USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 911 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 68 GLN : amide:sc= -0.261 K(o=-1,f=-5.4) USER MOD Set 1.2: A 88 LYS NZ :NH3+ 134:sc= -0.77 (180deg=-3.79!) USER MOD Single : A 3 ASN : amide:sc= -0.308 K(o=-0.31,f=-2) USER MOD Single : A 5 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.61) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -22:sc= -0.231 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.0683 X(o=-0.068,f=-0.28) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 MET CE :methyl -167:sc= 0 (180deg=-0.128) USER MOD Single : A 43 ASN : amide:sc= -1.24 K(o=-1.2,f=-3.4!) USER MOD Single : A 45 SER OG : rot 86:sc= 0.976 USER MOD Single : A 46 THR OG1 : rot 25:sc= 1.21 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.385 USER MOD Single : A 59 GLN : amide:sc= -5.6! C(o=-5.6!,f=-14!) USER MOD Single : A 65 CYS SG : rot 180:sc= -0.588 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -152:sc= 0.373 USER MOD Single : A 78 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.055) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 71:sc= 1.32 USER MOD Single : A 97 ASN : amide:sc= -0.128 X(o=-0.13,f=-0.46) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -59:sc= 0.917 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.233 USER MOD Single : A 108 ASN : amide:sc= -0.0492 X(o=-0.049,f=0) USER MOD Single : A 109 MET CE :methyl 152:sc= -0.114 (180deg=-0.675) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.667 USER MOD Single : A 111 SER OG : rot 180:sc= -0.446 USER MOD Single : A 112 GLN : amide:sc= -1.45 K(o=-1.5,f=-3.8!) USER MOD Single : A 113 MET CE :methyl 171:sc= 0 (180deg=-0.0275) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 7.767 -0.265 2.227 1.00 13.00 N ATOM 2 CA GLY A 2 7.350 -0.844 0.964 1.00 45.03 C ATOM 3 C GLY A 2 6.865 0.200 -0.021 1.00 23.22 C ATOM 4 O GLY A 2 5.661 0.366 -0.216 1.00 71.10 O ATOM 0 HA2 GLY A 2 8.184 -1.392 0.526 1.00 45.03 H new ATOM 0 HA3 GLY A 2 6.554 -1.566 1.144 1.00 45.03 H new ATOM 8 N ASN A 3 7.803 0.907 -0.643 1.00 23.32 N ATOM 9 CA ASN A 3 7.463 1.943 -1.611 1.00 43.45 C ATOM 10 C ASN A 3 7.135 1.331 -2.969 1.00 62.44 C ATOM 11 O ASN A 3 7.129 0.111 -3.127 1.00 44.25 O ATOM 12 CB ASN A 3 8.619 2.935 -1.753 1.00 72.52 C ATOM 13 CG ASN A 3 9.742 2.396 -2.616 1.00 50.54 C ATOM 14 OD1 ASN A 3 9.954 1.186 -2.693 1.00 60.33 O ATOM 15 ND2 ASN A 3 10.468 3.294 -3.272 1.00 52.11 N ATOM 0 H ASN A 3 8.804 0.781 -0.494 1.00 23.32 H new ATOM 0 HA ASN A 3 6.581 2.471 -1.247 1.00 43.45 H new ATOM 0 HB2 ASN A 3 8.246 3.863 -2.185 1.00 72.52 H new ATOM 0 HB3 ASN A 3 9.009 3.178 -0.765 1.00 72.52 H new ATOM 0 HD21 ASN A 3 11.237 2.990 -3.869 1.00 52.11 H new ATOM 0 HD22 ASN A 3 10.257 4.287 -3.179 1.00 52.11 H new ATOM 22 N GLY A 4 6.860 2.188 -3.948 1.00 73.35 N ATOM 23 CA GLY A 4 6.534 1.713 -5.280 1.00 12.30 C ATOM 24 C GLY A 4 5.353 2.447 -5.885 1.00 0.21 C ATOM 25 O GLY A 4 4.251 2.418 -5.338 1.00 44.21 O ATOM 0 H GLY A 4 6.857 3.202 -3.842 1.00 73.35 H new ATOM 0 HA2 GLY A 4 7.403 1.833 -5.928 1.00 12.30 H new ATOM 0 HA3 GLY A 4 6.312 0.647 -5.238 1.00 12.30 H new ATOM 29 N GLN A 5 5.585 3.109 -7.014 1.00 50.45 N ATOM 30 CA GLN A 5 4.532 3.855 -7.691 1.00 24.30 C ATOM 31 C GLN A 5 3.792 2.970 -8.689 1.00 53.44 C ATOM 32 O GLN A 5 4.064 1.774 -8.795 1.00 33.25 O ATOM 33 CB GLN A 5 5.119 5.072 -8.407 1.00 41.13 C ATOM 34 CG GLN A 5 6.197 4.720 -9.421 1.00 21.30 C ATOM 35 CD GLN A 5 7.541 5.333 -9.080 1.00 65.42 C ATOM 36 OE1 GLN A 5 7.614 6.459 -8.589 1.00 34.41 O ATOM 37 NE2 GLN A 5 8.612 4.594 -9.341 1.00 5.44 N ATOM 0 H GLN A 5 6.492 3.144 -7.479 1.00 50.45 H new ATOM 0 HA GLN A 5 3.821 4.194 -6.938 1.00 24.30 H new ATOM 0 HB2 GLN A 5 4.316 5.607 -8.914 1.00 41.13 H new ATOM 0 HB3 GLN A 5 5.538 5.753 -7.666 1.00 41.13 H new ATOM 0 HG2 GLN A 5 6.299 3.636 -9.475 1.00 21.30 H new ATOM 0 HG3 GLN A 5 5.887 5.061 -10.409 1.00 21.30 H new ATOM 0 HE21 GLN A 5 8.504 3.665 -9.749 1.00 5.44 H new ATOM 0 HE22 GLN A 5 9.543 4.955 -9.134 1.00 5.44 H new ATOM 46 N GLY A 6 2.855 3.566 -9.421 1.00 1.44 N ATOM 47 CA GLY A 6 2.091 2.816 -10.401 1.00 52.24 C ATOM 48 C GLY A 6 1.345 3.716 -11.366 1.00 62.12 C ATOM 49 O GLY A 6 1.560 4.928 -11.387 1.00 23.40 O ATOM 0 H GLY A 6 2.612 4.554 -9.353 1.00 1.44 H new ATOM 0 HA2 GLY A 6 2.763 2.166 -10.961 1.00 52.24 H new ATOM 0 HA3 GLY A 6 1.379 2.171 -9.886 1.00 52.24 H new ATOM 53 N ARG A 7 0.468 3.122 -12.169 1.00 72.01 N ATOM 54 CA ARG A 7 -0.309 3.879 -13.143 1.00 45.15 C ATOM 55 C ARG A 7 -1.183 4.920 -12.451 1.00 72.41 C ATOM 56 O ARG A 7 -1.173 6.096 -12.816 1.00 54.32 O ATOM 57 CB ARG A 7 -1.182 2.935 -13.973 1.00 24.11 C ATOM 58 CG ARG A 7 -0.525 2.474 -15.263 1.00 44.14 C ATOM 59 CD ARG A 7 0.337 1.241 -15.040 1.00 42.30 C ATOM 60 NE ARG A 7 -0.399 0.005 -15.295 1.00 11.44 N ATOM 61 CZ ARG A 7 0.161 -1.199 -15.284 1.00 12.01 C ATOM 62 NH1 ARG A 7 1.456 -1.329 -15.032 1.00 12.25 N ATOM 63 NH2 ARG A 7 -0.574 -2.277 -15.526 1.00 72.25 N ATOM 0 H ARG A 7 0.278 2.120 -12.164 1.00 72.01 H new ATOM 0 HA ARG A 7 0.387 4.396 -13.804 1.00 45.15 H new ATOM 0 HB2 ARG A 7 -1.432 2.062 -13.371 1.00 24.11 H new ATOM 0 HB3 ARG A 7 -2.120 3.437 -14.212 1.00 24.11 H new ATOM 0 HG2 ARG A 7 -1.293 2.253 -16.005 1.00 44.14 H new ATOM 0 HG3 ARG A 7 0.088 3.279 -15.668 1.00 44.14 H new ATOM 0 HD2 ARG A 7 1.209 1.285 -15.693 1.00 42.30 H new ATOM 0 HD3 ARG A 7 0.707 1.238 -14.015 1.00 42.30 H new ATOM 0 HE ARG A 7 -1.398 0.070 -15.492 1.00 11.44 H new ATOM 0 HH11 ARG A 7 2.025 -0.503 -14.846 1.00 12.25 H new ATOM 0 HH12 ARG A 7 1.884 -2.255 -15.024 1.00 12.25 H new ATOM 0 HH21 ARG A 7 -1.571 -2.182 -15.721 1.00 72.25 H new ATOM 0 HH22 ARG A 7 -0.142 -3.201 -15.517 1.00 72.25 H new ATOM 77 N ASP A 8 -1.939 4.481 -11.451 1.00 41.10 N ATOM 78 CA ASP A 8 -2.818 5.375 -10.706 1.00 43.32 C ATOM 79 C ASP A 8 -2.042 6.570 -10.162 1.00 21.34 C ATOM 80 O ASP A 8 -2.540 7.696 -10.161 1.00 11.14 O ATOM 81 CB ASP A 8 -3.493 4.622 -9.559 1.00 35.14 C ATOM 82 CG ASP A 8 -4.864 4.098 -9.936 1.00 53.33 C ATOM 83 OD1 ASP A 8 -5.644 3.763 -9.020 1.00 42.43 O ATOM 84 OD2 ASP A 8 -5.157 4.024 -11.148 1.00 13.13 O ATOM 0 H ASP A 8 -1.961 3.511 -11.137 1.00 41.10 H new ATOM 0 HA ASP A 8 -3.585 5.743 -11.388 1.00 43.32 H new ATOM 0 HB2 ASP A 8 -2.860 3.788 -9.254 1.00 35.14 H new ATOM 0 HB3 ASP A 8 -3.585 5.284 -8.698 1.00 35.14 H new ATOM 89 N TRP A 9 -0.823 6.317 -9.700 1.00 61.50 N ATOM 90 CA TRP A 9 0.020 7.373 -9.151 1.00 72.11 C ATOM 91 C TRP A 9 0.354 8.411 -10.217 1.00 50.32 C ATOM 92 O TRP A 9 0.117 9.605 -10.030 1.00 60.15 O ATOM 93 CB TRP A 9 1.308 6.780 -8.578 1.00 44.55 C ATOM 94 CG TRP A 9 2.016 7.699 -7.630 1.00 61.30 C ATOM 95 CD1 TRP A 9 3.298 8.156 -7.735 1.00 62.32 C ATOM 96 CD2 TRP A 9 1.481 8.270 -6.431 1.00 73.25 C ATOM 97 NE1 TRP A 9 3.593 8.978 -6.674 1.00 71.51 N ATOM 98 CE2 TRP A 9 2.494 9.065 -5.861 1.00 11.42 C ATOM 99 CE3 TRP A 9 0.244 8.191 -5.786 1.00 42.12 C ATOM 100 CZ2 TRP A 9 2.308 9.772 -4.676 1.00 63.44 C ATOM 101 CZ3 TRP A 9 0.060 8.892 -4.610 1.00 32.33 C ATOM 102 CH2 TRP A 9 1.086 9.675 -4.065 1.00 52.03 C ATOM 0 H TRP A 9 -0.396 5.391 -9.694 1.00 61.50 H new ATOM 0 HA TRP A 9 -0.532 7.865 -8.350 1.00 72.11 H new ATOM 0 HB2 TRP A 9 1.073 5.849 -8.062 1.00 44.55 H new ATOM 0 HB3 TRP A 9 1.980 6.529 -9.399 1.00 44.55 H new ATOM 0 HD1 TRP A 9 3.980 7.908 -8.535 1.00 62.32 H new ATOM 0 HE1 TRP A 9 4.485 9.447 -6.517 1.00 71.51 H new ATOM 0 HE3 TRP A 9 -0.554 7.592 -6.200 1.00 42.12 H new ATOM 0 HZ2 TRP A 9 3.098 10.375 -4.254 1.00 63.44 H new ATOM 0 HZ3 TRP A 9 -0.891 8.835 -4.102 1.00 32.33 H new ATOM 0 HH2 TRP A 9 0.910 10.213 -3.145 1.00 52.03 H new ATOM 113 N LYS A 10 0.906 7.950 -11.334 1.00 50.32 N ATOM 114 CA LYS A 10 1.272 8.839 -12.430 1.00 44.22 C ATOM 115 C LYS A 10 0.045 9.561 -12.978 1.00 52.20 C ATOM 116 O LYS A 10 0.133 10.707 -13.418 1.00 42.44 O ATOM 117 CB LYS A 10 1.953 8.047 -13.550 1.00 13.01 C ATOM 118 CG LYS A 10 3.470 8.049 -13.459 1.00 64.53 C ATOM 119 CD LYS A 10 4.070 9.246 -14.177 1.00 70.21 C ATOM 120 CE LYS A 10 5.585 9.274 -14.044 1.00 74.20 C ATOM 121 NZ LYS A 10 6.122 10.661 -14.117 1.00 41.32 N ATOM 0 H LYS A 10 1.110 6.965 -11.504 1.00 50.32 H new ATOM 0 HA LYS A 10 1.968 9.584 -12.044 1.00 44.22 H new ATOM 0 HB2 LYS A 10 1.597 7.017 -13.524 1.00 13.01 H new ATOM 0 HB3 LYS A 10 1.654 8.463 -14.512 1.00 13.01 H new ATOM 0 HG2 LYS A 10 3.773 8.062 -12.412 1.00 64.53 H new ATOM 0 HG3 LYS A 10 3.863 7.129 -13.892 1.00 64.53 H new ATOM 0 HD2 LYS A 10 3.797 9.213 -15.232 1.00 70.21 H new ATOM 0 HD3 LYS A 10 3.651 10.165 -13.767 1.00 70.21 H new ATOM 0 HE2 LYS A 10 5.875 8.822 -13.096 1.00 74.20 H new ATOM 0 HE3 LYS A 10 6.030 8.670 -14.835 1.00 74.20 H new ATOM 0 HZ1 LYS A 10 7.157 10.638 -14.022 1.00 41.32 H new ATOM 0 HZ2 LYS A 10 5.867 11.084 -15.032 1.00 41.32 H new ATOM 0 HZ3 LYS A 10 5.717 11.231 -13.347 1.00 41.32 H new ATOM 135 N MET A 11 -1.097 8.884 -12.946 1.00 25.34 N ATOM 136 CA MET A 11 -2.342 9.463 -13.437 1.00 23.34 C ATOM 137 C MET A 11 -2.814 10.592 -12.525 1.00 44.43 C ATOM 138 O MET A 11 -3.169 11.673 -12.994 1.00 42.14 O ATOM 139 CB MET A 11 -3.426 8.387 -13.537 1.00 51.11 C ATOM 140 CG MET A 11 -4.609 8.795 -14.399 1.00 71.41 C ATOM 141 SD MET A 11 -6.161 8.821 -13.481 1.00 34.31 S ATOM 142 CE MET A 11 -7.068 10.073 -14.385 1.00 62.32 C ATOM 0 H MET A 11 -1.187 7.934 -12.585 1.00 25.34 H new ATOM 0 HA MET A 11 -2.155 9.874 -14.429 1.00 23.34 H new ATOM 0 HB2 MET A 11 -2.986 7.477 -13.945 1.00 51.11 H new ATOM 0 HB3 MET A 11 -3.782 8.148 -12.535 1.00 51.11 H new ATOM 0 HG2 MET A 11 -4.423 9.783 -14.819 1.00 71.41 H new ATOM 0 HG3 MET A 11 -4.699 8.104 -15.237 1.00 71.41 H new ATOM 0 HE1 MET A 11 -8.053 10.204 -13.936 1.00 62.32 H new ATOM 0 HE2 MET A 11 -6.523 11.016 -14.346 1.00 62.32 H new ATOM 0 HE3 MET A 11 -7.181 9.762 -15.423 1.00 62.32 H new ATOM 152 N ALA A 12 -2.814 10.332 -11.222 1.00 72.44 N ATOM 153 CA ALA A 12 -3.240 11.327 -10.246 1.00 30.20 C ATOM 154 C ALA A 12 -2.381 12.584 -10.333 1.00 21.33 C ATOM 155 O ALA A 12 -2.894 13.703 -10.275 1.00 42.34 O ATOM 156 CB ALA A 12 -3.186 10.745 -8.841 1.00 72.54 C ATOM 0 H ALA A 12 -2.524 9.441 -10.818 1.00 72.44 H new ATOM 0 HA ALA A 12 -4.269 11.605 -10.473 1.00 30.20 H new ATOM 0 HB1 ALA A 12 -3.507 11.499 -8.122 1.00 72.54 H new ATOM 0 HB2 ALA A 12 -3.847 9.881 -8.780 1.00 72.54 H new ATOM 0 HB3 ALA A 12 -2.165 10.438 -8.613 1.00 72.54 H new ATOM 162 N ILE A 13 -1.074 12.394 -10.471 1.00 13.51 N ATOM 163 CA ILE A 13 -0.145 13.514 -10.566 1.00 43.55 C ATOM 164 C ILE A 13 -0.384 14.319 -11.839 1.00 3.23 C ATOM 165 O ILE A 13 -0.643 15.522 -11.786 1.00 54.45 O ATOM 166 CB ILE A 13 1.318 13.034 -10.543 1.00 53.31 C ATOM 167 CG1 ILE A 13 1.626 12.330 -9.220 1.00 2.23 C ATOM 168 CG2 ILE A 13 2.263 14.207 -10.757 1.00 52.33 C ATOM 169 CD1 ILE A 13 1.567 13.246 -8.019 1.00 34.52 C ATOM 0 H ILE A 13 -0.634 11.475 -10.520 1.00 13.51 H new ATOM 0 HA ILE A 13 -0.325 14.149 -9.698 1.00 43.55 H new ATOM 0 HB ILE A 13 1.464 12.321 -11.355 1.00 53.31 H new ATOM 0 HG12 ILE A 13 0.918 11.514 -9.079 1.00 2.23 H new ATOM 0 HG13 ILE A 13 2.619 11.884 -9.278 1.00 2.23 H new ATOM 0 HG21 ILE A 13 3.293 13.852 -10.738 1.00 52.33 H new ATOM 0 HG22 ILE A 13 2.056 14.670 -11.722 1.00 52.33 H new ATOM 0 HG23 ILE A 13 2.117 14.941 -9.964 1.00 52.33 H new ATOM 0 HD11 ILE A 13 1.796 12.679 -7.117 1.00 34.52 H new ATOM 0 HD12 ILE A 13 2.295 14.049 -8.137 1.00 34.52 H new ATOM 0 HD13 ILE A 13 0.567 13.672 -7.935 1.00 34.52 H new ATOM 181 N LYS A 14 -0.298 13.648 -12.982 1.00 15.40 N ATOM 182 CA LYS A 14 -0.507 14.300 -14.270 1.00 3.03 C ATOM 183 C LYS A 14 -1.885 14.951 -14.332 1.00 61.33 C ATOM 184 O LYS A 14 -2.108 15.880 -15.108 1.00 61.24 O ATOM 185 CB LYS A 14 -0.358 13.287 -15.408 1.00 2.45 C ATOM 186 CG LYS A 14 -0.395 13.915 -16.789 1.00 64.24 C ATOM 187 CD LYS A 14 0.301 13.041 -17.818 1.00 43.05 C ATOM 188 CE LYS A 14 0.015 13.512 -19.236 1.00 71.31 C ATOM 189 NZ LYS A 14 0.905 12.853 -20.230 1.00 53.43 N ATOM 0 H LYS A 14 -0.085 12.652 -13.043 1.00 15.40 H new ATOM 0 HA LYS A 14 0.249 15.077 -14.383 1.00 3.03 H new ATOM 0 HB2 LYS A 14 0.584 12.752 -15.286 1.00 2.45 H new ATOM 0 HB3 LYS A 14 -1.156 12.548 -15.332 1.00 2.45 H new ATOM 0 HG2 LYS A 14 -1.431 14.077 -17.088 1.00 64.24 H new ATOM 0 HG3 LYS A 14 0.084 14.893 -16.758 1.00 64.24 H new ATOM 0 HD2 LYS A 14 1.376 13.053 -17.640 1.00 43.05 H new ATOM 0 HD3 LYS A 14 -0.029 12.009 -17.703 1.00 43.05 H new ATOM 0 HE2 LYS A 14 -1.025 13.303 -19.485 1.00 71.31 H new ATOM 0 HE3 LYS A 14 0.145 14.593 -19.293 1.00 71.31 H new ATOM 0 HZ1 LYS A 14 0.678 13.201 -21.183 1.00 53.43 H new ATOM 0 HZ2 LYS A 14 1.897 13.073 -20.008 1.00 53.43 H new ATOM 0 HZ3 LYS A 14 0.763 11.823 -20.194 1.00 53.43 H new ATOM 203 N ARG A 15 -2.805 14.458 -13.509 1.00 73.35 N ATOM 204 CA ARG A 15 -4.161 14.993 -13.471 1.00 64.11 C ATOM 205 C ARG A 15 -4.236 16.221 -12.569 