A 142 -6.443 -1.011 -12.854 1.00 55.12 H new ATOM 1669 N MET A 143 -2.597 -0.355 -12.020 1.00 61.11 N ATOM 1670 CA MET A 143 -1.326 -0.513 -12.744 1.00 13.15 C ATOM 1671 C MET A 143 -1.448 -0.196 -14.247 1.00 25.14 C ATOM 1672 O MET A 143 -0.444 0.068 -14.911 1.00 41.32 O ATOM 1673 CB MET A 143 -0.806 -1.948 -12.574 1.00 12.00 C ATOM 1674 CG MET A 143 -0.496 -2.333 -11.134 1.00 31.34 C ATOM 1675 SD MET A 143 0.818 -1.337 -10.409 1.00 61.22 S ATOM 1676 CE MET A 143 2.182 -1.722 -11.503 1.00 71.34 C ATOM 0 H MET A 143 -2.967 -1.228 -11.644 1.00 61.11 H new ATOM 0 HA MET A 143 -0.628 0.205 -12.314 1.00 13.15 H new ATOM 0 HB2 MET A 143 -1.548 -2.641 -12.972 1.00 12.00 H new ATOM 0 HB3 MET A 143 0.097 -2.069 -13.173 1.00 12.00 H new ATOM 0 HG2 MET A 143 -1.399 -2.227 -10.533 1.00 31.34 H new ATOM 0 HG3 MET A 143 -0.210 -3.384 -11.098 1.00 31.34 H new ATOM 0 HE1 MET A 143 2.940 -2.282 -10.956 1.00 71.34 H new ATOM 0 HE2 MET A 143 1.820 -2.321 -12.339 1.00 71.34 H new ATOM 0 HE3 MET A 143 2.617 -0.797 -11.881 1.00 71.34 H new ATOM 1686 N ASN A 144 -2.668 -0.237 -14.786 1.00 50.14 N ATOM 1687 CA ASN A 144 -2.870 -0.008 -16.223 1.00 54.10 C ATOM 1688 C ASN A 144 -2.754 1.483 -16.583 1.00 24.23 C ATOM 1689 O ASN A 144 -2.553 1.836 -17.747 1.00 3.25 O ATOM 1690 CB ASN A 144 -4.230 -0.561 -16.683 1.00 65.25 C ATOM 1691 CG ASN A 144 -5.406 0.309 -16.268 1.00 71.33 C ATOM 1692 OD1 ASN A 144 -5.799 1.222 -16.984 1.00 43.14 O ATOM 1693 ND2 ASN A 144 -5.994 0.026 -15.126 1.00 41.31 N ATOM 0 H ASN A 144 -3.522 -0.424 -14.260 1.00 50.14 H new ATOM 0 HA ASN A 144 -2.079 -0.543 -16.748 1.00 54.10 H new ATOM 0 HB2 ASN A 144 -4.226 -0.660 -17.769 1.00 65.25 H new ATOM 0 HB3 ASN A 144 -4.365 -1.562 -16.272 1.00 65.25 H new ATOM 0 HD21 ASN A 144 -6.798 0.572 -14.817 1.00 41.31 H new ATOM 0 HD22 ASN A 144 -5.646 -0.740 -14.549 1.00 41.31 H new ATOM 1700 N GLU A 145 -2.882 2.351 -15.582 1.00 20.12 N ATOM 1701 CA GLU A 145 -2.825 3.799 -15.800 1.00 55.32 C ATOM 1702 C GLU A 145 -1.407 4.242 -16.209 1.00 30.25 C ATOM 1703 O GLU A 145 -0.428 3.893 -15.548 1.00 23.21 O ATOM 1704 CB GLU A 145 -3.274 4.539 -14.533 1.00 75.14 C ATOM 1705 CG GLU A 145 -4.662 4.125 -14.047 1.00 51.14 C ATOM 1706 CD GLU A 145 -5.158 4.950 -12.870 1.00 14.42 C ATOM 1707 OE1 