USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1092 hydrogens (44 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 65 GLN : amide:sc=-0.00795 X(o=-0.008,f=-0.043) USER MOD Set 1.2: A 108 GLN : amide:sc= 0 X(o=-0.008,f=-0.008) USER MOD Set 2.1: A 29 TYR OH : rot 168:sc= 1.01 USER MOD Set 2.2: A 97 THR OG1 : rot 50:sc= 0.146 USER MOD Single : A 6 SER OG : rot 68:sc= 1.21 USER MOD Single : A 9 SER OG : rot 180:sc= -0.524 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 163:sc=-0.00177 (180deg=-0.167) USER MOD Single : A 27 LYS NZ :NH3+ 147:sc= 0.0866 (180deg=-0.00716) USER MOD Single : A 28 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.66) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -2.9! C(o=-2.9!,f=-8.8!) USER MOD Single : A 38 SER OG : rot 180:sc= -1.03 USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 53 THR OG1 : rot -37:sc= 1.56 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.296 USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 67 SER OG : rot -50:sc= 0.137 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -134:sc= 0.714 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -2.97! C(o=-3!,f=-5.8!) USER MOD Single : A 81 THR OG1 : rot -138:sc= -1.44 USER MOD Single : A 86 TYR OH : rot 180:sc= -0.406 USER MOD Single : A 87 CYS SG : rot 73:sc= -1.25 USER MOD Single : A 89 HIS : no HD1:sc= -1.41! C(o=-0.79!,f=-4.6!) USER MOD Single : A 90 GLN : amide:sc= -0.356 X(o=-0.36,f=-0.071) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.0051) USER MOD Single : A 117 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.254 X(o=-0.25,f=-0.042) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0.045 USER MOD Single : A 130 GLN : amide:sc= -0.0268 X(o=-0.027,f=-0.027) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PIO O2 : rot -159:sc= 0.0756 USER MOD Single : A 300 PIO O3 : rot -139:sc= 1.04 USER MOD Single : A 300 PIO O6 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 3.041 -3.670 3.593 1.00 13.00 N ATOM 2 CA GLY A 2 2.586 -4.023 4.925 1.00 45.03 C ATOM 3 C GLY A 2 3.459 -3.432 6.013 1.00 74.13 C ATOM 4 O GLY A 2 4.023 -4.159 6.831 1.00 11.13 O ATOM 0 HA2 GLY A 2 1.561 -3.677 5.059 1.00 45.03 H new ATOM 0 HA3 GLY A 2 2.572 -5.108 5.025 1.00 45.03 H new ATOM 8 N ALA A 3 3.573 -2.107 6.023 1.00 33.45 N ATOM 9 CA ALA A 3 4.385 -1.418 7.019 1.00 12.25 C ATOM 10 C ALA A 3 5.808 -1.964 7.041 1.00 30.44 C ATOM 11 O ALA A 3 6.207 -2.647 7.985 1.00 53.55 O ATOM 12 CB ALA A 3 3.748 -1.542 8.395 1.00 33.12 C ATOM 0 H ALA A 3 3.114 -1.490 5.353 1.00 33.45 H new ATOM 0 HA ALA A 3 4.434 -0.364 6.746 1.00 12.25 H new ATOM 0 HB1 ALA A 3 4.364 -1.023 9.129 1.00 33.12 H new ATOM 0 HB2 ALA A 3 2.753 -1.097 8.377 1.00 33.12 H new ATOM 0 HB3 ALA A 3 3.670 -2.595 8.666 1.00 33.12 H new ATOM 18 N ARG A 4 6.570 -1.661 5.995 1.00 63.51 N ATOM 19 CA ARG A 4 7.949 -2.125 5.894 1.00 13.31 C ATOM 20 C ARG A 4 8.920 -0.947 5.907 1.00 60.44 C ATOM 21 O ARG A 4 8.804 -0.026 5.100 1.00 12.11 O ATOM 22 CB ARG A 4 8.143 -2.945 4.617 1.00 44.45 C ATOM 23 CG ARG A 4 8.426 -4.416 4.876 1.00 34.11 C ATOM 24 CD ARG A 4 8.438 -5.216 3.583 1.00 21.22 C ATOM 25 NE ARG A 4 7.089 -5.548 3.133 1.00 64.31 N ATOM 26 CZ ARG A 4 6.834 -6.339 2.096 1.00 64.14 C ATOM 27 NH1 ARG A 4 7.831 -6.875 1.406 1.00 60.10 N ATOM 28 NH2 ARG A 4 5.580 -6.594 1.747 1.00 45.33 N ATOM 0 H ARG A 4 6.256 -1.096 5.206 1.00 63.51 H new ATOM 0 HA ARG A 4 8.157 -2.757 6.757 1.00 13.31 H new ATOM 0 HB2 ARG A 4 7.248 -2.859 4.000 1.00 44.45 H new ATOM 0 HB3 ARG A 4 8.967 -2.520 4.044 1.00 44.45 H new ATOM 0 HG2 ARG A 4 9.388 -4.520 5.379 1.00 34.11 H new ATOM 0 HG3 ARG A 4 7.670 -4.820 5.549 1.00 34.11 H new ATOM 0 HD2 ARG A 4 8.948 -4.645 2.808 1.00 21.22 H new ATOM 0 HD3 ARG A 4 9.007 -6.134 3.730 1.00 21.22 H new ATOM 0 HE ARG A 4 6.299 -5.151 3.642 1.00 64.31 H new ATOM 0 HH11 ARG A 4 8.797 -6.681 1.671 1.00 60.10 H new ATOM 0 HH12 ARG A 4 7.632 -7.482 0.611 1.00 60.10 H new ATOM 0 HH21 ARG A 4 4.810 -6.183 2.275 1.00 45.33 H new ATOM 0 HH22 ARG A 4 5.386 -7.201 0.951 1.00 45.33 H new ATOM 42 N ALA A 5 9.877 -0.986 6.828 1.00 41.43 N ATOM 43 CA ALA A 5 10.868 0.076 6.946 1.00 25.10 C ATOM 44 C ALA A 5 11.673 0.219 5.658 1.00 71.22 C ATOM 45 O ALA A 5 11.702 1.289 5.049 1.00 63.21 O ATOM 46 CB ALA A 5 11.794 -0.194 8.122 1.00 73.04 C ATOM 0 H ALA A 5 9.987 -1.742 7.504 1.00 41.43 H new ATOM 0 HA ALA A 5 10.341 1.014 7.122 1.00 25.10 H new ATOM 0 HB1 ALA A 5 12.529 0.607 8.198 1.00 73.04 H new ATOM 0 HB2 ALA A 5 11.211 -0.240 9.042 1.00 73.04 H new ATOM 0 HB3 ALA A 5 12.307 -1.144 7.971 1.00 73.04 H new ATOM 52 N SER A 6 12.326 -0.864 5.250 1.00 60.21 N ATOM 53 CA SER A 6 13.135 -0.857 4.037 1.00 72.04 C ATOM 54 C SER A 6 13.759 -2.228 3.792 1.00 3.11 C ATOM 55 O SER A 6 13.327 -2.970 2.910 1.00 1.43 O ATOM 56 CB SER A 6 14.233 0.203 4.138 1.00 54.30 C ATOM 57 OG SER A 6 13.821 1.421 3.541 1.00 33.52 O ATOM 0 H SER A 6 12.311 -1.758 5.742 1.00 60.21 H new ATOM 0 HA SER A 6 12.483 -0.618 3.197 1.00 72.04 H new ATOM 0 HB2 SER A 6 14.483 0.374 5.185 1.00 54.30 H new ATOM 0 HB3 SER A 6 15.138 -0.158 3.649 1.00 54.30 H new ATOM 0 HG SER A 6 13.099 1.817 4.071 1.00 33.52 H new ATOM 63 N VAL A 7 14.777 -2.558 4.581 1.00 0.03 N ATOM 64 CA VAL A 7 15.460 -3.839 4.451 1.00 22.22 C ATOM 65 C VAL A 7 14.835 -4.890 5.363 1.00 14.41 C ATOM 66 O VAL A 7 14.378 -5.936 4.900 1.00 60.02 O ATOM 67 CB VAL A 7 16.958 -3.713 4.784 1.00 33.31 C ATOM 68 CG1 VAL A 7 17.688 -5.009 4.465 1.00 12.44 C ATOM 69 CG2 VAL A 7 17.574 -2.544 4.030 1.00 21.13 C ATOM 0 H VAL A 7 15.146 -1.956 5.317 1.00 0.03 H new ATOM 0 HA VAL A 7 15.351 -4.151 3.412 1.00 22.22 H new ATOM 0 HB VAL A 7 17.060 -3.521 5.852 1.00 33.31 H new ATOM 0 HG11 VAL A 7 18.745 -4.900 4.707 1.00 12.44 H new ATOM 0 HG12 VAL A 7 17.262 -5.821 5.055 1.00 12.44 H new ATOM 0 HG13 VAL A 7 17.580 -5.236 3.404 1.00 12.44 H new ATOM 0 HG21 VAL A 7 18.633 -2.469 4.277 1.00 21.13 H new ATOM 0 HG22 VAL A 7 17.462 -2.703 2.958 1.00 21.13 H new ATOM 0 HG23 VAL A 7 17.069 -1.621 4.315 1.00 21.13 H new ATOM 79 N LEU A 8 14.817 -4.604 6.660 1.00 0.00 N ATOM 80 CA LEU A 8 14.246 -5.524 7.638 1.00 32.21 C ATOM 81 C LEU A 8 13.051 -4.894 8.346 1.00 34.13 C ATOM 82 O LEU A 8 13.151 -3.800 8.900 1.00 14.31 O ATOM 83 CB LEU A 8 15.306 -5.929 8.664 1.00 62.34 C ATOM 84 CG LEU A 8 16.476 -6.757 8.131 1.00 54.22 C ATOM 85 CD1 LEU A 8 17.527 -6.955 9.212 1.00 62.42 C ATOM 86 CD2 LEU A 8 15.986 -8.099 7.608 1.00 52.20 C ATOM 0 H LEU A 8 15.191 -3.743 7.059 1.00 0.00 H new ATOM 0 HA LEU A 8 13.903 -6.413 7.108 1.00 32.21 H new ATOM 0 HB2 LEU A 8 15.706 -5.023 9.120 1.00 62.34 H new ATOM 0 HB3 LEU A 8 14.817 -6.496 9.457 1.00 62.34 H new ATOM 0 HG LEU A 8 16.933 -6.213 7.304 1.00 54.22 H new ATOM 0 HD11 LEU A 8 18.352 -7.546 8.814 1.00 62.42 H new ATOM 0 HD12 LEU A 8 17.901 -5.984 9.538 1.00 62.42 H new ATOM 0 HD13 LEU A 8 17.083 -7.476 10.060 1.00 62.42 H new ATOM 0 HD21 LEU A 8 16.832 -8.674 7.233 1.00 52.20 H new ATOM 0 HD22 LEU A 8 15.502 -8.649 8.415 1.00 52.20 H new ATOM 0 HD23 LEU A 8 15.272 -7.936 6.801 1.00 52.20 H new ATOM 98 N SER A 9 11.922 -5.594 8.325 1.00 42.34 N ATOM 99 CA SER A 9 10.707 -5.103 8.964 1.00 1.44 C ATOM 100 C SER A 9 10.811 -5.205 10.482 1.00 73.13 C ATOM 101 O SER A 9 11.868 -5.529 11.023 1.00 44.01 O ATOM 102 CB SER A 9 9.491 -5.892 8.471 1.00 34.32 C ATOM 103 OG SER A 9 9.470 -7.195 9.026 1.00 62.13 O ATOM 0 H SER A 9 11.823 -6.503 7.873 1.00 42.34 H new ATOM 0 HA SER A 9 10.584 -4.054 8.696 1.00 1.44 H new ATOM 0 HB2 SER A 9 8.577 -5.363 8.741 1.00 34.32 H new ATOM 0 HB3 SER A 9 9.512 -5.957 7.383 1.00 34.32 H new ATOM 0 HG SER A 9 8.683 -7.678 8.697 1.00 62.13 H new ATOM 109 N GLY A 10 9.705 -4.925 11.166 1.00 24.01 N ATOM 110 CA GLY A 10 9.692 -4.990 12.616 1.00 32.02 C ATOM 111 C GLY A 10 10.162 -6.332 13.140 1.00 24.24 C ATOM 112 O GLY A 10 11.030 -6.399 14.009 1.00 34.10 O ATOM 0 H GLY A 10 8.818 -4.654 10.741 1.00 24.01 H new ATOM 0 HA2 GLY A 10 10.330 -4.203 13.018 1.00 32.02 H new ATOM 0 HA3 GLY A 10 8.682 -4.796 12.976 1.00 32.02 H new ATOM 116 N GLY A 11 9.586 -7.408 12.610 1.00 54.32 N ATOM 117 CA GLY A 11 9.962 -8.741 13.043 1.00 74.32 C ATOM 118 C GLY A 11 11.385 -9.095 12.658 1.00 23.53 C ATOM 119 O GLY A 11 12.143 -9.620 13.473 1.00 51.33 O ATOM 0 H GLY A 11 8.866 -7.379 11.888 1.00 54.32 H new ATOM 0 HA2 GLY A 11 9.853 -8.813 14.125 1.00 74.32 H new ATOM 0 HA3 GLY A 11 9.279 -9.468 12.605 1.00 74.32 H new ATOM 123 N GLU A 12 11.747 -8.811 11.411 1.00 61.32 N ATOM 124 CA GLU A 12 13.087 -9.106 10.919 1.00 62.51 C ATOM 125 C GLU A 12 14.139 -8.324 11.701 1.00 20.11 C ATOM 126 O GLU A 12 15.277 -8.769 11.851 1.00 43.11 O ATOM 127 CB GLU A 12 13.193 -8.775 9.429 1.00 62.23 C ATOM 128 CG GLU A 12 12.042 -9.322 8.602 1.00 30.25 C ATOM 129 CD GLU A 12 12.239 -9.102 7.113 1.00 44.54 C ATOM 130 OE1 GLU A 12 11.855 -8.021 6.619 1.00 61.33 O ATOM 131 OE2 GLU A 12 12.773 -10.010 6.444 1.00 61.24 O ATOM 0 H GLU A 12 11.131 -8.377 10.723 1.00 61.32 H new ATOM 0 HA GLU A 12 13.271 -10.171 11.061 1.00 62.51 H new ATOM 0 HB2 GLU A 12 13.235 -7.693 9.308 1.00 62.23 H new ATOM 0 HB3 GLU A 12 14.130 -9.175 9.042 1.00 62.23 H new ATOM 0 HG2 GLU A 12 11.934 -10.389 8.797 1.00 30.25 H new ATOM 0 HG3 GLU A 12 11.114 -8.845 8.917 1.00 30.25 H new ATOM 138 N LEU A 13 13.749 -7.155 12.198 1.00 33.14 N ATOM 139 CA LEU A 13 14.657 -6.308 12.964 1.00 41.22 C ATOM 140 C LEU A 13 15.033 -6.970 14.286 1.00 41.12 C ATOM 141 O LEU A 13 16.212 -7.083 14.622 1.00 24.02 O ATOM 142 CB LEU A 13 14.014 -4.945 13.228 1.00 13.12 C ATOM 143 CG LEU A 13 14.961 -3.834 13.683 1.00 61.35 C ATOM 144 CD1 LEU A 13 15.948 -3.487 12.580 1.00 24.40 C ATOM 145 CD2 LEU A 13 14.173 -2.601 14.103 1.00 10.13 C ATOM 0 H LEU A 13 12.810 -6.772 12.084 1.00 33.14 H new ATOM 0 HA LEU A 13 15.565 -6.167 12.378 1.00 41.22 H new ATOM 0 HB2 LEU A 13 13.514 -4.618 12.316 1.00 13.12 H new ATOM 0 HB3 LEU A 13 13.242 -5.071 13.987 1.00 13.12 H new ATOM 0 HG LEU A 13 15.523 -4.193 14.545 1.00 61.35 H new ATOM 0 HD11 LEU A 13 16.613 -2.695 12.923 1.00 24.40 H new ATOM 0 HD12 LEU A 13 16.535 -4.369 12.327 1.00 24.40 H new ATOM 0 HD13 LEU A 13 15.404 -3.148 11.698 1.00 24.40 H new ATOM 0 HD21 LEU A 13 14.863 -1.820 14.424 1.00 10.13 H new ATOM 0 HD22 LEU A 13 13.584 -2.241 13.259 1.00 10.13 H new ATOM 0 HD23 LEU A 13 13.507 -2.858 14.927 1.00 10.13 H new ATOM 157 N ASP A 14 14.024 -7.407 15.031 1.00 22.13 N ATOM 158 CA ASP A 14 14.249 -8.061 16.315 1.00 4.14 C ATOM 159 C ASP A 14 15.245 -9.208 16.173 1.00 54.43 C ATOM 160 O ASP A 14 16.225 -9.287 16.914 1.00 74.33 O ATOM 161 CB ASP A 14 12.928 -8.584 16.882 1.00 61.32 C ATOM 162 CG ASP A 14 13.023 -8.915 18.359 1.00 53.14 C ATOM 163 OD1 ASP A 14 14.128 -8.783 18.926 1.00 21.12 O ATOM 164 OD2 ASP A 14 11.992 -9.304 18.948 1.00 14.13 O ATOM 0 H ASP A 14 13.042 -7.320 14.768 1.00 22.13 H new ATOM 0 HA ASP A 14 14.665 -7.325 17.003 1.00 4.14 H new ATOM 0 HB2 ASP A 14 12.149 -7.837 16.729 1.00 61.32 H new ATOM 0 HB3 ASP A 14 12.627 -9.475 16.331 1.00 61.32 H new ATOM 169 N LYS A 15 14.987 -10.095 15.219 1.00 34.24 N ATOM 170 CA LYS A 15 15.861 -11.237 14.978 1.00 60.23 C ATOM 171 C LYS A 15 17.245 -10.779 14.527 1.00 13.33 C ATOM 172 O LYS A 15 18.261 -11.317 14.967 1.00 52.24 O ATOM 173 CB LYS A 15 15.249 -12.161 13.924 1.00 25.10 C ATOM 174 CG LYS A 15 14.236 -13.142 14.488 1.00 53.42 C ATOM 175 CD LYS A 15 14.915 -14.334 15.140 1.00 15.24 C ATOM 176 CE LYS A 15 14.344 -14.616 16.520 1.00 43.11 C ATOM 177 NZ LYS A 15 15.026 -15.765 17.179 1.00 55.24 N ATOM 0 H LYS A 15 14.179 -10.045 14.599 1.00 34.24 H new ATOM 0 HA LYS A 15 15.967 -11.785 15.914 1.00 60.23 H new ATOM 0 HB2 LYS A 15 14.767 -11.554 13.158 1.00 25.10 H new ATOM 0 HB3 LYS A 15 16.047 -12.718 13.434 1.00 25.10 H new ATOM 0 HG2 LYS A 15 13.607 -12.636 15.220 1.00 53.42 H new ATOM 0 HG3 LYS A 15 13.580 -13.488 13.689 1.00 53.42 H new ATOM 0 HD2 LYS A 15 14.793 -15.214 14.508 1.00 15.24 H new ATOM 0 HD3 LYS A 15 15.986 -14.145 15.220 1.00 15.24 H new ATOM 0 HE2 LYS A 15 14.445 -13.728 17.143 1.00 43.11 H new ATOM 0 HE3 LYS A 15 13.278 -14.826 16.436 1.00 43.11 H new ATOM 0 HZ1 LYS A 15 14.608 -15.925 18.118 1.00 55.24 H new ATOM 0 HZ2 LYS A 15 14.908 -16.619 16.597 1.00 55.24 H new ATOM 0 HZ3 LYS A 15 16.039 -15.554 17.283 1.00 55.24 H new ATOM 191 N TRP A 16 17.276 -9.783 13.649 1.00 43.32 N ATOM 192 CA TRP A 16 18.535 -9.252 13.140 1.00 12.41 C ATOM 193 C TRP A 16 19.436 -8.798 14.282 1.00 25.32 C ATOM 194 O TRP A 16 20.577 -9.245 14.398 1.00 2.11 O ATOM 195 CB TRP A 16 18.271 -8.085 12.187 1.00 71.20 C ATOM 196 CG TRP A 16 19.525 -7.443 11.673 1.00 2.31 C ATOM 197 CD1 TRP A 16 20.114 -6.304 12.142 1.00 52.41 C ATOM 198 CD2 TRP A 16 20.342 -7.903 10.591 1.00 4.21 C ATOM 199 NE1 TRP A 16 21.248 -6.027 11.416 1.00 3.03 N ATOM 200 CE2 TRP A 16 21.409 -6.995 10.459 1.00 72.32 C ATOM 201 CE3 TRP A 16 20.275 -8.996 9.721 1.00 74.20 C ATOM 202 CZ2 TRP A 16 22.401 -7.146 9.493 1.00 41.40 C ATOM 203 CZ3 TRP A 16 21.259 -9.144 8.763 1.00 72.30 C ATOM 204 CH2 TRP A 16 22.311 -8.224 8.655 1.00 43.03 C ATOM 0 H TRP A 16 16.444 -9.327 13.275 1.00 43.32 H new ATOM 0 HA TRP A 16 19.043 -10.048 12.596 1.00 12.41 H new ATOM 0 HB2 TRP A 16 17.681 -8.441 11.342 1.00 71.20 H new ATOM 0 HB3 TRP A 16 17.671 -7.334 12.701 1.00 71.20 H new ATOM 0 HD1 TRP A 16 19.743 -5.708 12.963 1.00 52.41 H new ATOM 0 HE1 TRP A 16 21.868 -5.231 11.565 1.00 3.03 H new ATOM 0 HE3 TRP A 16 19.469 -9.711 9.797 1.00 74.20 H new ATOM 0 HZ2 TRP A 16 23.212 -6.438 9.408 1.00 41.40 H new ATOM 0 HZ3 TRP A 16 21.217 -9.984 8.085 1.00 72.30 H new ATOM 0 HH2 TRP A 16 23.065 -8.369 7.896 1.00 43.03 H new ATOM 215 N GLU A 17 18.917 -7.910 15.123 1.00 60.01 N ATOM 216 CA GLU A 17 19.677 -7.396 16.257 1.00 22.52 C ATOM 217 C GLU A 17 20.138 -8.534 17.162 1.00 61.23 C ATOM 218 O GLU A 17 21.132 -8.409 17.879 1.00 22.54 O ATOM 219 CB GLU A 17 18.833 -6.402 17.058 1.00 24.55 C ATOM 220 CG GLU A 17 18.693 -5.046 16.388 1.00 51.33 C ATOM 221 CD GLU A 17 18.094 -4.000 17.308 1.00 13.01 C ATOM 222 OE1 GLU A 17 17.149 -4.337 18.053 1.00 73.33 O ATOM 223 OE2 GLU A 17 18.568 -2.845 17.285 1.00 34.35 O ATOM 0 H GLU A 17 17.974 -7.531 15.041 1.00 60.01 H new ATOM 0 HA GLU A 17 20.557 -6.883 15.869 1.00 22.52 H new ATOM 0 HB2 GLU A 17 17.841 -6.825 17.215 1.00 24.55 H new ATOM 0 HB3 GLU A 17 19.282 -6.267 18.042 1.00 24.55 H new ATOM 0 HG2 GLU A 17 19.673 -4.709 16.050 1.00 51.33 H new ATOM 0 HG3 GLU A 17 18.067 -5.146 15.501 1.00 51.33 H new ATOM 230 N LYS A 18 19.408 -9.644 17.126 1.00 74.21 N ATOM 231 CA LYS A 18 19.741 -10.806 17.943 1.00 23.02 C ATOM 232 C LYS A 18 20.897 -11.590 17.329 1.00 11.01 C ATOM 233 O LYS A 18 21.859 -11.934 18.015 1.00 71.14 O ATOM 234 CB LYS A 18 18.519 -11.714 18.094 1.00 61.02 C ATOM 235 CG LYS A 18 18.410 -12.363 19.463 1.00 60.05 C ATOM 236 CD LYS A 18 17.367 -11.672 20.327 1.00 30.13 C ATOM 237 CE LYS A 18 18.005 -10.672 21.278 1.00 43.20 C ATOM 238 NZ LYS A 18 17.304 -9.358 21.254 1.00 3.23 N ATOM 0 H LYS A 18 18.582 -9.764 16.540 1.00 74.21 H new ATOM 0 HA LYS A 18 20.048 -10.452 18.927 1.00 23.02 H new ATOM 0 HB2 LYS A 18 17.618 -11.131 17.905 1.00 61.02 H new ATOM 0 HB3 LYS A 18 18.560 -12.494 17.334 1.00 61.02 H new ATOM 0 HG2 LYS A 18 18.149 -13.415 19.348 1.00 60.05 H new ATOM 0 HG3 LYS A 18 19.379 -12.327 19.962 1.00 60.05 H new ATOM 0 HD2 LYS A 18 16.646 -11.160 19.689 1.00 30.13 H new ATOM 0 HD3 LYS A 18 16.814 -12.418 20.899 1.00 30.13 H new ATOM 0 HE2 LYS A 18 17.989 -11.073 22.291 1.00 43.20 H new ATOM 0 HE3 LYS A 18 19.051 -10.530 21.008 1.00 43.20 H new ATOM 0 HZ1 LYS A 18 17.769 -8.704 21.916 1.00 3.23 H new ATOM 0 HZ2 LYS A 18 17.341 -8.962 20.293 1.00 3.23 H new ATOM 0 HZ3 LYS A 18 16.312 -9.489 21.537 1.00 3.23 H new ATOM 252 N ILE A 19 20.796 -11.867 16.033 1.00 4.31 N ATOM 253 CA ILE A 19 21.834 -12.607 15.327 1.00 61.52 C ATOM 254 C ILE A 19 23.208 -11.988 15.563 1.00 42.31 C ATOM 255 O ILE A 19 23.360 -10.767 15.545 1.00 11.11 O ATOM 256 CB ILE A 19 21.559 -12.657 13.813 1.00 25.42 C ATOM 257 CG1 ILE A 19 20.205 -13.316 13.540 1.00 63.42 C ATOM 258 CG2 ILE A 19 22.673 -13.407 13.097 1.00 5.43 C ATOM 259 CD1 ILE A 19 19.395 -12.614 12.473 1.00 53.32 C ATOM 0 H ILE A 19 20.006 -11.590 15.451 1.00 4.31 H new ATOM 0 HA ILE A 19 21.823 -13.622 15.724 1.00 61.52 H new ATOM 0 HB ILE A 19 21.529 -11.637 13.430 1.00 25.42 H new ATOM 0 HG12 ILE A 19 20.368 -14.351 13.239 1.00 63.42 H new ATOM 0 HG13 ILE A 19 19.629 -13.340 14.465 1.00 63.42 H new ATOM 0 HG21 ILE A 19 22.464 -13.434 12.027 1.00 5.43 H new ATOM 0 HG22 ILE A 19 23.622 -12.900 13.269 1.00 5.43 H new ATOM 0 HG23 ILE A 19 22.731 -14.425 13.481 1.00 5.43 H new ATOM 0 HD11 ILE A 19 18.448 -13.136 12.333 1.00 53.32 H new ATOM 0 HD12 ILE A 19 19.201 -11.587 12.781 1.00 53.32 H new ATOM 0 HD13 ILE A 19 19.951 -12.613 11.536 1.00 53.32 H new ATOM 271 N ARG A 20 24.205 -12.839 15.783 1.00 4.50 N ATOM 272 CA ARG A 20 25.566 -12.375 16.022 1.00 2.44 C ATOM 273 C ARG A 20 26.433 -12.575 14.782 1.00 43.10 C ATOM 274 O ARG A 20 26.243 -13.528 14.025 1.00 12.32 O ATOM 275 CB ARG A 20 26.179 -13.117 17.211 1.00 1.14 C ATOM 276 CG ARG A 20 25.545 -12.757 18.545 1.00 12.04 C ATOM 277 CD ARG A 20 25.952 -13.735 19.636 1.00 51.23 C ATOM 278 NE ARG A 20 26.316 -13.053 20.875 1.00 10.43 N ATOM 279 CZ ARG A 20 26.783 -13.678 21.949 1.00 20.54 C ATOM 280 NH1 ARG A 20 26.945 -14.995 21.936 1.00 52.30 N ATOM 281 NH2 ARG A 20 27.092 -12.987 23.039 1.00 63.40 N ATOM 0 H ARG A 20 24.096 -13.853 15.801 1.00 4.50 H new ATOM 0 HA ARG A 20 25.526 -11.310 16.249 1.00 2.44 H new ATOM 0 HB2 ARG A 20 26.080 -14.190 17.049 1.00 1.14 H new ATOM 0 HB3 ARG A 20 27.246 -12.898 17.254 1.00 1.14 H new ATOM 0 HG2 ARG A 20 25.842 -11.748 18.830 1.00 12.04 H new ATOM 0 HG3 ARG A 20 24.460 -12.753 18.444 1.00 12.04 H new ATOM 0 HD2 ARG A 20 25.130 -14.424 19.830 1.00 51.23 H new ATOM 0 HD3 ARG A 20 26.795 -14.333 19.290 1.00 51.23 H new ATOM 0 HE ARG A 20 26.205 -12.040 20.918 1.00 10.43 H new ATOM 0 HH11 ARG A 20 26.711 -15.529 21.099 1.00 52.30 H new ATOM 0 HH12 ARG A 20 27.304 -15.473 22.763 1.00 52.30 H new ATOM 0 HH21 ARG A 20 26.971 -11.974 23.052 1.00 63.40 H new ATOM 0 HH22 ARG A 20 27.451 -13.469 23.864 1.00 63.40 H new ATOM 295 N LEU A 21 27.385 -11.671 14.581 1.00 72.32 N ATOM 296 CA LEU A 21 28.283 -11.747 13.433 1.00 14.42 C ATOM 297 C LEU A 21 29.017 -13.083 13.404 1.00 3.55 C ATOM 298 O LEU A 21 29.406 -13.566 12.339 1.00 52.43 O ATOM 299 CB LEU A 21 29.291 -10.598 13.472 1.00 74.45 C ATOM 300 CG LEU A 21 28.707 -9.196 13.644 1.00 22.23 C ATOM 301 CD1 LEU A 21 29.792 -8.211 14.049 1.00 60.15 C ATOM 302 CD2 LEU A 21 28.024 -8.743 12.362 1.00 34.43 C ATOM 0 H LEU A 21 27.556 -10.877 15.198 1.00 72.32 H new ATOM 0 HA LEU A 21 27.683 -11.664 12.527 1.00 14.42 H new ATOM 0 HB2 LEU A 21 29.989 -10.781 14.289 1.00 74.45 H new ATOM 0 HB3 LEU A 21 29.869 -10.618 12.548 1.00 74.45 H new ATOM 0 HG LEU A 21 27.961 -9.229 14.438 1.00 22.23 H new ATOM 0 HD11 LEU A 21 29.357 -7.219 14.167 1.00 60.15 H new ATOM 0 HD12 LEU A 21 30.236 -8.527 14.993 1.00 60.15 H new ATOM 0 HD13 LEU A 21 30.562 -8.181 13.278 1.00 60.15 H new ATOM 0 HD21 LEU A 21 27.614 -7.743 12.502 1.00 34.43 H new ATOM 0 HD22 LEU A 21 28.750 -8.727 11.549 1.00 34.43 H new ATOM 0 HD23 LEU A 21 27.218 -9.434 12.115 1.00 34.43 H new ATOM 314 N ARG A 22 29.200 -13.678 14.577 1.00 63.24 N ATOM 315 CA ARG A 22 29.887 -14.959 14.685 1.00 65.23 C ATOM 316 C ARG A 22 29.265 -15.819 15.784 1.00 12.33 C ATOM 317 O ARG A 22 28.583 -15.324 16.681 1.00 0.52 O ATOM 318 CB ARG A 22 31.374 -14.744 14.972 1.00 53.34 C ATOM 319 CG ARG A 22 32.259 -14.898 13.747 1.00 0.11 C ATOM 320 CD ARG A 22 33.554 -15.622 14.083 1.00 24.31 C ATOM 321 NE ARG A 22 34.523 -15.546 12.993 1.00 44.35 N ATOM 322 CZ ARG A 22 35.644 -16.257 12.955 1.00 25.31 C ATOM 323 NH1 ARG A 22 35.935 -17.094 13.941 1.00 63.41 N ATOM 324 NH2 ARG A 22 36.475 -16.133 11.929 1.00 13.03 N ATOM 0 H ARG A 22 28.882 -13.294 15.467 1.00 63.24 H new ATOM 0 HA ARG A 22 29.780 -15.480 13.734 1.00 65.23 H new ATOM 0 HB2 ARG A 22 31.514 -13.746 15.388 1.00 53.34 H new ATOM 0 HB3 ARG A 22 31.695 -15.455 15.733 1.00 53.34 H new ATOM 0 HG2 ARG A 22 31.722 -15.450 12.976 1.00 0.11 H new ATOM 0 HG3 ARG A 22 32.487 -13.915 13.335 1.00 0.11 H new ATOM 0 HD2 ARG A 22 33.988 -15.189 14.984 1.00 24.31 H new ATOM 0 HD3 ARG A 22 33.338 -16.667 14.304 1.00 24.31 H new ATOM 0 HE ARG A 22 34.328 -14.912 12.218 1.00 44.35 H new ATOM 0 HH11 ARG A 22 35.297 -17.193 14.731 1.00 63.41 H new ATOM 0 HH12 ARG A 22 36.797 -17.639 13.910 1.00 63.41 H new ATOM 0 HH21 ARG A 22 36.253 -15.491 11.168 1.00 13.03 H new ATOM 0 HH22 ARG A 22 37.336 -16.680 11.901 1.00 13.03 H new ATOM 338 N PRO A 23 29.505 -17.136 15.712 1.00 34.42 N ATOM 339 CA PRO A 23 28.979 -18.091 16.691 1.00 1.20 C ATOM 340 C PRO A 23 29.640 -17.945 18.057 1.00 71.45 C ATOM 341 O PRO A 23 28.998 -18.122 19.092 1.00 24.14 O ATOM 342 CB PRO A 23 29.317 -19.452 16.077 1.00 4.32 C ATOM 343 CG PRO A 23 30.492 -19.190 15.200 1.00 3.25 C ATOM 344 CD PRO A 23 30.311 -17.795 14.670 1.00 1.33 C ATOM 0 HA PRO A 23 27.915 -17.942 16.873 1.00 1.20 H new ATOM 0 HB2 PRO A 23 29.554 -20.186 16.847 1.00 4.32 H new ATOM 0 HB3 PRO A 23 28.477 -19.848 15.506 1.00 4.32 H new ATOM 0 HG2 PRO A 23 31.423 -19.277 15.759 1.00 3.25 H new ATOM 0 HG3 PRO A 23 30.540 -19.913 14.386 1.00 3.25 H new ATOM 0 HD2 PRO A 23 31.268 -17.293 14.525 1.00 1.33 H new ATOM 0 HD3 PRO A 23 29.801 -17.794 13.707 1.00 1.33 H new ATOM 352 N GLY A 24 30.930 -17.620 18.053 1.00 61.04 N ATOM 353 CA GLY A 24 31.657 -17.455 19.300 1.00 13.35 C ATOM 354 C GLY A 24 32.076 -16.019 19.540 1.00 52.10 C ATOM 355 O GLY A 24 33.122 -15.761 20.135 1.00 3.24 O ATOM 0 H GLY A 24 31.484 -17.468 17.210 1.00 61.04 H new ATOM 0 HA2 GLY A 24 31.033 -17.792 20.128 1.00 13.35 H new ATOM 0 HA3 GLY A 24 32.542 -18.091 19.288 1.00 13.35 H new ATOM 359 N GLY A 25 31.259 -15.078 19.075 1.00 21.02 N ATOM 360 CA GLY A 25 31.569 -13.672 19.251 1.00 34.03 C ATOM 361 C GLY A 25 30.602 -12.977 20.189 1.00 24.10 C ATOM 362 O GLY A 25 29.582 -13.549 20.577 1.00 72.01 O ATOM 0 H GLY A 25 30.387 -15.265 18.579 1.00 21.02 H new ATOM 0 HA2 GLY A 25 32.582 -13.573 19.640 1.00 34.03 H new ATOM 0 HA3 GLY A 25 31.550 -13.175 18.281 1.00 34.03 H new ATOM 366 N LYS A 26 30.922 -11.742 20.558 1.00 44.23 N ATOM 367 CA LYS A 26 30.075 -10.968 21.458 1.00 62.22 C ATOM 368 C LYS A 26 29.617 -9.672 20.794 1.00 61.45 C ATOM 369 O LYS A 26 29.322 -8.687 21.471 1.00 33.11 O ATOM 370 CB LYS A 26 30.826 -10.653 22.754 1.00 10.15 C ATOM 371 CG LYS A 26 29.932 -10.616 23.981 1.00 63.32 C ATOM 372 CD LYS A 26 30.640 -11.179 25.203 1.00 33.05 C ATOM 373 CE LYS A 26 30.419 -10.304 26.427 1.00 3.42 C ATOM 374 NZ LYS A 26 28.971 -10.111 26.716 1.00 51.43 N ATOM 0 H LYS A 26 31.763 -11.255 20.248 1.00 44.23 H new ATOM 0 HA LYS A 26 29.194 -11.566 21.693 1.00 62.22 H new ATOM 0 HB2 LYS A 26 31.604 -11.401 22.904 1.00 10.15 H new ATOM 0 HB3 LYS A 26 31.326 -9.690 22.650 1.00 10.15 H new ATOM 0 HG2 LYS A 26 29.625 -9.589 24.178 1.00 63.32 H new ATOM 0 HG3 LYS A 26 29.025 -11.189 23.789 1.00 63.32 H new ATOM 0 HD2 LYS A 26 30.276 -12.186 25.404 1.00 33.05 H new ATOM 0 HD3 LYS A 26 31.708 -11.261 25.001 1.00 33.05 H new ATOM 0 HE2 LYS A 26 30.904 -10.758 27.291 1.00 3.42 H new ATOM 0 HE3 LYS A 26 30.891 -9.334 26.270 1.00 3.42 H new ATOM 0 HZ1 LYS A 26 28.854 -9.767 27.690 1.00 51.43 H new ATOM 0 HZ2 LYS A 26 28.574 -9.415 26.053 1.00 51.43 H new ATOM 0 HZ3 LYS A 26 28.472 -11.017 26.607 1.00 51.43 H new ATOM 388 N LYS A 27 29.559 -9.682 19.468 1.00 10.04 N ATOM 389 CA LYS A 27 29.135 -8.509 18.712 1.00 1.24 C ATOM 390 C LYS A 27 27.889 -8.815 17.886 1.00 34.44 C ATOM 391 O LYS A 27 27.983 -9.345 16.780 1.00 12.31 O ATOM 392 CB LYS A 27 30.263 -8.032 17.794 1.00 33.52 C ATOM 393 CG LYS A 27 30.166 -6.562 17.423 1.00 45.22 C ATOM 394 CD LYS A 27 31.492 -6.028 16.910 1.00 51.11 C ATOM 395 CE LYS A 27 31.297 -5.110 15.712 1.00 64.54 C ATOM 396 NZ LYS A 27 32.461 -4.203 15.514 1.00 10.14 N ATOM 0 H LYS A 27 29.800 -10.489 18.893 1.00 10.04 H new ATOM 0 HA LYS A 27 28.894 -7.718 19.422 1.00 1.24 H new ATOM 0 HB2 LYS A 27 31.220 -8.212 18.285 1.00 33.52 H new ATOM 0 HB3 LYS A 27 30.255 -8.629 16.882 1.00 33.52 H new ATOM 0 HG2 LYS A 27 29.399 -6.428 16.660 1.00 45.22 H new ATOM 0 HG3 LYS A 27 29.853 -5.986 18.294 1.00 45.22 H new ATOM 0 HD2 LYS A 27 32.000 -5.485 17.707 1.00 51.11 H new ATOM 0 HD3 LYS A 27 32.137 -6.861 16.630 1.00 51.11 H new ATOM 0 HE2 LYS A 27 31.148 -5.711 14.815 1.00 64.54 H new ATOM 0 HE3 LYS A 27 30.394 -4.516 15.852 1.00 64.54 H new ATOM 0 HZ1 LYS A 27 32.591 -4.022 14.498 1.00 10.14 H new ATOM 0 HZ2 LYS A 27 32.288 -3.304 16.007 1.00 10.14 H new ATOM 0 HZ3 LYS A 27 33.318 -4.649 15.898 1.00 10.14 H new ATOM 410 N GLN A 28 26.726 -8.476 18.432 1.00 14.34 N ATOM 411 CA GLN A 28 25.462 -8.714 17.743 1.00 42.03 C ATOM 412 C GLN A 28 25.384 -7.906 16.453 1.00 31.54 C ATOM 413 O GLN A 28 26.235 -7.056 16.188 1.00 30.04 O ATOM 414 CB GLN A 28 24.287 -8.357 18.654 1.00 52.35 C ATOM 415 CG GLN A 28 24.426 -8.895 20.069 1.00 24.03 C ATOM 416 CD GLN A 28 24.862 -7.833 21.058 1.00 31.31 C ATOM 417 OE1 GLN A 28 24.288 -6.746 21.112 1.00 12.51 O ATOM 418 NE2 GLN A 28 25.884 -8.143 21.848 1.00 33.24 N ATOM 0 H GLN A 28 26.632 -8.036 19.348 1.00 14.34 H new ATOM 0 HA GLN A 28 25.409 -9.773 17.490 1.00 42.03 H new ATOM 0 HB2 GLN A 28 24.187 -7.272 18.695 1.00 52.35 H new ATOM 0 HB3 GLN A 28 23.368 -8.745 18.216 1.00 52.35 H new ATOM 0 HG2 GLN A 28 23.472 -9.314 20.389 1.00 24.03 H new ATOM 0 HG3 GLN A 28 25.150 -9.710 20.074 1.00 24.03 H new ATOM 0 HE21 GLN A 28 26.331 -9.057 21.769 1.00 33.24 H new ATOM 0 HE22 GLN A 28 26.222 -7.467 22.533 1.00 33.24 H new ATOM 427 N TYR A 29 24.360 -8.178 15.651 1.00 64.52 N ATOM 428 CA TYR A 29 24.173 -7.479 14.386 1.00 72.31 C ATOM 429 C TYR A 29 23.459 -6.148 14.599 1.00 3.20 C ATOM 430 O TYR A 29 22.640 -6.007 15.508 1.00 23.32 O ATOM 431 CB TYR A 29 23.376 -8.348 13.412 1.00 53.41 C ATOM 432 CG TYR A 29 24.237 -9.065 12.396 1.00 52.10 C ATOM 433 CD1 TYR A 29 24.747 -8.393 11.292 1.00 32.34 C ATOM 434 CD2 TYR A 29 24.538 -10.413 12.539 1.00 73.35 C ATOM 435 CE1 TYR A 29 25.533 -9.044 10.360 1.00 51.11 C ATOM 436 CE2 TYR A 29 25.325 -11.072 11.614 1.00 73.23 C ATOM 437 CZ TYR A 29 25.820 -10.382 10.526 1.00 22.33 C ATOM 438 OH TYR A 29 26.603 -11.035 9.601 1.00 52.13 O ATOM 0 H TYR A 29 23.647 -8.878 15.855 1.00 64.52 H new ATOM 0 HA TYR A 29 25.157 -7.279 13.962 1.00 72.31 H new ATOM 0 HB2 TYR A 29 22.807 -9.085 13.978 1.00 53.41 H new ATOM 0 HB3 TYR A 29 22.654 -7.722 12.887 1.00 53.41 H new ATOM 0 HD1 TYR A 29 24.525 -7.344 11.160 1.00 32.34 H new ATOM 0 HD2 TYR A 29 24.150 -10.956 13.388 1.00 73.35 H new ATOM 0 HE1 TYR A 29 25.920 -8.507 9.506 1.00 51.11 H new ATOM 0 HE2 TYR A 29 25.551 -12.120 11.742 1.00 73.23 H new ATOM 0 HH TYR A 29 26.870 -11.908 9.957 1.00 52.13 H new ATOM 448 N LYS A 30 23.773 -5.173 13.754 1.00 74.32 N ATOM 449 CA LYS A 30 23.162 -3.852 13.846 1.00 34.14 C ATOM 450 C LYS A 30 22.986 -3.236 12.462 1.00 1.24 C ATOM 451 O LYS A 30 23.570 -3.705 11.483 1.00 45.42 O ATOM 452 CB LYS A 30 24.017 -2.931 14.720 1.00 65.02 C ATOM 453 CG LYS A 30 23.615 -2.937 16.185 1.00 21.45 C ATOM 454 CD LYS A 30 23.633 -1.537 16.774 1.00 63.10 C ATOM 455 CE LYS A 30 23.858 -1.567 18.277 1.00 65.14 C ATOM 456 NZ LYS A 30 22.585 -1.768 19.025 1.00 2.35 N ATOM 0 H LYS A 30 24.448 -5.272 12.996 1.00 74.32 H new ATOM 0 HA LYS A 30 22.178 -3.966 14.302 1.00 34.14 H new ATOM 0 HB2 LYS A 30 25.061 -3.232 14.637 1.00 65.02 H new ATOM 0 HB3 LYS A 30 23.947 -1.913 14.337 1.00 65.02 H new ATOM 0 HG2 LYS A 30 22.617 -3.363 16.288 1.00 21.45 H new ATOM 0 HG3 LYS A 30 24.294 -3.578 16.747 1.00 21.45 H new ATOM 0 HD2 LYS A 30 24.420 -0.952 16.299 1.00 63.10 H new ATOM 0 HD3 LYS A 30 22.689 -1.038 16.556 1.00 63.10 H new ATOM 0 HE2 LYS A 30 24.555 -2.368 18.524 1.00 65.14 H new ATOM 0 HE3 LYS A 30 24.322 -0.633 18.594 1.00 65.14 H new ATOM 0 HZ1 LYS A 30 22.781 -1.783 20.046 1.00 2.35 H new ATOM 0 HZ2 LYS A 30 21.929 -0.990 18.809 1.00 2.35 H new ATOM 0 HZ3 LYS A 30 22.155 -2.672 18.742 1.00 2.35 H new ATOM 470 N LEU A 31 22.179 -2.184 12.386 1.00 11.11 N ATOM 471 CA LEU A 31 21.928 -1.502 11.121 1.00 43.45 C ATOM 472 C LEU A 31 23.237 -1.132 10.432 1.00 50.53 C ATOM 473 O LEU A 31 23.310 -1.078 9.204 1.00 74.53 O ATOM 474 CB LEU A 31 21.086 -0.245 11.354 1.00 74.45 C ATOM 475 CG LEU A 31 19.608 -0.475 11.666 1.00 13.24 C ATOM 476 CD1 LEU A 31 19.136 0.477 12.753 1.00 51.42 C ATOM 477 CD2 LEU A 31 18.767 -0.309 10.408 1.00 24.33 C ATOM 0 H LEU A 31 21.687 -1.784 13.185 1.00 11.11 H new ATOM 0 HA LEU A 31 21.379 -2.184 10.472 1.00 43.45 H new ATOM 0 HB2 LEU A 31 21.527 0.316 12.178 1.00 74.45 H new ATOM 0 HB3 LEU A 31 21.156 0.384 10.467 1.00 74.45 H new ATOM 0 HG LEU A 31 19.488 -1.496 12.029 1.00 13.24 H new ATOM 0 HD11 LEU A 31 18.081 0.298 12.961 1.00 51.42 H new ATOM 0 HD12 LEU A 31 19.718 0.311 13.660 1.00 51.42 H new ATOM 0 HD13 LEU A 31 19.270 1.506 12.419 1.00 51.42 H new ATOM 0 HD21 LEU A 31 17.717 -0.476 10.648 1.00 24.33 H new ATOM 0 HD22 LEU A 31 18.894 0.700 10.016 1.00 24.33 H new ATOM 0 HD23 LEU A 31 19.088 -1.032 9.658 1.00 24.33 H new ATOM 489 N LYS A 32 24.268 -0.879 11.230 1.00 20.10 N ATOM 490 CA LYS A 32 25.577 -0.517 10.698 1.00 1.24 C ATOM 491 C LYS A 32 26.037 -1.527 9.651 1.00 75.25 C ATOM 492 O LYS A 32 26.641 -1.159 8.644 1.00 34.13 O ATOM 493 CB LYS A 32 26.605 -0.434 11.828 1.00 42.25 C ATOM 494 CG LYS A 32 26.749 0.958 12.419 1.00 75.44 C ATOM 495 CD LYS A 32 28.094 1.136 13.104 1.00 43.55 C ATOM 496 CE LYS A 32 27.980 2.030 14.329 1.00 73.10 C ATOM 497 NZ LYS A 32 27.991 3.475 13.966 1.00 30.44 N ATOM 0 H LYS A 32 24.223 -0.918 12.248 1.00 20.10 H new ATOM 0 HA LYS A 32 25.490 0.460 10.222 1.00 1.24 H new ATOM 0 HB2 LYS A 32 26.320 -1.128 12.619 1.00 42.25 H new ATOM 0 HB3 LYS A 32 27.574 -0.762 11.451 1.00 42.25 H new ATOM 0 HG2 LYS A 32 26.640 1.702 11.630 1.00 75.44 H new ATOM 0 HG3 LYS A 32 25.948 1.134 13.137 1.00 75.44 H new ATOM 0 HD2 LYS A 32 28.486 0.162 13.398 1.00 43.55 H new ATOM 0 HD3 LYS A 32 28.807 1.568 12.402 1.00 43.55 H new ATOM 0 HE2 LYS A 32 27.059 1.797 14.864 1.00 73.10 H new ATOM 0 HE3 LYS A 32 28.805 1.820 15.009 1.00 73.10 H new ATOM 0 HZ1 LYS A 32 27.911 4.050 14.829 1.00 30.44 H new ATOM 0 HZ2 LYS A 32 28.881 3.704 13.478 1.00 30.44 H new ATOM 0 HZ3 LYS A 32 27.189 3.681 13.337 1.00 30.44 H new ATOM 511 N HIS A 33 25.746 -2.800 9.896 1.00 4.04 N ATOM 512 CA HIS A 33 26.129 -3.863 8.973 1.00 61.01 C ATOM 513 C HIS A 33 25.207 -3.882 7.756 1.00 62.52 C ATOM 514 O HIS A 33 25.704 -4.203 6.677 1.00 11.01 O ATOM 515 CB HIS A 33 26.088 -5.219 9.678 1.00 32.40 C ATOM 516 CG HIS A 33 26.757 -5.216 11.019 1.00 65.43 C ATOM 517 ND1 HIS A 33 26.179 -5.753 12.150 1.00 4.31 N ATOM 518 CD2 HIS A 33 27.963 -4.739 11.406 1.00 25.23 C ATOM 519 CE1 HIS A 33 26.999 -5.605 13.174 1.00 50.20 C ATOM 520 NE2 HIS A 33 28.090 -4.994 12.749 1.00 14.20 N ATOM 0 H HIS A 33 25.246 -3.121 10.725 1.00 4.04 H new ATOM 0 HA HIS A 33 27.147 -3.668 8.635 1.00 61.01 H new ATOM 0 HB2 HIS A 33 25.049 -5.525 9.800 1.00 32.40 H new