1.00 71.54 C ATOM 206 O ARG A 15 -4.517 17.328 -13.033 1.00 45.31 O ATOM 207 CB ARG A 15 -5.140 13.925 -12.979 1.00 12.24 C ATOM 208 CG ARG A 15 -6.596 14.351 -13.054 1.00 60.12 C ATOM 209 CD ARG A 15 -7.038 14.567 -14.493 1.00 60.33 C ATOM 210 NE ARG A 15 -8.008 13.563 -14.924 1.00 2.13 N ATOM 211 CZ ARG A 15 -8.359 13.376 -16.192 1.00 15.10 C ATOM 212 NH1 ARG A 15 -7.822 14.121 -17.149 1.00 14.25 N ATOM 213 NH2 ARG A 15 -9.248 12.442 -16.504 1.00 54.15 N ATOM 0 H ARG A 15 -2.636 13.689 -12.860 1.00 73.35 H new ATOM 0 HA ARG A 15 -4.436 15.290 -14.483 1.00 64.11 H new ATOM 0 HB2 ARG A 15 -5.004 13.020 -13.571 1.00 12.24 H new ATOM 0 HB3 ARG A 15 -4.898 13.670 -11.947 1.00 12.24 H new ATOM 0 HG2 ARG A 15 -7.223 13.590 -12.589 1.00 60.12 H new ATOM 0 HG3 ARG A 15 -6.737 15.271 -12.487 1.00 60.12 H new ATOM 0 HD2 ARG A 15 -7.476 15.560 -14.593 1.00 60.33 H new ATOM 0 HD3 ARG A 15 -6.168 14.535 -15.148 1.00 60.33 H new ATOM 0 HE ARG A 15 -8.440 12.973 -14.212 1.00 2.13 H new ATOM 0 HH11 ARG A 15 -7.138 14.840 -16.913 1.00 14.25 H new ATOM 0 HH12 ARG A 15 -8.093 13.975 -18.121 1.00 14.25 H new ATOM 0 HH21 ARG A 15 -9.662 11.867 -15.770 1.00 54.15 H new ATOM 0 HH22 ARG A 15 -9.517 12.299 -17.477 1.00 54.15 H new ATOM 227 N CYS A 16 -3.984 16.019 -11.282 1.00 14.23 N ATOM 228 CA CYS A 16 -4.024 17.111 -10.314 1.00 54.50 C ATOM 229 C CYS A 16 -3.059 18.223 -10.710 1.00 73.11 C ATOM 230 O CYS A 16 -3.233 19.378 -10.319 1.00 43.22 O ATOM 231 CB CYS A 16 -3.679 16.594 -8.917 1.00 22.02 C ATOM 232 SG CYS A 16 -1.933 16.185 -8.690 1.00 61.25 S ATOM 0 H CYS A 16 -3.750 15.110 -10.883 1.00 14.23 H new ATOM 0 HA CYS A 16 -5.035 17.518 -10.304 1.00 54.50 H new ATOM 0 HB2 CYS A 16 -3.963 17.348 -8.182 1.00 22.02 H new ATOM 0 HB3 CYS A 16 -4.278 15.707 -8.712 1.00 22.02 H new ATOM 0 HG CYS A 16 -1.385 15.963 -9.848 1.00 61.25 H new ATOM 238 N SER A 17 -2.040 17.869 -11.487 1.00 43.01 N ATOM 239 CA SER A 17 -1.044 18.836 -11.932 1.00 75.42 C ATOM 240 C SER A 17 -1.701 19.977 -12.702 1.00 61.14 C ATOM 241 O SER A 17 -1.151 21.073 -12.801 1.00 3.21 O ATOM 242 CB SER A 17 0.007 18.152 -12.809 1.00 23.24 C ATOM 243 OG SER A 17 0.870 19.104 -13.405 1.00 21.01 O ATOM 0 H SER A 17 -1.883 16.918 -11.821 1.00 43.01 H new ATOM 0 HA SER A 17 -0.556 19.250 -11.049 1.00 75.42 H new ATOM 0 HB2 SER A 17 0.590 17.455 -12.207 1.00 23.24 H new ATOM 0 HB3 SER A 17 -0.487 17.568 -13.585 1.00 23.24 H new ATOM 0 HG SER A 17 1.533 18.642 -13.959 1.00 21.01 H new ATOM 249 N ASN A 18 -2.885 19.711 -13.248 1.00 14.54 N ATOM 250 CA ASN A 18 -3.617 20.714 -14.011 1.00 63.32 C ATOM 251 C ASN A 18 -4.749 21.310 -13.180 1.00 12.11 C ATOM 252 O ASN A 18 -5.792 21.690 -13.712 1.00 42.31 O ATOM 253 CB ASN A 18 -4.181 20.098 -15.293 1.00 10.02 C ATOM 254 CG ASN A 18 -3.097 19.524 -16.184 1.00 3.02 C ATOM 255 OD1 ASN A 18 -2.703 18.367 -16.033 1.00 50.55 O ATOM 256 ND2 ASN A 18 -2.609 20.332 -17.118 1.00 1.44 N ATOM 0 H ASN A 18 -3.356 18.809 -13.175 1.00 14.54 H new ATOM 0 HA ASN A 18 -2.923 21.512 -14.274 1.00 63.32 H new ATOM 0 HB2 ASN A 18 -4.889 19.311 -15.034 1.00 10.02 H new ATOM 0 HB3 ASN A 18 -4.736 20.857 -15.844 1.00 10.02 H new ATOM 0 HD21 ASN A 18 -1.877 20.001 -17.747 1.00 1.44 H new ATOM 0 HD22 ASN A 18 -2.966 21.283 -17.206 1.00 1.44 H new ATOM 263 N VAL A 19 -4.536 21.389 -11.870 1.00 14.51 N ATOM 264 CA VAL A 19 -5.536 21.941 -10.964 1.00 51.23 C ATOM 265 C VAL A 19 -5.009 23.182 -10.252 1.00 63.23 C ATOM 266 O VAL A 19 -3.972 23.137 -9.591 1.00 71.14 O ATOM 267 CB VAL A 19 -5.971 20.905 -9.911 1.00 45.01 C ATOM 268 CG1 VAL A 19 -7.033 21.489 -8.992 1.00 74.35 C ATOM 269 CG2 VAL A 19 -6.477 19.638 -10.587 1.00 33.22 C ATOM 0 H VAL A 19 -3.679 21.077 -11.413 1.00 14.51 H new ATOM 0 HA VAL A 19 -6.398 22.214 -11.573 1.00 51.23 H new ATOM 0 HB VAL A 19 -5.104 20.645 -9.304 1.00 45.01 H new ATOM 0 HG11 VAL A 19 -7.327 20.742 -8.255 1.00 74.35 H new ATOM 0 HG12 VAL A 19 -6.631 22.364 -8.481 1.00 74.35 H new ATOM 0 HG13 VAL A 19 -7.903 21.781 -9.580 1.00 74.35 H new ATOM 0 HG21 VAL A 19 -6.780 18.917 -9.828 1.00 33.22 H new ATOM 0 HG22 VAL A 19 -7.331 19.879 -11.220 1.00 33.22 H new ATOM 0 HG23 VAL A 19 -5.683 19.209 -11.198 1.00 33.22 H new ATOM 279 N ALA A 20 -5.731 24.289 -10.393 1.00 44.13 N ATOM 280 CA ALA A 20 -5.338 25.542 -9.761 1.00 61.12 C ATOM 281 C ALA A 20 -5.265 25.394 -8.246 1.00 2.23 C ATOM 282 O ALA A 20 -5.434 24.299 -7.710 1.00 24.53 O ATOM 283 CB ALA A 20 -6.309 26.650 -10.139 1.00 33.21 C ATOM 0 H ALA A 20 -6.591 24.343 -10.939 1.00 44.13 H new ATOM 0 HA ALA A 20 -4.344 25.806 -10.122 1.00 61.12 H new ATOM 0 HB1 ALA A 20 -6.004 27.580 -9.660 1.00 33.21 H new ATOM 0 HB2 ALA A 20 -6.308 26.781 -11.221 1.00 33.21 H new ATOM 0 HB3 ALA A 20 -7.312 26.383 -9.807 1.00 33.21 H new ATOM 289 N VAL A 21 -5.011 26.503 -7.558 1.00 72.23 N ATOM 290 CA VAL A 21 -4.916 26.497 -6.104 1.00 62.21 C ATOM 291 C VAL A 21 -5.939 27.440 -5.482 1.00 74.53 C ATOM 292 O VAL A 21 -6.445 27.192 -4.388 1.00 41.53 O ATOM 293 CB VAL A 21 -3.507 26.901 -5.631 1.00 72.24 C ATOM 294 CG1 VAL A 21 -2.524 25.760 -5.844 1.00 14.22 C ATOM 295 CG2 VAL A 21 -3.043 28.157 -6.355 1.00 32.23 C ATOM 0 H VAL A 21 -4.867 27.418 -7.986 1.00 72.23 H new ATOM 0 HA VAL A 21 -5.121 25.477 -5.778 1.00 62.21 H new ATOM 0 HB VAL A 21 -3.549 27.118 -4.564 1.00 72.24 H new ATOM 0 HG11 VAL A 21 -1.534 26.064 -5.504 1.00 14.22 H new ATOM 0 HG12 VAL A 21 -2.850 24.888 -5.277 1.00 14.22 H new ATOM 0 HG13 VAL A 21 -2.482 25.509 -6.904 1.00 14.22 H new ATOM 0 HG21 VAL A 21 -2.046 28.429 -6.009 1.00 32.23 H new ATOM 0 HG22 VAL A 21 -3.016 27.969 -7.428 1.00 32.23 H new ATOM 0 HG23 VAL A 21 -3.734 28.973 -6.147 1.00 32.23 H new ATOM 305 N GLY A 22 -6.241 28.526 -6.188 1.00 52.10 N ATOM 306 CA GLY A 22 -7.203 29.491 -5.690 1.00 34.43 C ATOM 307 C GLY A 22 -8.262 29.838 -6.719 1.00 22.24 C ATOM 308 O GLY A 22 -8.137 29.488 -7.892 1.00 44.50 O ATOM 0 H GLY A 22 -5.836 28.754 -7.096 1.00 52.10 H new ATOM 0 HA2 GLY A 22 -7.685 29.092 -4.798 1.00 34.43 H new ATOM 0 HA3 GLY A 22 -6.680 30.399 -5.391 1.00 34.43 H new ATOM 312 N VAL A 23 -9.309 30.528 -6.278 1.00 60.11 N ATOM 313 CA VAL A 23 -10.394 30.923 -7.168 1.00 20.15 C ATOM 314 C VAL A 23 -10.469 32.439 -7.305 1.00 41.11 C ATOM 315 O VAL A 23 -10.890 32.960 -8.338 1.00 4.31 O ATOM 316 CB VAL A 23 -11.752 30.396 -6.666 1.00 52.40 C ATOM 317 CG1 VAL A 23 -12.097 31.009 -5.316 1.00 54.44 C ATOM 318 CG2 VAL A 23 -12.844 30.682 -7.685 1.00 22.31 C ATOM 0 H VAL A 23 -9.429 30.825 -5.310 1.00 60.11 H new ATOM 0 HA VAL A 23 -10.180 30.484 -8.142 1.00 20.15 H new ATOM 0 HB VAL A 23 -11.679 29.316 -6.540 1.00 52.40 H new ATOM 0 HG11 VAL A 23 -13.059 30.625 -4.977 1.00 54.44 H new ATOM 0 HG12 VAL A 23 -11.327 30.748 -4.590 1.00 54.44 H new ATOM 0 HG13 VAL A 23 -12.152 32.093 -5.412 1.00 54.44 H new ATOM 0 HG21 VAL A 23 -13.796 30.303 -7.314 1.00 22.31 H new ATOM 0 HG22 VAL A 23 -12.919 31.757 -7.845 1.00 22.31 H new ATOM 0 HG23 VAL A 23 -12.600 30.191 -8.627 1.00 22.31 H new ATOM 328 N GLY A 24 -10.057 33.144 -6.256 1.00 0.04 N ATOM 329 CA GLY A 24 -10.085 34.595 -6.279 1.00 5.11 C ATOM 330 C GLY A 24 -9.003 35.182 -7.163 1.00 43.23 C ATOM 331 O GLY A 24 -8.835 34.767 -8.310 1.00 33.23 O ATOM 0 H GLY A 24 -9.704 32.736 -5.390 1.00 0.04 H new ATOM 0 HA2 GLY A 24 -11.060 34.931 -6.632 1.00 5.11 H new ATOM 0 HA3 GLY A 24 -9.966 34.974 -5.264 1.00 5.11 H new ATOM 335 N GLY A 25 -8.265 36.151 -6.630 1.00 31.35 N ATOM 336 CA GLY A 25 -7.204 36.781 -7.392 1.00 53.04 C ATOM 337 C GLY A 25 -5.871 36.077 -7.222 1.00 62.25 C ATOM 338 O GLY A 25 -4.958 36.606 -6.589 1.00 54.22 O ATOM 0 H GLY A 25 -8.384 36.511 -5.683 1.00 31.35 H new ATOM 0 HA2 GLY A 25 -7.475 36.790 -8.448 1.00 53.04 H new ATOM 0 HA3 GLY A 25 -7.105 37.821 -7.080 1.00 53.04 H new ATOM 342 N LYS A 26 -5.760 34.880 -7.787 1.00 70.12 N ATOM 343 CA LYS A 26 -4.531 34.101 -7.696 1.00 74.50 C ATOM 344 C LYS A 26 -4.501 33.004 -8.754 1.00 62.53 C ATOM 345 O LYS A 26 -5.069 31.929 -8.563 1.00 43.33 O ATOM 346 CB LYS A 26 -4.396 33.484 -6.302 1.00 24.11 C ATOM 347 CG LYS A 26 -3.209 34.010 -5.516 1.00 11.43 C ATOM 348 CD LYS A 26 -3.548 34.189 -4.045 1.00 61.25 C ATOM 349 CE LYS A 26 -2.761 35.334 -3.426 1.00 73.44 C ATOM 350 NZ LYS A 26 -3.074 35.506 -1.981 1.00 44.12 N ATOM 0 H LYS A 26 -6.507 34.428 -8.314 1.00 70.12 H new ATOM 0 HA LYS A 26 -3.691 34.773 -7.872 1.00 74.50 H new ATOM 0 HB2 LYS A 26 -5.309 33.678 -5.738 1.00 24.11 H new ATOM 0 HB3 LYS A 26 -4.305 32.402 -6.400 1.00 24.11 H new ATOM 0 HG2 LYS A 26 -2.371 33.320 -5.616 1.00 11.43 H new ATOM 0 HG3 LYS A 26 -2.888 34.964 -5.935 1.00 11.43 H new ATOM 0 HD2 LYS A 26 -4.616 34.380 -3.937 1.00 61.25 H new ATOM 0 HD3 LYS A 26 -3.334 33.266 -3.506 1.00 61.25 H new ATOM 0 HE2 LYS A 26 -1.694 35.148 -3.547 1.00 73.44 H new ATOM 0 HE3 LYS A 26 -2.985 36.258 -3.958 1.00 73.44 H new ATOM 0 HZ1 LYS A 26 -2.517 36.296 -1.597 1.00 44.12 H new ATOM 0 HZ2 LYS A 26 -4.088 35.709 -1.867 1.00 44.12 H new ATOM 0 HZ3 LYS A 26 -2.836 34.633 -1.468 1.00 44.12 H new ATOM 364 N SER A 27 -3.835 33.283 -9.871 1.00 25.02 N ATOM 365 CA SER A 27 -3.735 32.319 -10.961 1.00 73.00 C ATOM 366 C SER A 27 -2.507 31.430 -10.788 1.00 53.23 C ATOM 367 O SER A 27 -1.382 31.844 -11.067 1.00 35.25 O ATOM 368 CB SER A 27 -3.668 33.045 -12.306 1.00 52.53 C ATOM 369 OG SER A 27 -4.916 33.632 -12.632 1.00 13.10 O ATOM 0 H SER A 27 -3.357 34.167 -10.044 1.00 25.02 H new ATOM 0 HA SER A 27 -4.624 31.689 -10.940 1.00 73.00 H new ATOM 0 HB2 SER A 27 -2.899 33.816 -12.268 1.00 52.53 H new ATOM 0 HB3 SER A 27 -3.378 32.343 -13.088 1.00 52.53 H new ATOM 0 HG SER A 27 -4.846 34.091 -13.495 1.00 13.10 H new ATOM 375 N LYS A 28 -2.732 30.205 -10.326 1.00 31.41 N ATOM 376 CA LYS A 28 -1.646 29.254 -10.116 1.00 71.34 C ATOM 377 C LYS A 28 -2.193 27.866 -9.802 1.00 62.02 C ATOM 378 O LYS A 28 -3.335 27.719 -9.365 1.00 75.45 O ATOM 379 CB LYS A 28 -0.740 29.727 -8.977 1.00 60.02 C ATOM 380 CG LYS A 28 0.656 29.132 -9.024 1.00 5.43 C ATOM 381 CD LYS A 28 1.691 30.089 -8.457 1.00 64.12 C ATOM 382 CE LYS A 28 1.655 30.112 -6.937 1.00 4.35 C ATOM 383 NZ LYS A 28 2.705 29.238 -6.343 1.00 65.44 N ATOM 0 H LYS A 28 -3.657 29.847 -10.090 1.00 31.41 H new ATOM 0 HA LYS A 28 -1.063 29.196 -11.035 1.00 71.34 H new ATOM 0 HB2 LYS A 28 -0.664 30.814 -9.012 1.00 60.02 H new ATOM 0 HB3 LYS A 28 -1.204 29.470 -8.025 1.00 60.02 H new ATOM 0 HG2 LYS A 28 0.674 28.200 -8.460 1.00 5.43 H new ATOM 0 HG3 LYS A 28 0.913 28.886 -10.054 1.00 5.43 H new ATOM 0 HD2 LYS A 28 2.685 29.793 -8.794 1.00 64.12 H new ATOM 0 HD3 LYS A 28 1.509 31.093 -8.842 1.00 64.12 H new ATOM 0 HE2 LYS A 28 1.793 31.135 -6.586 1.00 4.35 H new ATOM 0 HE3 LYS A 28 0.674 29.786 -6.592 1.00 4.35 H new ATOM 0 HZ1 LYS A 28 2.647 29.282 -5.306 1.00 65.44 H new ATOM 0 HZ2 LYS A 28 2.559 28.257 -6.657 1.00 65.44 H new ATOM 0 HZ3 LYS A 28 3.643 29.564 -6.651 1.00 65.44 H new ATOM 397 N LYS A 29 -1.370 26.847 -10.026 1.00 25.14 N ATOM 398 CA LYS A 29 -1.769 25.469 -9.765 1.00 2.24 C ATOM 399 C LYS A 29 -0.674 24.720 -9.010 1.00 65.12 C ATOM 400 O LYS A 29 0.439 25.219 -8.855 1.00 11.21 O ATOM 401 CB LYS A 29 -2.082 24.749 -11.078 1.00 4.00 C ATOM 402 CG LYS A 29 -1.035 24.968 -12.156 1.00 60.04 C ATOM 403 CD LYS A 29 -1.463 26.046 -13.138 1.00 65.13 C ATOM 404 CE LYS A 29 -0.280 26.578 -13.931 1.00 53.23 C ATOM 405 NZ LYS A 29 -0.433 28.025 -14.252 1.00 42.30 N ATOM 0 H LYS A 29 -0.422 26.950 -10.388 1.00 25.14 H new ATOM 0 HA LYS A 29 -2.666 25.488 -9.146 1.00 2.24 H new ATOM 0 HB2 LYS A 29 -2.173 23.680 -10.884 1.00 4.00 H new ATOM 0 HB3 LYS A 29 -3.049 25.090 -11.448 1.00 4.00 H new ATOM 0 HG2 LYS A 29 -0.089 25.250 -11.694 1.00 60.04 H new ATOM 0 HG3 LYS A 29 -0.862 24.035 -12.692 1.00 60.04 H new ATOM 0 HD2 LYS A 29 -2.209 25.641 -13.822 1.00 65.13 H new ATOM 0 HD3 LYS A 29 -1.938 26.865 -12.597 1.00 65.13 H new ATOM 0 HE2 LYS A 29 0.637 26.427 -13.361 1.00 53.23 H new ATOM 0 HE3 LYS A 29 -0.177 26.010 -14.855 1.00 53.23 H new ATOM 0 HZ1 LYS A 29 0.394 28.350 -14.793 1.00 42.30 H new ATOM 0 HZ2 LYS A 29 -1.294 28.166 -14.818 1.00 42.30 H new ATOM 0 HZ3 LYS A 29 -0.505 28.571 -13.370 1.00 42.30 H new ATOM 419 N PHE A 30 -0.999 23.517 -8.546 1.00 74.51 N ATOM 420 CA PHE A 30 -0.044 22.699 -7.809 1.00 30.51 C ATOM 421 C PHE A 30 0.337 21.457 -8.607 1.00 41.44 C ATOM 422 O PHE A 30 -0.524 20.683 -9.023 1.00 41.40 O ATOM 423 CB PHE A 30 -0.628 22.290 -6.455 1.00 43.02 C ATOM 424 CG PHE A 30 -1.944 21.572 -6.563 1.00 10.13 C ATOM 425 CD1 PHE A 30 -1.993 20.188 -6.572 1.00 1.34 C ATOM 426 CD2 PHE A 30 -3.130 22.282 -6.654 1.00 31.30 C ATOM 427 CE1 PHE A 30 -3.202 19.524 -6.671 1.00 4.15 C ATOM 428 CE2 PHE A 30 -4.341 21.623 -6.752 1.00 35.24 C ATOM 429 CZ PHE A 30 -4.377 20.243 -6.762 1.00 21.54 C ATOM 0 H PHE A 30 -1.916 23.088 -8.668 1.00 74.51 H new ATOM 0 HA PHE A 30 0.855 23.294 -7.644 1.00 30.51 H new ATOM 0 HB2 PHE A 30 0.086 21.648 -5.939 1.00 43.02 H new ATOM 0 HB3 PHE A 30 -0.758 