GLU A 145 -5.803 5.995 -13.105 1.00 74.04 O ATOM 1708 OE2 GLU A 145 -4.929 4.555 -11.705 1.00 44.33 O ATOM 0 H GLU A 145 -3.026 2.079 -14.610 1.00 20.12 H new ATOM 0 HA GLU A 145 -3.503 4.050 -16.616 1.00 55.32 H new ATOM 0 HB2 GLU A 145 -2.550 4.356 -13.739 1.00 75.14 H new ATOM 0 HB3 GLU A 145 -3.270 5.612 -14.727 1.00 75.14 H new ATOM 0 HG2 GLU A 145 -5.370 4.217 -14.870 1.00 51.14 H new ATOM 0 HG3 GLU A 145 -4.641 3.073 -13.761 1.00 51.14 H new ATOM 1715 N PRO A 146 -1.282 5.040 -17.295 1.00 4.44 N ATOM 1716 CA PRO A 146 0.021 5.414 -17.882 1.00 71.41 C ATOM 1717 C PRO A 146 1.033 5.945 -16.858 1.00 62.53 C ATOM 1718 O PRO A 146 2.194 5.528 -16.854 1.00 22.51 O ATOM 1719 CB PRO A 146 -0.338 6.504 -18.914 1.00 11.22 C ATOM 1720 CG PRO A 146 -1.756 6.876 -18.625 1.00 63.05 C ATOM 1721 CD PRO A 146 -2.394 5.647 -18.040 1.00 41.11 C ATOM 0 HA PRO A 146 0.516 4.544 -18.313 1.00 71.41 H new ATOM 0 HB2 PRO A 146 0.321 7.367 -18.819 1.00 11.22 H new ATOM 0 HB3 PRO A 146 -0.230 6.131 -19.932 1.00 11.22 H new ATOM 0 HG2 PRO A 146 -1.806 7.712 -17.927 1.00 63.05 H new ATOM 0 HG3 PRO A 146 -2.271 7.188 -19.534 1.00 63.05 H new ATOM 0 HD2 PRO A 146 -3.232 5.895 -17.389 1.00 41.11 H new ATOM 0 HD3 PRO A 146 -2.777 4.981 -18.813 1.00 41.11 H new ATOM 1729 N TYR A 147 0.595 6.855 -15.990 1.00 64.32 N ATOM 1730 CA TYR A 147 1.485 7.446 -14.988 1.00 4.45 C ATOM 1731 C TYR A 147 2.053 6.380 -14.033 1.00 14.40 C ATOM 1732 O TYR A 147 3.253 6.353 -13.764 1.00 32.24 O ATOM 1733 CB TYR A 147 0.757 8.532 -14.181 1.00 74.50 C ATOM 1734 CG TYR A 147 1.643 9.192 -13.136 1.00 14.23 C ATOM 1735 CD1 TYR A 147 2.530 10.208 -13.487 1.00 13.20 C ATOM 1736 CD2 TYR A 147 1.610 8.784 -11.803 1.00 51.12 C ATOM 1737 CE1 TYR A 147 3.359 10.788 -12.545 1.00 23.01 C ATOM 1738 CE2 TYR A 147 2.433 9.365 -10.857 1.00 41.14 C ATOM 1739 CZ TYR A 147 3.303 10.365 -11.233 1.00 12.34 C ATOM 1740 OH TYR A 147 4.141 10.928 -10.296 1.00 31.44 O ATOM 0 H TYR A 147 -0.365 7.199 -15.959 1.00 64.32 H new ATOM 0 HA TYR A 147 2.317 7.900 -15.527 1.00 4.45 H new ATOM 0 HB2 TYR A 147 0.382 9.294 -14.864 1.00 74.50 H new ATOM 0 HB3 TYR A 147 -0.109 8.091 -13.688 1.00 74.50 H new ATOM 0 HD1 TYR A 147 2.570 10.548 -14.511 1.00 13.20 H new ATOM 0 HD2 TYR A 147 0.929 8.000 -11.505 