ATOM 0 HB3 HIS A 33 26.567 -5.964 9.043 1.00 32.40 H new ATOM 0 HD2 HIS A 33 28.690 -4.249 10.776 1.00 25.23 H new ATOM 0 HE1 HIS A 33 26.810 -5.929 14.187 1.00 50.20 H new ATOM 0 HE2 HIS A 33 28.896 -4.751 13.325 1.00 14.20 H new ATOM 528 N ILE A 34 23.926 -3.560 7.897 1.00 12.21 N ATOM 529 CA ILE A 34 23.009 -3.564 6.764 1.00 33.14 C ATOM 530 C ILE A 34 23.355 -2.456 5.774 1.00 24.35 C ATOM 531 O ILE A 34 23.245 -2.638 4.561 1.00 1.43 O ATOM 532 CB ILE A 34 21.549 -3.391 7.221 1.00 14.44 C ATOM 533 CG1 ILE A 34 21.192 -4.441 8.275 1.00 21.24 C ATOM 534 CG2 ILE A 34 20.606 -3.486 6.031 1.00 14.23 C ATOM 535 CD1 ILE A 34 19.851 -4.207 8.932 1.00 61.21 C ATOM 0 H ILE A 34 23.500 -3.293 8.784 1.00 12.21 H new ATOM 0 HA ILE A 34 23.115 -4.532 6.275 1.00 33.14 H new ATOM 0 HB ILE A 34 21.440 -2.403 7.669 1.00 14.44 H new ATOM 0 HG12 ILE A 34 21.192 -5.426 7.809 1.00 21.24 H new ATOM 0 HG13 ILE A 34 21.966 -4.452 9.042 1.00 21.24 H new ATOM 0 HG21 ILE A 34 19.578 -3.362 6.371 1.00 14.23 H new ATOM 0 HG22 ILE A 34 20.848 -2.703 5.312 1.00 14.23 H new ATOM 0 HG23 ILE A 34 20.716 -4.461 5.557 1.00 14.23 H new ATOM 0 HD11 ILE A 34 19.665 -4.990 9.667 1.00 61.21 H new ATOM 0 HD12 ILE A 34 19.853 -3.236 9.428 1.00 61.21 H new ATOM 0 HD13 ILE A 34 19.067 -4.226 8.175 1.00 61.21 H new ATOM 547 N VAL A 35 23.775 -1.311 6.299 1.00 55.25 N ATOM 548 CA VAL A 35 24.141 -0.175 5.461 1.00 53.45 C ATOM 549 C VAL A 35 25.546 -0.340 4.893 1.00 50.34 C ATOM 550 O VAL A 35 25.810 0.024 3.748 1.00 11.11 O ATOM 551 CB VAL A 35 24.069 1.148 6.247 1.00 14.31 C ATOM 552 CG1 VAL A 35 24.484 2.317 5.366 1.00 5.32 C ATOM 553 CG2 VAL A 35 22.670 1.360 6.805 1.00 54.23 C ATOM 0 H VAL A 35 23.871 -1.144 7.301 1.00 55.25 H new ATOM 0 HA VAL A 35 23.423 -0.142 4.641 1.00 53.45 H new ATOM 0 HB VAL A 35 24.765 1.091 7.084 1.00 14.31 H new ATOM 0 HG11 VAL A 35 24.427 3.243 5.939 1.00 5.32 H new ATOM 0 HG12 VAL A 35 25.507 2.167 5.020 1.00 5.32 H new ATOM 0 HG13 VAL A 35 23.816 2.380 4.507 1.00 5.32 H new ATOM 0 HG21 VAL A 35 22.637 2.299 7.357 1.00 54.23 H new ATOM 0 HG22 VAL A 35 21.953 1.396 5.985 1.00 54.23 H new ATOM 0 HG23 VAL A 35 22.416 0.537 7.473 1.00 54.23 H new ATOM 563 N TRP A 36 26.443 -0.892 5.701 1.00 51.24 N ATOM 564 CA TRP A 36 27.822 -1.106 5.279 1.00 33.50 C ATOM 565 C TRP A 36 27.878 -1.929 3.997 1.00 15.45 C ATOM 566 O TRP A 36 28.759 -1.733 3.160 1.00 63.02 O ATOM 567 CB TRP A 36 28.613 -1.809 6.384 1.00 1.01 C ATOM 568 CG TRP A 36 29.992 -2.216 5.962 1.00 23.13 C ATOM 569 CD1 TRP A 36 31.159 -1.560 6.230 1.00 71.12 C ATOM 570 CD2 TRP A 36 30.347 -3.371 5.194 1.00 20.04 C ATOM 571 NE1 TRP A 36 32.218 -2.237 5.675 1.00 51.01 N ATOM 572 CE2 TRP A 36 31.746 -3.352 5.035 1.00 52.00 C ATOM 573 CE3 TRP A 36 29.619 -4.420 4.625 1.00 72.23 C ATOM 574 CZ2 TRP A 36 32.429 -4.341 4.331 1.00 42.14 C ATOM 575 CZ3 TRP A 36 30.298 -5.400 3.928 1.00 24.14 C ATOM 576 CH2 TRP A 36 31.691 -5.356 3.786 1.00 14.12 C ATOM 0 H TRP A 36 26.240 -1.200 6.652 1.00 51.24 H new ATOM 0 HA TRP A 36 28.270 -0.132 5.084 1.00 33.50 H new ATOM 0 HB2 TRP A 36 28.686 -1.146 7.246 1.00 1.01 H new ATOM 0 HB3 TRP A 36 28.064 -2.694 6.707 1.00 1.01 H new ATOM 0 HD1 TRP A 36 31.238 -0.643 6.795 1.00 71.12 H new ATOM 0 HE1 TRP A 36 33.197 -1.955 5.731 1.00 51.01 H new ATOM 0 HE3 TRP A 36 28.545 -4.463 4.729 1.00 72.23 H new ATOM 0 HZ2 TRP A 36 33.503 -4.308 4.219 1.00 42.14 H new ATOM 0 HZ3 TRP A 36 29.745 -6.215 3.484 1.00 24.14 H new ATOM 0 HH2 TRP A 36 32.192 -6.139 3.236 1.00 14.12 H new ATOM 587 N ALA A 37 26.930 -2.849 3.848 1.00 52.31 N ATOM 588 CA ALA A 37 26.871 -3.700 2.665 1.00 53.52 C ATOM 589 C ALA A 37 26.222 -2.967 1.495 1.00 33.31 C ATOM 590 O ALA A 37 26.542 -3.227 0.335 1.00 43.42 O ATOM 591 CB ALA A 37 26.110 -4.981 2.975 1.00 75.43 C ATOM 0 H ALA A 37 26.193 -3.024 4.531 1.00 52.31 H new ATOM 0 HA ALA A 37 27.891 -3.956 2.379 1.00 53.52 H new ATOM 0 HB1 ALA A 37 26.073 -5.607 2.084 1.00 75.43 H new ATOM 0 HB2 ALA A 37 26.616 -5.520 3.776 1.00 75.43 H new ATOM 0 HB3 ALA A 37 25.095 -4.735 3.287 1.00 75.43 H new ATOM 597 N SER A 38 25.310 -2.052 1.807 1.00 41.32 N ATOM 598 CA SER A 38 24.613 -1.285 0.781 1.00 22.43 C ATOM 599 C SER A 38 25.576 -0.352 0.054 1.00 11.54 C ATOM 600 O SER A 38 25.471 -0.157 -1.158 1.00 33.11 O ATOM 601 CB SER A 38 23.474 -0.477 1.404 1.00 4.21 C ATOM 602 OG SER A 38 22.231 -1.136 1.236 1.00 42.51 O ATOM 0 H SER A 38 25.036 -1.824 2.763 1.00 41.32 H new ATOM 0 HA SER A 38 24.197 -1.986 0.057 1.00 22.43 H new ATOM 0 HB2 SER A 38 23.669 -0.327 2.466 1.00 4.21 H new ATOM 0 HB3 SER A 38 23.431 0.511 0.945 1.00 4.21 H new ATOM 0 HG SER A 38 21.519 -0.600 1.644 1.00 42.51 H new ATOM 608 N ARG A 39 26.513 0.222 0.801 1.00 24.22 N ATOM 609 CA ARG A 39 27.494 1.135 0.228 1.00 10.41 C ATOM 610 C ARG A 39 28.533 0.375 -0.590 1.00 71.02 C ATOM 611 O ARG A 39 29.078 0.900 -1.560 1.00 44.01 O ATOM 612 CB ARG A 39 28.185 1.935 1.335 1.00 11.14 C ATOM 613 CG ARG A 39 28.156 3.437 1.110 1.00 34.33 C ATOM 614 CD ARG A 39 26.735 3.979 1.139 1.00 20.54 C ATOM 615 NE ARG A 39 26.486 4.920 0.050 1.00 63.21 N ATOM 616 CZ ARG A 39 25.312 5.504 -0.162 1.00 55.32 C ATOM 617 NH1 ARG A 39 24.286 5.246 0.636 1.00 43.24 N ATOM 618 NH2 ARG A 39 25.163 6.350 -1.173 1.00 25.33 N ATOM 0 H ARG A 39 26.613 0.071 1.805 1.00 24.22 H new ATOM 0 HA ARG A 39 26.969 1.823 -0.435 1.00 10.41 H new ATOM 0 HB2 ARG A 39 27.706 1.710 2.288 1.00 11.14 H new ATOM 0 HB3 ARG A 39 29.222 1.608 1.415 1.00 11.14 H new ATOM 0 HG2 ARG A 39 28.751 3.932 1.877 1.00 34.33 H new ATOM 0 HG3 ARG A 39 28.616 3.671 0.150 1.00 34.33 H new ATOM 0 HD2 ARG A 39 26.030 3.151 1.071 1.00 20.54 H new ATOM 0 HD3 ARG A 39 26.555 4.473 2.094 1.00 20.54 H new ATOM 0 HE ARG A 39 27.256 5.141 -0.582 1.00 63.21 H new ATOM 0 HH11 ARG A 39 24.397 4.597 1.415 1.00 43.24 H new ATOM 0 HH12 ARG A 39 23.386 5.696 0.471 1.00 43.24 H new ATOM 0 HH21 ARG A 39 25.951 6.553 -1.789 1.00 25.33 H new ATOM 0 HH22 ARG A 39 24.261 6.798 -1.335 1.00 25.33 H new ATOM 632 N GLU A 40 28.803 -0.863 -0.189 1.00 24.32 N ATOM 633 CA GLU A 40 29.779 -1.695 -0.884 1.00 3.32 C ATOM 634 C GLU A 40 29.145 -2.384 -2.090 1.00 50.13 C ATOM 635 O GLU A 40 29.830 -2.724 -3.056 1.00 10.12 O ATOM 636 CB GLU A 40 30.360 -2.742 0.067 1.00 63.33 C ATOM 637 CG GLU A 40 31.840 -3.009 -0.151 1.00 50.31 C ATOM 638 CD GLU A 40 32.650 -2.882 1.124 1.00 64.44 C ATOM 639 OE1 GLU A 40 32.654 -1.785 1.720 1.00 0.04 O ATOM 640 OE2 GLU A 40 33.281 -3.883 1.527 1.00 14.01 O ATOM 0 H GLU A 40 28.360 -1.312 0.613 1.00 24.32 H new ATOM 0 HA GLU A 40 30.583 -1.049 -1.236 1.00 3.32 H new ATOM 0 HB2 GLU A 40 30.207 -2.412 1.094 1.00 63.33 H new ATOM 0 HB3 GLU A 40 29.810 -3.675 -0.054 1.00 63.33 H new ATOM 0 HG2 GLU A 40 31.968 -4.011 -0.560 1.00 50.31 H new ATOM 0 HG3 GLU A 40 32.226 -2.310 -0.893 1.00 50.31 H new ATOM 647 N LEU A 41 27.834 -2.587 -2.026 1.00 20.01 N ATOM 648 CA LEU A 41 27.107 -3.236 -3.111 1.00 41.40 C ATOM 649 C LEU A 41 27.061 -2.343 -4.347 1.00 44.32 C ATOM 650 O LEU A 41 27.373 -2.781 -5.453 1.00 31.34 O ATOM 651 CB LEU A 41 25.684 -3.581 -2.665 1.00 75.43 C ATOM 652 CG LEU A 41 25.482 -4.986 -2.097 1.00 4.41 C ATOM 653 CD1 LEU A 41 24.043 -5.175 -1.641 1.00 42.31 C ATOM 654 CD2 LEU A 41 25.858 -6.038 -3.131 1.00 42.55 C ATOM 0 H LEU A 41 27.253 -2.312 -1.234 1.00 20.01 H new ATOM 0 HA LEU A 41 27.634 -4.155 -3.368 1.00 41.40 H new ATOM 0 HB2 LEU A 41 25.376 -2.858 -1.910 1.00 75.43 H new ATOM 0 HB3 LEU A 41 25.017 -3.456 -3.518 1.00 75.43 H new ATOM 0 HG LEU A 41 26.135 -5.105 -1.232 1.00 4.41 H new ATOM 0 HD11 LEU A 41 23.918 -6.181 -1.240 1.00 42.31 H new ATOM 0 HD12 LEU A 41 23.807 -4.444 -0.868 1.00 42.31 H new ATOM 0 HD13 LEU A 41 23.372 -5.036 -2.488 1.00 42.31 H new ATOM 0 HD21 LEU A 41 25.708 -7.032 -2.710 1.00 42.55 H new ATOM 0 HD22 LEU A 41 25.231 -5.920 -4.015 1.00 42.55 H new ATOM 0 HD23 LEU A 41 26.905 -5.916 -3.410 1.00 42.55 H new ATOM 666 N GLU A 42 26.671 -1.087 -4.149 1.00 70.14 N ATOM 667 CA GLU A 42 26.587 -0.132 -5.247 1.00 1.44 C ATOM 668 C GLU A 42 27.920 -0.028 -5.982 1.00 14.30 C ATOM 669 O GLU A 42 27.965 0.315 -7.163 1.00 0.25 O ATOM 670 CB GLU A 42 26.170 1.244 -4.725 1.00 72.24 C ATOM 671 CG GLU A 42 24.804 1.694 -5.216 1.00 72.42 C ATOM 672 CD GLU A 42 24.892 2.738 -6.312 1.00 34.55 C ATOM 673 OE1 GLU A 42 25.385 3.851 -6.033 1.00 61.34 O ATOM 674 OE2 GLU A 42 24.470 2.442 -7.449 1.00 2.00 O ATOM 0 H GLU A 42 26.409 -0.708 -3.239 1.00 70.14 H new ATOM 0 HA GLU A 42 25.833 -0.490 -5.948 1.00 1.44 H new ATOM 0 HB2 GLU A 42 26.166 1.224 -3.635 1.00 72.24 H new ATOM 0 HB3 GLU A 42 26.916 1.979 -5.028 1.00 72.24 H new ATOM 0 HG2 GLU A 42 24.253 0.830 -5.586 1.00 72.42 H new ATOM 0 HG3 GLU A 42 24.236 2.099 -4.378 1.00 72.42 H new ATOM 681 N ARG A 43 29.004 -0.325 -5.272 1.00 23.34 N ATOM 682 CA ARG A 43 30.339 -0.264 -5.855 1.00 54.01 C ATOM 683 C ARG A 43 30.557 -1.411 -6.838 1.00 22.43 C ATOM 684 O ARG A 43 31.347 -1.298 -7.775 1.00 32.45 O ATOM 685 CB ARG A 43 31.401 -0.312 -4.756 1.00 63.02 C ATOM 686 CG ARG A 43 32.116 1.012 -4.542 1.00 75.55 C ATOM 687 CD ARG A 43 33.421 1.072 -5.321 1.00 55.33 C ATOM 688 NE ARG A 43 34.569 0.710 -4.494 1.00 74.24 N ATOM 689 CZ ARG A 43 35.792 0.519 -4.977 1.00 4.35 C ATOM 690 NH1 ARG A 43 36.024 0.654 -6.275 1.00 4.44 N ATOM 691 NH2 ARG A 43 36.785 0.190 -4.160 1.00 33.15 N ATOM 0 H ARG A 43 28.984 -0.610 -4.293 1.00 23.34 H new ATOM 0 HA ARG A 43 30.428 0.678 -6.397 1.00 54.01 H new ATOM 0 HB2 ARG A 43 30.931 -0.617 -3.821 1.00 63.02 H new ATOM 0 HB3 ARG A 43 32.137 -1.076 -5.006 1.00 63.02 H new ATOM 0 HG2 ARG A 43 31.468 1.831 -4.852 1.00 75.55 H new ATOM 0 HG3 ARG A 43 32.318 1.150 -3.480 1.00 75.55 H new ATOM 0 HD2 ARG A 43 33.364 0.399 -6.176 1.00 55.33 H new ATOM 0 HD3 ARG A 43 33.562 2.078 -5.716 1.00 55.33 H new ATOM 0 HE ARG A 43 34.424 0.598 -3.491 1.00 74.24 H new ATOM 0 HH11 ARG A 43 35.263 0.905 -6.906 1.00 4.44 H new ATOM 0 HH12 ARG A 43 36.964 0.507 -6.643 1.00 4.44 H new ATOM 0 HH21 ARG A 43 36.609 0.084 -3.161 1.00 33.15 H new ATOM 0 HH22 ARG A 43 37.724 0.043 -4.531 1.00 33.15 H new ATOM 705 N PHE A 44 29.851 -2.515 -6.617 1.00 22.34 N ATOM 706 CA PHE A 44 29.968 -3.683 -7.482 1.00 3.30 C ATOM 707 C PHE A 44 28.870 -3.688 -8.541 1.00 4.10 C ATOM 708 O PHE A 44 28.470 -4.743 -9.031 1.00 22.44 O ATOM 709 CB PHE A 44 29.898 -4.967 -6.652 1.00 64.13 C ATOM 710 CG PHE A 44 31.087 -5.168 -5.757 1.00 31.00 C ATOM 711 CD1 PHE A 44 32.365 -5.248 -6.288 1.00 41.12 C ATOM 712 CD2 PHE A 44 30.928 -5.277 -4.385 1.00 0.22 C ATOM 713 CE1 PHE A 44 33.460 -5.434 -5.466 1.00 21.22 C ATOM 714 CE2 PHE A 44 32.020 -5.463 -3.558 1.00 14.34 C ATOM 715 CZ PHE A 44 33.288 -5.540 -4.100 1.00 33.11 C ATOM 0 H PHE A 44 29.192 -2.625 -5.846 1.00 22.34 H new ATOM 0 HA PHE A 44 30.933 -3.636 -7.986 1.00 3.30 H new ATOM 0 HB2 PHE A 44 28.994 -4.948 -6.043 1.00 64.13 H new ATOM 0 HB3 PHE A 44 29.811 -5.820 -7.324 1.00 64.13 H new ATOM 0 HD1 PHE A 44 32.506 -5.164 -7.355 1.00 41.12 H new ATOM 0 HD2 PHE A 44 29.939 -5.216 -3.956 1.00 0.22 H new ATOM 0 HE1 PHE A 44 34.450 -5.496 -5.892 1.00 21.22 H new ATOM 0 HE2 PHE A 44 31.882 -5.548 -2.490 1.00 14.34 H new ATOM 0 HZ PHE A 44 34.144 -5.683 -3.457 1.00 33.11 H new ATOM 725 N ALA A 45 28.386 -2.500 -8.889 1.00 43.35 N ATOM 726 CA ALA A 45 27.335 -2.367 -9.890 1.00 71.01 C ATOM 727 C ALA A 45 26.044 -3.029 -9.423 1.00 54.22 C ATOM 728 O ALA A 45 25.181 -3.370 -10.232 1.00 64.41 O ATOM 729 CB ALA A 45 27.789 -2.965 -11.214 1.00 43.51 C ATOM 0 H ALA A 45 28.705 -1.616 -8.492 1.00 43.35 H new ATOM 0 HA ALA A 45 27.136 -1.305 -10.033 1.00 71.01 H new ATOM 0 HB1 ALA A 45 26.994 -2.859 -11.953 1.00 43.51 H new ATOM 0 HB2 ALA A 45 28.680 -2.443 -11.562 1.00 43.51 H new ATOM 0 HB3 ALA A 45 28.018 -4.022 -11.077 1.00 43.51 H new ATOM 735 N VAL A 46 25.917 -3.208 -8.111 1.00 2.24 N ATOM 736 CA VAL A 46 24.729 -3.830 -7.537 1.00 74.40 C ATOM 737 C VAL A 46 24.008 -2.870 -6.596 1.00 24.23 C ATOM 738 O VAL A 46 24.540 -2.489 -5.555 1.00 13.12 O ATOM 739 CB VAL A 46 25.086 -5.115 -6.766 1.00 71.41 C ATOM 740 CG1 VAL A 46 23.842 -5.725 -6.141 1.00 25.30 C ATOM 741 CG2 VAL A 46 25.776 -6.112 -7.684 1.00 34.45 C ATOM 0 H VAL A 46 26.621 -2.931 -7.427 1.00 2.24 H new ATOM 0 HA VAL A 46 24.071 -4.084 -8.368 1.00 74.40 H new ATOM 0 HB VAL A 46 25.777 -4.857 -5.963 1.00 71.41 H new ATOM 0 HG11 VAL A 46 24.114 -6.632 -5.601 1.00 25.30 H new ATOM 0 HG12 VAL A 46 23.395 -5.011 -5.450 1.00 25.30 H new ATOM 0 HG13 VAL A 46 23.124 -5.970 -6.924 1.00 25.30 H new ATOM 0 HG21 VAL A 46 26.021 -7.014 -7.123 1.00 34.45 H new ATOM 0 HG22 VAL A 46 25.111 -6.367 -8.509 1.00 34.45 H new ATOM 0 HG23 VAL A 46 26.691 -5.670 -8.079 1.00 34.45 H new ATOM 751 N ASN A 47 22.793 -2.486 -6.972 1.00 44.15 N ATOM 752 CA ASN A 47 21.997 -1.571 -6.161 1.00 10.52 C ATOM 753 C ASN A 47 21.686 -2.180 -4.798 1.00 60.53 C ATOM 754 O ASN A 47 21.479 -3.387 -4.662 1.00 13.40 O ATOM 755 CB ASN A 47 20.694 -1.219 -6.884 1.00 75.33 C ATOM 756 CG ASN A 47 20.877 -0.105 -7.896 1.00 14.02 C ATOM 757 OD1 ASN A 47 20.926 1.072 -7.538 1.00 42.20 O ATOM 758 ND2 ASN A 47 20.980 -0.472 -9.167 1.00 4.15 N ATOM 0 H ASN A 47 22.338 -2.793 -7.832 1.00 44.15 H new ATOM 0 HA ASN A 47 22.578 -0.662 -6.008 1.00 10.52 H new ATOM 0 HB2 ASN A 47 20.311 -2.106 -7.389 1.00 75.33 H new ATOM 0 HB3 ASN A 47 19.944 -0.921 -6.151 1.00 75.33 H new ATOM 0 HD21 ASN A 47 21.105 0.233 -9.893 1.00 4.15 H new ATOM 0 HD22 ASN A 47 20.934 -1.460 -9.418 1.00 4.15 H new ATOM 765 N PRO A 48 21.655 -1.328 -3.762 1.00 1.35 N ATOM 766 CA PRO A 48 21.370 -1.760 -2.391 1.00 5.51 C ATOM 767 C PRO A 48 19.919 -2.190 -2.208 1.00 5.43 C ATOM 768 O PRO A 48 19.557 -2.775 -1.187 1.00 31.11 O ATOM 769 CB PRO A 48 21.665 -0.511 -1.557 1.00 55.21 C ATOM 770 CG PRO A 48 21.473 0.628 -2.499 1.00 44.25 C ATOM 771 CD PRO A 48 21.893 0.122 -3.851 1.00 51.30 C ATOM 0 HA PRO A 48 21.963 -2.630 -2.107 1.00 5.51 H new ATOM 0 HB2 PRO A 48 20.991 -0.437 -0.703 1.00 55.21 H new ATOM 0 HB3 PRO A 48 22.680 -0.530 -1.161 1.00 55.21 H new ATOM 0 HG2 PRO A 48 20.433 0.954 -2.510 1.00 44.25 H new ATOM 0 HG3 PRO A 48 22.073 1.487 -2.200 1.00 44.25 H new ATOM 0 HD2 PRO A 48 21.307 0.577 -4.650 1.00 51.30 H new ATOM 0 HD3 PRO A 48 22.940 0.345 -4.056 1.00 51.30 H new ATOM 779 N GLY A 49 19.089 -1.899 -3.206 1.00 52.54 N ATOM 780 CA GLY A 49 17.686 -2.263 -3.135 1.00 54.12 C ATOM 781 C GLY A 49 17.475 -3.764 -3.160 1.00 72.21 C ATOM 782 O GLY A 49 16.399 -4.254 -2.813 1.00 54.50 O ATOM 0 H GLY A 49 19.364 -1.418 -4.062 1.00 52.54 H new ATOM 0 HA2 GLY A 49 17.253 -1.853 -2.222 1.00 54.12 H new ATOM 0 HA3 GLY A 49 17.153 -1.810 -3.971 1.00 54.12 H new ATOM 786 N LEU A 50 18.503 -4.497 -3.570 1.00 33.35 N ATOM 787 CA LEU A 50 18.426 -5.952 -3.642 1.00 51.14 C ATOM 788 C LEU A 50 18.517 -6.570 -2.250 1.00 51.31 C ATOM 789 O LEU A 50 18.035 -7.680 -2.019 1.00 5.41 O ATOM 790 CB LEU A 50 19.546 -6.500 -4.529 1.00 62.24 C ATOM 791 CG LEU A 50 19.673 -5.867 -5.914 1.00 22.55 C ATOM 792 CD1 LEU A 50 20.796 -6.526 -6.701 1.00 63.30 C ATOM 793 CD2 LEU A 50 18.357 -5.972 -6.671 1.00 13.42 C ATOM 0 H LEU A 50 19.401 -4.108 -3.858 1.00 33.35 H new ATOM 0 HA LEU A 50 17.463 -6.219 -4.078 1.00 51.14 H new ATOM 0 HB2 LEU A 50 20.493 -6.373 -4.005 1.00 62.24 H new ATOM 0 HB3 LEU A 50 19.392 -7.572 -4.654 1.00 62.24 H new ATOM 0 HG LEU A 50 19.915 -4.811 -5.789 1.00 22.55 H new ATOM 0 HD11 LEU A 50 20.872 -6.062 -7.685 1.00 63.30 H new ATOM 0 HD12 LEU A 50 21.738 -6.399 -6.167 1.00 63.30 H new ATOM 0 HD13 LEU A 50 20.584 -7.589 -6.816 1.00 63.30 H new ATOM 0 HD21 LEU A 50 18.466 -5.516 -7.655 1.00 13.42 H new ATOM 0 HD22 LEU