23.181 -5.840 1.00 43.02 H new ATOM 0 HD1 PHE A 30 -1.077 19.621 -6.501 1.00 1.34 H new ATOM 0 HD2 PHE A 30 -3.108 23.362 -6.648 1.00 31.30 H new ATOM 0 HE1 PHE A 30 -3.227 18.444 -6.677 1.00 4.15 H new ATOM 0 HE2 PHE A 30 -5.259 22.188 -6.821 1.00 35.24 H new ATOM 0 HZ PHE A 30 -5.322 19.727 -6.841 1.00 21.54 H new ATOM 439 N GLY A 31 1.638 21.272 -8.818 1.00 64.52 N ATOM 440 CA GLY A 31 2.112 20.122 -9.567 1.00 31.51 C ATOM 441 C GLY A 31 2.641 19.023 -8.667 1.00 51.24 C ATOM 442 O GLY A 31 2.389 19.023 -7.463 1.00 32.42 O ATOM 0 H GLY A 31 2.371 21.898 -8.484 1.00 64.52 H new ATOM 0 HA2 GLY A 31 1.298 19.728 -10.176 1.00 31.51 H new ATOM 0 HA3 GLY A 31 2.899 20.437 -10.252 1.00 31.51 H new ATOM 446 N GLU A 32 3.377 18.083 -9.254 1.00 53.00 N ATOM 447 CA GLU A 32 3.941 16.973 -8.497 1.00 22.14 C ATOM 448 C GLU A 32 4.710 17.479 -7.280 1.00 50.41 C ATOM 449 O GLU A 32 4.626 16.903 -6.196 1.00 34.14 O ATOM 450 CB GLU A 32 4.864 16.137 -9.386 1.00 61.20 C ATOM 451 CG GLU A 32 6.022 16.927 -9.973 1.00 42.31 C ATOM 452 CD GLU A 32 6.524 16.343 -11.280 1.00 23.45 C ATOM 453 OE1 GLU A 32 7.548 15.628 -11.256 1.00 31.44 O ATOM 454 OE2 GLU A 32 5.892 16.600 -12.326 1.00 63.04 O ATOM 0 H GLU A 32 3.596 18.069 -10.250 1.00 53.00 H new ATOM 0 HA GLU A 32 3.118 16.348 -8.151 1.00 22.14 H new ATOM 0 HB2 GLU A 32 5.261 15.305 -8.803 1.00 61.20 H new ATOM 0 HB3 GLU A 32 4.280 15.706 -10.199 1.00 61.20 H new ATOM 0 HG2 GLU A 32 5.708 17.958 -10.137 1.00 42.31 H new ATOM 0 HG3 GLU A 32 6.840 16.954 -9.253 1.00 42.31 H new ATOM 461 N GLY A 33 5.461 18.560 -7.469 1.00 24.15 N ATOM 462 CA GLY A 33 6.235 19.125 -6.379 1.00 22.23 C ATOM 463 C GLY A 33 5.360 19.637 -5.251 1.00 54.15 C ATOM 464 O GLY A 33 5.542 19.258 -4.095 1.00 42.42 O ATOM 0 H GLY A 33 5.547 19.054 -8.357 1.00 24.15 H new ATOM 0 HA2 GLY A 33 6.917 18.368 -5.991 1.00 22.23 H new ATOM 0 HA3 GLY A 33 6.848 19.942 -6.758 1.00 22.23 H new ATOM 468 N ASN A 34 4.411 20.503 -5.589 1.00 24.24 N ATOM 469 CA ASN A 34 3.506 21.070 -4.594 1.00 61.42 C ATOM 470 C ASN A 34 2.733 19.971 -3.872 1.00 14.43 C ATOM 471 O ASN A 34 2.574 20.009 -2.652 1.00 62.33 O ATOM 472 CB ASN A 34 2.530 22.042 -5.259 1.00 33.33 C ATOM 473 CG ASN A 34 3.102 23.441 -5.383 1.00 74.15 C ATOM 474 OD1 ASN A 34 2.654 24.369 -4.711 1.00 13.33 O ATOM 475 ND2 ASN A 34 4.097 23.599 -6.249 1.00 21.01 N ATOM 0 H ASN A 34 4.248 20.828 -6.542 1.00 24.24 H new ATOM 0 HA ASN A 34 4.105 21.610 -3.860 1.00 61.42 H new ATOM 0 HB2 ASN A 34 2.269 21.670 -6.250 1.00 33.33 H new ATOM 0 HB3 ASN A 34 1.607 22.080 -4.680 1.00 33.33 H new ATOM 0 HD21 ASN A 34 4.521 24.518 -6.377 1.00 21.01 H new ATOM 0 HD22 ASN A 34 4.437 22.801 -6.786 1.00 21.01 H new ATOM 482 N PHE A 35 2.258 18.991 -4.633 1.00 60.33 N ATOM 483 CA PHE A 35 1.502 17.880 -4.067 1.00 33.22 C ATOM 484 C PHE A 35 2.295 17.191 -2.961 1.00 4.24 C ATOM 485 O PHE A 35 1.767 16.912 -1.884 1.00 33.21 O ATOM 486 CB PHE A 35 1.143 16.870 -5.158 1.00 34.52 C ATOM 487 CG PHE A 35 0.627 15.565 -4.621 1.00 74.13 C ATOM 488 CD1 PHE A 35 1.314 14.385 -4.855 1.00 62.20 C ATOM 489 CD2 PHE A 35 -0.545 15.520 -3.884 1.00 3.21 C ATOM 490 CE1 PHE A 35 0.842 13.183 -4.362 1.00 64.32 C ATOM 491 CE2 PHE A 35 -1.021 14.320 -3.388 1.00 73.31 C ATOM 492 CZ PHE A 35 -0.328 13.151 -3.629 1.00 50.51 C ATOM 0 H PHE A 35 2.383 18.944 -5.644 1.00 60.33 H new ATOM 0 HA PHE A 35 0.584 18.280 -3.637 1.00 33.22 H new ATOM 0 HB2 PHE A 35 0.390 17.307 -5.813 1.00 34.52 H new ATOM 0 HB3 PHE A 35 2.025 16.679 -5.769 1.00 34.52 H new ATOM 0 HD1 PHE A 35 2.229 14.404 -5.429 1.00 62.20 H new ATOM 0 HD2 PHE A 35 -1.093 16.431 -3.695 1.00 3.21 H new ATOM 0 HE1 PHE A 35 1.388 12.270 -4.550 1.00 64.32 H new ATOM 0 HE2 PHE A 35 -1.935 14.298 -2.812 1.00 73.31 H new ATOM 0 HZ PHE A 35 -0.700 12.213 -3.245 1.00 50.51 H new ATOM 502 N ARG A 36 3.566 16.917 -3.236 1.00 11.32 N ATOM 503 CA ARG A 36 4.433 16.258 -2.265 1.00 2.00 C ATOM 504 C ARG A 36 4.529 17.075 -0.980 1.00 40.44 C ATOM 505 O ARG A 36 4.320 16.554 0.115 1.00 44.11 O ATOM 506 CB ARG A 36 5.828 16.049 -2.856 1.00 1.21 C ATOM 507 CG ARG A 36 5.829 15.252 -4.151 1.00 13.24 C ATOM 508 CD ARG A 36 6.410 13.861 -3.948 1.00 72.13 C ATOM 509 NE ARG A 36 7.869 13.861 -4.023 1.00 65.40 N ATOM 510 CZ ARG A 36 8.625 12.857 -3.595 1.00 53.11 C ATOM 511 NH1 ARG A 36 8.066 11.779 -3.064 1.00 60.33 N ATOM 512 NH2 ARG A 36 9.947 12.931 -3.698 1.00 44.32 N ATOM 0 H ARG A 36 4.019 17.141 -4.122 1.00 11.32 H new ATOM 0 HA ARG A 36 3.998 15.287 -2.026 1.00 2.00 H new ATOM 0 HB2 ARG A 36 6.286 17.021 -3.038 1.00 1.21 H new ATOM 0 HB3 ARG A 36 6.450 15.536 -2.123 1.00 1.21 H new ATOM 0 HG2 ARG A 36 4.810 15.170 -4.530 1.00 13.24 H new ATOM 0 HG3 ARG A 36 6.409 15.783 -4.906 1.00 13.24 H new ATOM 0 HD2 ARG A 36 6.097 13.475 -2.978 1.00 72.13 H new ATOM 0 HD3 ARG A 36 6.008 13.186 -4.704 1.00 72.13 H new ATOM 0 HE ARG A 36 8.332 14.676 -4.426 1.00 65.40 H new ATOM 0 HH11 ARG A 36 7.051 11.718 -2.983 1.00 60.33 H new ATOM 0 HH12 ARG A 36 8.651 11.010 -2.737 1.00 60.33 H new ATOM 0 HH21 ARG A 36 10.381 13.759 -4.106 1.00 44.32 H new ATOM 0 HH22 ARG A 36 10.528 12.160 -3.369 1.00 44.32 H new ATOM 526 N TRP A 37 4.849 18.356 -1.122 1.00 72.43 N ATOM 527 CA TRP A 37 4.974 19.244 0.028 1.00 54.11 C ATOM 528 C TRP A 37 3.710 19.213 0.880 1.00 21.14 C ATOM 529 O TRP A 37 3.774 19.309 2.106 1.00 55.44 O ATOM 530 CB TRP A 37 5.256 20.675 -0.435 1.00 11.20 C ATOM 531 CG TRP A 37 5.056 21.697 0.642 1.00 72.45 C ATOM 532 CD1 TRP A 37 6.018 22.248 1.439 1.00 33.12 C ATOM 533 CD2 TRP A 37 3.815 22.291 1.040 1.00 41.21 C ATOM 534 NE1 TRP A 37 5.451 23.147 2.309 1.00 74.12 N ATOM 535 CE2 TRP A 37 4.100 23.193 2.084 1.00 51.12 C ATOM 536 CE3 TRP A 37 2.491 22.150 0.615 1.00 23.12 C ATOM 537 CZ2 TRP A 37 3.110 23.948 2.707 1.00 44.41 C ATOM 538 CZ3 TRP A 37 1.509 22.899 1.235 1.00 53.13 C ATOM 539 CH2 TRP A 37 1.822 23.789 2.271 1.00 11.11 C ATOM 0 H TRP A 37 5.027 18.803 -2.022 1.00 72.43 H new ATOM 0 HA TRP A 37 5.808 18.895 0.636 1.00 54.11 H new ATOM 0 HB2 TRP A 37 6.282 20.736 -0.798 1.00 11.20 H new ATOM 0 HB3 TRP A 37 4.605 20.912 -1.277 1.00 11.20 H new ATOM 0 HD1 TRP A 37 7.071 22.012 1.392 1.00 33.12 H new ATOM 0 HE1 TRP A 37 5.954 23.692 3.009 1.00 74.12 H new ATOM 0 HE3 TRP A 37 2.240 21.468 -0.184 1.00 23.12 H new ATOM 0 HZ2 TRP A 37 3.349 24.635 3.506 1.00 44.41 H new ATOM 0 HZ3 TRP A 37 0.482 22.797 0.915 1.00 53.13 H new ATOM 0 HH2 TRP A 37 1.032 24.361 2.735 1.00 11.11 H new ATOM 550 N ALA A 38 2.562 19.077 0.224 1.00 14.42 N ATOM 551 CA ALA A 38 1.284 19.030 0.923 1.00 62.52 C ATOM 552 C ALA A 38 1.068 17.673 1.582 1.00 3.10 C ATOM 553 O ALA A 38 0.987 17.572 2.806 1.00 52.01 O ATOM 554 CB ALA A 38 0.145 19.340 -0.038 1.00 75.11 C ATOM 0 H ALA A 38 2.491 18.997 -0.790 1.00 14.42 H new ATOM 0 HA ALA A 38 1.299 19.787 1.707 1.00 62.52 H new ATOM 0 HB1 ALA A 38 -0.804 19.301 0.498 1.00 75.11 H new ATOM 0 HB2 ALA A 38 0.284 20.336 -0.458 1.00 75.11 H new ATOM 0 HB3 ALA A 38 0.138 18.605 -0.843 1.00 75.11 H new ATOM 560 N ILE A 39 0.973 16.630 0.762 1.00 73.34 N ATOM 561 CA ILE A 39 0.767 15.279 1.266 1.00 24.50 C ATOM 562 C ILE A 39 1.777 14.938 2.357 1.00 61.14 C ATOM 563 O ILE A 39 1.456 14.239 3.318 1.00 42.14 O ATOM 564 CB ILE A 39 0.874 14.236 0.139 1.00 64.03 C ATOM 565 CG1 ILE A 39 0.481 12.851 0.657 1.00 3.04 C ATOM 566 CG2 ILE A 39 2.284 14.214 -0.430 1.00 44.32 C ATOM 567 CD1 ILE A 39 0.065 11.891 -0.437 1.00 32.31 C ATOM 0 H ILE A 39 1.036 16.696 -0.254 1.00 73.34 H new ATOM 0 HA ILE A 39 -0.239 15.249 1.684 1.00 24.50 H new ATOM 0 HB ILE A 39 0.185 14.513 -0.659 1.00 64.03 H new ATOM 0 HG12 ILE A 39 1.322 12.424 1.203 1.00 3.04 H new ATOM 0 HG13 ILE A 39 -0.339 12.957 1.367 1.00 3.04 H new ATOM 0 HG21 ILE A 39 2.344 13.472 -1.226 1.00 44.32 H new ATOM 0 HG22 ILE A 39 2.530 15.197 -0.832 1.00 44.32 H new ATOM 0 HG23 ILE A 39 2.991 13.958 0.359 1.00 44.32 H new ATOM 0 HD11 ILE A 39 -0.200 10.930 0.004 1.00 32.31 H new ATOM 0 HD12 ILE A 39 -0.796 12.296 -0.968 1.00 32.31 H new ATOM 0 HD13 ILE A 39 0.891 11.755 -1.135 1.00 32.31 H new ATOM 579 N ARG A 40 2.998 15.439 2.202 1.00 71.05 N ATOM 580 CA ARG A 40 4.056 15.188 3.173 1.00 61.43 C ATOM 581 C ARG A 40 3.746 15.872 4.502 1.00 51.32 C ATOM 582 O ARG A 40 3.709 15.227 5.549 1.00 5.31 O ATOM 583 CB ARG A 40 5.399 15.682 2.634 1.00 13.54 C ATOM 584 CG ARG A 40 6.579 15.326 3.524 1.00 51.41 C ATOM 585 CD ARG A 40 7.885 15.321 2.742 1.00 23.14 C ATOM 586 NE ARG A 40 9.032 15.629 3.592 1.00 3.54 N ATOM 587 CZ ARG A 40 9.258 16.828 4.116 1.00 33.31 C ATOM 588 NH1 ARG A 40 8.419 17.828 3.878 1.00 15.53 N ATOM 589 NH2 ARG A 40 10.325 17.030 4.879 1.00 72.22 N ATOM 0 H ARG A 40 3.279 16.021 1.413 1.00 71.05 H new ATOM 0 HA ARG A 40 4.114 14.113 3.342 1.00 61.43 H new ATOM 0 HB2 ARG A 40 5.561 15.259 1.643 1.00 13.54 H new ATOM 0 HB3 ARG A 40 5.358 16.765 2.515 1.00 13.54 H new ATOM 0 HG2 ARG A 40 6.647 16.041 4.344 1.00 51.41 H new ATOM 0 HG3 ARG A 40 6.417 14.345 3.970 1.00 51.41 H new ATOM 0 HD2 ARG A 40 8.028 14.344 2.280 1.00 23.14 H new ATOM 0 HD3 ARG A 40 7.827 16.050 1.934 1.00 23.14 H new ATOM 0 HE ARG A 40 9.696 14.882 3.794 1.00 3.54 H new ATOM 0 HH11 ARG A 40 7.598 17.677 3.291 1.00 15.53 H new ATOM 0 HH12 ARG A 40 8.595 18.748 4.282 1.00 15.53 H new ATOM 0 HH21 ARG A 40 10.973 16.264 5.063 1.00 72.22 H new ATOM 0 HH22 ARG A 40 10.498 17.951 5.281 1.00 72.22 H new ATOM 603 N MET A 41 3.525 17.181 4.450 1.00 1.13 N ATOM 604 CA MET A 41 3.218 17.952 5.650 1.00 54.31 C ATOM 605 C MET A 41 2.066 17.319 6.423 1.00 0.33 C ATOM 606 O MET A 41 2.078 17.282 7.653 1.00 33.54 O ATOM 607 CB MET A 41 2.867 19.394 5.279 1.00 35.32 C ATOM 608 CG MET A 41 4.084 20.270 5.026 1.00 62.41 C ATOM 609 SD MET A 41 4.390 21.437 6.366 1.00 13.51 S ATOM 610 CE MET A 41 5.927 22.180 5.824 1.00 42.14 C ATOM 0 H MET A 41 3.553 17.730 3.591 1.00 1.13 H new ATOM 0 HA MET A 41 4.102 17.953 6.287 1.00 54.31 H new ATOM 0 HB2 MET A 41 2.241 19.389 4.386 1.00 35.32 H new ATOM 0 HB3 MET A 41 2.274 19.833 6.081 1.00 35.32 H new ATOM 0 HG2 MET A 41 4.961 19.637 4.893 1.00 62.41 H new ATOM 0 HG3 MET A 41 3.944 20.820 4.095 1.00 62.41 H new ATOM 0 HE1 MET A 41 6.365 22.749 6.644 1.00 42.14 H new ATOM 0 HE2 MET A 41 6.620 21.398 5.514 1.00 42.14 H new ATOM 0 HE3 MET A 41 5.732 22.847 4.984 1.00 42.14 H new ATOM 620 N ALA A 42 1.073 16.819 5.694 1.00 35.13 N ATOM 621 CA ALA A 42 -0.084 16.186 6.312 1.00 61.55 C ATOM 622 C ALA A 42 0.308 14.895 7.021 1.00 54.33 C ATOM 623 O ALA A 42 -0.181 14.600 8.110 1.00 11.21 O ATOM 624 CB ALA A 42 -1.157 15.912 5.267 1.00 53.32 C ATOM 0 H ALA A 42 1.048 16.841 4.675 1.00 35.13 H new ATOM 0 HA ALA A 42 -0.485 16.871 7.059 1.00 61.55 H new ATOM 0 HB1 ALA A 42 -2.016 15.439 5.743 1.00 53.32 H new ATOM 0 HB2 ALA A 42 -1.468 16.851 4.809 1.00 53.32 H new ATOM 0 HB3 ALA A 42 -0.757 15.249 4.500 1.00 53.32 H new ATOM 630 N ASN A 43 1.196 14.128 6.395 1.00 62.11 N ATOM 631 CA ASN A 43 1.654 12.867 6.965 1.00 22.12 C ATOM 632 C ASN A 43 2.347 13.096 8.306 1.00 72.33 C ATOM 633 O ASN A 43 1.988 12.489 9.315 1.00 53.44 O ATOM 634 CB ASN A 43 2.608 12.162 5.999 1.00 34.31 C ATOM 635 CG ASN A 43 2.480 10.652 6.057 1.00 23.35 C ATOM 636 OD1 ASN A 43 1.388 10.118 6.256 1.00 53.43 O ATOM 637 ND2 ASN A 43 3.598 9.957 5.886 1.00 64.31 N ATOM 0 H ASN A 43 1.612 14.359 5.493 1.00 62.11 H new ATOM 0 HA ASN A 43 0.782 12.234 7.130 1.00 22.12 H new ATOM 0 HB2 ASN A 43 2.408 12.502 4.983 1.00 34.31 H new ATOM 0 HB3 ASN A 43 3.634 12.446 6.234 1.00 34.31 H new ATOM 0 HD21 ASN A 43 3.575 8.938 5.917 1.00 64.31 H new ATOM 0 HD22 ASN A 43 4.480 10.442 5.724 1.00 64.31 H new ATOM 644 N VAL A 44 3.341 13.978 8.308 1.00 53.14 N ATOM 645 CA VAL A 44 4.084 14.290 9.523 1.00 53.50 C ATOM 646 C VAL A 44 3.173 14.900 10.582 1.00 73.12 C ATOM 647 O VAL A 44 3.259 14.557 11.761 1.00 30.40 O ATOM 648 CB VAL A 44 5.245 15.261 9.238 1.00 20.32 C ATOM 649 CG1 VAL A 44 6.068 15.494 10.496 1.00 73.41 C ATOM 650 CG2 VAL A 44 6.118 14.732 8.110 1.00 43.30 C ATOM 0 H VAL A 44 3.651 14.489 7.482 1.00 53.14 H new ATOM 0 HA VAL A 44 4.491 13.350 9.896 1.00 53.50 H new ATOM 0 HB VAL A 44 4.827 16.217 8.924 1.00 20.32 H new ATOM 0 HG11 VAL A 44 6.884 16.183 10.275 1.00 73.41 H new ATOM 0 HG12 VAL A 44 5.433 15.921 11.272 1.00 73.41 H new ATOM 0 HG13 VAL A 44 6.478 14.546 10.843 1.00 73.41 H new ATOM 0 HG21 VAL A 44 6.933 15.431 7.922 1.00 43.30 H new ATOM 0 HG22 VAL A 44 6.529 13.763 8.392 1.00 43.30 H new ATOM 0 HG23 VAL A 44 5.518 14.623 7.206 1.00 43.30 H new ATOM 660 N SER A 45 2.301 15.807 10.153 1.00 31.21 N ATOM 661 CA SER A 45 1.375 16.468 11.065 1.00 30.13 C ATOM 662 C SER A 45 0.475 15.450 11.759 1.00 12.41 C ATOM 663 O SER A 45 -0.090 15.723 12.819 1.00 0.30 O ATOM 664 CB SER A 45 0.523 17.488 10.309 1.00 32.31 C ATOM 665 OG SER A 45 1.295 18.611 9.920 1.00 15.25 O ATOM 0 H SER A 45 2.216 16.101 9.180 1.00 31.21 H new ATOM 0 HA SER A 45 1.960 16.986 11.825 1.00 30.13 H new ATOM 0 