1.00 51.12 H new ATOM 0 HE1 TYR A 147 4.047 11.568 -12.835 1.00 23.01 H new ATOM 0 HE2 TYR A 147 2.394 9.037 -9.829 1.00 41.14 H new ATOM 0 HH TYR A 147 3.974 10.520 -9.421 1.00 31.44 H new ATOM 1750 N TRP A 148 1.192 5.498 -13.536 1.00 44.21 N ATOM 1751 CA TRP A 148 1.611 4.476 -12.569 1.00 71.34 C ATOM 1752 C TRP A 148 2.430 3.372 -13.254 1.00 50.52 C ATOM 1753 O TRP A 148 3.431 2.897 -12.712 1.00 43.11 O ATOM 1754 CB TRP A 148 0.388 3.881 -11.856 1.00 30.13 C ATOM 1755 CG TRP A 148 -0.388 4.892 -11.053 1.00 22.45 C ATOM 1756 CD1 TRP A 148 -1.597 5.445 -11.368 1.00 51.25 C ATOM 1757 CD2 TRP A 148 0.004 5.477 -9.804 1.00 74.31 C ATOM 1758 NE1 TRP A 148 -1.982 6.331 -10.392 1.00 64.33 N ATOM 1759 CE2 TRP A 148 -1.016 6.369 -9.422 1.00 45.42 C ATOM 1760 CE3 TRP A 148 1.118 5.330 -8.971 1.00 50.44 C ATOM 1761 CZ2 TRP A 148 -0.955 7.110 -8.244 1.00 63.01 C ATOM 1762 CZ3 TRP A 148 1.178 6.066 -7.802 1.00 24.23 C ATOM 1763 CH2 TRP A 148 0.147 6.947 -7.447 1.00 32.44 C ATOM 0 H TRP A 148 0.203 5.466 -13.782 1.00 44.21 H new ATOM 0 HA TRP A 148 2.249 4.953 -11.825 1.00 71.34 H new ATOM 0 HB2 TRP A 148 -0.273 3.433 -12.598 1.00 30.13 H new ATOM 0 HB3 TRP A 148 0.717 3.079 -11.196 1.00 30.13 H new ATOM 0 HD1 TRP A 148 -2.168 5.218 -12.256 1.00 51.25 H new ATOM 0 HE1 TRP A 148 -2.846 6.872 -10.390 1.00 64.33 H new ATOM 0 HE3 TRP A 148 1.917 4.654 -9.236 1.00 50.44 H new ATOM 0 HZ2 TRP A 148 -1.749 7.789 -7.969 1.00 63.01 H new ATOM 0 HZ3 TRP A 148 2.034 5.960 -7.151 1.00 24.23 H new ATOM 0 HH2 TRP A 148 0.223 7.508 -6.527 1.00 32.44 H new ATOM 1774 N LYS A 149 2.010 2.988 -14.459 1.00 75.21 N ATOM 1775 CA LYS A 149 2.723 1.983 -15.258 1.00 44.22 C ATOM 1776 C LYS A 149 4.210 2.351 -15.439 1.00 32.52 C ATOM 1777 O LYS A 149 5.093 1.503 -15.287 1.00 3.12 O ATOM 1778 CB LYS A 149 2.046 1.831 -16.631 1.00 22.43 C ATOM 1779 CG LYS A 149 2.698 0.778 -17.528 1.00 3.22 C ATOM 1780 CD LYS A 149 2.014 0.666 -18.892 1.00 3.34 C ATOM 1781 CE LYS A 149 2.009 1.998 -19.640 1.00 1.32 C ATOM 1782 NZ LYS A 149 1.491 1.854 -21.026 1.00 11.34 N ATOM 0 H LYS A 149 1.173 3.359 -14.909 1.00 75.21 H new ATOM 0 HA LYS A 149 2.679 1.035 -14.722 1.00 44.22 H new ATOM 0 HB2 LYS A 149 0.998 1.569 -16.482 1.00 22.43 H new ATOM 0 HB3 LYS A 149 2.065 2.793 -17.143 1.00 22.43 H new ATOM 0 HG2 LYS A 149 3.749 1.028 -17.672 1.00 3.22 H new ATOM 0 HG3 LYS A 149 2.666 -0.190 -17.029 1.00 3.22 H new ATOM 0 HD2 LYS A 149 2.525 -0.086 -19.493 1.00 3.34 H new ATOM 0 HD3 LYS A 149 0.989 0.322 -18.756 1.00 3.34 H new ATOM 0 HE2 LYS A 149 1.396 2.717 -19.096 1.00 1.32 H new ATOM 0 HE3 LYS A 149 3.021 2.401 -19.671 1.00 1.32 H new ATOM 0 HZ1 LYS A 149 1.504 2.780 -21.499 1.00 11.34 H new ATOM 0 HZ2 LYS A 149 2.090 1.187 -21.553 1.00 11.34 H new ATOM 0 HZ3 LYS A 149 0.516 1.494 -20.996 1.00 11.34 H new ATOM 1796 N LYS A 150 4.483 3.618 -15.755 1.00 61.34 N ATOM 1797 CA LYS A 150 5.865 4.084 -15.945 1.00 3.04 C ATOM 1798 C LYS A 150 6.577 4.329 -14.599 1.00 43.04 C ATOM 1799 O LYS A 150 7.789 4.126 -14.483 1.00 22.31 O ATOM 1800 CB LYS A 150 5.895 5.353 -16.811 1.00 34.45 C ATOM 1801 CG LYS A 150 5.127 6.534 -16.225 1.00 3.42 C ATOM 1802 CD LYS A 150 5.167 7.750 -17.148 1.00 63.33 C ATOM 1803 CE LYS A 150 4.509 7.465 -18.496 1.00 2.12 C ATOM 1804 NZ LYS A 150 4.531 8.653 -19.388 1.00 50.22 N ATOM 0 H LYS A 150 3.773 4.339 -15.885 1.00 61.34 H new ATOM 0 HA LYS A 150 6.408 3.294 -16.464 1.00 3.04 H new ATOM 0 HB2 LYS A 150 6.933 5.650 -16.964 1.00 34.45 H new ATOM 0 HB3 LYS A 150 5.483 5.118 -17.792 1.00 34.45 H new ATOM 0 HG2 LYS A 150 4.091 6.244 -16.051 1.00 3.42 H new ATOM 0 HG3 LYS A 150 5.551 6.799 -15.256 1.00 3.42 H new ATOM 0 HD2 LYS A 150 4.661 8.587 -16.667 1.00 63.33 H new ATOM 0 HD3 LYS A 150 6.202 8.051 -17.306 1.00 63.33 H new ATOM 0 HE2 LYS A 150 5.024 6.637 -18.983 1.00 2.12 H new ATOM 0 HE3 LYS A 150 3.478 7.150 -18.337 1.00 2.12 H new ATOM 0 HZ1 LYS A 150 4.075 8.417 -20.292 1.00 50.22 H new ATOM 0 HZ2 LYS A 150 4.018 9.436 -18.936 1.00 50.22 H new ATOM 0 HZ3 LYS A 150 5.516 8.939 -19.562 1.00 50.22 H new ATOM 1818 N ARG A 151 5.823 4.749 -13.581 1.00 34.01 N ATOM 1819 CA ARG A 151 6.383 4.950 -12.235 1.00 3.32 C ATOM 1820 C ARG A 151 6.748 3.617 -11.561 1.00 32.40 C ATOM 1821 O ARG A 151 7.520 3.591 -10.599 1.00 14.40 O ATOM 1822 CB ARG A 151 5.394 5.718 -11.342 1.00 24.33 C ATOM 1823 CG ARG A 151 5.283 7.208 -11.651 1.00 14.21 C ATOM 1824 CD ARG A 151 6.609 7.936 -11.447 1.00 45.43 C ATOM 1825 NE ARG A 151 6.422 9.378 -11.276 1.00 44.54 N ATOM 1826 CZ ARG A 151 7.286 