A 50 18.086 -7.022 -6.785 1.00 13.42 H new ATOM 0 HD23 LEU A 50 17.575 -5.454 -6.116 1.00 13.42 H new ATOM 805 N LEU A 51 19.135 -5.845 -1.325 1.00 51.53 N ATOM 806 CA LEU A 51 19.286 -6.320 0.046 1.00 31.11 C ATOM 807 C LEU A 51 17.927 -6.503 0.712 1.00 52.14 C ATOM 808 O LEU A 51 17.784 -7.293 1.645 1.00 1.12 O ATOM 809 CB LEU A 51 20.136 -5.339 0.856 1.00 12.24 C ATOM 810 CG LEU A 51 21.642 -5.381 0.595 1.00 64.35 C ATOM 811 CD1 LEU A 51 22.247 -3.993 0.731 1.00 64.24 C ATOM 812 CD2 LEU A 51 22.320 -6.357 1.547 1.00 75.45 C ATOM 0 H LEU A 51 19.540 -4.925 -1.499 1.00 51.53 H new ATOM 0 HA LEU A 51 19.788 -7.287 0.016 1.00 31.11 H new ATOM 0 HB2 LEU A 51 19.781 -4.329 0.654 1.00 12.24 H new ATOM 0 HB3 LEU A 51 19.966 -5.531 1.915 1.00 12.24 H new ATOM 0 HG LEU A 51 21.805 -5.726 -0.426 1.00 64.35 H new ATOM 0 HD11 LEU A 51 23.319 -4.043 0.542 1.00 64.24 H new ATOM 0 HD12 LEU A 51 21.782 -3.321 0.009 1.00 64.24 H new ATOM 0 HD13 LEU A 51 22.074 -3.618 1.740 1.00 64.24 H new ATOM 0 HD21 LEU A 51 23.391 -6.375 1.348 1.00 75.45 H new ATOM 0 HD22 LEU A 51 22.147 -6.041 2.576 1.00 75.45 H new ATOM 0 HD23 LEU A 51 21.907 -7.355 1.400 1.00 75.45 H new ATOM 824 N GLU A 52 16.931 -5.768 0.226 1.00 25.52 N ATOM 825 CA GLU A 52 15.582 -5.851 0.774 1.00 21.12 C ATOM 826 C GLU A 52 14.700 -6.753 -0.085 1.00 15.10 C ATOM 827 O GLU A 52 13.476 -6.619 -0.093 1.00 73.25 O ATOM 828 CB GLU A 52 14.961 -4.457 0.874 1.00 74.51 C ATOM 829 CG GLU A 52 14.754 -3.785 -0.474 1.00 40.12 C ATOM 830 CD GLU A 52 13.735 -2.664 -0.416 1.00 50.33 C ATOM 831 OE1 GLU A 52 12.539 -2.959 -0.212 1.00 2.33 O ATOM 832 OE2 GLU A 52 14.133 -1.491 -0.575 1.00 71.31 O ATOM 0 H GLU A 52 17.033 -5.109 -0.546 1.00 25.52 H new ATOM 0 HA GLU A 52 15.649 -6.283 1.773 1.00 21.12 H new ATOM 0 HB2 GLU A 52 14.001 -4.532 1.385 1.00 74.51 H new ATOM 0 HB3 GLU A 52 15.602 -3.826 1.490 1.00 74.51 H new ATOM 0 HG2 GLU A 52 15.705 -3.388 -0.828 1.00 40.12 H new ATOM 0 HG3 GLU A 52 14.429 -4.529 -1.201 1.00 40.12 H new ATOM 839 N THR A 53 15.332 -7.672 -0.810 1.00 42.53 N ATOM 840 CA THR A 53 14.606 -8.594 -1.674 1.00 11.31 C ATOM 841 C THR A 53 15.111 -10.022 -1.502 1.00 34.12 C ATOM 842 O THR A 53 16.300 -10.294 -1.670 1.00 15.03 O ATOM 843 CB THR A 53 14.731 -8.192 -3.155 1.00 32.23 C ATOM 844 OG1 THR A 53 16.049 -8.484 -3.633 1.00 52.22 O ATOM 845 CG2 THR A 53 14.435 -6.711 -3.342 1.00 71.25 C ATOM 0 H THR A 53 16.344 -7.797 -0.815 1.00 42.53 H new ATOM 0 HA THR A 53 13.558 -8.545 -1.379 1.00 11.31 H new ATOM 0 HB THR A 53 14.002 -8.767 -3.726 1.00 32.23 H new ATOM 0 HG1 THR A 53 16.701 -8.305 -2.924 1.00 52.22 H new ATOM 0 HG21 THR A 53 14.530 -6.451 -4.396 1.00 71.25 H new ATOM 0 HG22 THR A 53 13.421 -6.497 -3.005 1.00 71.25 H new ATOM 0 HG23 THR A 53 15.142 -6.122 -2.758 1.00 71.25 H new ATOM 853 N SER A 54 14.202 -10.930 -1.166 1.00 5.03 N ATOM 854 CA SER A 54 14.557 -12.331 -0.969 1.00 25.12 C ATOM 855 C SER A 54 15.208 -12.909 -2.222 1.00 74.23 C ATOM 856 O SER A 54 15.952 -13.886 -2.153 1.00 75.41 O ATOM 857 CB SER A 54 13.316 -13.147 -0.603 1.00 3.12 C ATOM 858 OG SER A 54 12.845 -13.887 -1.718 1.00 74.35 O ATOM 0 H SER A 54 13.214 -10.721 -1.024 1.00 5.03 H new ATOM 0 HA SER A 54 15.274 -12.386 -0.150 1.00 25.12 H new ATOM 0 HB2 SER A 54 13.552 -13.827 0.215 1.00 3.12 H new ATOM 0 HB3 SER A 54 12.531 -12.480 -0.247 1.00 3.12 H new ATOM 0 HG SER A 54 12.052 -14.401 -1.458 1.00 74.35 H new ATOM 864 N GLU A 55 14.922 -12.296 -3.366 1.00 12.14 N ATOM 865 CA GLU A 55 15.479 -12.749 -4.635 1.00 20.41 C ATOM 866 C GLU A 55 16.870 -12.163 -4.860 1.00 44.52 C ATOM 867 O GLU A 55 17.808 -12.878 -5.209 1.00 53.25 O ATOM 868 CB GLU A 55 14.556 -12.358 -5.792 1.00 52.01 C ATOM 869 CG GLU A 55 13.721 -13.511 -6.321 1.00 21.24 C ATOM 870 CD GLU A 55 12.861 -13.113 -7.504 1.00 1.51 C ATOM 871 OE1 GLU A 55 13.035 -11.987 -8.014 1.00 54.44 O ATOM 872 OE2 GLU A 55 12.011 -13.929 -7.921 1.00 35.54 O ATOM 0 H GLU A 55 14.308 -11.485 -3.440 1.00 12.14 H new ATOM 0 HA GLU A 55 15.563 -13.835 -4.597 1.00 20.41 H new ATOM 0 HB2 GLU A 55 13.891 -11.561 -5.461 1.00 52.01 H new ATOM 0 HB3 GLU A 55 15.158 -11.954 -6.605 1.00 52.01 H new ATOM 0 HG2 GLU A 55 14.381 -14.328 -6.614 1.00 21.24 H new ATOM 0 HG3 GLU A 55 13.082 -13.888 -5.523 1.00 21.24 H new ATOM 879 N GLY A 56 16.994 -10.855 -4.656 1.00 10.02 N ATOM 880 CA GLY A 56 18.273 -10.193 -4.841 1.00 22.33 C ATOM 881 C GLY A 56 19.371 -10.809 -3.997 1.00 50.20 C ATOM 882 O GLY A 56 20.445 -11.135 -4.505 1.00 51.44 O ATOM 0 H GLY A 56 16.232 -10.242 -4.366 1.00 10.02 H new ATOM 0 HA2 GLY A 56 18.556 -10.243 -5.892 1.00 22.33 H new ATOM 0 HA3 GLY A 56 18.173 -9.138 -4.587 1.00 22.33 H new ATOM 886 N CYS A 57 19.103 -10.966 -2.705 1.00 34.21 N ATOM 887 CA CYS A 57 20.079 -11.544 -1.787 1.00 54.02 C ATOM 888 C CYS A 57 20.599 -12.876 -2.315 1.00 31.51 C ATOM 889 O CYS A 57 21.792 -13.168 -2.226 1.00 62.53 O ATOM 890 CB CYS A 57 19.457 -11.737 -0.404 1.00 43.12 C ATOM 891 SG CYS A 57 20.025 -10.549 0.834 1.00 44.22 S ATOM 0 H CYS A 57 18.219 -10.702 -2.270 1.00 34.21 H new ATOM 0 HA CYS A 57 20.919 -10.854 -1.706 1.00 54.02 H new ATOM 0 HB2 CYS A 57 18.373 -11.664 -0.492 1.00 43.12 H new ATOM 0 HB3 CYS A 57 19.681 -12.745 -0.054 1.00 43.12 H new ATOM 0 HG CYS A 57 19.441 -10.793 1.969 1.00 44.22 H new ATOM 897 N ARG A 58 19.697 -13.683 -2.865 1.00 52.31 N ATOM 898 CA ARG A 58 20.064 -14.986 -3.404 1.00 34.14 C ATOM 899 C ARG A 58 20.991 -14.834 -4.608 1.00 62.11 C ATOM 900 O ARG A 58 21.888 -15.651 -4.819 1.00 52.02 O ATOM 901 CB ARG A 58 18.812 -15.766 -3.807 1.00 4.02 C ATOM 902 CG ARG A 58 19.101 -17.184 -4.272 1.00 25.22 C ATOM 903 CD ARG A 58 18.031 -18.155 -3.797 1.00 24.11 C ATOM 904 NE ARG A 58 17.539 -19.001 -4.882 1.00 71.12 N ATOM 905 CZ ARG A 58 16.595 -19.922 -4.725 1.00 50.33 C ATOM 906 NH1 ARG A 58 16.044 -20.116 -3.534 1.00 14.04 N ATOM 907 NH2 ARG A 58 16.200 -20.652 -5.760 1.00 31.10 N ATOM 0 H ARG A 58 18.706 -13.456 -2.949 1.00 52.31 H new ATOM 0 HA ARG A 58 20.593 -15.537 -2.626 1.00 34.14 H new ATOM 0 HB2 ARG A 58 18.129 -15.803 -2.959 1.00 4.02 H new ATOM 0 HB3 ARG A 58 18.300 -15.228 -4.605 1.00 4.02 H new ATOM 0 HG2 ARG A 58 19.157 -17.207 -5.360 1.00 25.22 H new ATOM 0 HG3 ARG A 58 20.074 -17.500 -3.896 1.00 25.22 H new ATOM 0 HD2 ARG A 58 18.437 -18.783 -3.004 1.00 24.11 H new ATOM 0 HD3 ARG A 58 17.200 -17.596 -3.367 1.00 24.11 H new ATOM 0 HE ARG A 58 17.943 -18.878 -5.811 1.00 71.12 H new ATOM 0 HH11 ARG A 58 16.345 -19.557 -2.736 1.00 14.04 H new ATOM 0 HH12 ARG A 58 15.319 -20.824 -3.417 1.00 14.04 H new ATOM 0 HH21 ARG A 58 16.621 -20.506 -6.677 1.00 31.10 H new ATOM 0 HH22 ARG A 58 15.475 -21.359 -5.638 1.00 31.10 H new ATOM 921 N GLN A 59 20.767 -13.786 -5.393 1.00 40.25 N ATOM 922 CA GLN A 59 21.581 -13.528 -6.574 1.00 3.44 C ATOM 923 C GLN A 59 22.957 -13.001 -6.183 1.00 23.02 C ATOM 924 O GLN A 59 23.977 -13.456 -6.703 1.00 55.02 O ATOM 925 CB GLN A 59 20.880 -12.527 -7.495 1.00 61.45 C ATOM 926 CG GLN A 59 21.717 -12.114 -8.695 1.00 22.52 C ATOM 927 CD GLN A 59 20.932 -11.292 -9.698 1.00 20.24 C ATOM 928 OE1 GLN A 59 19.801 -10.885 -9.435 1.00 23.44 O ATOM 929 NE2 GLN A 59 21.531 -11.044 -10.857 1.00 73.41 N ATOM 0 H GLN A 59 20.028 -13.101 -5.232 1.00 40.25 H new ATOM 0 HA GLN A 59 21.712 -14.470 -7.106 1.00 3.44 H new ATOM 0 HB2 GLN A 59 19.945 -12.963 -7.847 1.00 61.45 H new ATOM 0 HB3 GLN A 59 20.620 -11.638 -6.921 1.00 61.45 H new ATOM 0 HG2 GLN A 59 22.577 -11.538 -8.353 1.00 22.52 H new ATOM 0 HG3 GLN A 59 22.106 -13.006 -9.187 1.00 22.52 H new ATOM 0 HE21 GLN A 59 22.470 -11.401 -11.032 1.00 73.41 H new ATOM 0 HE22 GLN A 59 21.052 -10.496 -11.572 1.00 73.41 H new ATOM 938 N ILE A 60 22.978 -12.040 -5.267 1.00 52.44 N ATOM 939 CA ILE A 60 24.229 -11.452 -4.805 1.00 12.23 C ATOM 940 C ILE A 60 25.186 -12.523 -4.295 1.00 64.34 C ATOM 941 O ILE A 60 26.397 -12.440 -4.500 1.00 11.01 O ATOM 942 CB ILE A 60 23.988 -10.419 -3.689 1.00 74.44 C ATOM 943 CG1 ILE A 60 23.058 -9.310 -4.182 1.00 72.14 C ATOM 944 CG2 ILE A 60 25.311 -9.837 -3.211 1.00 1.44 C ATOM 945 CD1 ILE A 60 22.423 -8.512 -3.063 1.00 4.32 C ATOM 0 H ILE A 60 22.143 -11.651 -4.830 1.00 52.44 H new ATOM 0 HA ILE A 60 24.676 -10.949 -5.663 1.00 12.23 H new ATOM 0 HB ILE A 60 23.509 -10.920 -2.848 1.00 74.44 H new ATOM 0 HG12 ILE A 60 23.621 -8.634 -4.825 1.00 72.14 H new ATOM 0 HG13 ILE A 60 22.272 -9.752 -4.794 1.00 72.14 H new ATOM 0 HG21 ILE A 60 25.124 -9.108 -2.422 1.00 1.44 H new ATOM 0 HG22 ILE A 60 25.942 -10.637 -2.824 1.00 1.44 H new ATOM 0 HG23 ILE A 60 25.816 -9.348 -4.044 1.00 1.44 H new ATOM 0 HD11 ILE A 60 21.776 -7.743 -3.486 1.00 4.32 H new ATOM 0 HD12 ILE A 60 21.832 -9.176 -2.432 1.00 4.32 H new ATOM 0 HD13 ILE A 60 23.203 -8.041 -2.464 1.00 4.32 H new ATOM 957 N LEU A 61 24.634 -13.532 -3.629 1.00 42.20 N ATOM 958 CA LEU A 61 25.438 -14.623 -3.089 1.00 42.24 C ATOM 959 C LEU A 61 25.924 -15.544 -4.203 1.00 34.54 C ATOM 960 O LEU A 61 26.951 -16.208 -4.070 1.00 0.01 O ATOM 961 CB LEU A 61 24.626 -15.424 -2.069 1.00 65.35 C ATOM 962 CG LEU A 61 24.066 -14.633 -0.887 1.00 53.13 C ATOM 963 CD1 LEU A 61 22.803 -15.290 -0.353 1.00 1.55 C ATOM 964 CD2 LEU A 61 25.109 -14.508 0.214 1.00 62.55 C ATOM 0 H LEU A 61 23.633 -13.617 -3.450 1.00 42.20 H new ATOM 0 HA LEU A 61 26.308 -14.190 -2.594 1.00 42.24 H new ATOM 0 HB2 LEU A 61 23.794 -15.899 -2.589 1.00 65.35 H new ATOM 0 HB3 LEU A 61 25.257 -16.223 -1.679 1.00 65.35 H new ATOM 0 HG LEU A 61 23.811 -13.632 -1.235 1.00 53.13 H new ATOM 0 HD11 LEU A 61 22.420 -14.712 0.488 1.00 1.55 H new ATOM 0 HD12 LEU A 61 22.051 -15.327 -1.141 1.00 1.55 H new ATOM 0 HD13 LEU A 61 23.032 -16.303 -0.023 1.00 1.55 H new ATOM 0 HD21 LEU A 61 24.693 -13.942 1.047 1.00 62.55 H new ATOM 0 HD22 LEU A 61 25.396 -15.502 0.558 1.00 62.55 H new ATOM 0 HD23 LEU A 61 25.987 -13.991 -0.173 1.00 62.55 H new ATOM 976 N GLY A 62 25.179 -15.577 -5.305 1.00 20.52 N ATOM 977 CA GLY A 62 25.553 -16.417 -6.428 1.00 61.12 C ATOM 978 C GLY A 62 26.821 -15.943 -7.111 1.00 43.43 C ATOM 979 O GLY A 62 27.469 -16.706 -7.826 1.00 2.54 O ATOM 0 H GLY A 62 24.324 -15.037 -5.439 1.00 20.52 H new ATOM 0 HA2 GLY A 62 25.692 -17.441 -6.081 1.00 61.12 H new ATOM 0 HA3 GLY A 62 24.739 -16.434 -7.152 1.00 61.12 H new ATOM 983 N GLN A 63 27.172 -14.680 -6.891 1.00 4.10 N ATOM 984 CA GLN A 63 28.369 -14.106 -7.494 1.00 72.14 C ATOM 985 C GLN A 63 29.558 -14.204 -6.543 1.00 71.43 C ATOM 986 O GLN A 63 30.678 -14.498 -6.962 1.00 55.12 O ATOM 987 CB GLN A 63 28.124 -12.644 -7.872 1.00 10.30 C ATOM 988 CG GLN A 63 27.939 -12.426 -9.365 1.00 53.01 C ATOM 989 CD GLN A 63 27.594 -10.989 -9.706 1.00 30.30 C ATOM 990 OE1 GLN A 63 28.259 -10.055 -9.256 1.00 10.44 O ATOM 991 NE2 GLN A 63 26.550 -10.805 -10.505 1.00 12.13 N ATOM 0 H GLN A 63 26.646 -14.036 -6.301 1.00 4.10 H new ATOM 0 HA GLN A 63 28.599 -14.674 -8.395 1.00 72.14 H new ATOM 0 HB2 GLN A 63 27.238 -12.285 -7.348 1.00 10.30 H new ATOM 0 HB3 GLN A 63 28.964 -12.042 -7.526 1.00 10.30 H new ATOM 0 HG2 GLN A 63 28.853 -12.710 -9.886 1.00 53.01 H new ATOM 0 HG3 GLN A 63 27.148 -13.082 -9.729 1.00 53.01 H new ATOM 0 HE21 GLN A 63 26.028 -11.608 -10.855 1.00 12.13 H new ATOM 0 HE22 GLN A 63 26.270 -9.860 -10.769 1.00 12.13 H new ATOM 1000 N LEU A 64 29.306 -13.957 -5.262 1.00 74.23 N ATOM 1001 CA LEU A 64 30.357 -14.018 -4.251 1.00 53.42 C ATOM 1002 C LEU A 64 30.677 -15.462 -3.884 1.00 23.22 C ATOM 1003 O LEU A 64 31.786 -15.772 -3.450 1.00 54.43 O ATOM 1004 CB LEU A 64 29.934 -13.243 -3.002 1.00 42.15 C ATOM 1005 CG LEU A 64 29.424 -11.820 -3.234 1.00 71.12 C ATOM 1006 CD1 LEU A 64 28.845 -11.245 -1.951 1.00 73.01 C ATOM 1007 CD2 LEU A 64 30.541 -10.933 -3.763 1.00 51.13 C ATOM 0 H LEU A 64 28.385 -13.713 -4.899 1.00 74.23 H new ATOM 0 HA LEU A 64 31.255 -13.562 -4.668 1.00 53.42 H new ATOM 0 HB2 LEU A 64 29.153 -13.809 -2.495 1.00 42.15 H new ATOM 0 HB3 LEU A 64 30.785 -13.196 -2.323 1.00 42.15 H new ATOM 0 HG LEU A 64 28.631 -11.855 -3.981 1.00 71.12 H new ATOM 0 HD11 LEU A 64 28.487 -10.232 -2.135 1.00 73.01 H new ATOM 0 HD12 LEU A 64 28.016 -11.867 -1.615 1.00 73.01 H new ATOM 0 HD13 LEU A 64 29.617 -11.223 -1.182 1.00 73.01 H new ATOM 0 HD21 LEU A 64 30.160 -9.924 -3.922 1.00 51.13 H new ATOM 0 HD22 LEU A 64 31.356 -10.903 -3.039 1.00 51.13 H new ATOM 0 HD23 LEU A 64 30.909 -11.335 -4.707 1.00 51.13 H new ATOM 1019 N GLN A 65 29.698 -16.344 -4.063 1.00 13.42 N ATOM 1020 CA GLN A 65 29.876 -17.757 -3.752 1.00 63.21 C ATOM 1021 C GLN A 65 31.126 -18.310 -4.429 1.00 53.14 C ATOM 1022 O GLN A 65 32.055 -18.789 -3.777 1.00 53.24 O ATOM 1023 CB GLN A 65 28.648 -18.556 -4.190 1.00 21.34 C ATOM 1024 CG GLN A 65 28.964 -19.992 -4.577 1.00 30.21 C ATOM 1025 CD GLN A 65 27.722 -20.857 -4.673 1.00 22.30 C ATOM 1026 OE1 GLN A 65 26.873 -20.650 -5.540 1.00 53.42 O ATOM 1027 NE2 GLN A 65 27.610 -21.834 -3.781 1.00 62.10 N ATOM 0 H GLN A 65 28.774 -16.104 -4.422 1.00 13.42 H new ATOM 0 HA GLN A 65 29.997 -17.853 -2.673 1.00 63.21 H new ATOM 0 HB2 GLN A 65 27.919 -18.559 -3.380 1.00 21.34 H new ATOM 0 HB3 GLN A 65 28.181 -18.054 -5.038 1.00 21.34 H new ATOM 0 HG2 GLN A 65 29.483 -20.000 -5.535 1.00 30.21 H new ATOM 0 HG3 GLN A 65 29.645 -20.421 -3.842 1.00 30.21 H new ATOM 0 HE21 GLN A 65 28.338 -21.970 -3.079 1.00 62.10 H new ATOM 0 HE22 GLN A 65 26.796 -22.449 -3.797 1.00 62.10 H new ATOM 1036 N PRO A 66 31.152 -18.244 -5.768 1.00 63.53 N ATOM 1037 CA PRO A 66 32.283 -18.734 -6.563 1.00 52.44 C ATOM 1038 C PRO A 66 33.526 -17.866 -6.398 1.00 43.13 C ATOM 1039 O PRO A 66 34.635 -18.282 -6.733 1.00 23.40 O ATOM 1040 CB PRO A 66 31.765 -18.658 -8.001 1.00 35.11 C ATOM 1041 CG PRO A 66 30.716 -17.601 -7.970 1.00 0.25 C ATOM 1042 CD PRO A 66 30.081 -17.686 -6.610 1.00 20.35 C ATOM 0 HA PRO A 66 32.592 -19.734 -6.259 1.00 52.44 H new ATOM 0 HB2 PRO A 66 32.564 -18.402 -8.697 1.00 35.11 H new ATOM 0 HB3 PRO A 66 31.354 -19.614 -8.325 1.00 35.11 H new ATOM 0 HG2 PRO A 66 31.150 -16.615 -8.137 1.00 0.25 H new ATOM 0 HG3 PRO A 66 29.978 -17.761 -8.756 1.00 0.25 H new ATOM 0 HD2 PRO A 66 29.759 -16.707 -6.255 1.00 20.35 H new ATOM 0 HD3 PRO A 66 29.200 -18.328 -6.617 1.00 20.35 H new ATOM 1050 N SER A 67 33.334 -16.657 -5.878 1.00 23.44 N ATOM 1051 CA SER A 67 34.440 -15.729 -5.672 1.00 21.10 C ATOM 1052 C SER A 67 34.828 -15.665 -4.198 1.00 1.23 C ATOM 1053 O SER A 67 35.356 -14.657 -3.726 1.00 45.20 O ATOM 1054 CB SER A 67 34.063 -14.334 -6.173 1.00 44.23 C ATOM 1055 OG SER A 67 35.216 -13.537 -6.382 1.00 41.13 O ATOM 0 H SER A 67 32.423 -16.298 -5.592 1.00 23.44 H new ATOM 0 HA SER A 67 35.297 -16.092 -6.240 1.00 21.10 H new ATOM 0 HB2 SER A 67 33.502 -14.418 -7.104 1.00 44.23 H new ATOM 0 HB3 SER A 67 33.408 -13.849 -5.449 1.00 44.23 H new ATOM 0 HG SER A 67 35.785 -13.570 -5.585 1.00 41.13 H new ATOM 1061 N LEU A 68 34.562 -16.748 -3.476 1.00 13.01 N ATOM 1062 CA LEU A 68 34.883 -16.817 -2.054 1.00 35.24 C ATOM 1063 C LEU A 68 36.361 -17.134 -1.845 1.00 52.44 C ATOM 1064 O LEU A 68 36.989 -16.618 -0.921 1.00 14.32 O ATOM 1065 CB LEU A 68 34.020 -17.878 -1.368 1.00 74.03 C ATOM 1066 CG LEU A 68 32.734 -17.374 -0.711 1.00 12.42 C ATOM 1067 CD1 LEU A 68 31.801 -18.535 -0.405 1.00 33.31 C ATOM 1068 CD2 LEU A 68 33.052 -16.593 0.555 1.00 45.22 C ATOM 0 H LEU A 68 34.125 -17.590 -3.851 1.00 13.01 H new ATOM 0 HA LEU A 68 34.673 -15.844 -1.611 1.00 35.24 H new ATOM 0 HB2 LEU A 68 33.755 -18.635 -2.106 1.00 74.03 H new ATOM 0 HB3 LEU A 68 34.624 -18.372 -0.607 1.00 74.03 H new ATOM 0 HG LEU A 68 32.230 -16.705 -1.408 1.00 12.42 H new ATOM 0 HD11 LEU A 68 30.891 -18.157 0.062 1.00 33.31 H new ATOM 0 HD12 LEU A 68 31.546 -19.051 -1.331 1.00 