HB2 SER A 45 0.087 17.019 9.427 1.00 32.31 H new ATOM 0 HB3 SER A 45 -0.305 17.813 10.939 1.00 32.31 H new ATOM 0 HG SER A 45 1.739 18.423 9.067 1.00 15.25 H new ATOM 671 N THR A 46 0.346 14.274 11.153 1.00 40.15 N ATOM 672 CA THR A 46 -0.486 13.215 11.709 1.00 63.13 C ATOM 673 C THR A 46 0.367 12.130 12.358 1.00 25.43 C ATOM 674 O THR A 46 -0.131 11.324 13.143 1.00 2.44 O ATOM 675 CB THR A 46 -1.376 12.573 10.629 1.00 71.54 C ATOM 676 OG1 THR A 46 -0.595 12.267 9.468 1.00 43.43 O ATOM 677 CG2 THR A 46 -2.518 13.503 10.246 1.00 51.23 C ATOM 0 H THR A 46 0.808 14.031 10.276 1.00 40.15 H new ATOM 0 HA THR A 46 -1.121 13.677 12.465 1.00 63.13 H new ATOM 0 HB THR A 46 -1.797 11.654 11.036 1.00 71.54 H new ATOM 0 HG1 THR A 46 0.343 12.151 9.726 1.00 43.43 H new ATOM 0 HG21 THR A 46 -3.133 13.028 9.482 1.00 51.23 H new ATOM 0 HG22 THR A 46 -3.128 13.711 11.125 1.00 51.23 H new ATOM 0 HG23 THR A 46 -2.112 14.437 9.857 1.00 51.23 H new ATOM 685 N GLY A 47 1.653 12.118 12.026 1.00 11.50 N ATOM 686 CA GLY A 47 2.554 11.127 12.587 1.00 13.22 C ATOM 687 C GLY A 47 2.309 9.738 12.032 1.00 73.45 C ATOM 688 O GLY A 47 2.239 8.766 12.782 1.00 42.20 O ATOM 0 H GLY A 47 2.088 12.776 11.379 1.00 11.50 H new ATOM 0 HA2 GLY A 47 3.584 11.420 12.382 1.00 13.22 H new ATOM 0 HA3 GLY A 47 2.438 11.107 13.671 1.00 13.22 H new ATOM 692 N ARG A 48 2.176 9.646 10.712 1.00 71.34 N ATOM 693 CA ARG A 48 1.934 8.367 10.057 1.00 42.21 C ATOM 694 C ARG A 48 3.239 7.757 9.554 1.00 73.14 C ATOM 695 O ARG A 48 3.298 7.218 8.449 1.00 4.44 O ATOM 696 CB ARG A 48 0.959 8.543 8.891 1.00 61.10 C ATOM 697 CG ARG A 48 -0.054 7.416 8.768 1.00 11.10 C ATOM 698 CD ARG A 48 -1.360 7.762 9.465 1.00 74.42 C ATOM 699 NE ARG A 48 -1.909 6.624 10.196 1.00 63.30 N ATOM 700 CZ ARG A 48 -2.972 6.703 10.990 1.00 52.31 C ATOM 701 NH1 ARG A 48 -3.596 7.861 11.154 1.00 60.55 N ATOM 702 NH2 ARG A 48 -3.412 5.622 11.621 1.00 51.31 N ATOM 0 H ARG A 48 2.232 10.442 10.076 1.00 71.34 H new ATOM 0 HA ARG A 48 1.495 7.690 10.790 1.00 42.21 H new ATOM 0 HB2 ARG A 48 0.427 9.487 9.013 1.00 61.10 H new ATOM 0 HB3 ARG A 48 1.525 8.614 7.962 1.00 61.10 H new ATOM 0 HG2 ARG A 48 -0.246 7.211 7.715 1.00 11.10 H new ATOM 0 HG3 ARG A 48 0.360 6.505 9.200 1.00 11.10 H new ATOM 0 HD2 ARG A 48 -1.194 8.590 10.154 1.00 74.42 H new ATOM 0 HD3 ARG A 48 -2.086 8.103 8.726 1.00 74.42 H new ATOM 0 HE ARG A 48 -1.452 5.718 10.092 1.00 63.30 H new ATOM 0 HH11 ARG A 48 -3.261 8.694 10.670 1.00 60.55 H new ATOM 0 HH12 ARG A 48 -4.412 7.919 11.764 1.00 60.55 H new ATOM 0 HH21 ARG A 48 -2.934 4.729 11.497 1.00 51.31 H new ATOM 0 HH22 ARG A 48 -4.228 5.684 12.230 1.00 51.31 H new ATOM 716 N GLU A 49 4.283 7.850 10.371 1.00 33.01 N ATOM 717 CA GLU A 49 5.588 7.309 10.008 1.00 20.01 C ATOM 718 C GLU A 49 6.153 8.028 8.787 1.00 53.02 C ATOM 719 O GLU A 49 5.423 8.603 7.979 1.00 12.30 O ATOM 720 CB GLU A 49 5.482 5.808 9.727 1.00 33.43 C ATOM 721 CG GLU A 49 6.027 4.940 10.848 1.00 3.01 C ATOM 722 CD GLU A 49 4.931 4.330 11.699 1.00 22.54 C ATOM 723 OE1 GLU A 49 4.937 3.094 11.878 1.00 11.13 O ATOM 724 OE2 GLU A 49 4.065 5.088 12.185 1.00 13.24 O ATOM 0 H GLU A 49 4.251 8.295 11.288 1.00 33.01 H new ATOM 0 HA GLU A 49 6.266 7.467 10.847 1.00 20.01 H new ATOM 0 HB2 GLU A 49 4.436 5.552 9.556 1.00 33.43 H new ATOM 0 HB3 GLU A 49 6.021 5.580 8.807 1.00 33.43 H new ATOM 0 HG2 GLU A 49 6.637 4.143 10.422 1.00 3.01 H new ATOM 0 HG3 GLU A 49 6.682 5.539 11.481 1.00 3.01 H new ATOM 731 N PRO A 50 7.487 7.995 8.646 1.00 31.42 N ATOM 732 CA PRO A 50 8.182 8.638 7.527 1.00 32.30 C ATOM 733 C PRO A 50 7.927 7.927 6.201 1.00 33.14 C ATOM 734 O PRO A 50 7.576 8.559 5.205 1.00 41.20 O ATOM 735 CB PRO A 50 9.658 8.531 7.915 1.00 23.25 C ATOM 736 CG PRO A 50 9.725 7.352 8.824 1.00 1.12 C ATOM 737 CD PRO A 50 8.420 7.328 9.570 1.00 62.33 C ATOM 0 HA PRO A 50 7.842 9.662 7.371 1.00 32.30 H new ATOM 0 HB2 PRO A 50 10.289 8.391 7.037 1.00 23.25 H new ATOM 0 HB3 PRO A 50 10.003 9.436 8.414 1.00 23.25 H new ATOM 0 HG2 PRO A 50 9.868 6.431 8.259 1.00 1.12 H new ATOM 0 HG3 PRO A 50 10.566 7.437 9.512 1.00 1.12 H new ATOM 0 HD2 PRO A 50 8.104 6.309 9.794 1.00 62.33 H new ATOM 0 HD3 PRO A 50 8.491 7.856 10.521 1.00 62.33 H new ATOM 745 N GLY A 51 8.104 6.610 6.198 1.00 15.32 N ATOM 746 CA GLY A 51 7.889 5.836 4.990 1.00 12.22 C ATOM 747 C GLY A 51 6.449 5.391 4.835 1.00 31.43 C ATOM 748 O GLY A 51 6.147 4.201 4.919 1.00 65.20 O ATOM 0 H GLY A 51 8.392 6.065 7.011 1.00 15.32 H new ATOM 0 HA2 GLY A 51 8.177 6.432 4.124 1.00 12.22 H new ATOM 0 HA3 GLY A 51 8.537 4.960 5.003 1.00 12.22 H new ATOM 752 N ASP A 52 5.557 6.349 4.610 1.00 32.30 N ATOM 753 CA ASP A 52 4.139 6.051 4.445 1.00 41.35 C ATOM 754 C ASP A 52 3.479 7.052 3.501 1.00 10.15 C ATOM 755 O ASP A 52 3.070 8.136 3.918 1.00 22.34 O ATOM 756 CB ASP A 52 3.430 6.065 5.800 1.00 33.15 C ATOM 757 CG ASP A 52 2.519 4.869 5.990 1.00 0.23 C ATOM 758 OD1 ASP A 52 2.597 4.227 7.059 1.00 72.35 O ATOM 759 OD2 ASP A 52 1.727 4.575 5.070 1.00 73.21 O ATOM 0 H ASP A 52 5.791 7.339 4.538 1.00 32.30 H new ATOM 0 HA ASP A 52 4.052 5.056 4.009 1.00 41.35 H new ATOM 0 HB2 ASP A 52 4.175 6.081 6.596 1.00 33.15 H new ATOM 0 HB3 ASP A 52 2.846 6.981 5.892 1.00 33.15 H new ATOM 764 N ILE A 53 3.382 6.683 2.229 1.00 62.10 N ATOM 765 CA ILE A 53 2.773 7.549 1.226 1.00 2.24 C ATOM 766 C ILE A 53 1.518 6.911 0.639 1.00 30.15 C ATOM 767 O ILE A 53 1.480 6.518 -0.527 1.00 70.45 O ATOM 768 CB ILE A 53 3.756 7.867 0.085 1.00 14.15 C ATOM 769 CG1 ILE A 53 3.083 8.756 -0.963 1.00 31.20 C ATOM 770 CG2 ILE A 53 4.265 6.582 -0.550 1.00 51.31 C ATOM 771 CD1 ILE A 53 4.009 9.792 -1.561 1.00 50.33 C ATOM 0 H ILE A 53 3.717 5.790 1.868 1.00 62.10 H new ATOM 0 HA ILE A 53 2.504 8.477 1.731 1.00 2.24 H new ATOM 0 HB ILE A 53 4.608 8.406 0.499 1.00 14.15 H new ATOM 0 HG12 ILE A 53 2.690 8.128 -1.762 1.00 31.20 H new ATOM 0 HG13 ILE A 53 2.232 9.261 -0.507 1.00 31.20 H new ATOM 0 HG21 ILE A 53 4.959 6.824 -1.355 1.00 51.31 H new ATOM 0 HG22 ILE A 53 4.777 5.982 0.203 1.00 51.31 H new ATOM 0 HG23 ILE A 53 3.424 6.018 -0.953 1.00 51.31 H new ATOM 0 HD11 ILE A 53 3.465 10.386 -2.295 1.00 50.33 H new ATOM 0 HD12 ILE A 53 4.383 10.445 -0.772 1.00 50.33 H new ATOM 0 HD13 ILE A 53 4.848 9.293 -2.047 1.00 50.33 H new ATOM 783 N PRO A 54 0.465 6.806 1.464 1.00 15.31 N ATOM 784 CA PRO A 54 -0.811 6.219 1.047 1.00 73.25 C ATOM 785 C PRO A 54 -1.555 7.100 0.049 1.00 22.45 C ATOM 786 O PRO A 54 -1.094 8.186 -0.299 1.00 21.24 O ATOM 787 CB PRO A 54 -1.597 6.112 2.356 1.00 33.33 C ATOM 788 CG PRO A 54 -1.015 7.166 3.235 1.00 41.22 C ATOM 789 CD PRO A 54 0.441 7.254 2.866 1.00 5.32 C ATOM 0 HA PRO A 54 -0.674 5.265 0.537 1.00 73.25 H new ATOM 0 HB2 PRO A 54 -2.662 6.276 2.193 1.00 33.33 H new ATOM 0 HB3 PRO A 54 -1.492 5.123 2.801 1.00 33.33 H new ATOM 0 HG2 PRO A 54 -1.515 8.122 3.082 1.00 41.22 H new ATOM 0 HG3 PRO A 54 -1.136 6.908 4.287 1.00 41.22 H new ATOM 0 HD2 PRO A 54 0.821 8.270 2.970 1.00 5.32 H new ATOM 0 HD3 PRO A 54 1.056 6.617 3.502 1.00 5.32 H new ATOM 797 N GLU A 55 -2.710 6.624 -0.406 1.00 63.03 N ATOM 798 CA GLU A 55 -3.518 7.370 -1.365 1.00 1.34 C ATOM 799 C GLU A 55 -4.831 6.645 -1.651 1.00 54.52 C ATOM 800 O GLU A 55 -5.144 6.336 -2.801 1.00 31.53 O ATOM 801 CB GLU A 55 -2.743 7.577 -2.667 1.00 51.14 C ATOM 802 CG GLU A 55 -2.297 6.281 -3.323 1.00 3.41 C ATOM 803 CD GLU A 55 -2.772 6.159 -4.758 1.00 12.14 C ATOM 804 OE1 GLU A 55 -2.767 7.184 -5.472 1.00 62.30 O ATOM 805 OE2 GLU A 55 -3.149 5.041 -5.165 1.00 73.54 O ATOM 0 H GLU A 55 -3.107 5.727 -0.127 1.00 63.03 H new ATOM 0 HA GLU A 55 -3.747 8.342 -0.929 1.00 1.34 H new ATOM 0 HB2 GLU A 55 -3.367 8.133 -3.367 1.00 51.14 H new ATOM 0 HB3 GLU A 55 -1.866 8.192 -2.464 1.00 51.14 H new ATOM 0 HG2 GLU A 55 -1.209 6.222 -3.298 1.00 3.41 H new ATOM 0 HG3 GLU A 55 -2.676 5.437 -2.746 1.00 3.41 H new ATOM 812 N THR A 56 -5.593 6.374 -0.596 1.00 52.20 N ATOM 813 CA THR A 56 -6.869 5.685 -0.733 1.00 25.11 C ATOM 814 C THR A 56 -8.009 6.516 -0.154 1.00 54.54 C ATOM 815 O THR A 56 -7.800 7.338 0.739 1.00 52.21 O ATOM 816 CB THR A 56 -6.844 4.312 -0.033 1.00 55.20 C ATOM 817 OG1 THR A 56 -6.826 4.488 1.388 1.00 10.01 O ATOM 818 CG2 THR A 56 -5.628 3.507 -0.465 1.00 2.21 C ATOM 0 H THR A 56 -5.348 6.621 0.363 1.00 52.20 H new ATOM 0 HA THR A 56 -7.035 5.539 -1.800 1.00 25.11 H new ATOM 0 HB THR A 56 -7.742 3.765 -0.320 1.00 55.20 H new ATOM 0 HG1 THR A 56 -6.812 3.611 1.826 1.00 10.01 H new ATOM 0 HG21 THR A 56 -5.632 2.542 0.042 1.00 2.21 H new ATOM 0 HG22 THR A 56 -5.659 3.351 -1.543 1.00 2.21 H new ATOM 0 HG23 THR A 56 -4.720 4.051 -0.204 1.00 2.21 H new ATOM 826 N LEU A 57 -9.214 6.297 -0.668 1.00 75.23 N ATOM 827 CA LEU A 57 -10.388 7.028 -0.201 1.00 40.51 C ATOM 828 C LEU A 57 -10.505 6.956 1.318 1.00 25.12 C ATOM 829 O LEU A 57 -10.851 7.941 1.971 1.00 70.24 O ATOM 830 CB LEU A 57 -11.654 6.464 -0.849 1.00 4.43 C ATOM 831 CG LEU A 57 -12.742 7.481 -1.194 1.00 24.02 C ATOM 832 CD1 LEU A 57 -13.152 8.264 0.044 1.00 2.32 C ATOM 833 CD2 LEU A 57 -12.264 8.423 -2.289 1.00 1.13 C ATOM 0 H LEU A 57 -9.404 5.620 -1.407 1.00 75.23 H new ATOM 0 HA LEU A 57 -10.274 8.073 -0.489 1.00 40.51 H new ATOM 0 HB2 LEU A 57 -11.369 5.943 -1.763 1.00 4.43 H new ATOM 0 HB3 LEU A 57 -12.081 5.719 -0.177 1.00 4.43 H new ATOM 0 HG LEU A 57 -13.614 6.941 -1.563 1.00 24.02 H new ATOM 0 HD11 LEU A 57 -13.927 8.983 -0.221 1.00 2.32 H new ATOM 0 HD12 LEU A 57 -13.536 7.577 0.798 1.00 2.32 H new ATOM 0 HD13 LEU A 57 -12.287 8.794 0.443 1.00 2.32 H new ATOM 0 HD21 LEU A 57 -13.051 9.140 -2.522 1.00 1.13 H new ATOM 0 HD22 LEU A 57 -11.377 8.956 -1.948 1.00 1.13 H new ATOM 0 HD23 LEU A 57 -12.021 7.848 -3.183 1.00 1.13 H new ATOM 845 N ASP A 58 -10.212 5.786 1.875 1.00 41.13 N ATOM 846 CA ASP A 58 -10.282 5.587 3.317 1.00 44.51 C ATOM 847 C ASP A 58 -9.179 6.367 4.027 1.00 63.22 C ATOM 848 O ASP A 58 -9.411 6.972 5.073 1.00 34.04 O ATOM 849 CB ASP A 58 -10.169 4.099 3.654 1.00 74.01 C ATOM 850 CG ASP A 58 -11.523 3.440 3.825 1.00 4.32 C ATOM 851 OD1 ASP A 58 -11.898 3.144 4.979 1.00 51.34 O ATOM 852 OD2 ASP A 58 -12.208 3.221 2.805 1.00 40.34 O ATOM 0 H ASP A 58 -9.924 4.961 1.349 1.00 41.13 H new ATOM 0 HA ASP A 58 -11.246 5.958 3.664 1.00 44.51 H new ATOM 0 HB2 ASP A 58 -9.618 3.591 2.862 1.00 74.01 H new ATOM 0 HB3 ASP A 58 -9.592 3.980 4.571 1.00 74.01 H new ATOM 857 N GLN A 59 -7.982 6.346 3.451 1.00 55.33 N ATOM 858 CA GLN A 59 -6.843 7.051 4.030 1.00 21.32 C ATOM 859 C GLN A 59 -7.047 8.561 3.964 1.00 51.33 C ATOM 860 O GLN A 59 -7.081 9.238 4.991 1.00 31.54 O ATOM 861 CB GLN A 59 -5.555 6.665 3.302 1.00 35.32 C ATOM 862 CG GLN A 59 -4.388 7.594 3.599 1.00 42.34 C ATOM 863 CD GLN A 59 -4.040 8.486 2.425 1.00 74.25 C ATOM 864 OE1 GLN A 59 -4.343 8.167 1.275 1.00 2.22 O ATOM 865 NE2 GLN A 59 -3.399 9.615 2.707 1.00 3.44 N ATOM 0 H GLN A 59 -7.775 5.849 2.585 1.00 55.33 H new ATOM 0 HA GLN A 59 -6.761 6.760 5.077 1.00 21.32 H new ATOM 0 HB2 GLN A 59 -5.280 5.648 3.582 1.00 35.32 H new ATOM 0 HB3 GLN A 59 -5.741 6.661 2.228 1.00 35.32 H new ATOM 0 HG2 GLN A 59 -4.632 8.214 4.462 1.00 42.34 H new ATOM 0 HG3 GLN A 59 -3.515 7.000 3.870 1.00 42.34 H new ATOM 0 HE21 GLN A 59 -3.167 9.842 3.674 1.00 3.44 H new ATOM 0 HE22 GLN A 59 -3.139 10.255 1.957 1.00 3.44 H new ATOM 874 N LEU A 60 -7.182 9.081 2.749 1.00 15.20 N ATOM 875 CA LEU A 60 -7.381 10.513 2.548 1.00 3.22 C ATOM 876 C LEU A 60 -8.523 11.031 3.418 1.00 2.43 C ATOM 877 O LEU A 60 -8.458 12.140 3.948 1.00 42.03 O ATOM 878 CB LEU A 60 -7.674 10.805 1.075 1.00 23.43 C ATOM 879 CG LEU A 60 -6.615 10.339 0.075 1.00 22.32 C ATOM 880 CD1 LEU A 60 -7.259 9.547 -1.052 1.00 23.14 C ATOM 881 CD2 LEU A 60 -5.845 11.529 -0.478 1.00 20.52 C ATOM 0 H LEU A 60 -7.157 8.534 1.889 1.00 15.20 H new ATOM 0 HA LEU A 60 -6.465 11.027 2.839 1.00 3.22 H new ATOM 0 HB2 LEU A 60 -8.623 10.336 0.814 1.00 23.43 H new ATOM 0 HB3 LEU A 60 -7.807 11.880 0.958 1.00 23.43 H new ATOM 0 HG LEU A 60 -5.912 9.687 0.594 1.00 22.32 H new ATOM 0 HD11 LEU A 60 -6.491 9.223 -1.754 1.00 23.14 H new ATOM 0 HD12 LEU A 60 -7.765 8.674 -0.640 1.00 23.14 H new ATOM 0 HD13 LEU A 60 -7.983 10.175 -1.571 1.00 23.14 H new ATOM 0 HD21 LEU A 60 -5.096 11.179 -1.188 1.00 20.52 H new ATOM 0 HD22 LEU A 60 -6.535 12.206 -0.982 1.00 20.52 H new ATOM 0 HD23 LEU A 60 -5.353 12.055 0.340 1.00 20.52 H new ATOM 893 N ARG A 61 -9.565 10.219 3.562 1.00 42.21 N ATOM 894 CA ARG A 61 -10.720 10.594 4.369 1.00 71.53 C ATOM 895 C ARG A 61 -10.317 10.822 5.823 1.00 44.24 C ATOM 896 O ARG A 61 -10.601 11.872 6.401 1.00 24.40 O ATOM 897 CB ARG A 61 -11.798 9.512 4.290 1.00 2.10 C ATOM 898 CG ARG A 61 -12.994 9.778 5.188 1.00 4.12 C ATOM 899 CD ARG A 61 -13.216 8.640 6.173 1.00 10.11 C ATOM 900 NE ARG A 61 -14.632 8.441 6.470 1.00 31.45 N ATOM 901 CZ ARG A 61 -15.083 7.535 7.331 1.00 51.32 C ATOM 902 NH1 ARG A 61 -14.232 6.748 7.975 1.00 3.14 N ATOM 903 NH2 ARG A 61 -16.386 7.415 7.548 1.00 12.43 N ATOM 0 H ARG A 61 -9.633 9.297 3.130 1.00 