10.288 -11.639 1.00 71.01 C ATOM 1827 NH1 ARG A 151 8.387 9.962 -12.239 1.00 63.34 N ATOM 1828 NH2 ARG A 151 7.044 11.533 -11.397 1.00 22.44 N ATOM 0 H ARG A 151 4.827 4.957 -13.658 1.00 34.01 H new ATOM 0 HA ARG A 151 7.295 5.535 -12.356 1.00 3.32 H new ATOM 0 HB2 ARG A 151 4.408 5.265 -11.442 1.00 24.33 H new ATOM 0 HB3 ARG A 151 5.696 5.598 -10.302 1.00 24.33 H new ATOM 0 HG2 ARG A 151 4.952 7.341 -12.681 1.00 14.21 H new ATOM 0 HG3 ARG A 151 4.522 7.655 -11.011 1.00 14.21 H new ATOM 0 HD2 ARG A 151 7.115 7.530 -10.571 1.00 45.43 H new ATOM 0 HD3 ARG A 151 7.258 7.754 -12.303 1.00 45.43 H new ATOM 0 HE ARG A 151 5.555 9.695 -10.842 1.00 44.54 H new ATOM 0 HH11 ARG A 151 8.590 8.982 -12.435 1.00 63.34 H new ATOM 0 HH12 ARG A 151 9.051 10.686 -12.516 1.00 63.34 H new ATOM 0 HH21 ARG A 151 6.181 11.802 -10.924 1.00 22.44 H new ATOM 0 HH22 ARG A 151 7.716 12.247 -11.679 1.00 22.44 H new ATOM 1842 N TYR A 152 6.180 2.521 -12.062 1.00 11.05 N ATOM 1843 CA TYR A 152 6.417 1.190 -11.495 1.00 22.14 C ATOM 1844 C TYR A 152 7.915 0.840 -11.454 1.00 14.21 C ATOM 1845 O TYR A 152 8.561 0.657 -12.492 1.00 61.22 O ATOM 1846 CB TYR A 152 5.645 0.127 -12.293 1.00 12.52 C ATOM 1847 CG TYR A 152 5.753 -1.275 -11.718 1.00 53.13 C ATOM 1848 CD1 TYR A 152 5.462 -1.525 -10.379 1.00 24.43 C ATOM 1849 CD2 TYR A 152 6.143 -2.346 -12.514 1.00 32.12 C ATOM 1850 CE1 TYR A 152 5.551 -2.802 -9.856 1.00 30.34 C ATOM 1851 CE2 TYR A 152 6.232 -3.624 -11.999 1.00 0.23 C ATOM 1852 CZ TYR A 152 5.939 -3.847 -10.669 1.00 64.40 C ATOM 1853 OH TYR A 152 6.032 -5.121 -10.152 1.00 73.43 O ATOM 0 H TYR A 152 5.549 2.527 -12.863 1.00 11.05 H new ATOM 0 HA TYR A 152 6.055 1.203 -10.467 1.00 22.14 H new ATOM 0 HB2 TYR A 152 4.594 0.411 -12.335 1.00 12.52 H new ATOM 0 HB3 TYR A 152 6.014 0.118 -13.318 1.00 12.52 H new ATOM 0 HD1 TYR A 152 5.162 -0.708 -9.739 1.00 24.43 H new ATOM 0 HD2 TYR A 152 6.381 -2.175 -13.554 1.00 32.12 H new ATOM 0 HE1 TYR A 152 5.318 -2.980 -8.817 1.00 30.34 H new ATOM 0 HE2 TYR A 152 6.530 -4.445 -12.634 1.00 0.23 H new ATOM 0 HH TYR A 152 6.317 -5.740 -10.856 1.00 73.43 H new ATOM 1863 N ASN A 153 8.454 0.766 -10.240 1.00 1.34 N ATOM 1864 CA ASN A 153 9.854 0.401 -10.017 1.00 40.11 C ATOM 1865 C ASN A 153 9.985 -1.116 -9.876 1.00 65.33 