33.31 H new ATOM 0 HD13 LEU A 68 32.296 -19.230 0.273 1.00 33.31 H new ATOM 0 HD21 LEU A 68 32.125 -16.242 1.009 1.00 45.22 H new ATOM 0 HD22 LEU A 68 33.579 -17.238 1.258 1.00 45.22 H new ATOM 0 HD23 LEU A 68 33.681 -15.738 0.307 1.00 45.22 H new ATOM 1080 N GLN A 69 36.907 -17.982 -2.708 1.00 31.14 N ATOM 1081 CA GLN A 69 38.311 -18.365 -2.618 1.00 73.40 C ATOM 1082 C GLN A 69 39.220 -17.157 -2.820 1.00 2.04 C ATOM 1083 O GLN A 69 40.071 -16.859 -1.983 1.00 73.04 O ATOM 1084 CB GLN A 69 38.636 -19.442 -3.654 1.00 14.13 C ATOM 1085 CG GLN A 69 39.516 -20.559 -3.116 1.00 21.23 C ATOM 1086 CD GLN A 69 38.857 -21.921 -3.218 1.00 2.02 C ATOM 1087 OE1 GLN A 69 38.105 -22.326 -2.332 1.00 3.44 O ATOM 1088 NE2 GLN A 69 39.139 -22.635 -4.302 1.00 45.33 N ATOM 0 H GLN A 69 36.399 -18.418 -3.478 1.00 31.14 H new ATOM 0 HA GLN A 69 38.488 -18.766 -1.620 1.00 73.40 H new ATOM 0 HB2 GLN A 69 37.705 -19.871 -4.024 1.00 14.13 H new ATOM 0 HB3 GLN A 69 39.133 -18.977 -4.505 1.00 14.13 H new ATOM 0 HG2 GLN A 69 40.457 -20.573 -3.666 1.00 21.23 H new ATOM 0 HG3 GLN A 69 39.760 -20.354 -2.073 1.00 21.23 H new ATOM 0 HE21 GLN A 69 39.768 -22.259 -5.011 1.00 45.33 H new ATOM 0 HE22 GLN A 69 38.726 -23.560 -4.425 1.00 45.33 H new ATOM 1097 N THR A 70 39.033 -16.464 -3.940 1.00 52.43 N ATOM 1098 CA THR A 70 39.836 -15.288 -4.254 1.00 23.32 C ATOM 1099 C THR A 70 39.129 -14.008 -3.823 1.00 20.05 C ATOM 1100 O THR A 70 39.324 -12.950 -4.419 1.00 45.31 O ATOM 1101 CB THR A 70 40.147 -15.208 -5.760 1.00 41.14 C ATOM 1102 OG1 THR A 70 38.939 -15.333 -6.518 1.00 62.11 O ATOM 1103 CG2 THR A 70 41.125 -16.299 -6.170 1.00 13.22 C ATOM 0 H THR A 70 38.333 -16.697 -4.644 1.00 52.43 H new ATOM 0 HA THR A 70 40.771 -15.386 -3.702 1.00 23.32 H new ATOM 0 HB THR A 70 40.603 -14.239 -5.963 1.00 41.14 H new ATOM 0 HG1 THR A 70 39.146 -15.279 -7.474 1.00 62.11 H new ATOM 0 HG21 THR A 70 41.329 -16.222 -7.238 1.00 13.22 H new ATOM 0 HG22 THR A 70 42.055 -16.182 -5.613 1.00 13.22 H new ATOM 0 HG23 THR A 70 40.693 -17.276 -5.953 1.00 13.22 H new ATOM 1111 N GLY A 71 38.307 -14.112 -2.782 1.00 31.42 N ATOM 1112 CA GLY A 71 37.585 -12.955 -2.289 1.00 53.51 C ATOM 1113 C GLY A 71 38.302 -12.267 -1.144 1.00 31.12 C ATOM 1114 O GLY A 71 38.735 -12.918 -0.194 1.00 23.34 O ATOM 0 H GLY A 71 38.129 -14.977 -2.272 1.00 31.42 H new ATOM 0 HA2 GLY A 71 37.444 -12.245 -3.104 1.00 53.51 H new ATOM 0 HA3 GLY A 71 36.593 -13.263 -1.959 1.00 53.51 H new ATOM 1118 N SER A 72 38.430 -10.947 -1.236 1.00 72.51 N ATOM 1119 CA SER A 72 39.106 -10.172 -0.202 1.00 51.52 C ATOM 1120 C SER A 72 38.207 -9.993 1.018 1.00 13.02 C ATOM 1121 O SER A 72 37.096 -10.521 1.066 1.00 34.03 O ATOM 1122 CB SER A 72 39.520 -8.804 -0.749 1.00 24.04 C ATOM 1123 OG SER A 72 38.395 -8.079 -1.214 1.00 73.51 O ATOM 0 H SER A 72 38.075 -10.392 -2.015 1.00 72.51 H new ATOM 0 HA SER A 72 39.998 -10.719 0.103 1.00 51.52 H new ATOM 0 HB2 SER A 72 40.026 -8.235 0.031 1.00 24.04 H new ATOM 0 HB3 SER A 72 40.234 -8.935 -1.562 1.00 24.04 H new ATOM 0 HG SER A 72 38.686 -7.208 -1.557 1.00 73.51 H new ATOM 1129 N GLU A 73 38.696 -9.244 2.001 1.00 32.12 N ATOM 1130 CA GLU A 73 37.937 -8.995 3.220 1.00 45.14 C ATOM 1131 C GLU A 73 36.566 -8.408 2.899 1.00 44.03 C ATOM 1132 O GLU A 73 35.586 -8.679 3.591 1.00 65.10 O ATOM 1133 CB GLU A 73 38.707 -8.047 4.142 1.00 53.31 C ATOM 1134 CG GLU A 73 39.839 -8.719 4.899 1.00 71.41 C ATOM 1135 CD GLU A 73 39.342 -9.675 5.967 1.00 13.44 C ATOM 1136 OE1 GLU A 73 39.082 -9.216 7.098 1.00 70.43 O ATOM 1137 OE2 GLU A 73 39.213 -10.881 5.670 1.00 0.23 O ATOM 0 H GLU A 73 39.614 -8.799 1.977 1.00 32.12 H new ATOM 0 HA GLU A 73 37.794 -9.949 3.728 1.00 45.14 H new ATOM 0 HB2 GLU A 73 39.114 -7.228 3.549 1.00 53.31 H new ATOM 0 HB3 GLU A 73 38.013 -7.607 4.858 1.00 53.31 H new ATOM 0 HG2 GLU A 73 40.469 -9.263 4.195 1.00 71.41 H new ATOM 0 HG3 GLU A 73 40.464 -7.956 5.363 1.00 71.41 H new ATOM 1144 N GLU A 74 36.507 -7.602 1.844 1.00 32.45 N ATOM 1145 CA GLU A 74 35.257 -6.975 1.430 1.00 63.55 C ATOM 1146 C GLU A 74 34.258 -8.022 0.946 1.00 14.14 C ATOM 1147 O GLU A 74 33.057 -7.914 1.197 1.00 43.35 O ATOM 1148 CB GLU A 74 35.515 -5.949 0.326 1.00 25.44 C ATOM 1149 CG GLU A 74 36.494 -4.858 0.724 1.00 72.11 C ATOM 1150 CD GLU A 74 37.197 -4.241 -0.469 1.00 74.24 C ATOM 1151 OE1 GLU A 74 36.623 -4.273 -1.577 1.00 15.42 O ATOM 1152 OE2 GLU A 74 38.322 -3.726 -0.295 1.00 63.44 O ATOM 0 H GLU A 74 37.310 -7.368 1.260 1.00 32.45 H new ATOM 0 HA GLU A 74 34.832 -6.465 2.295 1.00 63.55 H new ATOM 0 HB2 GLU A 74 35.897 -6.465 -0.555 1.00 25.44 H new ATOM 0 HB3 GLU A 74 34.569 -5.489 0.041 1.00 25.44 H new ATOM 0 HG2 GLU A 74 35.962 -4.079 1.270 1.00 72.11 H new ATOM 0 HG3 GLU A 74 37.238 -5.273 1.404 1.00 72.11 H new ATOM 1159 N LEU A 75 34.762 -9.033 0.248 1.00 74.54 N ATOM 1160 CA LEU A 75 33.915 -10.100 -0.274 1.00 53.10 C ATOM 1161 C LEU A 75 33.373 -10.968 0.857 1.00 71.53 C ATOM 1162 O LEU A 75 32.166 -11.182 0.964 1.00 65.14 O ATOM 1163 CB LEU A 75 34.700 -10.963 -1.264 1.00 21.41 C ATOM 1164 CG LEU A 75 33.879 -11.639 -2.362 1.00 32.12 C ATOM 1165 CD1 LEU A 75 34.596 -11.542 -3.701 1.00 52.02 C ATOM 1166 CD2 LEU A 75 33.606 -13.093 -2.006 1.00 0.12 C ATOM 0 H LEU A 75 35.753 -9.137 0.030 1.00 74.54 H new ATOM 0 HA LEU A 75 33.072 -9.641 -0.791 1.00 53.10 H new ATOM 0 HB2 LEU A 75 35.459 -10.339 -1.737 1.00 21.41 H new ATOM 0 HB3 LEU A 75 35.227 -11.736 -0.704 1.00 21.41 H new ATOM 0 HG LEU A 75 32.924 -11.121 -2.446 1.00 32.12 H new ATOM 0 HD11 LEU A 75 33.997 -12.029 -4.471 1.00 52.02 H new ATOM 0 HD12 LEU A 75 34.740 -10.493 -3.962 1.00 52.02 H new ATOM 0 HD13 LEU A 75 35.566 -12.034 -3.631 1.00 52.02 H new ATOM 0 HD21 LEU A 75 33.020 -13.558 -2.799 1.00 0.12 H new ATOM 0 HD22 LEU A 75 34.551 -13.624 -1.894 1.00 0.12 H new ATOM 0 HD23 LEU A 75 33.050 -13.140 -1.069 1.00 0.12 H new ATOM 1178 N ARG A 76 34.275 -11.463 1.699 1.00 62.31 N ATOM 1179 CA ARG A 76 33.888 -12.308 2.823 1.00 44.54 C ATOM 1180 C ARG A 76 32.836 -11.616 3.686 1.00 1.44 C ATOM 1181 O ARG A 76 31.830 -12.219 4.059 1.00 63.21 O ATOM 1182 CB ARG A 76 35.111 -12.656 3.673 1.00 54.31 C ATOM 1183 CG ARG A 76 35.304 -14.149 3.879 1.00 54.13 C ATOM 1184 CD ARG A 76 34.355 -14.693 4.935 1.00 11.24 C ATOM 1185 NE ARG A 76 34.847 -14.453 6.289 1.00 31.55 N ATOM 1186 CZ ARG A 76 35.852 -15.128 6.836 1.00 21.13 C ATOM 1187 NH1 ARG A 76 36.469 -16.079 6.148 1.00 44.32 N ATOM 1188 NH2 ARG A 76 36.242 -14.852 8.074 1.00 60.01 N ATOM 0 H ARG A 76 35.278 -11.294 1.624 1.00 62.31 H new ATOM 0 HA ARG A 76 33.459 -13.227 2.423 1.00 44.54 H new ATOM 0 HB2 ARG A 76 36.002 -12.245 3.198 1.00 54.31 H new ATOM 0 HB3 ARG A 76 35.017 -12.173 4.645 1.00 54.31 H new ATOM 0 HG2 ARG A 76 35.140 -14.672 2.937 1.00 54.13 H new ATOM 0 HG3 ARG A 76 36.334 -14.346 4.177 1.00 54.13 H new ATOM 0 HD2 ARG A 76 33.376 -14.228 4.817 1.00 11.24 H new ATOM 0 HD3 ARG A 76 34.219 -15.764 4.783 1.00 11.24 H new ATOM 0 HE ARG A 76 34.394 -13.728 6.845 1.00 31.55 H new ATOM 0 HH11 ARG A 76 36.172 -16.294 5.196 1.00 44.32 H new ATOM 0 HH12 ARG A 76 37.240 -16.596 6.571 1.00 44.32 H new ATOM 0 HH21 ARG A 76 35.770 -14.121 8.606 1.00 60.01 H new ATOM 0 HH22 ARG A 76 37.014 -15.371 8.493 1.00 60.01 H new ATOM 1202 N SER A 77 33.076 -10.346 3.998 1.00 3.21 N ATOM 1203 CA SER A 77 32.152 -9.574 4.819 1.00 55.22 C ATOM 1204 C SER A 77 30.766 -9.528 4.184 1.00 31.23 C ATOM 1205 O SER A 77 29.751 -9.661 4.868 1.00 63.51 O ATOM 1206 CB SER A 77 32.681 -8.151 5.018 1.00 51.13 C ATOM 1207 OG SER A 77 33.635 -8.103 6.065 1.00 45.41 O ATOM 0 H SER A 77 33.902 -9.831 3.694 1.00 3.21 H new ATOM 0 HA SER A 77 32.071 -10.065 5.789 1.00 55.22 H new ATOM 0 HB2 SER A 77 33.134 -7.795 4.093 1.00 51.13 H new ATOM 0 HB3 SER A 77 31.853 -7.480 5.246 1.00 51.13 H new ATOM 0 HG SER A 77 33.438 -7.343 6.652 1.00 45.41 H new ATOM 1213 N LEU A 78 30.731 -9.340 2.868 1.00 64.34 N ATOM 1214 CA LEU A 78 29.471 -9.278 2.138 1.00 53.44 C ATOM 1215 C LEU A 78 28.700 -10.587 2.268 1.00 23.21 C ATOM 1216 O LEU A 78 27.557 -10.604 2.722 1.00 4.54 O ATOM 1217 CB LEU A 78 29.729 -8.968 0.662 1.00 1.42 C ATOM 1218 CG LEU A 78 29.444 -7.533 0.217 1.00 64.44 C ATOM 1219 CD1 LEU A 78 27.998 -7.162 0.506 1.00 51.10 C ATOM 1220 CD2 LEU A 78 30.393 -6.563 0.905 1.00 51.21 C ATOM 0 H LEU A 78 31.561 -9.228 2.286 1.00 64.34 H new ATOM 0 HA LEU A 78 28.868 -8.480 2.571 1.00 53.44 H new ATOM 0 HB2 LEU A 78 30.772 -9.195 0.441 1.00 1.42 H new ATOM 0 HB3 LEU A 78 29.121 -9.642 0.058 1.00 1.42 H new ATOM 0 HG LEU A 78 29.606 -7.467 -0.859 1.00 64.44 H new ATOM 0 HD11 LEU A 78 27.814 -6.138 0.183 1.00 51.10 H new ATOM 0 HD12 LEU A 78 27.334 -7.838 -0.033 1.00 51.10 H new ATOM 0 HD13 LEU A 78 27.808 -7.244 1.576 1.00 51.10 H new ATOM 0 HD21 LEU A 78 30.176 -5.547 0.576 1.00 51.21 H new ATOM 0 HD22 LEU A 78 30.263 -6.631 1.985 1.00 51.21 H new ATOM 0 HD23 LEU A 78 31.421 -6.816 0.647 1.00 51.21 H new ATOM 1232 N TYR A 79 29.336 -11.683 1.868 1.00 64.23 N ATOM 1233 CA TYR A 79 28.711 -12.998 1.939 1.00 44.51 C ATOM 1234 C TYR A 79 28.164 -13.266 3.338 1.00 65.21 C ATOM 1235 O TYR A 79 27.178 -13.984 3.504 1.00 75.11 O ATOM 1236 CB TYR A 79 29.715 -14.086 1.555 1.00 32.20 C ATOM 1237 CG TYR A 79 29.078 -15.302 0.924 1.00 20.45 C ATOM 1238 CD1 TYR A 79 28.385 -15.204 -0.276 1.00 12.12 C ATOM 1239 CD2 TYR A 79 29.171 -16.551 1.525 1.00 45.14 C ATOM 1240 CE1 TYR A 79 27.801 -16.312 -0.858 1.00 62.53 C ATOM 1241 CE2 TYR A 79 28.591 -17.666 0.951 1.00 73.11 C ATOM 1242 CZ TYR A 79 27.907 -17.542 -0.240 1.00 55.13 C ATOM 1243 OH TYR A 79 27.328 -18.649 -0.815 1.00 44.11 O ATOM 0 H TYR A 79 30.284 -11.686 1.491 1.00 64.23 H new ATOM 0 HA TYR A 79 27.880 -13.015 1.234 1.00 44.51 H new ATOM 0 HB2 TYR A 79 30.444 -13.667 0.862 1.00 32.20 H new ATOM 0 HB3 TYR A 79 30.263 -14.394 2.446 1.00 32.20 H new ATOM 0 HD1 TYR A 79 28.301 -14.244 -0.763 1.00 12.12 H new ATOM 0 HD2 TYR A 79 29.706 -16.652 2.458 1.00 45.14 H new ATOM 0 HE1 TYR A 79 27.265 -16.217 -1.791 1.00 62.53 H new ATOM 0 HE2 TYR A 79 28.673 -18.629 1.432 1.00 73.11 H new ATOM 0 HH TYR A 79 27.496 -19.435 -0.254 1.00 44.11 H new ATOM 1253 N ASN A 80 28.811 -12.683 4.342 1.00 32.35 N ATOM 1254 CA ASN A 80 28.392 -12.858 5.727 1.00 1.33 C ATOM 1255 C ASN A 80 27.070 -12.142 5.990 1.00 2.14 C ATOM 1256 O ASN A 80 26.073 -12.766 6.352 1.00 4.14 O ATOM 1257 CB ASN A 80 29.467 -12.332 6.678 1.00 75.33 C ATOM 1258 CG ASN A 80 30.456 -13.407 7.086 1.00 24.33 C ATOM 1259 OD1 ASN A 80 30.154 -14.599 7.024 1.00 13.22 O ATOM 1260 ND2 ASN A 80 31.644 -12.990 7.507 1.00 14.43 N ATOM 0 H ASN A 80 29.628 -12.085 4.222 1.00 32.35 H new ATOM 0 HA ASN A 80 28.250 -13.924 5.905 1.00 1.33 H new ATOM 0 HB2 ASN A 80 30.003 -11.513 6.199 1.00 75.33 H new ATOM 0 HB3 ASN A 80 28.991 -11.923 7.569 1.00 75.33 H new ATOM 0 HD21 ASN A 80 32.350 -13.668 7.795 1.00 14.43 H new ATOM 0 HD22 ASN A 80 31.851 -11.992 7.542 1.00 14.43 H new ATOM 1267 N THR A 81 27.069 -10.825 5.803 1.00 31.53 N ATOM 1268 CA THR A 81 25.872 -10.023 6.020 1.00 20.14 C ATOM 1269 C THR A 81 24.734 -10.479 5.112 1.00 54.43 C ATOM 1270 O THR A 81 23.612 -10.695 5.570 1.00 42.13 O ATOM 1271 CB THR A 81 26.145 -8.528 5.770 1.00 62.24 C ATOM 1272 OG1 THR A 81 27.253 -8.093 6.567 1.00 52.01 O ATOM 1273 CG2 THR A 81 24.917 -7.692 6.101 1.00 34.22 C ATOM 0 H THR A 81 27.885 -10.292 5.502 1.00 31.53 H new ATOM 0 HA THR A 81 25.582 -10.162 7.061 1.00 20.14 H new ATOM 0 HB THR A 81 26.382 -8.395 4.715 1.00 62.24 H new ATOM 0 HG1 THR A 81 27.056 -7.212 6.949 1.00 52.01 H new ATOM 0 HG21 THR A 81 25.133 -6.640 5.917 1.00 34.22 H new ATOM 0 HG22 THR A 81 24.083 -8.006 5.474 1.00 34.22 H new ATOM 0 HG23 THR A 81 24.654 -7.830 7.150 1.00 34.22 H new ATOM 1281 N ILE A 82 25.031 -10.620 3.825 1.00 63.44 N ATOM 1282 CA ILE A 82 24.032 -11.052 2.855 1.00 74.22 C ATOM 1283 C ILE A 82 23.410 -12.384 3.260 1.00 71.04 C ATOM 1284 O ILE A 82 22.281 -12.694 2.882 1.00 32.42 O ATOM 1285 CB ILE A 82 24.639 -11.189 1.446 1.00 1.32 C ATOM 1286 CG1 ILE A 82 25.241 -9.857 0.994 1.00 71.12 C ATOM 1287 CG2 ILE A 82 23.582 -11.659 0.458 1.00 3.11 C ATOM 1288 CD1 ILE A 82 26.224 -9.994 -0.148 1.00 44.21 C ATOM 0 H ILE A 82 25.954 -10.442 3.430 1.00 63.44 H new ATOM 0 HA ILE A 82 23.258 -10.284 2.836 1.00 74.22 H new ATOM 0 HB ILE A 82 25.435 -11.933 1.480 1.00 1.32 H new ATOM 0 HG12 ILE A 82 24.436 -9.188 0.691 1.00 71.12 H new ATOM 0 HG13 ILE A 82 25.743 -9.389 1.841 1.00 71.12 H new ATOM 0 HG21 ILE A 82 24.026 -11.751 -0.533 1.00 3.11 H new ATOM 0 HG22 ILE A 82 23.194 -12.628 0.773 1.00 3.11 H new ATOM 0 HG23 ILE A 82 22.767 -10.935 0.425 1.00 3.11 H new ATOM 0 HD11 ILE A 82 26.610 -9.010 -0.416 1.00 44.21 H new ATOM 0 HD12 ILE A 82 27.049 -10.637 0.157 1.00 44.21 H new ATOM 0 HD13 ILE A 82 25.722 -10.433 -1.010 1.00 44.21 H new ATOM 1300 N ALA A 83 24.156 -13.166 4.034 1.00 45.54 N ATOM 1301 CA ALA A 83 23.675 -14.463 4.495 1.00 61.51 C ATOM 1302 C ALA A 83 22.636 -14.305 5.599 1.00 12.42 C ATOM 1303 O ALA A 83 21.477 -14.687 5.435 1.00 23.53 O ATOM 1304 CB ALA A 83 24.839 -15.313 4.983 1.00 72.52 C ATOM 0 H ALA A 83 25.094 -12.925 4.354 1.00 45.54 H new ATOM 0 HA ALA A 83 23.198 -14.965 3.653 1.00 61.51 H new ATOM 0 HB1 ALA A 83 24.466 -16.279 5.324 1.00 72.52 H new ATOM 0 HB2 ALA A 83 25.546 -15.465 4.167 1.00 72.52 H new ATOM 0 HB3 ALA A 83 25.340 -14.805 5.807 1.00 72.52 H new ATOM 1310 N VAL A 84 23.057 -13.737 6.725 1.00 23.13 N ATOM 1311 CA VAL A 84 22.161 -13.527 7.857 1.00 11.31 C ATOM 1312 C VAL A 84 20.889 -12.807 7.424 1.00 23.01 C ATOM 1313 O VAL A 84 19.798 -13.101 7.914 1.00 73.54 O ATOM 1314 CB VAL A 84 22.846 -12.712 8.970 1.00 11.42 C ATOM 1315 CG1 VAL A 84 21.889 -12.484 10.130 1.00 63.23 C ATOM 1316 CG2 VAL A 84 24.112 -13.412 9.441 1.00 44.24 C ATOM 0 H VAL A 84 24.012 -13.414 6.878 1.00 23.13 H new ATOM 0 HA VAL A 84 21.903 -14.513 8.245 1.00 11.31 H new ATOM 0 HB VAL A 84 23.126 -11.740 8.565 1.00 11.42 H new ATOM 0 HG11 VAL A 84 22.390 -11.907 10.907 1.00 63.23 H new ATOM 0 HG12 VAL A 84 21.015 -11.937 9.778 1.00 63.23 H new ATOM 0 HG13 VAL A 84 21.576 -13.445 10.537 1.00 63.23 H new ATOM 0 HG21 VAL A 84 24.583 -12.822 10.227 1.00 44.24 H new ATOM 0 HG22 VAL A 84 23.859 -14.399 9.829 1.00 44.24 H new ATOM 0 HG23 VAL A 84 24.802 -13.518 8.604 1.00 44.24 H new ATOM 1326 N LEU A 85 21.035 -11.862 6.501 1.00 63.24 N ATOM 1327 CA LEU A 85 19.896 -11.099 6.001 1.00 71.30 C ATOM 1328 C LEU A 85 19.018 -11.961 5.100 1.00 21.03 C ATOM 1329 O LEU A 85 17.797 -11.989 5.249 1.00 43.43 O ATOM 1330 CB LEU A 85 20.381 -9.868 5.234 1.00 42.12 C ATOM 1331 CG LEU A 85 19.334 -8.785 4.974 1.00 52.52 C ATOM 1332 CD1 LEU A 85 19.068 -7.984 6.239 1.00 72.14 C ATOM 1333 CD2 LEU A 85 19.783 -7.868 3.845 1.00 2.22 C ATOM 0 H LEU A 85 21.930 -11.606 6.084 1.00 63.24 H new ATOM 0 HA LEU A 85 19.301 -10.776 6.855 1.00 71.30 H new ATOM 0 HB2 LEU A 85 21.207 -9.422 5.788 1.00 42.12 H new ATOM 0 HB3 LEU A 85 20.781 -10.196 4.275 1.00 42.12 H new ATOM 0 HG LEU A 85 18.405 -9.270 4.674 1.00 52.52 H new ATOM 0 HD11 LEU A 85 18.320 -7.218 6.034 1.00 72.14 H new ATOM 0 HD12 LEU A 85 18.701 -8.649 7.021 1.00 72.14 H new ATOM 0 HD13 LEU A 85 19.992 -7.510 6.570 1.00 72.14 H new ATOM 0 HD21 LEU A 85 19.025 -7.103 3.674 1.00 2.22 H new ATOM 0 HD22 LEU A 85 20.725 -7.391 4.116 1.00 2.22 H new ATOM 0 HD23 LEU A 85 19.921 -8.452 2.935 1.00 2.22 H new ATOM 1345 N TYR A 86 19.648 -12.663 4.164 1.00 62.22 N ATOM 1346 CA TYR A 86 18.923 -13.526 3.239 1.00 41.30 C ATOM 1347 C TYR A 86 18.066 -14.537 3.994 1.00 13.12 C ATOM 1348 O TYR A 86 16.873 -14.681 3.723 1.00 22.11 O ATOM 1349 CB TYR A 86 19.902 -14.257 2.317 