42.21 H new ATOM 0 HA ARG A 61 -11.122 11.526 3.971 1.00 71.53 H new ATOM 0 HB2 ARG A 61 -12.140 9.427 3.259 1.00 2.10 H new ATOM 0 HB3 ARG A 61 -11.358 8.552 4.560 1.00 2.10 H new ATOM 0 HG2 ARG A 61 -12.840 10.709 5.734 1.00 4.12 H new ATOM 0 HG3 ARG A 61 -13.887 9.911 4.577 1.00 4.12 H new ATOM 0 HD2 ARG A 61 -12.799 7.720 5.764 1.00 10.11 H new ATOM 0 HD3 ARG A 61 -12.678 8.851 7.097 1.00 10.11 H new ATOM 0 HE ARG A 61 -15.312 9.030 5.990 1.00 31.45 H new ATOM 0 HH11 ARG A 61 -13.229 6.838 7.810 1.00 3.14 H new ATOM 0 HH12 ARG A 61 -14.580 6.053 8.636 1.00 3.14 H new ATOM 0 HH21 ARG A 61 -17.043 8.019 7.054 1.00 12.43 H new ATOM 0 HH22 ARG A 61 -16.731 6.719 8.209 1.00 12.43 H new ATOM 917 N LEU A 62 -9.653 9.832 6.409 1.00 5.04 N ATOM 918 CA LEU A 62 -9.211 9.922 7.796 1.00 74.03 C ATOM 919 C LEU A 62 -8.157 11.013 7.962 1.00 62.31 C ATOM 920 O LEU A 62 -8.140 11.727 8.964 1.00 53.15 O ATOM 921 CB LEU A 62 -8.648 8.579 8.261 1.00 5.15 C ATOM 922 CG LEU A 62 -9.433 7.867 9.363 1.00 21.23 C ATOM 923 CD1 LEU A 62 -9.549 8.753 10.594 1.00 21.42 C ATOM 924 CD2 LEU A 62 -10.813 7.466 8.862 1.00 50.41 C ATOM 0 H LEU A 62 -9.409 8.957 5.945 1.00 5.04 H new ATOM 0 HA LEU A 62 -10.074 10.179 8.410 1.00 74.03 H new ATOM 0 HB2 LEU A 62 -8.588 7.915 7.399 1.00 5.15 H new ATOM 0 HB3 LEU A 62 -7.629 8.737 8.613 1.00 5.15 H new ATOM 0 HG LEU A 62 -8.892 6.962 9.640 1.00 21.23 H new ATOM 0 HD11 LEU A 62 -10.111 8.229 11.368 1.00 21.42 H new ATOM 0 HD12 LEU A 62 -8.553 8.990 10.967 1.00 21.42 H new ATOM 0 HD13 LEU A 62 -10.067 9.675 10.331 1.00 21.42 H new ATOM 0 HD21 LEU A 62 -11.357 6.961 9.660 1.00 50.41 H new ATOM 0 HD22 LEU A 62 -11.362 8.357 8.556 1.00 50.41 H new ATOM 0 HD23 LEU A 62 -10.710 6.793 8.011 1.00 50.41 H new ATOM 936 N VAL A 63 -7.281 11.137 6.970 1.00 14.31 N ATOM 937 CA VAL A 63 -6.225 12.142 7.004 1.00 70.51 C ATOM 938 C VAL A 63 -6.809 13.551 7.027 1.00 62.43 C ATOM 939 O VAL A 63 -6.484 14.354 7.901 1.00 24.53 O ATOM 940 CB VAL A 63 -5.284 12.009 5.792 1.00 1.43 C ATOM 941 CG1 VAL A 63 -4.214 13.090 5.825 1.00 42.44 C ATOM 942 CG2 VAL A 63 -4.653 10.625 5.758 1.00 64.10 C ATOM 0 H VAL A 63 -7.282 10.554 6.133 1.00 14.31 H new ATOM 0 HA VAL A 63 -5.655 11.972 7.917 1.00 70.51 H new ATOM 0 HB VAL A 63 -5.871 12.139 4.883 1.00 1.43 H new ATOM 0 HG11 VAL A 63 -3.559 12.980 4.961 1.00 42.44 H new ATOM 0 HG12 VAL A 63 -4.687 14.071 5.799 1.00 42.44 H new ATOM 0 HG13 VAL A 63 -3.628 12.994 6.739 1.00 42.44 H new ATOM 0 HG21 VAL A 63 -3.991 10.548 4.895 1.00 64.10 H new ATOM 0 HG22 VAL A 63 -4.080 10.464 6.671 1.00 64.10 H new ATOM 0 HG23 VAL A 63 -5.436 9.870 5.683 1.00 64.10 H new ATOM 952 N ILE A 64 -7.673 13.844 6.059 1.00 10.50 N ATOM 953 CA ILE A 64 -8.303 15.154 5.970 1.00 11.02 C ATOM 954 C ILE A 64 -9.079 15.479 7.241 1.00 60.32 C ATOM 955 O ILE A 64 -9.121 16.629 7.680 1.00 53.22 O ATOM 956 CB ILE A 64 -9.255 15.239 4.763 1.00 20.55 C ATOM 957 CG1 ILE A 64 -8.489 14.994 3.462 1.00 73.12 C ATOM 958 CG2 ILE A 64 -9.948 16.594 4.729 1.00 11.03 C ATOM 959 CD1 ILE A 64 -9.341 14.401 2.362 1.00 42.11 C ATOM 0 H ILE A 64 -7.951 13.191 5.327 1.00 10.50 H new ATOM 0 HA ILE A 64 -7.502 15.882 5.842 1.00 11.02 H new ATOM 0 HB ILE A 64 -10.016 14.465 4.865 1.00 20.55 H new ATOM 0 HG12 ILE A 64 -8.067 15.937 3.115 1.00 73.12 H new ATOM 0 HG13 ILE A 64 -7.652 14.325 3.663 1.00 73.12 H new ATOM 0 HG21 ILE A 64 -10.618 16.639 3.870 1.00 11.03 H new ATOM 0 HG22 ILE A 64 -10.523 16.732 5.645 1.00 11.03 H new ATOM 0 HG23 ILE A 64 -9.200 17.383 4.648 1.00 11.03 H new ATOM 0 HD11 ILE A 64 -8.733 14.254 1.470 1.00 42.11 H new ATOM 0 HD12 ILE A 64 -9.742 13.442 2.689 1.00 42.11 H new ATOM 0 HD13 ILE A 64 -10.163 15.079 2.133 1.00 42.11 H new ATOM 971 N CYS A 65 -9.694 14.458 7.830 1.00 54.12 N ATOM 972 CA CYS A 65 -10.469 14.634 9.053 1.00 52.45 C ATOM 973 C CYS A 65 -9.557 14.945 10.235 1.00 72.34 C ATOM 974 O CYS A 65 -9.737 15.949 10.923 1.00 74.25 O ATOM 975 CB CYS A 65 -11.292 13.378 9.343 1.00 0.04 C ATOM 976 SG CYS A 65 -12.163 13.418 10.928 1.00 42.04 S ATOM 0 H CYS A 65 -9.671 13.500 7.480 1.00 54.12 H new ATOM 0 HA CYS A 65 -11.145 15.477 8.909 1.00 52.45 H new ATOM 0 HB2 CYS A 65 -12.020 13.241 8.544 1.00 0.04 H new ATOM 0 HB3 CYS A 65 -10.631 12.511 9.325 1.00 0.04 H new ATOM 0 HG CYS A 65 -12.833 12.315 11.083 1.00 42.04 H new ATOM 982 N ASP A 66 -8.579 14.077 10.465 1.00 44.22 N ATOM 983 CA ASP A 66 -7.639 14.257 11.565 1.00 10.10 C ATOM 984 C ASP A 66 -6.871 15.567 11.414 1.00 24.11 C ATOM 985 O ASP A 66 -6.830 16.384 12.334 1.00 14.23 O ATOM 986 CB ASP A 66 -6.660 13.084 11.626 1.00 3.23 C ATOM 987 CG ASP A 66 -7.367 11.742 11.654 1.00 32.21 C ATOM 988 OD1 ASP A 66 -6.712 10.720 11.355 1.00 31.45 O ATOM 989 OD2 ASP A 66 -8.573 11.714 11.975 1.00 62.05 O ATOM 0 H ASP A 66 -8.416 13.241 9.904 1.00 44.22 H new ATOM 0 HA ASP A 66 -8.208 14.294 12.494 1.00 10.10 H new ATOM 0 HB2 ASP A 66 -5.995 13.124 10.763 1.00 3.23 H new ATOM 0 HB3 ASP A 66 -6.035 13.181 12.514 1.00 3.23 H new ATOM 994 N LEU A 67 -6.266 15.761 10.248 1.00 54.32 N ATOM 995 CA LEU A 67 -5.499 16.971 9.975 1.00 32.34 C ATOM 996 C LEU A 67 -6.356 18.217 10.179 1.00 10.05 C ATOM 997 O LEU A 67 -5.873 19.241 10.660 1.00 73.05 O ATOM 998 CB LEU A 67 -4.953 16.943 8.547 1.00 53.25 C ATOM 999 CG LEU A 67 -3.806 17.909 8.247 1.00 23.53 C ATOM 1000 CD1 LEU A 67 -2.639 17.660 9.190 1.00 73.35 C ATOM 1001 CD2 LEU A 67 -3.362 17.776 6.797 1.00 34.23 C ATOM 0 H LEU A 67 -6.292 15.095 9.476 1.00 54.32 H new ATOM 0 HA LEU A 67 -4.665 17.007 10.675 1.00 32.34 H new ATOM 0 HB2 LEU A 67 -4.615 15.930 8.329 1.00 53.25 H new ATOM 0 HB3 LEU A 67 -5.773 17.160 7.862 1.00 53.25 H new ATOM 0 HG LEU A 67 -4.162 18.927 8.404 1.00 23.53 H new ATOM 0 HD11 LEU A 67 -1.832 18.356 8.962 1.00 73.35 H new ATOM 0 HD12 LEU A 67 -2.965 17.807 10.220 1.00 73.35 H new ATOM 0 HD13 LEU A 67 -2.282 16.638 9.065 1.00 73.35 H new ATOM 0 HD21 LEU A 67 -2.545 18.471 6.601 1.00 34.23 H new ATOM 0 HD22 LEU A 67 -3.023 16.757 6.612 1.00 34.23 H new ATOM 0 HD23 LEU A 67 -4.199 18.005 6.138 1.00 34.23 H new ATOM 1013 N GLN A 68 -7.630 18.119 9.814 1.00 63.15 N ATOM 1014 CA GLN A 68 -8.554 19.237 9.958 1.00 40.12 C ATOM 1015 C GLN A 68 -8.679 19.655 11.420 1.00 41.12 C ATOM 1016 O GLN A 68 -8.551 20.833 11.750 1.00 11.41 O ATOM 1017 CB GLN A 68 -9.930 18.863 9.403 1.00 33.15 C ATOM 1018 CG GLN A 68 -10.153 19.322 7.971 1.00 2.31 C ATOM 1019 CD GLN A 68 -10.506 20.793 7.877 1.00 42.54 C ATOM 1020 OE1 GLN A 68 -10.069 21.602 8.696 1.00 51.23 O ATOM 1021 NE2 GLN A 68 -11.301 21.149 6.874 1.00 3.30 N ATOM 0 H GLN A 68 -8.046 17.277 9.416 1.00 63.15 H new ATOM 0 HA GLN A 68 -8.157 20.079 9.391 1.00 40.12 H new ATOM 0 HB2 GLN A 68 -10.051 17.781 9.452 1.00 33.15 H new ATOM 0 HB3 GLN A 68 -10.700 19.299 10.040 1.00 33.15 H new ATOM 0 HG2 GLN A 68 -9.252 19.131 7.388 1.00 2.31 H new ATOM 0 HG3 GLN A 68 -10.953 18.731 7.525 1.00 2.31 H new ATOM 0 HE21 GLN A 68 -11.640 20.446 6.218 1.00 3.30 H new ATOM 0 HE22 GLN A 68 -11.572 22.126 6.760 1.00 3.30 H new ATOM 1030 N GLU A 69 -8.930 18.681 12.290 1.00 41.15 N ATOM 1031 CA GLU A 69 -9.073 18.949 13.715 1.00 20.14 C ATOM 1032 C GLU A 69 -7.834 19.654 14.262 1.00 5.14 C ATOM 1033 O GLU A 69 -7.940 20.635 14.999 1.00 21.51 O ATOM 1034 CB GLU A 69 -9.312 17.647 14.481 1.00 44.02 C ATOM 1035 CG GLU A 69 -9.370 17.828 15.988 1.00 72.13 C ATOM 1036 CD GLU A 69 -9.922 16.608 16.702 1.00 54.23 C ATOM 1037 OE1 GLU A 69 -9.443 16.306 17.815 1.00 72.13 O ATOM 1038 OE2 GLU A 69 -10.831 15.957 16.147 1.00 23.14 O ATOM 0 H GLU A 69 -9.038 17.700 12.032 1.00 41.15 H new ATOM 0 HA GLU A 69 -9.934 19.604 13.851 1.00 20.14 H new ATOM 0 HB2 GLU A 69 -10.247 17.202 14.141 1.00 44.02 H new ATOM 0 HB3 GLU A 69 -8.517 16.942 14.239 1.00 44.02 H new ATOM 0 HG2 GLU A 69 -8.369 18.042 16.363 1.00 72.13 H new ATOM 0 HG3 GLU A 69 -9.990 18.693 16.223 1.00 72.13 H new ATOM 1045 N ARG A 70 -6.662 19.146 13.898 1.00 1.11 N ATOM 1046 CA ARG A 70 -5.404 19.725 14.354 1.00 63.11 C ATOM 1047 C ARG A 70 -5.182 21.101 13.733 1.00 33.32 C ATOM 1048 O ARG A 70 -4.606 21.990 14.361 1.00 40.10 O ATOM 1049 CB ARG A 70 -4.237 18.801 14.001 1.00 11.30 C ATOM 1050 CG ARG A 70 -3.994 17.707 15.028 1.00 1.41 C ATOM 1051 CD ARG A 70 -3.584 16.402 14.365 1.00 2.24 C ATOM 1052 NE ARG A 70 -4.515 15.318 14.668 1.00 64.24 N ATOM 1053 CZ ARG A 70 -4.212 14.031 14.538 1.00 61.54 C ATOM 1054 NH1 ARG A 70 -3.009 13.669 14.114 1.00 3.22 N ATOM 1055 NH2 ARG A 70 -5.115 13.103 14.833 1.00 55.50 N ATOM 0 H ARG A 70 -6.557 18.335 13.289 1.00 1.11 H new ATOM 0 HA ARG A 70 -5.456 19.838 15.437 1.00 63.11 H new ATOM 0 HB2 ARG A 70 -4.429 18.341 13.032 1.00 11.30 H new ATOM 0 HB3 ARG A 70 -3.331 19.398 13.897 1.00 11.30 H new ATOM 0 HG2 ARG A 70 -3.215 18.024 15.722 1.00 1.41 H new ATOM 0 HG3 ARG A 70 -4.899 17.550 15.615 1.00 1.41 H new ATOM 0 HD2 ARG A 70 -3.532 16.544 13.286 1.00 2.24 H new ATOM 0 HD3 ARG A 70 -2.584 16.125 14.698 1.00 2.24 H new ATOM 0 HE ARG A 70 -5.449 15.563 14.997 1.00 64.24 H new ATOM 0 HH11 ARG A 70 -2.313 14.379 13.887 1.00 3.22 H new ATOM 0 HH12 ARG A 70 -2.779 12.680 14.015 1.00 3.22 H new ATOM 0 HH21 ARG A 70 -6.041 13.378 15.159 1.00 55.50 H new ATOM 0 HH22 ARG A 70 -4.882 12.115 14.733 1.00 55.50 H new ATOM 1069 N ARG A 71 -5.643 21.269 12.498 1.00 32.14 N ATOM 1070 CA ARG A 71 -5.495 22.537 11.793 1.00 52.40 C ATOM 1071 C ARG A 71 -6.180 23.667 12.555 1.00 14.51 C ATOM 1072 O ARG A 71 -5.636 24.765 12.676 1.00 22.40 O ATOM 1073 CB ARG A 71 -6.077 22.431 10.383 1.00 23.40 C ATOM 1074 CG ARG A 71 -6.166 23.765 9.660 1.00 75.15 C ATOM 1075 CD ARG A 71 -6.440 23.577 8.176 1.00 55.44 C ATOM 1076 NE ARG A 71 -7.871 23.560 7.881 1.00 55.52 N ATOM 1077 CZ ARG A 71 -8.613 24.657 7.785 1.00 4.15 C ATOM 1078 NH1 ARG A 71 -8.065 25.851 7.960 1.00 2.54 N ATOM 1079 NH2 ARG A 71 -9.909 24.560 7.514 1.00 13.32 N ATOM 0 H ARG A 71 -6.122 20.543 11.965 1.00 32.14 H new ATOM 0 HA ARG A 71 -4.431 22.763 11.723 1.00 52.40 H new ATOM 0 HB2 ARG A 71 -5.462 21.749 9.795 1.00 23.40 H new ATOM 0 HB3 ARG A 71 -7.073 21.992 10.442 1.00 23.40 H new ATOM 0 HG2 ARG A 71 -6.958 24.368 10.104 1.00 75.15 H new ATOM 0 HG3 ARG A 71 -5.234 24.315 9.792 1.00 75.15 H new ATOM 0 HD2 ARG A 71 -5.964 24.381 7.615 1.00 55.44 H new ATOM 0 HD3 ARG A 71 -5.989 22.643 7.840 1.00 55.44 H new ATOM 0 HE ARG A 71 -8.324 22.657 7.741 1.00 55.52 H new ATOM 0 HH11 ARG A 71 -7.070 25.930 8.169 1.00 2.54 H new ATOM 0 HH12 ARG A 71 -8.638 26.691 7.885 1.00 2.54 H new ATOM 0 HH21 ARG A 71 -10.335 23.643 7.380 1.00 13.32 H new ATOM 0 HH22 ARG A 71 -10.479 25.403 7.440 1.00 13.32 H new ATOM 1093 N GLU A 72 -7.374 23.390 13.068 1.00 51.45 N ATOM 1094 CA GLU A 72 -8.133 24.384 13.817 1.00 34.33 C ATOM 1095 C GLU A 72 -7.482 24.659 15.170 1.00 41.30 C ATOM 1096 O GLU A 72 -7.254 25.811 15.540 1.00 35.42 O ATOM 1097 CB GLU A 72 -9.574 23.913 14.019 1.00 45.24 C ATOM 1098 CG GLU A 72 -10.613 24.886 13.488 1.00 73.35 C ATOM 1099 CD GLU A 72 -10.881 26.032 14.444 1.00 20.50 C ATOM 1100 OE1 GLU A 72 -10.908 25.789 15.668 1.00 53.41 O ATOM 1101 OE2 GLU A 72 -11.064 27.172 13.968 1.00 65.32 O ATOM 0 H GLU A 72 -7.837 22.485 12.979 1.00 51.45 H new ATOM 0 HA GLU A 72 -8.139 25.309 13.240 1.00 34.33 H new ATOM 0 HB2 GLU A 72 -9.705 22.950 13.526 1.00 45.24 H new ATOM 0 HB3 GLU A 72 -9.749 23.753 15.083 1.00 45.24 H new ATOM 0 HG2 GLU A 72 -10.275 25.287 12.532 1.00 73.35 H new ATOM 0 HG3 GLU A 72 -11.543 24.351 13.298 1.00 73.35 H new ATOM 1108 N LYS A 73 -7.185 23.592 15.904 1.00 32.43 N ATOM 1109 CA LYS A 73 -6.561 23.717 17.216 1.00 3.32 C ATOM 1110 C LYS A 73 -5.313 24.590 17.144 1.00 73.22 C ATOM 1111 O LYS A 73 -4.980 25.295 18.098 1.00 41.00 O ATOM 1112 CB LYS A 73 -6.197 22.334 17.763 1.00 63.13 C ATOM 1113 CG LYS A 73 -7.393 21.545 18.266 1.00 5.10 C ATOM 1114 CD LYS A 73 -6.962 20.351 19.102 1.00 24.21 C ATOM 1115 CE LYS A 73 -6.810 20.722 20.569 1.00 34.52 C ATOM 1116 NZ LYS A 73 -5.657 20.024 21.201 1.00 32.55 N ATOM 0 H LYS A 73 -7.366 22.631 15.613 1.00 32.43 H new ATOM 0 HA LYS A 73 -7.277 24.191 17.888 1.00 3.32 H new ATOM 0 HB2 LYS A 73 -5.699 21.763 16.980 1.00 63.13 H new ATOM 0 HB3 LYS A 73 -5.481 22.451 18.577 1.00 63.13 H new ATOM 0 HG2 LYS A 73 -8.034 22.195 18.862 1.00 5.10 H new ATOM 0 HG3 LYS A 73 -7.986 21.202 17.418 1.00 5.10 H new ATOM 0 HD2 LYS A 73 -7.696 19.552 19.002 1.00 24.21 H new ATOM 0 HD3 LYS A 73 -6.016 19.964 18.724 1.00 24.21 H new ATOM 0 HE2 LYS A 73 -6.676 21.800 20.659 1.00 34.52 H new ATOM 0 HE3 LYS A 73 -7.725 20.469 21.104 1.00 34.52 H new ATOM 0 HZ1 LYS A 73 -5.587 20.303 22.200 1.00 32.55 H new ATOM 0 HZ2 LYS A 73 -5.797 18.995 21.138 1.00 32.55 H new ATOM 0 HZ3 LYS A 73 -4.780 20.285 20.707 1.00 32.55 H new ATOM 1130 N PHE A 74 -4.627 24.542 16.007 1.00 15.41 N ATOM 1131 CA PHE A 74 -3.416 25.331 15.811 1.00 42.21 C ATOM 1132 C PHE A 74 -3.741 26.674 15.163 1.00 13.43 C ATOM 1133 O PHE A 74 -3.000 27.644 15.318 1.00 22.41 O ATOM 1134 