C ATOM 1866 O ASN A 153 10.738 -1.763 -10.607 1.00 61.44 O ATOM 1867 CB ASN A 153 10.359 1.101 -8.742 1.00 64.14 C ATOM 1868 CG ASN A 153 11.860 0.971 -8.482 1.00 33.21 C ATOM 1869 OD1 ASN A 153 12.496 1.926 -8.059 1.00 3.00 O ATOM 1870 ND2 ASN A 153 12.438 -0.202 -8.671 1.00 70.00 N ATOM 0 H ASN A 153 7.935 0.957 -9.383 1.00 1.34 H new ATOM 0 HA ASN A 153 10.455 0.720 -10.868 1.00 40.11 H new ATOM 0 HB2 ASN A 153 10.107 2.160 -8.803 1.00 64.14 H new ATOM 0 HB3 ASN A 153 9.821 0.694 -7.886 1.00 64.14 H new ATOM 0 HD21 ASN A 153 13.429 -0.321 -8.463 1.00 70.00 H new ATOM 0 HD22 ASN A 153 11.893 -0.988 -9.024 1.00 70.00 H new ATOM 1877 N GLU A 154 9.254 -1.668 -8.916 1.00 41.24 N ATOM 1878 CA GLU A 154 9.332 -3.093 -8.580 1.00 64.31 C ATOM 1879 C GLU A 154 8.234 -3.470 -7.578 1.00 10.42 C ATOM 1880 O GLU A 154 7.481 -2.608 -7.115 1.00 3.01 O ATOM 1881 CB GLU A 154 10.711 -3.421 -7.985 1.00 61.41 C ATOM 1882 CG GLU A 154 11.008 -2.675 -6.686 1.00 4.45 C ATOM 1883 CD GLU A 154 12.423 -2.906 -6.180 1.00 13.40 C ATOM 1884 OE1 GLU A 154 12.735 -4.043 -5.773 1.00 73.51 O ATOM 1885 OE2 GLU A 154 13.224 -1.949 -6.173 1.00 13.24 O ATOM 0 H GLU A 154 8.589 -1.145 -8.346 1.00 41.24 H new ATOM 0 HA GLU A 154 9.188 -3.670 -9.493 1.00 64.31 H new ATOM 0 HB2 GLU A 154 10.772 -4.494 -7.801 1.00 61.41 H new ATOM 0 HB3 GLU A 154 11.481 -3.179 -8.718 1.00 61.41 H new ATOM 0 HG2 GLU A 154 10.854 -1.607 -6.843 1.00 4.45 H new ATOM 0 HG3 GLU A 154 10.298 -2.991 -5.921 1.00 4.45 H new ATOM 1892 N ALA A 155 8.145 -4.750 -7.235 1.00 71.44 N ATOM 1893 CA ALA A 155 7.144 -5.217 -6.274 1.00 43.32 C ATOM 1894 C ALA A 155 7.786 -5.995 -5.118 1.00 55.03 C ATOM 1895 O ALA A 155 8.866 -6.569 -5.257 1.00 4.43 O ATOM 1896 CB ALA A 155 6.100 -6.067 -6.982 1.00 1.21 C ATOM 0 H ALA A 155 8.750 -5.483 -7.605 1.00 71.44 H new ATOM 0 HA ALA A 155 6.657 -4.342 -5.843 1.00 43.32 H new ATOM 0 HB1 ALA A 155 5.359 -6.410 -6.260 1.00 1.21 H new ATOM 0 HB2 ALA A 155 5.608 -5.473 -7.752 1.00 1.21 H new ATOM 0 HB3 ALA A 155 6.584 -6.928 -7.443 1.00 1.21 H new ATOM 1902 N ARG A 156 7.113 -5.995 -3.973 1.00 51.32 N ATOM 1903 CA ARG A 156 7.599 -6.667 -2.762 1.00 64.44 C ATOM 1904 C ARG A 156 6.433 -7.339 -2.027 1.00 51.11 C ATOM 1905 O ARG A 156 5.277 -7.082 -2.334 1.00 