1.00 52.25 C ATOM 1350 CG TYR A 86 19.250 -15.323 1.466 1.00 32.03 C ATOM 1351 CD1 TYR A 86 18.362 -14.985 0.453 1.00 34.10 C ATOM 1352 CD2 TYR A 86 19.525 -16.669 1.675 1.00 5.21 C ATOM 1353 CE1 TYR A 86 17.764 -15.956 -0.327 1.00 34.21 C ATOM 1354 CE2 TYR A 86 18.933 -17.647 0.899 1.00 42.11 C ATOM 1355 CZ TYR A 86 18.053 -17.285 -0.100 1.00 3.12 C ATOM 1356 OH TYR A 86 17.461 -18.256 -0.876 1.00 2.51 O ATOM 0 H TYR A 86 20.659 -12.651 4.026 1.00 62.22 H new ATOM 0 HA TYR A 86 18.266 -12.899 2.637 1.00 41.30 H new ATOM 0 HB2 TYR A 86 20.387 -13.530 1.666 1.00 52.25 H new ATOM 0 HB3 TYR A 86 20.685 -14.715 2.922 1.00 52.25 H new ATOM 0 HD1 TYR A 86 18.135 -13.945 0.272 1.00 34.10 H new ATOM 0 HD2 TYR A 86 20.213 -16.955 2.457 1.00 5.21 H new ATOM 0 HE1 TYR A 86 17.074 -15.676 -1.110 1.00 34.21 H new ATOM 0 HE2 TYR A 86 19.158 -18.689 1.073 1.00 42.11 H new ATOM 0 HH TYR A 86 17.772 -19.140 -0.588 1.00 2.51 H new ATOM 1366 N CYS A 87 18.682 -15.234 4.942 1.00 61.30 N ATOM 1367 CA CYS A 87 17.977 -16.232 5.738 1.00 22.24 C ATOM 1368 C CYS A 87 16.707 -15.646 6.345 1.00 72.51 C ATOM 1369 O CYS A 87 15.725 -16.355 6.563 1.00 22.13 O ATOM 1370 CB CYS A 87 18.886 -16.769 6.844 1.00 31.34 C ATOM 1371 SG CYS A 87 20.356 -17.631 6.238 1.00 61.25 S ATOM 0 H CYS A 87 19.668 -15.126 5.178 1.00 61.30 H new ATOM 0 HA CYS A 87 17.696 -17.054 5.079 1.00 22.24 H new ATOM 0 HB2 CYS A 87 19.200 -15.939 7.477 1.00 31.34 H new ATOM 0 HB3 CYS A 87 18.312 -17.450 7.473 1.00 31.34 H new ATOM 0 HG CYS A 87 21.200 -16.766 5.759 1.00 61.25 H new ATOM 1377 N VAL A 88 16.735 -14.346 6.619 1.00 73.32 N ATOM 1378 CA VAL A 88 15.587 -13.663 7.204 1.00 13.01 C ATOM 1379 C VAL A 88 14.492 -13.442 6.166 1.00 13.23 C ATOM 1380 O VAL A 88 13.307 -13.613 6.451 1.00 40.52 O ATOM 1381 CB VAL A 88 15.989 -12.304 7.807 1.00 53.33 C ATOM 1382 CG1 VAL A 88 14.786 -11.626 8.447 1.00 23.34 C ATOM 1383 CG2 VAL A 88 17.111 -12.482 8.818 1.00 33.22 C ATOM 0 H VAL A 88 17.540 -13.744 6.445 1.00 73.32 H new ATOM 0 HA VAL A 88 15.207 -14.306 7.998 1.00 13.01 H new ATOM 0 HB VAL A 88 16.352 -11.663 7.004 1.00 53.33 H new ATOM 0 HG11 VAL A 88 15.090 -10.667 8.868 1.00 23.34 H new ATOM 0 HG12 VAL A 88 14.016 -11.464 7.693 1.00 23.34 H new ATOM 0 HG13 VAL A 88 14.390 -12.261 9.240 1.00 23.34 H new ATOM 0 HG21 VAL A 88 17.383 -11.512 9.234 1.00 33.22 H new ATOM 0 HG22 VAL A 88 16.777 -13.140 9.620 1.00 33.22 H new ATOM 0 HG23 VAL A 88 17.978 -12.921 8.325 1.00 33.22 H new ATOM 1393 N HIS A 89 14.898 -13.061 4.958 1.00 1.52 N ATOM 1394 CA HIS A 89 13.952 -12.817 3.874 1.00 40.21 C ATOM 1395 C HIS A 89 13.387 -14.131 3.342 1.00 14.12 C ATOM 1396 O HIS A 89 12.388 -14.067 2.626 1.00 4.15 O ATOM 1397 CB HIS A 89 14.628 -12.044 2.742 1.00 13.42 C ATOM 1398 CG HIS A 89 15.135 -10.697 3.156 1.00 41.15 C ATOM 1399 ND1 HIS A 89 14.640 -10.008 4.243 1.00 30.11 N ATOM 1400 CD2 HIS A 89 16.101 -9.911 2.624 1.00 4.12 C ATOM 1401 CE1 HIS A 89 15.278 -8.857 4.360 1.00 52.42 C ATOM 1402 NE2 HIS A 89 16.170 -8.775 3.390 1.00 12.12 N ATOM 0 H HIS A 89 15.875 -12.915 4.705 1.00 1.52 H new ATOM 0 HA HIS A 89 13.130 -12.221 4.269 1.00 40.21 H new ATOM 0 HB2 HIS A 89 15.460 -12.634 2.357 1.00 13.42 H new ATOM 0 HB3 HIS A 89 13.919 -11.920 1.923 1.00 13.42 H new ATOM 0 HD2 HIS A 89 16.705 -10.137 1.758 1.00 4.12 H new ATOM 0 HE1 HIS A 89 15.100 -8.110 5.120 1.00 52.42 H new ATOM 0 HE2 HIS A 89 16.807 -7.994 3.235 1.00 12.12 H new ATOM 1411 N GLN A 90 13.978 -15.278 3.661 1.00 2.05 N ATOM 1412 CA GLN A 90 13.474 -16.557 3.175 1.00 44.30 C ATOM 1413 C GLN A 90 12.631 -17.250 4.240 1.00 21.51 C ATOM 1414 O GLN A 90 11.408 -17.333 4.122 1.00 33.12 O ATOM 1415 CB GLN A 90 14.635 -17.462 2.757 1.00 71.34 C ATOM 1416 CG GLN A 90 14.822 -17.556 1.252 1.00 61.13 C ATOM 1417 CD GLN A 90 13.707 -18.327 0.573 1.00 43.51 C ATOM 1418 OE1 GLN A 90 13.754 -19.553 0.475 1.00 40.41 O ATOM 1419 NE2 GLN A 90 12.695 -17.609 0.099 1.00 11.02 N ATOM 0 H GLN A 90 14.805 -15.348 4.253 1.00 2.05 H new ATOM 0 HA GLN A 90 12.843 -16.364 2.307 1.00 44.30 H new ATOM 0 HB2 GLN A 90 15.555 -17.089 3.206 1.00 71.34 H new ATOM 0 HB3 GLN A 90 14.467 -18.462 3.157 1.00 71.34 H new ATOM 0 HG2 GLN A 90 14.872 -16.551 0.832 1.00 61.13 H new ATOM 0 HG3 GLN A 90 15.775 -18.039 1.037 1.00 61.13 H new ATOM 0 HE21 GLN A 90 12.697 -16.594 0.202 1.00 11.02 H new ATOM 0 HE22 GLN A 90 11.916 -18.072 -0.368 1.00 11.02 H new ATOM 1428 N ARG A 91 13.293 -17.749 5.279 1.00 51.11 N ATOM 1429 CA ARG A 91 12.605 -18.438 6.365 1.00 55.32 C ATOM 1430 C ARG A 91 13.593 -18.889 7.436 1.00 12.21 C ATOM 1431 O ARG A 91 13.288 -18.858 8.628 1.00 71.24 O ATOM 1432 CB ARG A 91 11.835 -19.643 5.825 1.00 5.25 C ATOM 1433 CG ARG A 91 12.636 -20.492 4.852 1.00 31.23 C ATOM 1434 CD ARG A 91 12.128 -21.925 4.812 1.00 51.32 C ATOM 1435 NE ARG A 91 12.657 -22.662 3.667 1.00 41.55 N ATOM 1436 CZ ARG A 91 12.251 -22.467 2.417 1.00 75.25 C ATOM 1437 NH1 ARG A 91 11.318 -21.563 2.152 1.00 63.13 N ATOM 1438 NH2 ARG A 91 12.780 -23.177 1.428 1.00 53.23 N ATOM 0 H ARG A 91 14.305 -17.689 5.392 1.00 51.11 H new ATOM 0 HA ARG A 91 11.901 -17.739 6.817 1.00 55.32 H new ATOM 0 HB2 ARG A 91 11.518 -20.266 6.662 1.00 5.25 H new ATOM 0 HB3 ARG A 91 10.930 -19.292 5.328 1.00 5.25 H new ATOM 0 HG2 ARG A 91 12.578 -20.056 3.854 1.00 31.23 H new ATOM 0 HG3 ARG A 91 13.687 -20.486 5.142 1.00 31.23 H new ATOM 0 HD2 ARG A 91 12.410 -22.435 5.733 1.00 51.32 H new ATOM 0 HD3 ARG A 91 11.039 -21.922 4.770 1.00 51.32 H new ATOM 0 HE ARG A 91 13.377 -23.364 3.836 1.00 41.55 H new ATOM 0 HH11 ARG A 91 10.910 -21.015 2.909 1.00 63.13 H new ATOM 0 HH12 ARG A 91 11.009 -21.416 1.191 1.00 63.13 H new ATOM 0 HH21 ARG A 91 13.499 -23.873 1.627 1.00 53.23 H new ATOM 0 HH22 ARG A 91 12.468 -23.027 0.469 1.00 53.23 H new ATOM 1452 N ILE A 92 14.777 -19.308 7.002 1.00 22.33 N ATOM 1453 CA ILE A 92 15.810 -19.766 7.923 1.00 34.15 C ATOM 1454 C ILE A 92 16.058 -18.739 9.023 1.00 61.40 C ATOM 1455 O ILE A 92 16.411 -17.592 8.748 1.00 63.34 O ATOM 1456 CB ILE A 92 17.135 -20.045 7.189 1.00 20.05 C ATOM 1457 CG1 ILE A 92 16.925 -21.094 6.095 1.00 32.20 C ATOM 1458 CG2 ILE A 92 18.199 -20.505 8.174 1.00 31.20 C ATOM 1459 CD1 ILE A 92 16.795 -20.504 4.709 1.00 3.11 C ATOM 0 H ILE A 92 15.045 -19.340 6.018 1.00 22.33 H new ATOM 0 HA ILE A 92 15.449 -20.693 8.368 1.00 34.15 H new ATOM 0 HB ILE A 92 17.476 -19.122 6.721 1.00 20.05 H new ATOM 0 HG12 ILE A 92 17.762 -21.792 6.107 1.00 32.20 H new ATOM 0 HG13 ILE A 92 16.027 -21.669 6.322 1.00 32.20 H new ATOM 0 HG21 ILE A 92 19.130 -20.698 7.640 1.00 31.20 H new ATOM 0 HG22 ILE A 92 18.364 -19.728 8.921 1.00 31.20 H new ATOM 0 HG23 ILE A 92 17.867 -21.419 8.668 1.00 31.20 H new ATOM 0 HD11 ILE A 92 16.648 -21.305 3.985 1.00 3.11 H new ATOM 0 HD12 ILE A 92 15.941 -19.828 4.680 1.00 3.11 H new ATOM 0 HD13 ILE A 92 17.702 -19.953 4.462 1.00 3.11 H new ATOM 1471 N ASP A 93 15.874 -19.161 10.269 1.00 62.10 N ATOM 1472 CA ASP A 93 16.081 -18.279 11.412 1.00 63.13 C ATOM 1473 C ASP A 93 17.323 -18.689 12.197 1.00 62.12 C ATOM 1474 O ASP A 93 17.227 -19.168 13.327 1.00 75.03 O ATOM 1475 CB ASP A 93 14.854 -18.300 12.328 1.00 74.31 C ATOM 1476 CG ASP A 93 13.732 -17.423 11.810 1.00 43.44 C ATOM 1477 OD1 ASP A 93 13.952 -16.203 11.662 1.00 63.01 O ATOM 1478 OD2 ASP A 93 12.631 -17.956 11.555 1.00 62.40 O ATOM 0 H ASP A 93 15.582 -20.107 10.513 1.00 62.10 H new ATOM 0 HA ASP A 93 16.228 -17.266 11.036 1.00 63.13 H new ATOM 0 HB2 ASP A 93 14.495 -19.324 12.427 1.00 74.31 H new ATOM 0 HB3 ASP A 93 15.142 -17.966 13.325 1.00 74.31 H new ATOM 1483 N VAL A 94 18.490 -18.499 11.589 1.00 24.33 N ATOM 1484 CA VAL A 94 19.752 -18.850 12.230 1.00 52.23 C ATOM 1485 C VAL A 94 19.995 -17.994 13.467 1.00 72.32 C ATOM 1486 O VAL A 94 19.205 -17.105 13.788 1.00 24.45 O ATOM 1487 CB VAL A 94 20.939 -18.683 11.262 1.00 41.41 C ATOM 1488 CG1 VAL A 94 20.846 -19.690 10.126 1.00 24.44 C ATOM 1489 CG2 VAL A 94 20.989 -17.262 10.722 1.00 72.34 C ATOM 0 H VAL A 94 18.588 -18.104 10.654 1.00 24.33 H new ATOM 0 HA VAL A 94 19.678 -19.897 12.524 1.00 52.23 H new ATOM 0 HB VAL A 94 21.862 -18.872 11.810 1.00 41.41 H new ATOM 0 HG11 VAL A 94 21.692 -19.557 9.452 1.00 24.44 H new ATOM 0 HG12 VAL A 94 20.861 -20.701 10.534 1.00 24.44 H new ATOM 0 HG13 VAL A 94 19.917 -19.534 9.577 1.00 24.44 H new ATOM 0 HG21 VAL A 94 21.833 -17.161 10.040 1.00 72.34 H new ATOM 0 HG22 VAL A 94 20.064 -17.043 10.189 1.00 72.34 H new ATOM 0 HG23 VAL A 94 21.106 -16.562 11.549 1.00 72.34 H new ATOM 1499 N LYS A 95 21.095 -18.267 14.162 1.00 2.21 N ATOM 1500 CA LYS A 95 21.445 -17.521 15.365 1.00 34.24 C ATOM 1501 C LYS A 95 22.698 -16.680 15.138 1.00 10.10 C ATOM 1502 O LYS A 95 22.898 -15.658 15.794 1.00 13.12 O ATOM 1503 CB LYS A 95 21.667 -18.479 16.537 1.00 21.41 C ATOM 1504 CG LYS A 95 20.565 -18.430 17.581 1.00 12.44 C ATOM 1505 CD LYS A 95 20.949 -17.544 18.755 1.00 1.34 C ATOM 1506 CE LYS A 95 21.508 -18.361 19.909 1.00 31.21 C ATOM 1507 NZ LYS A 95 20.939 -17.935 21.217 1.00 62.43 N ATOM 0 H LYS A 95 21.759 -19.000 13.912 1.00 2.21 H new ATOM 0 HA LYS A 95 20.617 -16.852 15.602 1.00 34.24 H new ATOM 0 HB2 LYS A 95 21.747 -19.496 16.153 1.00 21.41 H new ATOM 0 HB3 LYS A 95 22.618 -18.242 17.014 1.00 21.41 H new ATOM 0 HG2 LYS A 95 19.648 -18.056 17.126 1.00 12.44 H new ATOM 0 HG3 LYS A 95 20.355 -19.438 17.938 1.00 12.44 H new ATOM 0 HD2 LYS A 95 21.690 -16.812 18.433 1.00 1.34 H new ATOM 0 HD3 LYS A 95 20.076 -16.986 19.092 1.00 1.34 H new ATOM 0 HE2 LYS A 95 21.291 -19.417 19.745 1.00 31.21 H new ATOM 0 HE3 LYS A 95 22.593 -18.259 19.934 1.00 31.21 H new ATOM 0 HZ1 LYS A 95 21.345 -18.516 21.978 1.00 62.43 H new ATOM 0 HZ2 LYS A 95 21.167 -16.935 21.386 1.00 62.43 H new ATOM 0 HZ3 LYS A 95 19.906 -18.056 21.202 1.00 62.43 H new ATOM 1521 N ASP A 96 23.537 -17.117 14.205 1.00 1.23 N ATOM 1522 CA ASP A 96 24.769 -16.403 13.890 1.00 64.12 C ATOM 1523 C ASP A 96 25.019 -16.389 12.385 1.00 13.13 C ATOM 1524 O ASP A 96 24.201 -16.876 11.604 1.00 0.24 O ATOM 1525 CB ASP A 96 25.955 -17.046 14.611 1.00 11.33 C ATOM 1526 CG ASP A 96 25.952 -18.557 14.495 1.00 70.45 C ATOM 1527 OD1 ASP A 96 25.213 -19.209 15.261 1.00 43.34 O ATOM 1528 OD2 ASP A 96 26.691 -19.088 13.640 1.00 23.34 O ATOM 0 H ASP A 96 23.386 -17.962 13.654 1.00 1.23 H new ATOM 0 HA ASP A 96 24.661 -15.374 14.232 1.00 64.12 H new ATOM 0 HB2 ASP A 96 26.884 -16.654 14.197 1.00 11.33 H new ATOM 0 HB3 ASP A 96 25.932 -16.765 15.664 1.00 11.33 H new ATOM 1533 N THR A 97 26.155 -15.825 11.984 1.00 24.10 N ATOM 1534 CA THR A 97 26.512 -15.746 10.573 1.00 41.01 C ATOM 1535 C THR A 97 26.980 -17.097 10.047 1.00 64.42 C ATOM 1536 O THR A 97 26.757 -17.434 8.884 1.00 73.30 O ATOM 1537 CB THR A 97 27.619 -14.703 10.333 1.00 33.44 C ATOM 1538 OG1 THR A 97 27.240 -13.445 10.901 1.00 54.40 O ATOM 1539 CG2 THR A 97 27.889 -14.533 8.845 1.00 1.21 C ATOM 0 H THR A 97 26.843 -15.417 12.617 1.00 24.10 H new ATOM 0 HA THR A 97 25.613 -15.443 10.036 1.00 41.01 H new ATOM 0 HB THR A 97 28.531 -15.057 10.814 1.00 33.44 H new ATOM 0 HG1 THR A 97 26.944 -13.579 11.825 1.00 54.40 H new ATOM 0 HG21 THR A 97 28.675 -13.791 8.700 1.00 1.21 H new ATOM 0 HG22 THR A 97 28.207 -15.486 8.422 1.00 1.21 H new ATOM 0 HG23 THR A 97 26.979 -14.200 8.346 1.00 1.21 H new ATOM 1547 N LYS A 98 27.628 -17.872 10.911 1.00 61.11 N ATOM 1548 CA LYS A 98 28.127 -19.189 10.535 1.00 42.32 C ATOM 1549 C LYS A 98 26.974 -20.136 10.217 1.00 4.42 C ATOM 1550 O LYS A 98 26.919 -20.720 9.135 1.00 44.15 O ATOM 1551 CB LYS A 98 28.985 -19.773 11.659 1.00 24.14 C ATOM 1552 CG LYS A 98 30.478 -19.620 11.427 1.00 14.15 C ATOM 1553 CD LYS A 98 31.191 -20.961 11.474 1.00 50.34 C ATOM 1554 CE LYS A 98 32.663 -20.823 11.120 1.00 23.24 C ATOM 1555 NZ LYS A 98 33.536 -20.946 12.319 1.00 73.32 N ATOM 0 H LYS A 98 27.820 -17.610 11.878 1.00 61.11 H new ATOM 0 HA LYS A 98 28.740 -19.076 9.641 1.00 42.32 H new ATOM 0 HB2 LYS A 98 28.720 -19.286 12.597 1.00 24.14 H new ATOM 0 HB3 LYS A 98 28.750 -20.831 11.772 1.00 24.14 H new ATOM 0 HG2 LYS A 98 30.650 -19.149 10.459 1.00 14.15 H new ATOM 0 HG3 LYS A 98 30.898 -18.957 12.183 1.00 14.15 H new ATOM 0 HD2 LYS A 98 31.094 -21.391 12.471 1.00 50.34 H new ATOM 0 HD3 LYS A 98 30.713 -21.653 10.781 1.00 50.34 H new ATOM 0 HE2 LYS A 98 32.935 -21.588 10.393 1.00 23.24 H new ATOM 0 HE3 LYS A 98 32.833 -19.857 10.645 1.00 23.24 H new ATOM 0 HZ1 LYS A 98 34.532 -20.846 12.035 1.00 73.32 H new ATOM 0 HZ2 LYS A 98 33.294 -20.200 13.002 1.00 73.32 H new ATOM 0 HZ3 LYS A 98 33.393 -21.878 12.758 1.00 73.32 H new ATOM 1569 N GLU A 99 26.054 -20.282 11.167 1.00 33.14 N ATOM 1570 CA GLU A 99 24.903 -21.158 10.985 1.00 60.13 C ATOM 1571 C GLU A 99 24.175 -20.838 9.682 1.00 62.34 C ATOM 1572 O GLU A 99 23.679 -21.734 9.001 1.00 2.33 O ATOM 1573 CB GLU A 99 23.940 -21.021 12.167 1.00 23.43 C ATOM 1574 CG GLU A 99 23.534 -22.353 12.778 1.00 33.01 C ATOM 1575 CD GLU A 99 22.646 -23.169 11.860 1.00 43.33 C ATOM 1576 OE1 GLU A 99 21.558 -22.676 11.495 1.00 14.32 O ATOM 1577 OE2 GLU A 99 23.037 -24.301 11.508 1.00 32.35 O ATOM 0 H GLU A 99 26.084 -19.806 12.068 1.00 33.14 H new ATOM 0 HA GLU A 99 25.264 -22.185 10.935 1.00 60.13 H new ATOM 0 HB2 GLU A 99 24.407 -20.405 12.936 1.00 23.43 H new ATOM 0 HB3 GLU A 99 23.045 -20.494 11.837 1.00 23.43 H new ATOM 0 HG2 GLU A 99 24.429 -22.927 13.016 1.00 33.01 H new ATOM 0 HG3 GLU A 99 23.011 -22.173 13.718 1.00 33.01 H new ATOM 1584 N ALA A 100 24.117 -19.555 9.344 1.00 41.35 N ATOM 1585 CA ALA A 100 23.451 -19.116 8.124 1.00 35.33 C ATOM 1586 C ALA A 100 24.277 -19.471 6.892 1.00 10.32 C ATOM 1587 O ALA A 100 23.729 -19.759 5.826 1.00 42.33 O ATOM 1588 CB ALA A 100 23.192 -17.618 8.173 1.00 43.41 C ATOM 0 H ALA A 100 24.523 -18.801 9.898 1.00 41.35 H new ATOM 0 HA ALA A 100 22.496 -19.636 8.053 1.00 35.33 H new ATOM 0 HB1 ALA A 100 22.694 -17.305 7.255 1.00 43.41 H new ATOM 0 HB2 ALA A 100 22.557 -17.386 9.028 1.00 43.41 H new ATOM 0 HB3 ALA A 100 24.139 -17.088 8.271 1.00 43.41 H new ATOM 1594 N LEU A 101 25.597 -19.448 7.042 1.00 41.22 N ATOM 1595 CA LEU A 101 26.498 -19.767 5.941 1.00 11.24 C ATOM 1596 C LEU A 101 26.540 -21.271 5.689 1.00 4.22 C ATOM 1597 O LEU A 101 26.709 -21.717 4.554 1.00 14.52 O ATOM 1598 CB LEU A 101 27.905 -19.249 6.241 1.00 34.45 C ATOM 1599 CG LEU A 101 28.631 -18.566 5.081 1.00 25.00 C ATOM 1600 CD1 LEU A 101 28.836 -19.540 3.932 1.00 32.42 C ATOM 1601 CD2 LEU A 101 27.856 -17.342 4.614 1.00 64.10 C ATOM 0 H LEU A 101 26.067 -19.212 7.916 1.00 41.22 H new ATOM 0 HA LEU A 101 26.121 -19.278 5.043 1.00 11.24 H new ATOM 0 HB2 LEU A 101 27.842 -18.543 7.069 1.00 34.45 H new ATOM 0 HB3 LEU A 101 28.514 -20.087 6.582 1.00 34.45 H new ATOM 0 HG LEU A 101 29.610 -18.239 5.432 1.00 25.00 H new ATOM 0 HD11 LEU A 101 29.354 -19.036 3.116 1.00 32.42 H new ATOM 0 HD12 LEU A 101 29.433 -20.385 4.274 1.00 32.42 H new ATOM 0 HD13 LEU A 101 27.868 -19.898 3.581 1.00 32.42 H new ATOM 0 HD21 LEU A 101 28.387 -16.868 3.788 1.00 64.10 H new ATOM 0 HD22 LEU A 101 26.863 -17.645 4.281 1.00 64.10 H new ATOM 0 HD23 LEU A 101 27.762 -16.635 5.438 1.00 64.10 H new ATOM 1613 N ASP A 102 26.383 -22.049 6.755 1.00 14.11 N ATOM 1614 CA ASP A 102 26.400 -23.503 6.650 1.00 2.43 C ATOM 1615 C ASP A 102 25.182 -24.007 5.882 1.00 55.41 C ATOM 1616 O ASP A 102 25.279 -24.937 5.083 1.00 2.31 O ATOM 1617 CB ASP A 102 26.438 -24.135 8.042 1.00 60.11 C ATOM 1618 CG ASP A 102 27.297 -25.384 8.087 1.00 64.44 C ATOM 1619 OD1 ASP A 102 28.513 -25.259 8.345 1.00 4.34 O ATOM 1620 OD2 ASP A 102 26.753 -26.487 7.864 1.00 74.53 O ATOM 0 H ASP A 102 26.243 -21.696 7.702 1.00 14.11 H new ATOM 0 HA ASP A 