CB PHE A 74 -2.417 24.562 14.944 1.00 40.13 C ATOM 1135 CG PHE A 74 -1.093 25.257 14.794 1.00 71.45 C ATOM 1136 CD1 PHE A 74 -0.132 25.165 15.787 1.00 42.42 C ATOM 1137 CD2 PHE A 74 -0.813 26.004 13.661 1.00 52.33 C ATOM 1138 CE1 PHE A 74 1.087 25.802 15.652 1.00 11.20 C ATOM 1139 CE2 PHE A 74 0.405 26.644 13.521 1.00 24.53 C ATOM 1140 CZ PHE A 74 1.356 26.544 14.519 1.00 62.54 C ATOM 0 H PHE A 74 -4.889 23.965 15.207 1.00 15.41 H new ATOM 0 HA PHE A 74 -2.971 25.518 16.788 1.00 42.21 H new ATOM 0 HB2 PHE A 74 -2.254 23.576 15.380 1.00 40.13 H new ATOM 0 HB3 PHE A 74 -2.850 24.406 13.956 1.00 40.13 H new ATOM 0 HD1 PHE A 74 -0.338 24.589 16.677 1.00 42.42 H new ATOM 0 HD2 PHE A 74 -1.553 26.087 12.879 1.00 52.33 H new ATOM 0 HE1 PHE A 74 1.829 25.719 16.432 1.00 11.20 H new ATOM 0 HE2 PHE A 74 0.613 27.222 12.632 1.00 24.53 H new ATOM 0 HZ PHE A 74 2.307 27.045 14.413 1.00 62.54 H new ATOM 1150 N GLY A 75 -4.852 26.721 14.437 1.00 63.54 N ATOM 1151 CA GLY A 75 -5.256 27.948 13.776 1.00 31.43 C ATOM 1152 C GLY A 75 -5.140 27.860 12.268 1.00 70.50 C ATOM 1153 O GLY A 75 -4.541 26.925 11.738 1.00 13.44 O ATOM 0 H GLY A 75 -5.481 25.931 14.294 1.00 63.54 H new ATOM 0 HA2 GLY A 75 -6.287 28.179 14.045 1.00 31.43 H new ATOM 0 HA3 GLY A 75 -4.640 28.771 14.137 1.00 31.43 H new ATOM 1157 N SER A 76 -5.718 28.836 11.573 1.00 11.53 N ATOM 1158 CA SER A 76 -5.682 28.861 10.116 1.00 20.22 C ATOM 1159 C SER A 76 -4.321 29.333 9.615 1.00 52.23 C ATOM 1160 O SER A 76 -3.809 30.362 10.053 1.00 55.42 O ATOM 1161 CB SER A 76 -6.783 29.774 9.573 1.00 50.33 C ATOM 1162 OG SER A 76 -7.313 29.269 8.360 1.00 51.50 O ATOM 0 H SER A 76 -6.216 29.619 11.996 1.00 11.53 H new ATOM 0 HA SER A 76 -5.851 27.846 9.755 1.00 20.22 H new ATOM 0 HB2 SER A 76 -7.580 29.866 10.311 1.00 50.33 H new ATOM 0 HB3 SER A 76 -6.382 30.774 9.410 1.00 50.33 H new ATOM 0 HG SER A 76 -8.016 29.870 8.035 1.00 51.50 H new ATOM 1168 N SER A 77 -3.740 28.571 8.692 1.00 42.00 N ATOM 1169 CA SER A 77 -2.436 28.908 8.133 1.00 41.11 C ATOM 1170 C SER A 77 -2.370 28.545 6.653 1.00 43.43 C ATOM 1171 O SER A 77 -2.983 27.573 6.211 1.00 24.44 O ATOM 1172 CB SER A 77 -1.326 28.184 8.898 1.00 61.25 C ATOM 1173 OG SER A 77 -0.399 27.586 8.008 1.00 21.22 O ATOM 0 H SER A 77 -4.152 27.717 8.316 1.00 42.00 H new ATOM 0 HA SER A 77 -2.293 29.984 8.232 1.00 41.11 H new ATOM 0 HB2 SER A 77 -0.808 28.890 9.548 1.00 61.25 H new ATOM 0 HB3 SER A 77 -1.762 27.420 9.541 1.00 61.25 H new ATOM 0 HG SER A 77 0.008 26.804 8.436 1.00 21.22 H new ATOM 1179 N LYS A 78 -1.620 29.333 5.890 1.00 71.24 N ATOM 1180 CA LYS A 78 -1.470 29.096 4.459 1.00 61.24 C ATOM 1181 C LYS A 78 -0.837 27.733 4.197 1.00 51.34 C ATOM 1182 O LYS A 78 -1.104 27.102 3.174 1.00 22.30 O ATOM 1183 CB LYS A 78 -0.618 30.197 3.825 1.00 14.43 C ATOM 1184 CG LYS A 78 -1.390 31.471 3.529 1.00 1.44 C ATOM 1185 CD LYS A 78 -2.260 31.321 2.294 1.00 61.04 C ATOM 1186 CE LYS A 78 -3.365 32.365 2.260 1.00 72.54 C ATOM 1187 NZ LYS A 78 -4.461 32.045 3.216 1.00 34.10 N ATOM 0 H LYS A 78 -1.106 30.142 6.239 1.00 71.24 H new ATOM 0 HA LYS A 78 -2.462 29.109 4.008 1.00 61.24 H new ATOM 0 HB2 LYS A 78 0.212 30.432 4.492 1.00 14.43 H new ATOM 0 HB3 LYS A 78 -0.185 29.821 2.898 1.00 14.43 H new ATOM 0 HG2 LYS A 78 -2.014 31.727 4.386 1.00 1.44 H new ATOM 0 HG3 LYS A 78 -0.692 32.296 3.385 1.00 1.44 H new ATOM 0 HD2 LYS A 78 -1.643 31.413 1.400 1.00 61.04 H new ATOM 0 HD3 LYS A 78 -2.700 30.324 2.276 1.00 61.04 H new ATOM 0 HE2 LYS A 78 -2.948 33.343 2.500 1.00 72.54 H new ATOM 0 HE3 LYS A 78 -3.771 32.431 1.251 1.00 72.54 H new ATOM 0 HZ1 LYS A 78 -5.267 32.680 3.045 1.00 34.10 H new ATOM 0 HZ2 LYS A 78 -4.762 31.059 3.081 1.00 34.10 H new ATOM 0 HZ3 LYS A 78 -4.120 32.173 4.190 1.00 34.10 H new ATOM 1201 N GLU A 79 0.001 27.286 5.127 1.00 50.54 N ATOM 1202 CA GLU A 79 0.671 25.997 4.994 1.00 31.13 C ATOM 1203 C GLU A 79 -0.299 24.850 5.263 1.00 15.12 C ATOM 1204 O GLU A 79 -0.438 23.937 4.449 1.00 42.21 O ATOM 1205 CB GLU A 79 1.857 25.913 5.956 1.00 14.32 C ATOM 1206 CG GLU A 79 3.130 26.538 5.409 1.00 23.02 C ATOM 1207 CD GLU A 79 4.378 25.796 5.847 1.00 34.14 C ATOM 1208 OE1 GLU A 79 5.450 26.034 5.250 1.00 33.31 O ATOM 1209 OE2 GLU A 79 4.285 24.979 6.786 1.00 33.04 O ATOM 0 H GLU A 79 0.232 27.796 5.979 1.00 50.54 H new ATOM 0 HA GLU A 79 1.036 25.909 3.971 1.00 31.13 H new ATOM 0 HB2 GLU A 79 1.592 26.408 6.890 1.00 14.32 H new ATOM 0 HB3 GLU A 79 2.049 24.866 6.193 1.00 14.32 H new ATOM 0 HG2 GLU A 79 3.084 26.553 4.320 1.00 23.02 H new ATOM 0 HG3 GLU A 79 3.193 27.575 5.740 1.00 23.02 H new ATOM 1216 N ILE A 80 -0.966 24.905 6.411 1.00 3.42 N ATOM 1217 CA ILE A 80 -1.922 23.871 6.787 1.00 12.14 C ATOM 1218 C ILE A 80 -3.111 23.847 5.833 1.00 51.32 C ATOM 1219 O ILE A 80 -3.699 22.794 5.584 1.00 53.25 O ATOM 1220 CB ILE A 80 -2.437 24.077 8.225 1.00 72.22 C ATOM 1221 CG1 ILE A 80 -3.220 22.847 8.690 1.00 33.44 C ATOM 1222 CG2 ILE A 80 -3.304 25.324 8.302 1.00 15.12 C ATOM 1223 CD1 ILE A 80 -2.367 21.606 8.832 1.00 41.04 C ATOM 0 H ILE A 80 -0.862 25.654 7.096 1.00 3.42 H new ATOM 0 HA ILE A 80 -1.395 22.919 6.730 1.00 12.14 H new ATOM 0 HB ILE A 80 -1.582 24.211 8.887 1.00 72.22 H new ATOM 0 HG12 ILE A 80 -3.690 23.067 9.649 1.00 33.44 H new ATOM 0 HG13 ILE A 80 -4.022 22.647 7.980 1.00 33.44 H new ATOM 0 HG21 ILE A 80 -3.661 25.457 9.323 1.00 15.12 H new ATOM 0 HG22 ILE A 80 -2.717 26.194 8.007 1.00 15.12 H new ATOM 0 HG23 ILE A 80 -4.156 25.216 7.631 1.00 15.12 H new ATOM 0 HD11 ILE A 80 -2.988 20.774 9.165 1.00 41.04 H new ATOM 0 HD12 ILE A 80 -1.918 21.361 7.870 1.00 41.04 H new ATOM 0 HD13 ILE A 80 -1.580 21.787 9.564 1.00 41.04 H new ATOM 1235 N ASP A 81 -3.457 25.013 5.299 1.00 51.03 N ATOM 1236 CA ASP A 81 -4.573 25.126 4.367 1.00 24.34 C ATOM 1237 C ASP A 81 -4.247 24.445 3.042 1.00 4.22 C ATOM 1238 O ASP A 81 -5.050 23.676 2.514 1.00 20.04 O ATOM 1239 CB ASP A 81 -4.918 26.597 4.128 1.00 41.42 C ATOM 1240 CG ASP A 81 -5.800 27.170 5.219 1.00 33.02 C ATOM 1241 OD1 ASP A 81 -6.611 28.070 4.916 1.00 62.15 O ATOM 1242 OD2 ASP A 81 -5.679 26.719 6.378 1.00 70.15 O ATOM 0 H ASP A 81 -2.981 25.893 5.495 1.00 51.03 H new ATOM 0 HA ASP A 81 -5.435 24.626 4.809 1.00 24.34 H new ATOM 0 HB2 ASP A 81 -3.998 27.178 4.067 1.00 41.42 H new ATOM 0 HB3 ASP A 81 -5.423 26.697 3.167 1.00 41.42 H new ATOM 1247 N MET A 82 -3.063 24.733 2.510 1.00 5.14 N ATOM 1248 CA MET A 82 -2.631 24.147 1.247 1.00 44.10 C ATOM 1249 C MET A 82 -2.537 22.628 1.355 1.00 31.51 C ATOM 1250 O MET A 82 -2.858 21.909 0.410 1.00 52.51 O ATOM 1251 CB MET A 82 -1.278 24.725 0.829 1.00 71.13 C ATOM 1252 CG MET A 82 -1.371 26.117 0.225 1.00 31.44 C ATOM 1253 SD MET A 82 -2.177 26.122 -1.388 1.00 1.52 S ATOM 1254 CE MET A 82 -2.777 27.808 -1.462 1.00 1.13 C ATOM 0 H MET A 82 -2.387 25.368 2.934 1.00 5.14 H new ATOM 0 HA MET A 82 -3.374 24.394 0.488 1.00 44.10 H new ATOM 0 HB2 MET A 82 -0.622 24.759 1.699 1.00 71.13 H new ATOM 0 HB3 MET A 82 -0.814 24.055 0.106 1.00 71.13 H new ATOM 0 HG2 MET A 82 -1.922 26.767 0.904 1.00 31.44 H new ATOM 0 HG3 MET A 82 -0.369 26.534 0.127 1.00 31.44 H new ATOM 0 HE1 MET A 82 -3.300 27.967 -2.405 1.00 1.13 H new ATOM 0 HE2 MET A 82 -3.461 27.987 -0.633 1.00 1.13 H new ATOM 0 HE3 MET A 82 -1.935 28.497 -1.394 1.00 1.13 H new ATOM 1264 N ALA A 83 -2.096 22.149 2.513 1.00 44.32 N ATOM 1265 CA ALA A 83 -1.963 20.716 2.745 1.00 52.34 C ATOM 1266 C ALA A 83 -3.320 20.023 2.700 1.00 33.33 C ATOM 1267 O ALA A 83 -3.472 18.973 2.075 1.00 75.21 O ATOM 1268 CB ALA A 83 -1.280 20.458 4.080 1.00 61.31 C ATOM 0 H ALA A 83 -1.825 22.732 3.305 1.00 44.32 H new ATOM 0 HA ALA A 83 -1.347 20.301 1.948 1.00 52.34 H new ATOM 0 HB1 ALA A 83 -1.188 19.384 4.240 1.00 61.31 H new ATOM 0 HB2 ALA A 83 -0.289 20.911 4.075 1.00 61.31 H new ATOM 0 HB3 ALA A 83 -1.874 20.894 4.883 1.00 61.31 H new ATOM 1274 N ILE A 84 -4.304 20.616 3.368 1.00 53.41 N ATOM 1275 CA ILE A 84 -5.649 20.056 3.404 1.00 50.22 C ATOM 1276 C ILE A 84 -6.280 20.052 2.015 1.00 25.42 C ATOM 1277 O ILE A 84 -6.666 19.003 1.500 1.00 70.31 O ATOM 1278 CB ILE A 84 -6.560 20.839 4.368 1.00 41.12 C ATOM 1279 CG1 ILE A 84 -6.067 20.684 5.808 1.00 71.14 C ATOM 1280 CG2 ILE A 84 -7.999 20.362 4.241 1.00 74.15 C ATOM 1281 CD1 ILE A 84 -6.209 19.279 6.348 1.00 24.42 C ATOM 0 H ILE A 84 -4.195 21.484 3.892 1.00 53.41 H new ATOM 0 HA ILE A 84 -5.554 19.030 3.760 1.00 50.22 H new ATOM 0 HB ILE A 84 -6.523 21.896 4.103 1.00 41.12 H new ATOM 0 HG12 ILE A 84 -5.019 20.979 5.858 1.00 71.14 H new ATOM 0 HG13 ILE A 84 -6.622 21.369 6.449 1.00 71.14 H new ATOM 0 HG21 ILE A 84 -8.631 20.925 4.928 1.00 74.15 H new ATOM 0 HG22 ILE A 84 -8.345 20.518 3.219 1.00 74.15 H new ATOM 0 HG23 ILE A 84 -8.053 19.301 4.484 1.00 74.15 H new ATOM 0 HD11 ILE A 84 -5.840 19.244 7.373 1.00 24.42 H new ATOM 0 HD12 ILE A 84 -7.259 18.987 6.330 1.00 24.42 H new ATOM 0 HD13 ILE A 84 -5.631 18.592 5.730 1.00 24.42 H new ATOM 1293 N VAL A 85 -6.380 21.234 1.413 1.00 4.45 N ATOM 1294 CA VAL A 85 -6.961 21.367 0.083 1.00 21.25 C ATOM 1295 C VAL A 85 -6.314 20.398 -0.899 1.00 50.13 C ATOM 1296 O VAL A 85 -6.962 19.906 -1.823 1.00 24.02 O ATOM 1297 CB VAL A 85 -6.811 22.803 -0.453 1.00 53.54 C ATOM 1298 CG1 VAL A 85 -5.342 23.153 -0.636 1.00 61.55 C ATOM 1299 CG2 VAL A 85 -7.573 22.966 -1.760 1.00 3.30 C ATOM 0 H VAL A 85 -6.066 22.112 1.826 1.00 4.45 H new ATOM 0 HA VAL A 85 -8.021 21.131 0.175 1.00 21.25 H new ATOM 0 HB VAL A 85 -7.236 23.492 0.277 1.00 53.54 H new ATOM 0 HG11 VAL A 85 -5.255 24.171 -1.015 1.00 61.55 H new ATOM 0 HG12 VAL A 85 -4.828 23.078 0.322 1.00 61.55 H new ATOM 0 HG13 VAL A 85 -4.889 22.461 -1.346 1.00 61.55 H new ATOM 0 HG21 VAL A 85 -7.456 23.987 -2.124 1.00 3.30 H new ATOM 0 HG22 VAL A 85 -7.179 22.269 -2.500 1.00 3.30 H new ATOM 0 HG23 VAL A 85 -8.630 22.759 -1.593 1.00 3.30 H new ATOM 1309 N THR A 86 -5.029 20.126 -0.694 1.00 72.31 N ATOM 1310 CA THR A 86 -4.292 19.216 -1.561 1.00 54.30 C ATOM 1311 C THR A 86 -4.735 17.773 -1.349 1.00 21.43 C ATOM 1312 O THR A 86 -4.891 17.013 -2.305 1.00 52.41 O ATOM 1313 CB THR A 86 -2.774 19.315 -1.321 1.00 14.22 C ATOM 1314 OG1 THR A 86 -2.293 20.596 -1.745 1.00 70.23 O ATOM 1315 CG2 THR A 86 -2.034 18.217 -2.068 1.00 54.32 C ATOM 0 H THR A 86 -4.477 20.524 0.066 1.00 72.31 H new ATOM 0 HA THR A 86 -4.510 19.513 -2.587 1.00 54.30 H new ATOM 0 HB THR A 86 -2.589 19.193 -0.254 1.00 14.22 H new ATOM 0 HG1 THR A 86 -2.612 21.286 -1.127 1.00 70.23 H new ATOM 0 HG21 THR A 86 -0.964 18.308 -1.883 1.00 54.32 H new ATOM 0 HG22 THR A 86 -2.381 17.244 -1.721 1.00 54.32 H new ATOM 0 HG23 THR A 86 -2.226 18.311 -3.137 1.00 54.32 H new ATOM 1323 N LEU A 87 -4.938 17.401 -0.089 1.00 53.15 N ATOM 1324 CA LEU A 87 -5.365 16.048 0.250 1.00 74.22 C ATOM 1325 C LEU A 87 -6.744 15.751 -0.332 1.00 2.41 C ATOM 1326 O LEU A 87 -7.011 14.637 -0.784 1.00 74.34 O ATOM 1327 CB LEU A 87 -5.389 15.865 1.768 1.00 73.21 C ATOM 1328 CG LEU A 87 -4.380 14.869 2.340 1.00 64.04 C ATOM 1329 CD1 LEU A 87 -4.778 13.444 1.985 1.00 53.41 C ATOM 1330 CD2 LEU A 87 -2.979 15.175 1.831 1.00 72.42 C ATOM 0 H LEU A 87 -4.814 18.017 0.714 1.00 53.15 H new ATOM 0 HA LEU A 87 -4.650 15.348 -0.182 1.00 74.22 H new ATOM 0 HB2 LEU A 87 -5.216 16.835 2.234 1.00 73.21 H new ATOM 0 HB3 LEU A 87 -6.390 15.546 2.060 1.00 73.21 H new ATOM 0 HG LEU A 87 -4.379 14.966 3.426 1.00 64.04 H new ATOM 0 HD11 LEU A 87 -4.049 12.748 2.400 1.00 53.41 H new ATOM 0 HD12 LEU A 87 -5.763 13.227 2.399 1.00 53.41 H new ATOM 0 HD13 LEU A 87 -4.808 13.334 0.901 1.00 53.41 H new ATOM 0 HD21 LEU A 87 -2.275 14.456 2.249 1.00 72.42 H new ATOM 0 HD22 LEU A 87 -2.964 15.107 0.743 1.00 72.42 H new ATOM 0 HD23 LEU A 87 -2.693 16.182 2.136 1.00 72.42 H new ATOM 1342 N LYS A 88 -7.615 16.753 -0.317 1.00 63.41 N ATOM 1343 CA LYS A 88 -8.966 16.602 -0.846 1.00 4.45 C ATOM 1344 C LYS A 88 -8.955 16.589 -2.370 1.00 74.23 C ATOM 1345 O LYS A 88 -9.358 15.608 -2.996 1.00 41.03 O ATOM 1346 CB LYS A 88 -9.864 17.734 -0.340 1.00 52.42 C ATOM 1347 CG LYS A 88 -9.926 17.830 1.174 1.00 30.32 C ATOM 1348 CD LYS A 88 -10.234 19.247 1.630 1.00 4.32 C ATOM 1349 CE LYS A 88 -11.442 19.285 2.555 1.00 50.34 C ATOM 1350 NZ LYS A 88 -11.249 20.241 3.680 1.00 64.43 N ATOM 0 H LYS A 88 -7.410 17.680 0.056 1.00 63.41 H new ATOM 0 HA LYS A 88 -9.362 15.649 -0.496 1.00 4.45 H new ATOM 0 HB2 LYS A 88 -9.502 18.681 -0.741 1.00 52.42 H new ATOM 0 HB3 LYS A 88 -10.872 17.588 -0.728 1.00 52.42 H new ATOM 0 HG2 LYS A 88 -10.690 17.151 1.552 1.00 30.32 H new ATOM 0 HG3 LYS A 88 -8.975 17.508 1.599 1.00 30.32 H new ATOM 0 HD2 LYS A 88 -9.367 19.661 2.145 1.00 4.32 H new ATOM 0 HD3 LYS A 88 -10.420 19.878 0.761 1.00 4.32 H new ATOM 0 HE2 LYS A 88 -12.327 19.569 1.985 1.00 50.34 H new ATOM 0 HE3 LYS A 88 -11.626 18.287 2.954 1.00 50.34 H new ATOM 0 HZ1 LYS A 88 -12.104 20.822 3.792 1.00 64.43 H new ATOM 0 HZ2 LYS A 88 -11.072 19.713 4.558 1.00 64.43 H new ATOM 0 HZ3 LYS A 88 -10.436 20.857 3.477 1.00 64.43 H new ATOM 1364 