63.15 O ATOM 1906 CB ARG A 156 8.255 -5.642 -1.818 1.00 1.24 C ATOM 1907 CG ARG A 156 9.415 -4.858 -2.428 1.00 61.12 C ATOM 1908 CD ARG A 156 10.642 -5.734 -2.659 1.00 13.32 C ATOM 1909 NE ARG A 156 11.747 -4.983 -3.253 1.00 12.45 N ATOM 1910 CZ ARG A 156 12.831 -4.623 -2.612 1.00 74.42 C ATOM 1911 NH1 ARG A 156 13.001 -4.929 -1.367 1.00 4.10 N ATOM 1912 NH2 ARG A 156 13.743 -3.952 -3.228 1.00 5.20 N ATOM 0 H ARG A 156 6.213 -5.530 -3.853 1.00 51.32 H new ATOM 0 HA ARG A 156 8.330 -7.420 -3.056 1.00 64.44 H new ATOM 0 HB2 ARG A 156 7.494 -4.937 -1.485 1.00 1.24 H new ATOM 0 HB3 ARG A 156 8.615 -6.164 -0.931 1.00 1.24 H new ATOM 0 HG2 ARG A 156 9.098 -4.422 -3.375 1.00 61.12 H new ATOM 0 HG3 ARG A 156 9.679 -4.031 -1.769 1.00 61.12 H new ATOM 0 HD2 ARG A 156 10.964 -6.164 -1.711 1.00 13.32 H new ATOM 0 HD3 ARG A 156 10.376 -6.565 -3.312 1.00 13.32 H new ATOM 0 HE ARG A 156 11.668 -4.721 -4.236 1.00 12.45 H new ATOM 0 HH11 ARG A 156 12.285 -5.458 -0.870 1.00 4.10 H new ATOM 0 HH12 ARG A 156 13.851 -4.641 -0.883 1.00 4.10 H new ATOM 0 HH21 ARG A 156 13.618 -3.704 -4.210 1.00 5.20 H new ATOM 0 HH22 ARG A 156 14.589 -3.669 -2.734 1.00 5.20 H new ATOM 1926 N ARG A 157 6.734 -8.205 -1.065 1.00 52.35 N ATOM 1927 CA ARG A 157 5.706 -8.700 -0.141 1.00 45.43 C ATOM 1928 C ARG A 157 6.325 -9.170 1.180 1.00 70.41 C ATOM 1929 O ARG A 157 7.358 -9.844 1.196 1.00 71.33 O ATOM 1930 CB ARG A 157 4.843 -9.822 -0.755 1.00 64.02 C ATOM 1931 CG ARG A 157 5.578 -11.122 -1.072 1.00 42.25 C ATOM 1932 CD ARG A 157 6.391 -11.030 -2.360 1.00 60.10 C ATOM 1933 NE ARG A 157 6.782 -12.351 -2.845 1.00 43.11 N ATOM 1934 CZ ARG A 157 6.025 -13.099 -3.608 1.00 13.03 C ATOM 1935 NH1 ARG A 157 4.863 -12.681 -4.002 1.00 51.34 N ATOM 1936 NH2 ARG A 157 6.450 -14.259 -3.997 1.00 10.11 N ATOM 0 H ARG A 157 7.669 -8.578 -0.901 1.00 52.35 H new ATOM 0 HA ARG A 157 5.046 -7.856 0.059 1.00 45.43 H new ATOM 0 HB2 ARG A 157 4.027 -10.045 -0.068 1.00 64.02 H new ATOM 0 HB3 ARG A 157 4.392 -9.447 -1.674 1.00 64.02 H new ATOM 0 HG2 ARG A 157 6.241 -11.373 -0.244 1.00 42.25 H new ATOM 0 HG3 ARG A 157 4.855 -11.933 -1.159 1.00 42.25 H new ATOM 0 HD2 ARG A 157 5.805 -10.520 -3.125 1.00 60.10 H new ATOM 0 HD3 ARG A 157 7.282 -10.427 -2.186 1.00 60.10 H new ATOM 0 HE ARG A 157 