102 27.297 -23.793 6.103 1.00 2.43 H new ATOM 0 HB2 ASP A 102 26.821 -23.408 8.758 1.00 60.11 H new ATOM 0 HB3 ASP A 102 25.423 -24.384 8.353 1.00 60.11 H new ATOM 1625 N LYS A 103 24.033 -23.385 6.131 1.00 60.34 N ATOM 1626 CA LYS A 103 22.795 -23.769 5.464 1.00 63.14 C ATOM 1627 C LYS A 103 22.892 -23.532 3.961 1.00 22.03 C ATOM 1628 O LYS A 103 22.651 -24.441 3.164 1.00 54.30 O ATOM 1629 CB LYS A 103 21.616 -22.981 6.041 1.00 3.05 C ATOM 1630 CG LYS A 103 20.275 -23.370 5.443 1.00 54.50 C ATOM 1631 CD LYS A 103 19.828 -24.741 5.921 1.00 41.12 C ATOM 1632 CE LYS A 103 19.258 -24.681 7.331 1.00 3.52 C ATOM 1633 NZ LYS A 103 17.798 -24.974 7.351 1.00 41.14 N ATOM 0 H LYS A 103 23.935 -22.613 6.790 1.00 60.34 H new ATOM 0 HA LYS A 103 22.632 -24.833 5.636 1.00 63.14 H new ATOM 0 HB2 LYS A 103 21.581 -23.133 7.120 1.00 3.05 H new ATOM 0 HB3 LYS A 103 21.784 -21.917 5.874 1.00 3.05 H new ATOM 0 HG2 LYS A 103 19.525 -22.627 5.714 1.00 54.50 H new ATOM 0 HG3 LYS A 103 20.346 -23.368 4.355 1.00 54.50 H new ATOM 0 HD2 LYS A 103 19.075 -25.138 5.240 1.00 41.12 H new ATOM 0 HD3 LYS A 103 20.673 -25.429 5.898 1.00 41.12 H new ATOM 0 HE2 LYS A 103 19.781 -25.397 7.965 1.00 3.52 H new ATOM 0 HE3 LYS A 103 19.436 -23.692 7.753 1.00 3.52 H new ATOM 0 HZ1 LYS A 103 17.447 -24.923 8.329 1.00 41.14 H new ATOM 0 HZ2 LYS A 103 17.296 -24.276 6.766 1.00 41.14 H new ATOM 0 HZ3 LYS A 103 17.630 -25.928 6.972 1.00 41.14 H new ATOM 1647 N ILE A 104 23.246 -22.310 3.580 1.00 2.14 N ATOM 1648 CA ILE A 104 23.376 -21.957 2.172 1.00 2.21 C ATOM 1649 C ILE A 104 24.383 -22.862 1.469 1.00 4.44 C ATOM 1650 O ILE A 104 24.148 -23.313 0.348 1.00 61.14 O ATOM 1651 CB ILE A 104 23.812 -20.490 1.997 1.00 33.41 C ATOM 1652 CG1 ILE A 104 22.816 -19.554 2.683 1.00 3.41 C ATOM 1653 CG2 ILE A 104 23.939 -20.147 0.520 1.00 2.11 C ATOM 1654 CD1 ILE A 104 23.317 -18.133 2.820 1.00 63.30 C ATOM 0 H ILE A 104 23.448 -21.547 4.227 1.00 2.14 H new ATOM 0 HA ILE A 104 22.393 -22.092 1.721 1.00 2.21 H new ATOM 0 HB ILE A 104 24.787 -20.358 2.465 1.00 33.41 H new ATOM 0 HG12 ILE A 104 21.885 -19.549 2.116 1.00 3.41 H new ATOM 0 HG13 ILE A 104 22.584 -19.946 3.673 1.00 3.41 H new ATOM 0 HG21 ILE A 104 24.248 -19.107 0.413 1.00 2.11 H new ATOM 0 HG22 ILE A 104 24.683 -20.796 0.059 1.00 2.11 H new ATOM 0 HG23 ILE A 104 22.977 -20.292 0.029 1.00 2.11 H new ATOM 0 HD11 ILE A 104 22.559 -17.526 3.315 1.00 63.30 H new ATOM 0 HD12 ILE A 104 24.232 -18.125 3.412 1.00 63.30 H new ATOM 0 HD13 ILE A 104 23.522 -17.722 1.831 1.00 63.30 H new ATOM 1666 N GLU A 105 25.502 -23.123 2.136 1.00 4.42 N ATOM 1667 CA GLU A 105 26.544 -23.977 1.575 1.00 12.41 C ATOM 1668 C GLU A 105 26.039 -25.406 1.398 1.00 55.10 C ATOM 1669 O GLU A 105 26.472 -26.119 0.493 1.00 41.13 O ATOM 1670 CB GLU A 105 27.780 -23.968 2.475 1.00 73.15 C ATOM 1671 CG GLU A 105 29.067 -24.314 1.745 1.00 32.41 C ATOM 1672 CD GLU A 105 30.304 -23.868 2.500 1.00 31.30 C ATOM 1673 OE1 GLU A 105 30.215 -22.878 3.255 1.00 52.30 O ATOM 1674 OE2 GLU A 105 31.363 -24.510 2.335 1.00 23.20 O ATOM 0 H GLU A 105 25.711 -22.756 3.065 1.00 4.42 H new ATOM 0 HA GLU A 105 26.814 -23.582 0.596 1.00 12.41 H new ATOM 0 HB2 GLU A 105 27.883 -22.982 2.927 1.00 73.15 H new ATOM 0 HB3 GLU A 105 27.632 -24.678 3.289 1.00 73.15 H new ATOM 0 HG2 GLU A 105 29.112 -25.391 1.586 1.00 32.41 H new ATOM 0 HG3 GLU A 105 29.059 -23.847 0.760 1.00 32.41 H new ATOM 1681 N GLU A 106 25.124 -25.816 2.270 1.00 21.40 N ATOM 1682 CA GLU A 106 24.563 -27.162 2.210 1.00 53.44 C ATOM 1683 C GLU A 106 23.642 -27.314 1.003 1.00 13.12 C ATOM 1684 O GLU A 106 23.743 -28.284 0.252 1.00 40.23 O ATOM 1685 CB GLU A 106 23.792 -27.473 3.495 1.00 11.40 C ATOM 1686 CG GLU A 106 24.674 -27.966 4.630 1.00 14.13 C ATOM 1687 CD GLU A 106 24.004 -27.845 5.984 1.00 62.22 C ATOM 1688 OE1 GLU A 106 22.818 -27.453 6.027 1.00 32.43 O ATOM 1689 OE2 GLU A 106 24.664 -28.143 7.002 1.00 3.35 O ATOM 0 H GLU A 106 24.755 -25.238 3.025 1.00 21.40 H new ATOM 0 HA GLU A 106 25.387 -27.868 2.108 1.00 53.44 H new ATOM 0 HB2 GLU A 106 23.265 -26.575 3.819 1.00 11.40 H new ATOM 0 HB3 GLU A 106 23.035 -28.227 3.281 1.00 11.40 H new ATOM 0 HG2 GLU A 106 24.940 -29.008 4.452 1.00 14.13 H new ATOM 0 HG3 GLU A 106 25.603 -27.397 4.637 1.00 14.13 H new ATOM 1696 N GLU A 107 22.746 -26.349 0.823 1.00 53.32 N ATOM 1697 CA GLU A 107 21.807 -26.377 -0.293 1.00 34.21 C ATOM 1698 C GLU A 107 22.548 -26.366 -1.627 1.00 65.53 C ATOM 1699 O GLU A 107 22.074 -26.927 -2.615 1.00 51.14 O ATOM 1700 CB GLU A 107 20.854 -25.182 -0.216 1.00 51.33 C ATOM 1701 CG GLU A 107 19.704 -25.258 -1.206 1.00 41.44 C ATOM 1702 CD GLU A 107 18.977 -23.935 -1.357 1.00 61.22 C ATOM 1703 OE1 GLU A 107 19.537 -22.900 -0.939 1.00 32.14 O ATOM 1704 OE2 GLU A 107 17.849 -23.935 -1.892 1.00 5.02 O ATOM 0 H GLU A 107 22.650 -25.539 1.435 1.00 53.32 H new ATOM 0 HA GLU A 107 21.229 -27.299 -0.226 1.00 34.21 H new ATOM 0 HB2 GLU A 107 20.449 -25.115 0.794 1.00 51.33 H new ATOM 0 HB3 GLU A 107 21.417 -24.266 -0.395 1.00 51.33 H new ATOM 0 HG2 GLU A 107 20.086 -25.572 -2.178 1.00 41.44 H new ATOM 0 HG3 GLU A 107 18.998 -26.021 -0.879 1.00 41.44 H new ATOM 1711 N GLN A 108 23.711 -25.724 -1.647 1.00 64.14 N ATOM 1712 CA GLN A 108 24.517 -25.639 -2.859 1.00 1.20 C ATOM 1713 C GLN A 108 25.811 -26.432 -2.710 1.00 64.23 C ATOM 1714 O GLN A 108 26.815 -26.127 -3.352 1.00 11.44 O ATOM 1715 CB GLN A 108 24.834 -24.179 -3.185 1.00 52.51 C ATOM 1716 CG GLN A 108 23.601 -23.340 -3.483 1.00 44.31 C ATOM 1717 CD GLN A 108 23.916 -22.120 -4.326 1.00 41.34 C ATOM 1718 OE1 GLN A 108 23.919 -22.183 -5.555 1.00 44.32 O ATOM 1719 NE2 GLN A 108 24.182 -20.998 -3.667 1.00 42.03 N ATOM 0 H GLN A 108 24.117 -25.255 -0.837 1.00 64.14 H new ATOM 0 HA GLN A 108 23.941 -26.070 -3.678 1.00 1.20 H new ATOM 0 HB2 GLN A 108 25.370 -23.736 -2.346 1.00 52.51 H new ATOM 0 HB3 GLN A 108 25.503 -24.144 -4.045 1.00 52.51 H new ATOM 0 HG2 GLN A 108 22.864 -23.954 -4.001 1.00 44.31 H new ATOM 0 HG3 GLN A 108 23.147 -23.021 -2.545 1.00 44.31 H new ATOM 0 HE21 GLN A 108 24.169 -20.990 -2.647 1.00 42.03 H new ATOM 0 HE22 GLN A 108 24.400 -20.144 -4.181 1.00 42.03 H new ATOM 1728 N ASN A 109 25.780 -27.451 -1.857 1.00 3.41 N ATOM 1729 CA ASN A 109 26.951 -28.288 -1.623 1.00 74.11 C ATOM 1730 C ASN A 109 27.259 -29.147 -2.845 1.00 20.22 C ATOM 1731 O ASN A 109 28.418 -29.454 -3.127 1.00 0.14 O ATOM 1732 CB ASN A 109 26.730 -29.181 -0.400 1.00 0.41 C ATOM 1733 CG ASN A 109 28.033 -29.593 0.258 1.00 51.41 C ATOM 1734 OD1 ASN A 109 28.688 -30.540 -0.177 1.00 10.14 O ATOM 1735 ND2 ASN A 109 28.414 -28.882 1.312 1.00 15.51 N ATOM 0 H ASN A 109 24.957 -27.717 -1.317 1.00 3.41 H new ATOM 0 HA ASN A 109 27.803 -27.634 -1.437 1.00 74.11 H new ATOM 0 HB2 ASN A 109 26.111 -28.653 0.325 1.00 0.41 H new ATOM 0 HB3 ASN A 109 26.179 -30.073 -0.699 1.00 0.41 H new ATOM 0 HD21 ASN A 109 29.282 -29.113 1.796 1.00 15.51 H new ATOM 0 HD22 ASN A 109 27.839 -28.105 1.638 1.00 15.51 H new ATOM 1742 N LYS A 110 26.214 -29.533 -3.568 1.00 3.05 N ATOM 1743 CA LYS A 110 26.370 -30.356 -4.762 1.00 71.40 C ATOM 1744 C LYS A 110 26.976 -29.548 -5.905 1.00 60.14 C ATOM 1745 O LYS A 110 27.890 -30.009 -6.588 1.00 3.45 O ATOM 1746 CB LYS A 110 25.019 -30.932 -5.191 1.00 35.13 C ATOM 1747 CG LYS A 110 24.355 -31.784 -4.124 1.00 40.54 C ATOM 1748 CD LYS A 110 23.269 -31.013 -3.391 1.00 73.21 C ATOM 1749 CE LYS A 110 21.881 -31.467 -3.815 1.00 54.54 C ATOM 1750 NZ LYS A 110 21.524 -30.967 -5.171 1.00 32.35 N ATOM 0 H LYS A 110 25.248 -29.289 -3.348 1.00 3.05 H new ATOM 0 HA LYS A 110 27.047 -31.176 -4.521 1.00 71.40 H new ATOM 0 HB2 LYS A 110 24.352 -30.112 -5.457 1.00 35.13 H new ATOM 0 HB3 LYS A 110 25.159 -31.533 -6.089 1.00 35.13 H new ATOM 0 HG2 LYS A 110 23.924 -32.674 -4.583 1.00 40.54 H new ATOM 0 HG3 LYS A 110 25.105 -32.125 -3.411 1.00 40.54 H new ATOM 0 HD2 LYS A 110 23.386 -31.151 -2.316 1.00 73.21 H new ATOM 0 HD3 LYS A 110 23.381 -29.947 -3.589 1.00 73.21 H new ATOM 0 HE2 LYS A 110 21.837 -32.556 -3.806 1.00 54.54 H new ATOM 0 HE3 LYS A 110 21.146 -31.112 -3.092 1.00 54.54 H new ATOM 0 HZ1 LYS A 110 20.571 -31.298 -5.423 1.00 32.35 H new ATOM 0 HZ2 LYS A 110 21.541 -29.927 -5.173 1.00 32.35 H new ATOM 0 HZ3 LYS A 110 22.210 -31.326 -5.865 1.00 32.35 H new ATOM 1764 N SER A 111 26.463 -28.338 -6.105 1.00 43.21 N ATOM 1765 CA SER A 111 26.952 -27.466 -7.167 1.00 63.32 C ATOM 1766 C SER A 111 28.432 -27.149 -6.971 1.00 45.44 C ATOM 1767 O SER A 111 29.209 -27.141 -7.925 1.00 3.13 O ATOM 1768 CB SER A 111 26.142 -26.169 -7.204 1.00 2.52 C ATOM 1769 OG SER A 111 25.250 -26.156 -8.306 1.00 62.43 O ATOM 0 H SER A 111 25.709 -27.939 -5.546 1.00 43.21 H new ATOM 0 HA SER A 111 26.832 -27.988 -8.116 1.00 63.32 H new ATOM 0 HB2 SER A 111 25.580 -26.061 -6.276 1.00 2.52 H new ATOM 0 HB3 SER A 111 26.818 -25.316 -7.269 1.00 2.52 H new ATOM 0 HG SER A 111 24.743 -25.317 -8.306 1.00 62.43 H new ATOM 1775 N LYS A 112 28.814 -26.889 -5.726 1.00 74.44 N ATOM 1776 CA LYS A 112 30.200 -26.573 -5.401 1.00 34.11 C ATOM 1777 C LYS A 112 31.145 -27.636 -5.952 1.00 3.22 C ATOM 1778 O LYS A 112 32.270 -27.336 -6.350 1.00 14.13 O ATOM 1779 CB LYS A 112 30.377 -26.455 -3.885 1.00 13.12 C ATOM 1780 CG LYS A 112 31.788 -26.085 -3.464 1.00 13.00 C ATOM 1781 CD LYS A 112 31.974 -26.212 -1.962 1.00 45.42 C ATOM 1782 CE LYS A 112 32.321 -27.638 -1.561 1.00 32.33 C ATOM 1783 NZ LYS A 112 31.704 -28.015 -0.260 1.00 2.45 N ATOM 0 H LYS A 112 28.183 -26.891 -4.925 1.00 74.44 H new ATOM 0 HA LYS A 112 30.446 -25.618 -5.865 1.00 34.11 H new ATOM 0 HB2 LYS A 112 29.685 -25.704 -3.504 1.00 13.12 H new ATOM 0 HB3 LYS A 112 30.105 -27.403 -3.421 1.00 13.12 H new ATOM 0 HG2 LYS A 112 32.502 -26.730 -3.976 1.00 13.00 H new ATOM 0 HG3 LYS A 112 32.004 -25.062 -3.773 1.00 13.00 H new ATOM 0 HD2 LYS A 112 32.766 -25.538 -1.634 1.00 45.42 H new ATOM 0 HD3 LYS A 112 31.061 -25.902 -1.454 1.00 45.42 H new ATOM 0 HE2 LYS A 112 31.982 -28.326 -2.336 1.00 32.33 H new ATOM 0 HE3 LYS A 112 33.404 -27.743 -1.493 1.00 32.33 H new ATOM 0 HZ1 LYS A 112 31.965 -28.993 -0.023 1.00 2.45 H new ATOM 0 HZ2 LYS A 112 32.046 -27.375 0.485 1.00 2.45 H new ATOM 0 HZ3 LYS A 112 30.669 -27.940 -0.332 1.00 2.45 H new ATOM 1797 N LYS A 113 30.679 -28.881 -5.973 1.00 33.14 N ATOM 1798 CA LYS A 113 31.480 -29.989 -6.479 1.00 54.03 C ATOM 1799 C LYS A 113 31.893 -29.747 -7.927 1.00 52.30 C ATOM 1800 O LYS A 113 32.977 -30.148 -8.350 1.00 60.44 O ATOM 1801 CB LYS A 113 30.698 -31.300 -6.373 1.00 63.33 C ATOM 1802 CG LYS A 113 31.551 -32.537 -6.596 1.00 61.23 C ATOM 1803 CD LYS A 113 30.714 -33.805 -6.564 1.00 15.24 C ATOM 1804 CE LYS A 113 31.332 -34.903 -7.417 1.00 35.11 C ATOM 1805 NZ LYS A 113 30.295 -35.725 -8.098 1.00 24.15 N ATOM 0 H LYS A 113 29.751 -29.147 -5.645 1.00 33.14 H new ATOM 0 HA LYS A 113 32.382 -30.060 -5.870 1.00 54.03 H new ATOM 0 HB2 LYS A 113 30.237 -31.360 -5.387 1.00 63.33 H new ATOM 0 HB3 LYS A 113 29.889 -31.291 -7.103 1.00 63.33 H new ATOM 0 HG2 LYS A 113 32.060 -32.460 -7.557 1.00 61.23 H new ATOM 0 HG3 LYS A 113 32.324 -32.590 -5.829 1.00 61.23 H new ATOM 0 HD2 LYS A 113 30.618 -34.153 -5.535 1.00 15.24 H new ATOM 0 HD3 LYS A 113 29.708 -33.587 -6.922 1.00 15.24 H new ATOM 0 HE2 LYS A 113 31.989 -34.457 -8.163 1.00 35.11 H new ATOM 0 HE3 LYS A 113 31.951 -35.545 -6.790 1.00 35.11 H new ATOM 0 HZ1 LYS A 113 30.756 -36.462 -8.669 1.00 24.15 H new ATOM 0 HZ2 LYS A 113 29.683 -36.171 -7.386 1.00 24.15 H new ATOM 0 HZ3 LYS A 113 29.721 -35.117 -8.716 1.00 24.15 H new ATOM 1819 N LYS A 114 31.023 -29.086 -8.683 1.00 42.33 N ATOM 1820 CA LYS A 114 31.298 -28.787 -10.083 1.00 41.32 C ATOM 1821 C LYS A 114 32.452 -27.798 -10.212 1.00 2.13 C ATOM 1822 O LYS A 114 33.171 -27.796 -11.211 1.00 23.21 O ATOM 1823 CB LYS A 114 30.047 -28.218 -10.759 1.00 34.33 C ATOM 1824 CG LYS A 114 29.691 -28.913 -12.062 1.00 45.14 C ATOM 1825 CD LYS A 114 28.240 -29.367 -12.072 1.00 33.20 C ATOM 1826 CE LYS A 114 27.594 -29.133 -13.429 1.00 40.23 C ATOM 1827 NZ LYS A 114 26.791 -30.307 -13.870 1.00 0.25 N ATOM 0 H LYS A 114 30.121 -28.747 -8.349 1.00 42.33 H new ATOM 0 HA LYS A 114 31.582 -29.716 -10.578 1.00 41.32 H new ATOM 0 HB2 LYS A 114 29.205 -28.298 -10.072 1.00 34.33 H new ATOM 0 HB3 LYS A 114 30.200 -27.156 -10.953 1.00 34.33 H new ATOM 0 HG2 LYS A 114 29.867 -28.235 -12.897 1.00 45.14 H new ATOM 0 HG3 LYS A 114 30.344 -29.774 -12.207 1.00 45.14 H new ATOM 0 HD2 LYS A 114 28.187 -30.426 -11.820 1.00 33.20 H new ATOM 0 HD3 LYS A 114 27.684 -28.829 -11.305 1.00 33.20 H new ATOM 0 HE2 LYS A 114 26.953 -28.253 -13.379 1.00 40.23 H new ATOM 0 HE3 LYS A 114 28.367 -28.923 -14.168 1.00 40.23 H new ATOM 0 HZ1 LYS A 114 26.367 -30.109 -14.799 1.00 0.25 H new ATOM 0 HZ2 LYS A 114 27.407 -31.142 -13.942 1.00 0.25 H new ATOM 0 HZ3 LYS A 114 26.037 -30.492 -13.178 1.00 0.25 H new ATOM 1841 N ALA A 115 32.625 -26.961 -9.194 1.00 12.23 N ATOM 1842 CA ALA A 115 33.694 -25.970 -9.194 1.00 62.33 C ATOM 1843 C ALA A 115 35.055 -26.631 -9.388 1.00 62.25 C ATOM 1844 O ALA A 115 35.950 -26.059 -10.007 1.00 32.01 O ATOM 1845 CB ALA A 115 33.673 -25.172 -7.899 1.00 44.44 C ATOM 0 H ALA A 115 32.039 -26.950 -8.359 1.00 12.23 H new ATOM 0 HA ALA A 115 33.527 -25.291 -10.030 1.00 62.33 H new ATOM 0 HB1 ALA A 115 34.477 -24.436 -7.912 1.00 44.44 H new ATOM 0 HB2 ALA A 115 32.715 -24.662 -7.802 1.00 44.44 H new ATOM 0 HB3 ALA A 115 33.813 -25.846 -7.054 1.00 44.44 H new ATOM 1851 N GLN A 116 35.202 -27.840 -8.852 1.00 54.34 N ATOM 1852 CA GLN A 116 36.455 -28.577 -8.965 1.00 13.31 C ATOM 1853 C GLN A 116 36.213 -29.982 -9.506 1.00 52.42 C ATOM 1854 O GLN A 116 36.718 -30.962 -8.960 1.00 65.15 O ATOM 1855 CB GLN A 116 37.150 -28.654 -7.605 1.00 33.50 C ATOM 1856 CG GLN A 116 36.337 -29.376 -6.545 1.00 64.15 C ATOM 1857 CD GLN A 116 37.204 -30.051 -5.501 1.00 61.43 C ATOM 1858 OE1 GLN A 116 37.101 -29.760 -4.309 1.00 71.03 O ATOM 1859 NE2 GLN A 116 38.067 -30.958 -5.943 1.00 35.03 N ATOM 0 H GLN A 116 34.470 -28.328 -8.336 1.00 54.34 H new ATOM 0 HA GLN A 116 37.099 -28.044 -9.664 1.00 13.31 H new ATOM 0 HB2 GLN A 116 38.107 -29.161 -7.724 1.00 33.50 H new ATOM 0 HB3 GLN A 116 37.366 -27.643 -7.259 1.00 33.50 H new ATOM 0 HG2 GLN A 116 35.673 -28.664 -6.055 1.00 64.15 H new ATOM 0 HG3 GLN A 116 35.705 -30.123 -7.024 1.00 64.15 H new ATOM 0 HE21 GLN A 116 38.120 -31.169 -6.940 1.00 35.03 H new ATOM 0 HE22 GLN A 116 38.677 -31.444 -5.286 1.00 35.03 H new ATOM 1868 N GLN A 117 35.435 -30.071 -10.581 1.00 33.52 N ATOM 1869 CA GLN A 117 35.126 -31.357 -11.194 1.00 33.01 C ATOM 1870 C GLN A 117 35.810 -31.492 -12.551 1.00 42.14 C ATOM 1871 O GLN A 117 36.166 -32.594 -12.970 1.00 54.24 O ATOM 1872 CB GLN A 117 33.613 -31.518 -11.354 1.00 74.20 C ATOM 1873 CG GLN A 117 33.181 -32.947 -11.641 1.00 70.04 C ATOM 1874 CD GLN A 117 31.675 -33.121 -11.596 1.00 71.23 C ATOM 1875 OE1 GLN A 117 31.141 -33.783 -10.705 1.00 21.01 O ATOM 1876 NE2 GLN A 117 30.982 -32.527 -12.559 1.00 53.50 N ATOM 0 H GLN A 117 35.008 -29.269 -11.044 1.00 33.52 H new ATOM 0 HA GLN A 117 35.501 -32.143 -10.539 1.00 33.01 H new ATOM 0 HB2 GLN A 117 33.121 -31.174 -10.444 1.00 74.20 H new ATOM 0 HB3 GLN A 117 33.271 -30.874 -12.164 1.00 74.20 H new ATOM 0 HG2 GLN A 117 33.548 -33.243 -12.624 1.00 70.04 H new ATOM 0 HG3 GLN A 117 33.642 -33.615 -10.914 1.00 70.04 H new ATOM 0 HE21 GLN A 117 31.466 -31.988 -13.277 1.00 53.50 H new ATOM 0 HE22 GLN A 117 29.966 -32.609 -12.581 1.00 53.50 H new ATOM 1885 N ALA A 118 35.989 -30.366 -13.232 1.00 11.14 N ATOM 1886 CA ALA A 118 36.631 -30.358 -14.541 1.00 64.51 C ATOM 1887 C ALA A 118 38.150 -30.311 -14.407 1.00 62.15 C ATOM 1888 