N VAL A 89 -8.489 17.684 -2.964 1.00 21.12 N ATOM 1365 CA VAL A 89 -8.424 17.798 -4.416 1.00 4.53 C ATOM 1366 C VAL A 89 -7.731 16.587 -5.032 1.00 1.25 C ATOM 1367 O VAL A 89 -8.039 16.186 -6.154 1.00 10.13 O ATOM 1368 CB VAL A 89 -7.677 19.074 -4.845 1.00 72.45 C ATOM 1369 CG1 VAL A 89 -6.207 18.988 -4.467 1.00 11.01 C ATOM 1370 CG2 VAL A 89 -7.839 19.307 -6.340 1.00 53.53 C ATOM 0 H VAL A 89 -8.151 18.505 -2.461 1.00 21.12 H new ATOM 0 HA VAL A 89 -9.452 17.848 -4.776 1.00 4.53 H new ATOM 0 HB VAL A 89 -8.112 19.923 -4.317 1.00 72.45 H new ATOM 0 HG11 VAL A 89 -5.697 19.900 -4.779 1.00 11.01 H new ATOM 0 HG12 VAL A 89 -6.115 18.872 -3.387 1.00 11.01 H new ATOM 0 HG13 VAL A 89 -5.753 18.130 -4.964 1.00 11.01 H new ATOM 0 HG21 VAL A 89 -7.305 20.213 -6.627 1.00 53.53 H new ATOM 0 HG22 VAL A 89 -7.431 18.457 -6.887 1.00 53.53 H new ATOM 0 HG23 VAL A 89 -8.897 19.418 -6.578 1.00 53.53 H new ATOM 1380 N PHE A 90 -6.795 16.007 -4.288 1.00 4.43 N ATOM 1381 CA PHE A 90 -6.058 14.840 -4.760 1.00 51.13 C ATOM 1382 C PHE A 90 -6.905 13.577 -4.644 1.00 64.24 C ATOM 1383 O PHE A 90 -6.897 12.727 -5.534 1.00 0.24 O ATOM 1384 CB PHE A 90 -4.762 14.672 -3.963 1.00 72.12 C ATOM 1385 CG PHE A 90 -3.934 13.499 -4.404 1.00 61.42 C ATOM 1386 CD1 PHE A 90 -3.786 12.392 -3.584 1.00 13.21 C ATOM 1387 CD2 PHE A 90 -3.305 13.503 -5.639 1.00 12.13 C ATOM 1388 CE1 PHE A 90 -3.026 11.311 -3.987 1.00 42.52 C ATOM 1389 CE2 PHE A 90 -2.545 12.424 -6.047 1.00 53.15 C ATOM 1390 CZ PHE A 90 -2.403 11.327 -5.220 1.00 23.22 C ATOM 0 H PHE A 90 -6.529 16.326 -3.356 1.00 4.43 H new ATOM 0 HA PHE A 90 -5.814 14.997 -5.811 1.00 51.13 H new ATOM 0 HB2 PHE A 90 -4.168 15.581 -4.055 1.00 72.12 H new ATOM 0 HB3 PHE A 90 -5.007 14.557 -2.907 1.00 72.12 H new ATOM 0 HD1 PHE A 90 -4.270 12.374 -2.619 1.00 13.21 H new ATOM 0 HD2 PHE A 90 -3.410 14.359 -6.289 1.00 12.13 H new ATOM 0 HE1 PHE A 90 -2.919 10.454 -3.339 1.00 42.52 H new ATOM 0 HE2 PHE A 90 -2.062 12.438 -7.013 1.00 53.15 H new ATOM 0 HZ PHE A 90 -1.807 10.484 -5.536 1.00 23.22 H new ATOM 1400 N ALA A 91 -7.637 13.462 -3.541 1.00 43.51 N ATOM 1401 CA ALA A 91 -8.492 12.305 -3.309 1.00 2.43 C ATOM 1402 C ALA A 91 -9.671 12.289 -4.276 1.00 52.03 C ATOM 1403 O ALA A 91 -10.031 11.242 -4.814 1.00 4.52 O ATOM 1404 CB ALA A 91 -8.988 12.295 -1.870 1.00 23.05 C ATOM 0 H ALA A 91 -7.655 14.156 -2.794 1.00 43.51 H new ATOM 0 HA ALA A 91 -7.900 11.407 -3.485 1.00 2.43 H new ATOM 0 HB1 ALA A 91 -9.626 11.425 -1.711 1.00 23.05 H new ATOM 0 HB2 ALA A 91 -8.136 12.249 -1.192 1.00 23.05 H new ATOM 0 HB3 ALA A 91 -9.558 13.203 -1.675 1.00 23.05 H new ATOM 1410 N VAL A 92 -10.268 13.457 -4.493 1.00 1.40 N ATOM 1411 CA VAL A 92 -11.405 13.577 -5.397 1.00 43.51 C ATOM 1412 C VAL A 92 -10.967 13.452 -6.852 1.00 32.35 C ATOM 1413 O VAL A 92 -11.495 12.632 -7.601 1.00 71.14 O ATOM 1414 CB VAL A 92 -12.135 14.920 -5.205 1.00 31.23 C ATOM 1415 CG1 VAL A 92 -13.428 14.944 -6.004 1.00 71.31 C ATOM 1416 CG2 VAL A 92 -12.405 15.173 -3.729 1.00 43.04 C ATOM 0 H VAL A 92 -9.983 14.333 -4.055 1.00 1.40 H new ATOM 0 HA VAL A 92 -12.088 12.763 -5.156 1.00 43.51 H new ATOM 0 HB VAL A 92 -11.493 15.719 -5.575 1.00 31.23 H new ATOM 0 HG11 VAL A 92 -13.930 15.900 -5.856 1.00 71.31 H new ATOM 0 HG12 VAL A 92 -13.204 14.812 -7.063 1.00 71.31 H new ATOM 0 HG13 VAL A 92 -14.079 14.137 -5.667 1.00 71.31 H new ATOM 0 HG21 VAL A 92 -12.921 16.126 -3.612 1.00 43.04 H new ATOM 0 HG22 VAL A 92 -13.027 14.372 -3.330 1.00 43.04 H new ATOM 0 HG23 VAL A 92 -11.460 15.203 -3.186 1.00 43.04 H new ATOM 1426 N ALA A 93 -9.998 14.272 -7.244 1.00 52.11 N ATOM 1427 CA ALA A 93 -9.486 14.251 -8.609 1.00 72.31 C ATOM 1428 C ALA A 93 -8.624 13.019 -8.854 1.00 44.33 C ATOM 1429 O ALA A 93 -8.228 12.741 -9.985 1.00 54.41 O ATOM 1430 CB ALA A 93 -8.692 15.518 -8.893 1.00 71.32 C ATOM 0 H ALA A 93 -9.552 14.959 -6.636 1.00 52.11 H new ATOM 0 HA ALA A 93 -10.337 14.207 -9.289 1.00 72.31 H new ATOM 0 HB1 ALA A 93 -8.315 15.490 -9.915 1.00 71.32 H new ATOM 0 HB2 ALA A 93 -9.337 16.387 -8.768 1.00 71.32 H new ATOM 0 HB3 ALA A 93 -7.854 15.585 -8.199 1.00 71.32 H new ATOM 1436 N GLY A 94 -8.336 12.281 -7.786 1.00 24.14 N ATOM 1437 CA GLY A 94 -7.522 11.086 -7.906 1.00 63.12 C ATOM 1438 C GLY A 94 -8.334 9.814 -7.766 1.00 63.43 C ATOM 1439 O GLY A 94 -8.631 9.146 -8.758 1.00 64.23 O ATOM 0 H GLY A 94 -8.652 12.490 -6.839 1.00 24.14 H new ATOM 0 HA2 GLY A 94 -7.020 11.088 -8.873 1.00 63.12 H new ATOM 0 HA3 GLY A 94 -6.744 11.102 -7.143 1.00 63.12 H new ATOM 1443 N LEU A 95 -8.694 9.476 -6.533 1.00 24.10 N ATOM 1444 CA LEU A 95 -9.477 8.274 -6.266 1.00 51.23 C ATOM 1445 C LEU A 95 -10.846 8.357 -6.932 1.00 63.00 C ATOM 1446 O LEU A 95 -11.303 7.400 -7.559 1.00 73.43 O ATOM 1447 CB LEU A 95 -9.640 8.072 -4.759 1.00 30.13 C ATOM 1448 CG LEU A 95 -8.430 7.498 -4.023 1.00 13.44 C ATOM 1449 CD1 LEU A 95 -8.022 6.163 -4.626 1.00 63.23 C ATOM 1450 CD2 LEU A 95 -7.268 8.480 -4.061 1.00 13.21 C ATOM 0 H LEU A 95 -8.456 10.017 -5.702 1.00 24.10 H new ATOM 0 HA LEU A 95 -8.942 7.421 -6.684 1.00 51.23 H new ATOM 0 HB2 LEU A 95 -9.891 9.033 -4.309 1.00 30.13 H new ATOM 0 HB3 LEU A 95 -10.489 7.410 -4.591 1.00 30.13 H new ATOM 0 HG LEU A 95 -8.707 7.333 -2.982 1.00 13.44 H new ATOM 0 HD11 LEU A 95 -7.159 5.770 -4.089 1.00 63.23 H new ATOM 0 HD12 LEU A 95 -8.851 5.459 -4.546 1.00 63.23 H new ATOM 0 HD13 LEU A 95 -7.764 6.302 -5.676 1.00 63.23 H new ATOM 0 HD21 LEU A 95 -6.415 8.055 -3.532 1.00 13.21 H new ATOM 0 HD22 LEU A 95 -6.992 8.677 -5.097 1.00 13.21 H new ATOM 0 HD23 LEU A 95 -7.564 9.413 -3.581 1.00 13.21 H new ATOM 1462 N LEU A 96 -11.497 9.507 -6.793 1.00 11.20 N ATOM 1463 CA LEU A 96 -12.815 9.716 -7.382 1.00 72.31 C ATOM 1464 C LEU A 96 -12.701 10.042 -8.868 1.00 14.12 C ATOM 1465 O LEU A 96 -13.707 10.212 -9.556 1.00 1.22 O ATOM 1466 CB LEU A 96 -13.547 10.845 -6.656 1.00 32.54 C ATOM 1467 CG LEU A 96 -14.981 10.543 -6.218 1.00 23.11 C ATOM 1468 CD1 LEU A 96 -15.823 10.112 -7.410 1.00 35.34 C ATOM 1469 CD2 LEU A 96 -14.994 9.472 -5.137 1.00 63.34 C ATOM 0 H LEU A 96 -11.134 10.309 -6.278 1.00 11.20 H new ATOM 0 HA LEU A 96 -13.385 8.793 -7.273 1.00 72.31 H new ATOM 0 HB2 LEU A 96 -12.969 11.117 -5.773 1.00 32.54 H new ATOM 0 HB3 LEU A 96 -13.564 11.718 -7.308 1.00 32.54 H new ATOM 0 HG LEU A 96 -15.414 11.453 -5.804 1.00 23.11 H new ATOM 0 HD11 LEU A 96 -16.840 9.901 -7.080 1.00 35.34 H new ATOM 0 HD12 LEU A 96 -15.840 10.911 -8.151 1.00 35.34 H new ATOM 0 HD13 LEU A 96 -15.392 9.215 -7.854 1.00 35.34 H new ATOM 0 HD21 LEU A 96 -16.022 9.270 -4.837 1.00 63.34 H new ATOM 0 HD22 LEU A 96 -14.543 8.559 -5.524 1.00 63.34 H new ATOM 0 HD23 LEU A 96 -14.426 9.819 -4.274 1.00 63.34 H new ATOM 1481 N ASN A 97 -11.468 10.126 -9.358 1.00 34.35 N ATOM 1482 CA ASN A 97 -11.223 10.431 -10.763 1.00 12.23 C ATOM 1483 C ASN A 97 -11.997 11.672 -11.193 1.00 73.50 C ATOM 1484 O ASN A 97 -12.403 11.793 -12.348 1.00 62.34 O ATOM 1485 CB ASN A 97 -11.616 9.241 -11.640 1.00 33.31 C ATOM 1486 CG ASN A 97 -11.073 7.928 -11.110 1.00 70.21 C ATOM 1487 OD1 ASN A 97 -9.907 7.834 -10.728 1.00 13.52 O ATOM 1488 ND2 ASN A 97 -11.920 6.905 -11.084 1.00 63.11 N ATOM 0 H ASN A 97 -10.624 9.987 -8.803 1.00 34.35 H new ATOM 0 HA ASN A 97 -10.158 10.629 -10.886 1.00 12.23 H new ATOM 0 HB2 ASN A 97 -12.703 9.183 -11.703 1.00 33.31 H new ATOM 0 HB3 ASN A 97 -11.246 9.402 -12.653 1.00 33.31 H new ATOM 0 HD21 ASN A 97 -11.612 5.997 -10.737 1.00 63.11 H new ATOM 0 HD22 ASN A 97 -12.878 7.028 -11.411 1.00 63.11 H new ATOM 1495 N MET A 98 -12.196 12.594 -10.257 1.00 23.43 N ATOM 1496 CA MET A 98 -12.920 13.828 -10.540 1.00 62.03 C ATOM 1497 C MET A 98 -12.090 14.755 -11.422 1.00 11.43 C ATOM 1498 O MET A 98 -10.865 14.640 -11.481 1.00 34.55 O ATOM 1499 CB MET A 98 -13.289 14.540 -9.237 1.00 4.33 C ATOM 1500 CG MET A 98 -14.633 15.246 -9.289 1.00 72.15 C ATOM 1501 SD MET A 98 -14.475 17.016 -9.599 1.00 62.42 S ATOM 1502 CE MET A 98 -16.186 17.463 -9.886 1.00 51.13 C ATOM 0 H MET A 98 -11.866 12.510 -9.296 1.00 23.43 H new ATOM 0 HA MET A 98 -13.834 13.568 -11.074 1.00 62.03 H new ATOM 0 HB2 MET A 98 -13.302 13.812 -8.426 1.00 4.33 H new ATOM 0 HB3 MET A 98 -12.514 15.269 -8.999 1.00 4.33 H new ATOM 0 HG2 MET A 98 -15.245 14.797 -10.071 1.00 72.15 H new ATOM 0 HG3 MET A 98 -15.157 15.091 -8.346 1.00 72.15 H new ATOM 0 HE1 MET A 98 -16.253 18.531 -10.092 1.00 51.13 H new ATOM 0 HE2 MET A 98 -16.570 16.904 -10.739 1.00 51.13 H new ATOM 0 HE3 MET A 98 -16.777 17.227 -9.001 1.00 51.13 H new ATOM 1512 N THR A 99 -12.764 15.674 -12.107 1.00 13.43 N ATOM 1513 CA THR A 99 -12.088 16.621 -12.985 1.00 44.53 C ATOM 1514 C THR A 99 -12.037 18.011 -12.362 1.00 45.43 C ATOM 1515 O THR A 99 -12.377 19.003 -13.006 1.00 12.32 O ATOM 1516 CB THR A 99 -12.785 16.709 -14.356 1.00 0.12 C ATOM 1517 OG1 THR A 99 -12.098 17.644 -15.196 1.00 3.43 O ATOM 1518 CG2 THR A 99 -14.237 17.134 -14.198 1.00 21.41 C ATOM 0 H THR A 99 -13.778 15.782 -12.070 1.00 13.43 H new ATOM 0 HA THR A 99 -11.071 16.253 -13.125 1.00 44.53 H new ATOM 0 HB THR A 99 -12.760 15.721 -14.816 1.00 0.12 H new ATOM 0 HG1 THR A 99 -12.092 18.525 -14.768 1.00 3.43 H new ATOM 0 HG21 THR A 99 -14.709 17.189 -15.179 1.00 21.41 H new ATOM 0 HG22 THR A 99 -14.764 16.405 -13.582 1.00 21.41 H new ATOM 0 HG23 THR A 99 -14.280 18.112 -13.719 1.00 21.41 H new ATOM 1526 N VAL A 100 -11.609 18.075 -11.106 1.00 12.33 N ATOM 1527 CA VAL A 100 -11.511 19.345 -10.396 1.00 62.10 C ATOM 1528 C VAL A 100 -10.728 20.369 -11.208 1.00 75.42 C ATOM 1529 O VAL A 100 -9.708 20.047 -11.815 1.00 52.44 O ATOM 1530 CB VAL A 100 -10.836 19.169 -9.023 1.00 34.22 C ATOM 1531 CG1 VAL A 100 -10.717 20.509 -8.312 1.00 14.10 C ATOM 1532 CG2 VAL A 100 -11.609 18.173 -8.172 1.00 70.04 C ATOM 0 H VAL A 100 -11.324 17.263 -10.559 1.00 12.33 H new ATOM 0 HA VAL A 100 -12.529 19.705 -10.248 1.00 62.10 H new ATOM 0 HB VAL A 100 -9.832 18.776 -9.179 1.00 34.22 H new ATOM 0 HG11 VAL A 100 -10.238 20.366 -7.344 1.00 14.10 H new ATOM 0 HG12 VAL A 100 -10.117 21.190 -8.916 1.00 14.10 H new ATOM 0 HG13 VAL A 100 -11.711 20.933 -8.166 1.00 14.10 H new ATOM 0 HG21 VAL A 100 -11.117 18.061 -7.206 1.00 70.04 H new ATOM 0 HG22 VAL A 100 -12.626 18.535 -8.022 1.00 70.04 H new ATOM 0 HG23 VAL A 100 -11.638 17.208 -8.678 1.00 70.04 H new ATOM 1542 N SER A 101 -11.212 21.608 -11.213 1.00 43.31 N ATOM 1543 CA SER A 101 -10.559 22.681 -11.954 1.00 5.33 C ATOM 1544 C SER A 101 -9.713 23.545 -11.024 1.00 53.44 C ATOM 1545 O SER A 101 -8.686 24.093 -11.429 1.00 23.23 O ATOM 1546 CB SER A 101 -11.601 23.546 -12.665 1.00 61.22 C ATOM 1547 OG SER A 101 -11.834 23.084 -13.984 1.00 3.55 O ATOM 0 H SER A 101 -12.054 21.893 -10.712 1.00 43.31 H new ATOM 0 HA SER A 101 -9.904 22.229 -12.699 1.00 5.33 H new ATOM 0 HB2 SER A 101 -12.534 23.533 -12.102 1.00 61.22 H new ATOM 0 HB3 SER A 101 -11.260 24.581 -12.694 1.00 61.22 H new ATOM 0 HG SER A 101 -12.505 23.653 -14.416 1.00 3.55 H new ATOM 1553 N THR A 102 -10.151 23.664 -9.775 1.00 42.41 N ATOM 1554 CA THR A 102 -9.435 24.462 -8.787 1.00 44.21 C ATOM 1555 C THR A 102 -9.425 23.773 -7.427 1.00 1.15 C ATOM 1556 O THR A 102 -10.420 23.176 -7.015 1.00 51.23 O ATOM 1557 CB THR A 102 -10.060 25.862 -8.636 1.00 62.33 C ATOM 1558 OG1 THR A 102 -11.318 25.766 -7.959 1.00 25.44 O ATOM 1559 CG2 THR A 102 -10.260 26.515 -9.995 1.00 55.43 C ATOM 0 H THR A 102 -10.998 23.218 -9.423 1.00 42.41 H new ATOM 0 HA THR A 102 -8.411 24.566 -9.146 1.00 44.21 H new ATOM 0 HB THR A 102 -9.378 26.479 -8.051 1.00 62.33 H new ATOM 0 HG1 THR A 102 -11.708 26.660 -7.865 1.00 25.44 H new ATOM 0 HG21 THR A 102 -10.702 27.502 -9.863 1.00 55.43 H new ATOM 0 HG22 THR A 102 -9.297 26.613 -10.497 1.00 55.43 H new ATOM 0 HG23 THR A 102 -10.924 25.898 -10.601 1.00 55.43 H new ATOM 1567 N ALA A 103 -8.296 23.862 -6.732 1.00 40.32 N ATOM 1568 CA ALA A 103 -8.157 23.249 -5.417 1.00 70.24 C ATOM 1569 C ALA A 103 -9.305 23.656 -4.499 1.00 42.33 C ATOM 1570 O ALA A 103 -9.752 22.870 -3.664 1.00 61.32 O ATOM 1571 CB ALA A 103 -6.821 23.629 -4.795 1.00 61.14 C ATOM 0 H ALA A 103 -7.464 24.353 -7.058 1.00 40.32 H new ATOM 0 HA ALA A 103 -8.191 22.167 -5.542 1.00 70.24 H new ATOM 0 HB1 ALA A 103 -6.731 23.164 -3.813 1.00 61.14 H new ATOM 0 HB2 ALA A 103 -6.010 23.283 -5.436 1.00 61.14 H new ATOM 0 HB3 ALA A 103 -6.764 24.712 -4.690 1.00 61.14 H new ATOM 1577 N ALA A 104 -9.776 24.889 -4.659 1.00 4.43 N ATOM 1578 CA ALA A 104 -10.872 25.399 -3.845 1.00 11.22 C ATOM 1579 C ALA A 104 -12.154 24.610 -4.093 1.00 12.43 C ATOM 1580 O ALA A 104 -12.761 24.086 -3.159 1.00 61.33 O ATOM 1581 CB ALA A 104 -11.097 26.877 -4.128 1.00 12.12 C ATOM 0 H ALA A 104 -9.415 25.552 -5.345 1.00 4.43 H new ATOM 0 HA ALA A 104 -10.599 25.279 -2.797 1.00 11.22 H new ATOM 0 HB1 ALA A 104 -11.919 27.244 -3.513 1.00 12.12 H new ATOM 0 HB2 ALA A 104 -10.190 27.435 -3.893 1.00 12.12 H new ATOM 0 HB3 ALA A 104 -11.344 27.012 -5.181 1.00 12.12 H new ATOM 1587 N ALA A 105 -12.558 24.530 -5.355 