7.697 -12.711 -2.574 1.00 43.11 H new ATOM 0 HH11 ARG A 157 4.529 -11.760 -3.718 1.00 51.34 H new ATOM 0 HH12 ARG A 157 4.283 -13.273 -4.596 1.00 51.34 H new ATOM 0 HH21 ARG A 157 7.372 -14.587 -3.709 1.00 10.11 H new ATOM 0 HH22 ARG A 157 5.863 -14.844 -4.591 1.00 10.11 H new ATOM 1950 N VAL A 158 5.687 -8.791 2.286 1.00 72.12 N ATOM 1951 CA VAL A 158 6.171 -9.121 3.632 1.00 60.21 C ATOM 1952 C VAL A 158 5.358 -10.254 4.284 1.00 20.33 C ATOM 1953 O VAL A 158 5.590 -10.613 5.439 1.00 61.43 O ATOM 1954 CB VAL A 158 6.133 -7.864 4.539 1.00 3.12 C ATOM 1955 CG1 VAL A 158 7.217 -6.870 4.124 1.00 23.52 C ATOM 1956 CG2 VAL A 158 4.754 -7.203 4.485 1.00 43.13 C ATOM 0 H VAL A 158 4.823 -8.249 2.278 1.00 72.12 H new ATOM 0 HA VAL A 158 7.198 -9.470 3.525 1.00 60.21 H new ATOM 0 HB VAL A 158 6.326 -8.177 5.565 1.00 3.12 H new ATOM 0 HG11 VAL A 158 7.175 -5.994 4.772 1.00 23.52 H new ATOM 0 HG12 VAL A 158 8.196 -7.341 4.214 1.00 23.52 H new ATOM 0 HG13 VAL A 158 7.054 -6.565 3.090 1.00 23.52 H new ATOM 0 HG21 VAL A 158 4.747 -6.323 5.128 1.00 43.13 H new ATOM 0 HG22 VAL A 158 4.533 -6.905 3.460 1.00 43.13 H new ATOM 0 HG23 VAL A 158 3.998 -7.909 4.829 1.00 43.13 H new ATOM 1966 N LEU A 159 4.412 -10.818 3.536 1.00 52.32 N ATOM 1967 CA LEU A 159 3.578 -11.923 4.031 1.00 14.33 C ATOM 1968 C LEU A 159 4.220 -13.291 3.743 1.00 63.42 C ATOM 1969 O LEU A 159 5.048 -13.424 2.841 1.00 41.32 O ATOM 1970 CB LEU A 159 2.184 -11.864 3.381 1.00 12.43 C ATOM 1971 CG LEU A 159 1.341 -10.624 3.726 1.00 22.31 C ATOM 1972 CD1 LEU A 159 0.033 -10.622 2.934 1.00 2.52 C ATOM 1973 CD2 LEU A 159 1.060 -10.565 5.228 1.00 52.51 C ATOM 0 H LEU A 159 4.200 -10.530 2.581 1.00 52.32 H new ATOM 0 HA LEU A 159 3.488 -11.810 5.111 1.00 14.33 H new ATOM 0 HB2 LEU A 159 2.305 -11.909 2.299 1.00 12.43 H new ATOM 0 HB3 LEU A 159 1.627 -12.753 3.676 1.00 12.43 H new ATOM 0 HG LEU A 159 1.910 -9.737 3.448 1.00 22.31 H new ATOM 0 HD11 LEU A 159 -0.548 -9.737 3.193 1.00 2.52 H new ATOM 0 HD12 LEU A 159 0.254 -10.612 1.867 1.00 2.52 H new ATOM 0 HD13 LEU A 159 -0.541 -11.516 3.177 1.00 2.52 H new ATOM 0 HD21 LEU A 159 0.463 -9.681 5.452 1.00 52.51 H new ATOM 0 HD22 LEU A 159 0.514 -11.458 5.531 1.00 52.51 H new ATOM 0 HD23 LEU A 159 2.003 -10.513 5.773 1.00 52.51 H new