1.00 62.44 N ATOM 1588 CA ALA A 105 -13.767 23.804 -5.726 1.00 74.30 C ATOM 1589 C ALA A 105 -13.745 22.383 -5.173 1.00 15.25 C ATOM 1590 O ALA A 105 -14.774 21.856 -4.749 1.00 54.41 O ATOM 1591 CB ALA A 105 -13.926 23.782 -7.239 1.00 63.12 C ATOM 0 H ALA A 105 -12.066 24.959 -6.139 1.00 62.44 H new ATOM 0 HA ALA A 105 -14.621 24.322 -5.290 1.00 74.30 H new ATOM 0 HB1 ALA A 105 -14.833 23.237 -7.502 1.00 63.12 H new ATOM 0 HB2 ALA A 105 -13.996 24.804 -7.612 1.00 63.12 H new ATOM 0 HB3 ALA A 105 -13.064 23.290 -7.688 1.00 63.12 H new ATOM 1597 N ALA A 106 -12.567 21.769 -5.181 1.00 0.43 N ATOM 1598 CA ALA A 106 -12.412 20.409 -4.678 1.00 55.04 C ATOM 1599 C ALA A 106 -12.756 20.329 -3.195 1.00 11.12 C ATOM 1600 O ALA A 106 -13.589 19.521 -2.785 1.00 50.43 O ATOM 1601 CB ALA A 106 -10.993 19.916 -4.920 1.00 54.41 C ATOM 0 H ALA A 106 -11.706 22.191 -5.530 1.00 0.43 H new ATOM 0 HA ALA A 106 -13.106 19.766 -5.220 1.00 55.04 H new ATOM 0 HB1 ALA A 106 -10.891 18.900 -4.540 1.00 54.41 H new ATOM 0 HB2 ALA A 106 -10.782 19.926 -5.989 1.00 54.41 H new ATOM 0 HB3 ALA A 106 -10.288 20.569 -4.405 1.00 54.41 H new ATOM 1607 N GLU A 107 -12.109 21.171 -2.396 1.00 64.20 N ATOM 1608 CA GLU A 107 -12.347 21.193 -0.957 1.00 32.40 C ATOM 1609 C GLU A 107 -13.815 21.479 -0.653 1.00 63.13 C ATOM 1610 O GLU A 107 -14.423 20.826 0.194 1.00 33.10 O ATOM 1611 CB GLU A 107 -11.462 22.247 -0.287 1.00 45.30 C ATOM 1612 CG GLU A 107 -11.796 22.480 1.177 1.00 64.05 C ATOM 1613 CD GLU A 107 -10.581 22.870 1.997 1.00 70.51 C ATOM 1614 OE1 GLU A 107 -9.534 22.205 1.857 1.00 54.04 O ATOM 1615 OE2 GLU A 107 -10.679 23.839 2.779 1.00 71.14 O ATOM 0 H GLU A 107 -11.417 21.846 -2.720 1.00 64.20 H new ATOM 0 HA GLU A 107 -12.095 20.210 -0.558 1.00 32.40 H new ATOM 0 HB2 GLU A 107 -10.420 21.939 -0.369 1.00 45.30 H new ATOM 0 HB3 GLU A 107 -11.560 23.188 -0.828 1.00 45.30 H new ATOM 0 HG2 GLU A 107 -12.549 23.265 1.254 1.00 64.05 H new ATOM 0 HG3 GLU A 107 -12.236 21.574 1.594 1.00 64.05 H new ATOM 1622 N ASN A 108 -14.378 22.460 -1.351 1.00 72.32 N ATOM 1623 CA ASN A 108 -15.774 22.834 -1.156 1.00 21.23 C ATOM 1624 C ASN A 108 -16.697 21.650 -1.427 1.00 62.23 C ATOM 1625 O ASN A 108 -17.739 21.504 -0.788 1.00 70.03 O ATOM 1626 CB ASN A 108 -16.143 24.004 -2.071 1.00 64.12 C ATOM 1627 CG ASN A 108 -16.143 25.332 -1.339 1.00 65.43 C ATOM 1628 OD1 ASN A 108 -15.353 26.223 -1.648 1.00 21.22 O ATOM 1629 ND2 ASN A 108 -17.035 25.470 -0.364 1.00 51.41 N ATOM 0 H ASN A 108 -13.889 23.010 -2.057 1.00 72.32 H new ATOM 0 HA ASN A 108 -15.901 23.140 -0.118 1.00 21.23 H new ATOM 0 HB2 ASN A 108 -15.438 24.049 -2.901 1.00 64.12 H new ATOM 0 HB3 ASN A 108 -17.129 23.829 -2.501 1.00 64.12 H new ATOM 0 HD21 ASN A 108 -17.084 26.342 0.163 1.00 51.41 H new ATOM 0 HD22 ASN A 108 -17.671 24.704 -0.142 1.00 51.41 H new ATOM 1636 N MET A 109 -16.306 20.808 -2.377 1.00 70.45 N ATOM 1637 CA MET A 109 -17.098 19.635 -2.731 1.00 53.24 C ATOM 1638 C MET A 109 -16.881 18.509 -1.726 1.00 73.12 C ATOM 1639 O MET A 109 -17.830 18.020 -1.114 1.00 44.35 O ATOM 1640 CB MET A 109 -16.737 19.156 -4.139 1.00 61.23 C ATOM 1641 CG MET A 109 -17.938 18.708 -4.955 1.00 4.30 C ATOM 1642 SD MET A 109 -17.680 17.111 -5.753 1.00 12.21 S ATOM 1643 CE MET A 109 -17.476 16.048 -4.325 1.00 74.33 C ATOM 0 H MET A 109 -15.446 20.915 -2.916 1.00 70.45 H new ATOM 0 HA MET A 109 -18.150 19.918 -2.710 1.00 53.24 H new ATOM 0 HB2 MET A 109 -16.228 19.962 -4.669 1.00 61.23 H new ATOM 0 HB3 MET A 109 -16.031 18.329 -4.063 1.00 61.23 H new ATOM 0 HG2 MET A 109 -18.812 18.648 -4.306 1.00 4.30 H new ATOM 0 HG3 MET A 109 -18.156 19.458 -5.715 1.00 4.30 H new ATOM 0 HE1 MET A 109 -17.798 15.037 -4.575 1.00 74.33 H new ATOM 0 HE2 MET A 109 -16.427 16.032 -4.030 1.00 74.33 H new ATOM 0 HE3 MET A 109 -18.079 16.427 -3.500 1.00 74.33 H new ATOM 1653 N TYR A 110 -15.627 18.102 -1.563 1.00 12.04 N ATOM 1654 CA TYR A 110 -15.287 17.031 -0.634 1.00 15.03 C ATOM 1655 C TYR A 110 -15.870 17.303 0.750 1.00 74.30 C ATOM 1656 O TYR A 110 -16.192 16.377 1.494 1.00 62.52 O ATOM 1657 CB TYR A 110 -13.768 16.875 -0.537 1.00 72.41 C ATOM 1658 CG TYR A 110 -13.332 15.593 0.136 1.00 62.34 C ATOM 1659 CD1 TYR A 110 -12.924 15.586 1.464 1.00 24.54 C ATOM 1660 CD2 TYR A 110 -13.328 14.389 -0.556 1.00 43.11 C ATOM 1661 CE1 TYR A 110 -12.525 14.418 2.083 1.00 50.11 C ATOM 1662 CE2 TYR A 110 -12.932 13.215 0.055 1.00 51.22 C ATOM 1663 CZ TYR A 110 -12.531 13.234 1.374 1.00 1.01 C ATOM 1664 OH TYR A 110 -12.135 12.068 1.986 1.00 51.33 O ATOM 0 H TYR A 110 -14.830 18.497 -2.062 1.00 12.04 H new ATOM 0 HA TYR A 110 -15.718 16.105 -1.014 1.00 15.03 H new ATOM 0 HB2 TYR A 110 -13.343 16.912 -1.540 1.00 72.41 H new ATOM 0 HB3 TYR A 110 -13.359 17.722 0.014 1.00 72.41 H new ATOM 0 HD1 TYR A 110 -12.919 16.511 2.022 1.00 24.54 H new ATOM 0 HD2 TYR A 110 -13.640 14.370 -1.590 1.00 43.11 H new ATOM 0 HE1 TYR A 110 -12.210 14.431 3.116 1.00 50.11 H new ATOM 0 HE2 TYR A 110 -12.937 12.287 -0.498 1.00 51.22 H new ATOM 0 HH TYR A 110 -12.199 11.326 1.349 1.00 51.33 H new ATOM 1674 N SER A 111 -16.003 18.583 1.088 1.00 41.34 N ATOM 1675 CA SER A 111 -16.545 18.979 2.382 1.00 53.50 C ATOM 1676 C SER A 111 -18.065 19.082 2.326 1.00 21.53 C ATOM 1677 O SER A 111 -18.754 18.791 3.304 1.00 14.42 O ATOM 1678 CB SER A 111 -15.947 20.318 2.820 1.00 51.11 C ATOM 1679 OG SER A 111 -16.564 20.788 4.006 1.00 64.03 O ATOM 0 H SER A 111 -15.743 19.362 0.483 1.00 41.34 H new ATOM 0 HA SER A 111 -16.277 18.213 3.110 1.00 53.50 H new ATOM 0 HB2 SER A 111 -14.875 20.205 2.984 1.00 51.11 H new ATOM 0 HB3 SER A 111 -16.072 21.053 2.025 1.00 51.11 H new ATOM 0 HG SER A 111 -16.164 21.644 4.266 1.00 64.03 H new ATOM 1685 N GLN A 112 -18.583 19.499 1.175 1.00 41.41 N ATOM 1686 CA GLN A 112 -20.022 19.641 0.991 1.00 71.33 C ATOM 1687 C GLN A 112 -20.723 18.292 1.116 1.00 12.35 C ATOM 1688 O GLN A 112 -21.861 18.214 1.579 1.00 1.34 O ATOM 1689 CB GLN A 112 -20.325 20.260 -0.375 1.00 14.21 C ATOM 1690 CG GLN A 112 -21.799 20.240 -0.739 1.00 23.51 C ATOM 1691 CD GLN A 112 -22.218 18.944 -1.405 1.00 50.24 C ATOM 1692 OE1 GLN A 112 -21.377 18.156 -1.840 1.00 73.11 O ATOM 1693 NE2 GLN A 112 -23.523 18.715 -1.490 1.00 32.40 N ATOM 0 H GLN A 112 -18.027 19.744 0.356 1.00 41.41 H new ATOM 0 HA GLN A 112 -20.399 20.300 1.773 1.00 71.33 H new ATOM 0 HB2 GLN A 112 -19.971 21.291 -0.384 1.00 14.21 H new ATOM 0 HB3 GLN A 112 -19.763 19.724 -1.140 1.00 14.21 H new ATOM 0 HG2 GLN A 112 -22.394 20.390 0.162 1.00 23.51 H new ATOM 0 HG3 GLN A 112 -22.016 21.074 -1.407 1.00 23.51 H new ATOM 0 HE21 GLN A 112 -24.185 19.395 -1.116 1.00 32.40 H new ATOM 0 HE22 GLN A 112 -23.863 17.859 -1.929 1.00 32.40 H new ATOM 1702 N MET A 113 -20.035 17.233 0.702 1.00 32.14 N ATOM 1703 CA MET A 113 -20.592 15.887 0.769 1.00 23.33 C ATOM 1704 C MET A 113 -20.442 15.305 2.171 1.00 13.13 C ATOM 1705 O MET A 113 -21.086 14.316 2.517 1.00 22.12 O ATOM 1706 CB MET A 113 -19.906 14.976 -0.249 1.00 40.43 C ATOM 1707 CG MET A 113 -20.845 14.442 -1.319 1.00 35.44 C ATOM 1708 SD MET A 113 -20.799 12.645 -1.451 1.00 4.31 S ATOM 1709 CE MET A 113 -19.687 12.435 -2.839 1.00 54.21 C ATOM 0 H MET A 113 -19.092 17.281 0.317 1.00 32.14 H new ATOM 0 HA MET A 113 -21.654 15.949 0.532 1.00 23.33 H new ATOM 0 HB2 MET A 113 -19.097 15.526 -0.729 1.00 40.43 H new ATOM 0 HB3 MET A 113 -19.452 14.136 0.276 1.00 40.43 H new ATOM 0 HG2 MET A 113 -21.863 14.760 -1.094 1.00 35.44 H new ATOM 0 HG3 MET A 113 -20.579 14.880 -2.281 1.00 35.44 H new ATOM 0 HE1 MET A 113 -19.431 11.381 -2.944 1.00 54.21 H new ATOM 0 HE2 MET A 113 -20.173 12.783 -3.750 1.00 54.21 H new ATOM 0 HE3 MET A 113 -18.779 13.013 -2.668 1.00 54.21 H new ATOM 1719 N GLY A 114 -19.584 15.927 2.976 1.00 25.43 N ATOM 1720 CA GLY A 114 -19.364 15.457 4.332 1.00 43.25 C ATOM 1721 C GLY A 114 -18.188 14.506 4.431 1.00 52.40 C ATOM 1722 O GLY A 114 -18.156 13.633 5.300 1.00 64.02 O ATOM 0 H GLY A 114 -19.038 16.747 2.713 1.00 25.43 H new ATOM 0 HA2 GLY A 114 -19.193 16.312 4.986 1.00 43.25 H new ATOM 0 HA3 GLY A 114 -20.264 14.957 4.690 1.00 43.25 H new ATOM 1726 N LEU A 115 -17.218 14.672 3.539 1.00 52.45 N ATOM 1727 CA LEU A 115 -16.033 13.821 3.528 1.00 11.45 C ATOM 1728 C LEU A 115 -14.857 14.515 4.210 1.00 45.11 C ATOM 1729 O LEU A 115 -13.965 13.860 4.749 1.00 24.21 O ATOM 1730 CB LEU A 115 -15.659 13.450 2.093 1.00 74.25 C ATOM 1731 CG LEU A 115 -16.813 13.012 1.190 1.00 43.25 C ATOM 1732 CD1 LEU A 115 -16.899 13.904 -0.039 1.00 64.11 C ATOM 1733 CD2 LEU A 115 -16.647 11.555 0.783 1.00 62.11 C ATOM 0 H LEU A 115 -17.229 15.389 2.813 1.00 52.45 H new ATOM 0 HA LEU A 115 -16.265 12.911 4.082 1.00 11.45 H new ATOM 0 HB2 LEU A 115 -15.170 14.309 1.633 1.00 74.25 H new ATOM 0 HB3 LEU A 115 -14.925 12.645 2.127 1.00 74.25 H new ATOM 0 HG LEU A 115 -17.744 13.109 1.749 1.00 43.25 H new ATOM 0 HD11 LEU A 115 -17.726 13.577 -0.669 1.00 64.11 H new ATOM 0 HD12 LEU A 115 -17.065 14.936 0.271 1.00 64.11 H new ATOM 0 HD13 LEU A 115 -15.967 13.840 -0.601 1.00 64.11 H new ATOM 0 HD21 LEU A 115 -17.477 11.260 0.141 1.00 62.11 H new ATOM 0 HD22 LEU A 115 -15.708 11.433 0.242 1.00 62.11 H new ATOM 0 HD23 LEU A 115 -16.637 10.927 1.674 1.00 62.11 H new ATOM 1745 N ASP A 116 -14.865 15.842 4.182 1.00 54.35 N ATOM 1746 CA ASP A 116 -13.801 16.625 4.800 1.00 72.43 C ATOM 1747 C ASP A 116 -13.811 16.456 6.316 1.00 61.21 C ATOM 1748 O ASP A 116 -12.761 16.457 6.959 1.00 32.33 O ATOM 1749 CB ASP A 116 -13.951 18.104 4.439 1.00 64.33 C ATOM 1750 CG ASP A 116 -14.937 18.822 5.338 1.00 20.15 C ATOM 1751 OD1 ASP A 116 -16.106 18.387 5.406 1.00 64.10 O ATOM 1752 OD2 ASP A 116 -14.540 19.820 5.977 1.00 51.13 O ATOM 0 H ASP A 116 -15.596 16.399 3.738 1.00 54.35 H new ATOM 0 HA ASP A 116 -12.848 16.260 4.418 1.00 72.43 H new ATOM 0 HB2 ASP A 116 -12.979 18.592 4.508 1.00 64.33 H new ATOM 0 HB3 ASP A 116 -14.279 18.191 3.403 1.00 64.33 H new ATOM 1757 N THR A 117 -15.005 16.311 6.882 1.00 64.14 N ATOM 1758 CA THR A 117 -15.153 16.143 8.322 1.00 11.42 C ATOM 1759 C THR A 117 -14.411 17.235 9.082 1.00 61.22 C ATOM 1760 O THR A 117 -13.243 17.074 9.438 1.00 44.20 O ATOM 1761 CB THR A 117 -14.633 14.769 8.783 1.00 3.53 C ATOM 1762 OG1 THR A 117 -14.855 13.791 7.760 1.00 22.32 O ATOM 1763 CG2 THR A 117 -15.323 14.331 10.066 1.00 13.34 C ATOM 0 H THR A 117 -15.884 16.307 6.365 1.00 64.14 H new ATOM 0 HA THR A 117 -16.219 16.212 8.540 1.00 11.42 H new ATOM 0 HB THR A 117 -13.564 14.857 8.975 1.00 3.53 H new ATOM 0 HG1 THR A 117 -14.520 12.921 8.061 1.00 22.32 H new ATOM 0 HG21 THR A 117 -14.939 13.358 10.372 1.00 13.34 H new ATOM 0 HG22 THR A 117 -15.128 15.061 10.852 1.00 13.34 H new ATOM 0 HG23 THR A 117 -16.397 14.260 9.895 1.00 13.34 H new ATOM 1771 N ARG A 118 -15.095 18.348 9.328 1.00 24.10 N ATOM 1772 CA ARG A 118 -14.499 19.469 10.047 1.00 44.00 C ATOM 1773 C ARG A 118 -14.737 19.339 11.548 1.00 71.01 C ATOM 1774 O ARG A 118 -15.626 18.618 12.001 1.00 5.23 O ATOM 1775 CB ARG A 118 -15.077 20.791 9.540 1.00 74.15 C ATOM 1776 CG ARG A 118 -14.127 21.565 8.640 1.00 42.23 C ATOM 1777 CD ARG A 118 -14.080 23.038 9.016 1.00 11.24 C ATOM 1778 NE ARG A 118 -14.069 23.903 7.840 1.00 65.31 N ATOM 1779 CZ ARG A 118 -13.939 25.224 7.900 1.00 42.31 C ATOM 1780 NH1 ARG A 118 -13.808 25.828 9.073 1.00 22.20 N ATOM 1781 NH2 ARG A 118 -13.940 25.943 6.785 1.00 55.23 N ATOM 0 H ARG A 118 -16.062 18.498 9.040 1.00 24.10 H new ATOM 0 HA ARG A 118 -13.424 19.457 9.865 1.00 44.00 H new ATOM 0 HB2 ARG A 118 -15.998 20.589 8.994 1.00 74.15 H new ATOM 0 HB3 ARG A 118 -15.343 21.413 10.395 1.00 74.15 H new ATOM 0 HG2 ARG A 118 -13.127 21.138 8.712 1.00 42.23 H new ATOM 0 HG3 ARG A 118 -14.443 21.463 7.602 1.00 42.23 H new ATOM 0 HD2 ARG A 118 -14.942 23.281 9.637 1.00 11.24 H new ATOM 0 HD3 ARG A 118 -13.191 23.231 9.616 1.00 11.24 H new ATOM 0 HE ARG A 118 -14.166 23.469 6.922 1.00 65.31 H new ATOM 0 HH11 ARG A 118 -13.807 25.278 9.932 1.00 22.20 H new ATOM 0 HH12 ARG A 118 -13.708 26.842 9.116 1.00 22.20 H new ATOM 0 HH21 ARG A 118 -14.041 25.482 5.881 1.00 55.23 H new ATOM 0 HH22 ARG A 118 -13.840 26.957 6.832 1.00 55.23 H new ATOM 1795 N PRO A 119 -13.924 20.054 12.340 1.00 63.31 N ATOM 1796 CA PRO A 119 -14.026 20.036 13.802 1.00 75.13 C ATOM 1797 C PRO A 119 -15.287 20.732 14.304 1.00 75.22 C ATOM 1798 O PRO A 119 -16.363 20.580 13.725 1.00 72.31 O ATOM 1799 CB PRO A 119 -12.779 20.800 14.254 1.00 51.25 C ATOM 1800 CG PRO A 119 -12.442 21.689 13.107 1.00 63.12 C ATOM 1801 CD PRO A 119 -12.843 20.935 11.868 1.00 34.04 C ATOM 0 HA PRO A 119 -14.086 19.021 14.194 1.00 75.13 H new ATOM 0 HB2 PRO A 119 -12.974 21.377 15.158 1.00 51.25 H new ATOM 0 HB3 PRO A 119 -11.959 20.119 14.482 1.00 51.25 H new ATOM 0 HG2 PRO A 119 -12.976 22.637 13.177 1.00 63.12 H new ATOM 0 HG3 PRO A 119 -11.378 21.923 13.094 1.00 63.12 H new ATOM 0 HD2 PRO A 119 -13.187 21.607 11.082 1.00 34.04 H new ATOM 0 HD3 PRO A 119 -12.010 20.364 11.457 1.00 34.04 H new TER 1809 PRO A 119