O ALA A 118 38.873 -30.871 -15.230 1.00 32.04 O ATOM 1889 CB ALA A 118 36.135 -29.180 -15.365 1.00 31.42 C ATOM 0 H ALA A 118 35.698 -29.447 -12.899 1.00 11.14 H new ATOM 0 HA ALA A 118 36.366 -31.283 -15.054 1.00 64.51 H new ATOM 0 HB1 ALA A 118 36.623 -29.187 -16.340 1.00 31.42 H new ATOM 0 HB2 ALA A 118 35.056 -29.258 -15.499 1.00 31.42 H new ATOM 0 HB3 ALA A 118 36.370 -28.250 -14.848 1.00 31.42 H new ATOM 1895 N ALA A 119 38.626 -29.640 -13.363 1.00 55.11 N ATOM 1896 CA ALA A 119 40.058 -29.521 -13.121 1.00 72.34 C ATOM 1897 C ALA A 119 40.722 -30.893 -13.068 1.00 52.04 C ATOM 1898 O ALA A 119 41.884 -31.046 -13.443 1.00 72.31 O ATOM 1899 CB ALA A 119 40.314 -28.759 -11.829 1.00 14.32 C ATOM 0 H ALA A 119 38.041 -29.171 -12.672 1.00 55.11 H new ATOM 0 HA ALA A 119 40.496 -28.966 -13.950 1.00 72.34 H new ATOM 0 HB1 ALA A 119 41.388 -28.678 -11.661 1.00 14.32 H new ATOM 0 HB2 ALA A 119 39.882 -27.761 -11.903 1.00 14.32 H new ATOM 0 HB3 ALA A 119 39.856 -29.292 -10.996 1.00 14.32 H new ATOM 1905 N ALA A 120 39.977 -31.888 -12.598 1.00 41.01 N ATOM 1906 CA ALA A 120 40.492 -33.247 -12.497 1.00 33.22 C ATOM 1907 C ALA A 120 40.752 -33.840 -13.878 1.00 60.21 C ATOM 1908 O ALA A 120 41.602 -34.715 -14.038 1.00 64.20 O ATOM 1909 CB ALA A 120 39.523 -34.123 -11.717 1.00 4.25 C ATOM 0 H ALA A 120 39.014 -31.778 -12.281 1.00 41.01 H new ATOM 0 HA ALA A 120 41.441 -33.210 -11.962 1.00 33.22 H new ATOM 0 HB1 ALA A 120 39.921 -35.135 -11.650 1.00 4.25 H new ATOM 0 HB2 ALA A 120 39.392 -33.717 -10.714 1.00 4.25 H new ATOM 0 HB3 ALA A 120 38.560 -34.145 -12.228 1.00 4.25 H new ATOM 1915 N ASP A 121 40.013 -33.358 -14.872 1.00 63.23 N ATOM 1916 CA ASP A 121 40.164 -33.841 -16.240 1.00 71.03 C ATOM 1917 C ASP A 121 41.403 -33.239 -16.895 1.00 72.13 C ATOM 1918 O ASP A 121 42.074 -33.891 -17.695 1.00 22.11 O ATOM 1919 CB ASP A 121 38.920 -33.500 -17.062 1.00 33.11 C ATOM 1920 CG ASP A 121 38.912 -34.192 -18.412 1.00 44.55 C ATOM 1921 OD1 ASP A 121 39.918 -34.081 -19.141 1.00 61.51 O ATOM 1922 OD2 ASP A 121 37.897 -34.844 -18.738 1.00 52.00 O ATOM 0 H ASP A 121 39.304 -32.634 -14.756 1.00 63.23 H new ATOM 0 HA ASP A 121 40.283 -34.924 -16.207 1.00 71.03 H new ATOM 0 HB2 ASP A 121 38.029 -33.788 -16.504 1.00 33.11 H new ATOM 0 HB3 ASP A 121 38.870 -32.421 -17.209 1.00 33.11 H new ATOM 1927 N THR A 122 41.702 -31.991 -16.550 1.00 70.12 N ATOM 1928 CA THR A 122 42.859 -31.300 -17.105 1.00 1.20 C ATOM 1929 C THR A 122 43.080 -29.957 -16.419 1.00 62.11 C ATOM 1930 O THR A 122 42.127 -29.290 -16.017 1.00 33.14 O ATOM 1931 CB THR A 122 42.700 -31.070 -18.621 1.00 73.44 C ATOM 1932 OG1 THR A 122 43.830 -30.349 -19.127 1.00 72.44 O ATOM 1933 CG2 THR A 122 41.425 -30.298 -18.920 1.00 13.12 C ATOM 0 H THR A 122 41.158 -31.437 -15.888 1.00 70.12 H new ATOM 0 HA THR A 122 43.724 -31.940 -16.930 1.00 1.20 H new ATOM 0 HB THR A 122 42.640 -32.042 -19.110 1.00 73.44 H new ATOM 0 HG1 THR A 122 43.723 -30.208 -20.091 1.00 72.44 H new ATOM 0 HG21 THR A 122 41.334 -30.148 -19.996 1.00 13.12 H new ATOM 0 HG22 THR A 122 40.565 -30.862 -18.559 1.00 13.12 H new ATOM 0 HG23 THR A 122 41.460 -29.330 -18.420 1.00 13.12 H new ATOM 1941 N GLY A 123 44.343 -29.565 -16.288 1.00 61.44 N ATOM 1942 CA GLY A 123 44.667 -28.303 -15.650 1.00 42.32 C ATOM 1943 C GLY A 123 45.882 -28.403 -14.749 1.00 55.00 C ATOM 1944 O GLY A 123 46.710 -27.494 -14.711 1.00 54.30 O ATOM 0 H GLY A 123 45.149 -30.100 -16.613 1.00 61.44 H new ATOM 0 HA2 GLY A 123 44.848 -27.548 -16.416 1.00 42.32 H new ATOM 0 HA3 GLY A 123 43.812 -27.965 -15.065 1.00 42.32 H new ATOM 1948 N ASN A 124 45.988 -29.509 -14.021 1.00 30.33 N ATOM 1949 CA ASN A 124 47.110 -29.723 -13.114 1.00 32.04 C ATOM 1950 C ASN A 124 47.220 -28.583 -12.107 1.00 73.15 C ATOM 1951 O ASN A 124 47.937 -27.609 -12.332 1.00 15.13 O ATOM 1952 CB ASN A 124 48.414 -29.848 -13.904 1.00 11.01 C ATOM 1953 CG ASN A 124 48.778 -31.291 -14.196 1.00 1.41 C ATOM 1954 OD1 ASN A 124 48.999 -31.667 -15.347 1.00 32.34 O ATOM 1955 ND2 ASN A 124 48.841 -32.108 -13.151 1.00 5.42 N ATOM 0 H ASN A 124 45.311 -30.271 -14.041 1.00 30.33 H new ATOM 0 HA ASN A 124 46.933 -30.650 -12.569 1.00 32.04 H new ATOM 0 HB2 ASN A 124 48.320 -29.303 -14.843 1.00 11.01 H new ATOM 0 HB3 ASN A 124 49.222 -29.379 -13.343 1.00 11.01 H new ATOM 0 HD21 ASN A 124 49.080 -33.090 -13.285 1.00 5.42 H new ATOM 0 HD22 ASN A 124 48.650 -31.753 -12.214 1.00 5.42 H new ATOM 1962 N ASN A 125 46.504 -28.711 -10.994 1.00 30.33 N ATOM 1963 CA ASN A 125 46.521 -27.692 -9.951 1.00 32.53 C ATOM 1964 C ASN A 125 45.808 -28.185 -8.697 1.00 61.34 C ATOM 1965 O ASN A 125 44.659 -27.824 -8.441 1.00 12.54 O ATOM 1966 CB ASN A 125 45.863 -26.407 -10.455 1.00 41.43 C ATOM 1967 CG ASN A 125 46.187 -25.210 -9.581 1.00 0.14 C ATOM 1968 OD1 ASN A 125 45.333 -24.716 -8.846 1.00 70.35 O ATOM 1969 ND2 ASN A 125 47.425 -24.738 -9.661 1.00 22.51 N ATOM 0 H ASN A 125 45.905 -29.511 -10.792 1.00 30.33 H new ATOM 0 HA ASN A 125 47.560 -27.484 -9.697 1.00 32.53 H new ATOM 0 HB2 ASN A 125 46.193 -26.209 -11.475 1.00 41.43 H new ATOM 0 HB3 ASN A 125 44.782 -26.545 -10.491 1.00 41.43 H new ATOM 0 HD21 ASN A 125 47.701 -23.933 -9.099 1.00 22.51 H new ATOM 0 HD22 ASN A 125 48.100 -25.180 -10.285 1.00 22.51 H new ATOM 1976 N SER A 126 46.497 -29.012 -7.918 1.00 64.03 N ATOM 1977 CA SER A 126 45.927 -29.559 -6.690 1.00 34.31 C ATOM 1978 C SER A 126 46.733 -29.113 -5.474 1.00 44.12 C ATOM 1979 O SER A 126 47.872 -29.537 -5.283 1.00 34.40 O ATOM 1980 CB SER A 126 45.886 -31.086 -6.758 1.00 62.23 C ATOM 1981 OG SER A 126 44.551 -31.557 -6.838 1.00 33.21 O ATOM 0 H SER A 126 47.450 -29.319 -8.114 1.00 64.03 H new ATOM 0 HA SER A 126 44.910 -29.181 -6.589 1.00 34.31 H new ATOM 0 HB2 SER A 126 46.449 -31.430 -7.626 1.00 62.23 H new ATOM 0 HB3 SER A 126 46.371 -31.506 -5.877 1.00 62.23 H new ATOM 0 HG SER A 126 44.552 -32.536 -6.882 1.00 33.21 H new ATOM 1987 N GLN A 127 46.131 -28.258 -4.654 1.00 1.31 N ATOM 1988 CA GLN A 127 46.792 -27.755 -3.455 1.00 21.14 C ATOM 1989 C GLN A 127 45.968 -28.063 -2.209 1.00 15.35 C ATOM 1990 O GLN A 127 44.926 -27.450 -1.975 1.00 23.00 O ATOM 1991 CB GLN A 127 47.023 -26.247 -3.569 1.00 22.44 C ATOM 1992 CG GLN A 127 47.981 -25.698 -2.525 1.00 13.34 C ATOM 1993 CD GLN A 127 49.058 -24.817 -3.127 1.00 32.52 C ATOM 1994 OE1 GLN A 127 49.887 -25.279 -3.913 1.00 5.53 O ATOM 1995 NE2 GLN A 127 49.054 -23.541 -2.761 1.00 50.51 N ATOM 0 H GLN A 127 45.187 -27.899 -4.798 1.00 1.31 H new ATOM 0 HA GLN A 127 47.755 -28.257 -3.364 1.00 21.14 H new ATOM 0 HB2 GLN A 127 47.412 -26.022 -4.562 1.00 22.44 H new ATOM 0 HB3 GLN A 127 46.066 -25.733 -3.478 1.00 22.44 H new ATOM 0 HG2 GLN A 127 47.419 -25.125 -1.787 1.00 13.34 H new ATOM 0 HG3 GLN A 127 48.449 -26.528 -1.995 1.00 13.34 H new ATOM 0 HE21 GLN A 127 48.349 -23.200 -2.107 1.00 50.51 H new ATOM 0 HE22 GLN A 127 49.756 -22.901 -3.133 1.00 50.51 H new ATOM 2004 N VAL A 128 46.442 -29.015 -1.412 1.00 13.12 N ATOM 2005 CA VAL A 128 45.749 -29.403 -0.190 1.00 65.42 C ATOM 2006 C VAL A 128 46.609 -29.128 1.040 1.00 2.22 C ATOM 2007 O VAL A 128 47.560 -29.857 1.319 1.00 32.24 O ATOM 2008 CB VAL A 128 45.365 -30.895 -0.211 1.00 30.23 C ATOM 2009 CG1 VAL A 128 44.656 -31.283 1.077 1.00 32.13 C ATOM 2010 CG2 VAL A 128 44.497 -31.204 -1.422 1.00 33.11 C ATOM 0 H VAL A 128 47.303 -29.532 -1.591 1.00 13.12 H new ATOM 0 HA VAL A 128 44.841 -28.803 -0.137 1.00 65.42 H new ATOM 0 HB VAL A 128 46.278 -31.486 -0.286 1.00 30.23 H new ATOM 0 HG11 VAL A 128 44.393 -32.340 1.043 1.00 32.13 H new ATOM 0 HG12 VAL A 128 45.316 -31.100 1.925 1.00 32.13 H new ATOM 0 HG13 VAL A 128 43.750 -30.687 1.187 1.00 32.13 H new ATOM 0 HG21 VAL A 128 44.235 -32.262 -1.421 1.00 33.11 H new ATOM 0 HG22 VAL A 128 43.587 -30.605 -1.380 1.00 33.11 H new ATOM 0 HG23 VAL A 128 45.046 -30.967 -2.333 1.00 33.11 H new ATOM 2020 N SER A 129 46.265 -28.073 1.771 1.00 5.00 N ATOM 2021 CA SER A 129 47.007 -27.699 2.970 1.00 24.14 C ATOM 2022 C SER A 129 46.065 -27.516 4.156 1.00 31.32 C ATOM 2023 O SER A 129 44.854 -27.695 4.033 1.00 60.31 O ATOM 2024 CB SER A 129 47.796 -26.411 2.726 1.00 22.34 C ATOM 2025 OG SER A 129 48.841 -26.266 3.671 1.00 24.50 O ATOM 0 H SER A 129 45.478 -27.462 1.554 1.00 5.00 H new ATOM 0 HA SER A 129 47.704 -28.504 3.203 1.00 24.14 H new ATOM 0 HB2 SER A 129 48.212 -26.421 1.718 1.00 22.34 H new ATOM 0 HB3 SER A 129 47.126 -25.553 2.786 1.00 22.34 H new ATOM 0 HG SER A 129 49.331 -25.436 3.492 1.00 24.50 H new ATOM 2031 N GLN A 130 46.633 -27.158 5.303 1.00 54.04 N ATOM 2032 CA GLN A 130 45.845 -26.949 6.512 1.00 23.31 C ATOM 2033 C GLN A 130 45.657 -25.462 6.792 1.00 34.34 C ATOM 2034 O GLN A 130 46.605 -24.764 7.149 1.00 65.02 O ATOM 2035 CB GLN A 130 46.519 -27.624 7.708 1.00 33.52 C ATOM 2036 CG GLN A 130 46.914 -29.069 7.448 1.00 41.21 C ATOM 2037 CD GLN A 130 45.738 -29.929 7.025 1.00 72.02 C ATOM 2038 OE1 GLN A 130 45.677 -30.401 5.890 1.00 41.11 O ATOM 2039 NE2 GLN A 130 44.798 -30.136 7.939 1.00 3.45 N ATOM 0 H GLN A 130 47.635 -27.007 5.421 1.00 54.04 H new ATOM 0 HA GLN A 130 44.863 -27.396 6.356 1.00 23.31 H new ATOM 0 HB2 GLN A 130 47.409 -27.056 7.981 1.00 33.52 H new ATOM 0 HB3 GLN A 130 45.843 -27.589 8.563 1.00 33.52 H new ATOM 0 HG2 GLN A 130 47.679 -29.099 6.672 1.00 41.21 H new ATOM 0 HG3 GLN A 130 47.360 -29.488 8.350 1.00 41.21 H new ATOM 0 HE21 GLN A 130 44.890 -29.725 8.868 1.00 3.45 H new ATOM 0 HE22 GLN A 130 43.983 -30.707 7.713 1.00 3.45 H new ATOM 2048 N ASN A 131 44.428 -24.984 6.626 1.00 34.33 N ATOM 2049 CA ASN A 131 44.118 -23.579 6.859 1.00 44.33 C ATOM 2050 C ASN A 131 43.561 -23.371 8.264 1.00 11.34 C ATOM 2051 O ASN A 131 42.644 -24.074 8.691 1.00 1.14 O ATOM 2052 CB ASN A 131 43.111 -23.078 5.820 1.00 73.43 C ATOM 2053 CG ASN A 131 43.743 -22.144 4.807 1.00 34.01 C ATOM 2054 OD1 ASN A 131 44.288 -21.100 5.164 1.00 53.33 O ATOM 2055 ND2 ASN A 131 43.672 -22.517 3.534 1.00 50.31 N ATOM 0 H ASN A 131 43.631 -25.549 6.331 1.00 34.33 H new ATOM 0 HA ASN A 131 45.042 -23.008 6.765 1.00 44.33 H new ATOM 0 HB2 ASN A 131 42.674 -23.931 5.301 1.00 73.43 H new ATOM 0 HB3 ASN A 131 42.296 -22.562 6.327 1.00 73.43 H new ATOM 0 HD21 ASN A 131 44.079 -21.929 2.807 1.00 50.31 H new ATOM 0 HD22 ASN A 131 43.210 -23.391 3.284 1.00 50.31 H new ATOM 2062 N TYR A 132 44.120 -22.401 8.978 1.00 62.24 N ATOM 2063 CA TYR A 132 43.681 -22.101 10.336 1.00 70.14 C ATOM 2064 C TYR A 132 43.303 -20.630 10.474 1.00 30.41 C ATOM 2065 O TYR A 132 44.189 -19.776 10.468 1.00 41.24 O ATOM 2066 CB TYR A 132 44.780 -22.453 11.340 1.00 21.33 C ATOM 2067 CG TYR A 132 44.327 -22.397 12.780 1.00 43.21 C ATOM 2068 CD1 TYR A 132 43.156 -23.028 13.185 1.00 55.21 C ATOM 2069 CD2 TYR A 132 45.066 -21.713 13.737 1.00 51.22 C ATOM 2070 CE1 TYR A 132 42.736 -22.979 14.500 1.00 61.21 C ATOM 2071 CE2 TYR A 132 44.655 -21.661 15.055 1.00 73.22 C ATOM 2072 CZ TYR A 132 43.489 -22.294 15.431 1.00 71.40 C ATOM 2073 OH TYR A 132 43.076 -22.243 16.743 1.00 3.44 O ATOM 0 H TYR A 132 44.878 -21.809 8.639 1.00 62.24 H new ATOM 0 HA TYR A 132 42.799 -22.705 10.547 1.00 70.14 H new ATOM 0 HB2 TYR A 132 45.150 -23.455 11.124 1.00 21.33 H new ATOM 0 HB3 TYR A 132 45.617 -21.768 11.205 1.00 21.33 H new ATOM 0 HD1 TYR A 132 42.565 -23.566 12.459 1.00 55.21 H new ATOM 0 HD2 TYR A 132 45.978 -21.213 13.446 1.00 51.22 H new ATOM 0 HE1 TYR A 132 41.823 -23.474 14.798 1.00 61.21 H new ATOM 0 HE2 TYR A 132 45.244 -21.128 15.787 1.00 73.22 H new ATOM 0 HH TYR A 132 43.719 -21.723 17.268 1.00 3.44 H new TER 2083 TYR A 132 HETATM 2084 C1 PIO A 300 34.262 -6.468 11.709 1.00 64.01 C HETATM 2085 C2 PIO A 300 34.564 -6.755 13.220 1.00 1.14 C HETATM 2086 C3 PIO A 300 34.312 -8.244 13.550 1.00 43.30 C HETATM 2087 C4 PIO A 300 35.168 -9.190 12.621 1.00 44.32 C HETATM 2088 C5 PIO A 300 34.824 -8.867 11.113 1.00 74.25 C HETATM 2089 C6 PIO A 300 35.059 -7.378 10.757 1.00 35.24 C HETATM 2090 O1 PIO A 300 34.515 -5.025 11.250 1.00 72.23 O HETATM 2091 O2 PIO A 300 35.895 -6.415 13.598 1.00 44.41 O HETATM 2092 O3 PIO A 300 34.612 -8.441 14.939 1.00 30.13 O HETATM 2093 O4 PIO A 300 34.852 -10.640 12.948 1.00 0.43 O HETATM 2094 O5 PIO A 300 35.663 -9.703 10.252 1.00 73.34 O HETATM 2095 O6 PIO A 300 34.637 -7.063 9.421 1.00 4.53 O HETATM 2096 P1 PIO A 300 33.876 -3.560 11.738 1.00 21.30 P HETATM 2097 O11 PIO A 300 32.487 -3.946 12.254 1.00 74.22 O HETATM 2098 O12 PIO A 300 34.868 -3.045 12.748 1.00 11.42 O HETATM 2099 O13 PIO A 300 33.847 -2.669 10.532 1.00 20.14 O HETATM 2100 P4 PIO A 300 35.530 -11.687 14.052 1.00 72.21 P HETATM 2101 O41 PIO A 300 34.427 -12.742 14.079 1.00 73.43 O HETATM 2102 O42 PIO A 300 36.821 -12.147 13.430 1.00 73.23 O HETATM 2103 O43 PIO A 300 35.779 -10.964 15.365 1.00 53.21 O HETATM 2104 P5 PIO A 300 35.338 -10.750 9.021 1.00 23.11 P HETATM 2105 O53 PIO A 300 36.251 -10.277 7.914 1.00 45.01 O HETATM 2106 O52 PIO A 300 33.854 -10.539 8.764 1.00 34.44 O HETATM 2107 O51 PIO A 300 35.760 -12.059 9.660 1.00 10.44 O HETATM 2108 C1C PIO A 300 33.422 -3.203 9.295 1.00 44.23 C HETATM 2109 C2C PIO A 300 31.881 -3.355 9.240 1.00 55.42 C HETATM 2110 C3C PIO A 300 31.159 -2.005 9.470 1.00 4.22 C HETATM 2111 O2C PIO A 300 31.522 -3.859 7.965 1.00 74.04 O HETATM 2112 O3C PIO A 300 31.954 -0.958 8.956 1.00 51.13 O HETATM 2113 C1A PIO A 300 31.537 -5.265 7.791 1.00 11.21 C HETATM 2114 O1A PIO A 300 32.365 -5.786 7.076 1.00 2.21 O HETATM 2115 C2A PIO A 300 30.506 -6.136 8.528 1.00 41.22 C HETATM 2116 C3A PIO A 300 30.006 -7.265 7.607 1.00 62.52 C HETATM 2117 C4A PIO A 300 29.573 -8.470 8.462 1.00 60.15 C HETATM 2118 C5A PIO A 300 30.795 -9.360 8.756 1.00 12.33 C HETATM 2119 C6A PIO A 300 30.697 -9.911 10.189 1.00 40.14 C HETATM 2120 C7A PIO A 300 30.449 -11.431 10.141 1.00 11.40 C HETATM 2121 C8A PIO A 300 31.732 -12.174 10.557 1.00 22.32 C HETATM 2122 C1B PIO A 300 32.511 0.035 9.787 1.00 71.35 C HETATM 2123 O1B PIO A 300 33.694 0.122 10.061 1.00 1.35 O HETATM 2124 C2B PIO A 300 31.493 1.025 10.417 1.00 2.40 C HETATM 2125 C3B PIO A 300 31.015 2.114 9.442 1.00 3.44 C HETATM 2126 C4B PIO A 300 32.205 2.806 8.755 1.00 2.34 C HETATM 2127 C5B PIO A 300 32.021 2.741 7.227 1.00 45.32 C HETATM 2128 C6B PIO A 300 31.107 3.892 6.770 1.00 53.35 C HETATM 2129 C7B PIO A 300 31.963 5.137 6.468 1.00 31.12 C HETATM 2130 C8B PIO A 300 31.096 6.194 5.758 1.00 21.12 C HETATM 0 H8BB PIO A 300 30.711 5.782 4.825 1.00 21.12 H new HETATM 0 H8BA PIO A 300 30.262 6.473 6.402 1.00 21.12 H new HETATM 0 H8AB PIO A 300 32.540 -11.916 9.872 1.00 22.32 H new HETATM 0 H8AA PIO A 300 32.009 -11.883 11.570 1.00 22.32 H new HETATM 0 H7BA PIO A 300 32.369 5.546 7.393 1.00 31.12 H new HETATM 0 H7AA PIO A 300 29.629 -11.698 10.808 1.00 11.40 H new HETATM 0 H6BA PIO A 300 30.549 3.597 5.882 1.00 53.35 H new HETATM 0 H6AA PIO A 300 31.616 -9.699 10.735 1.00 40.14 H new HETATM 0 H5BA PIO A 300 32.989 2.812 6.730 1.00 45.32 H new HETATM 0 H5AA PIO A 300 30.840 -10.182 8.041 1.00 12.33 H new HETATM 0 H4BA PIO A 300 32.274 3.844 9.080 1.00 2.34 H new HETATM 0 H4AA PIO A 300 29.128 -8.125 9.396 1.00 60.15 H new HETATM 0 H3CA PIO A 300 30.185 -2.012 8.980 1.00 4.22 H new HETATM 0 H3BA PIO A 300 30.364 1.671 8.688 1.00 3.44 H new HETATM 0 H3AA PIO A 300 29.169 -6.913 7.004 1.00 62.52 H new HETATM 0 H2BA PIO A 300 30.629 0.466 10.777 1.00 2.40 H new HETATM 0 H2AA PIO A 300 30.954 -6.561 9.426 1.00 41.22 H new HETATM 0 H1CA PIO A 300 33.754 -2.554 8.484 1.00 44.23 H new HETATM 0 HO6 PIO A 300 35.126 -7.624 8.783 1.00 4.53 H new HETATM 0 HO3 PIO A 300 35.088 -9.290 15.054 1.00 30.13 H new HETATM 0 HO2 PIO A 300 36.138 -6.901 14.414 1.00 44.41 H new HETATM 0 H8B PIO A 300 31.700 7.076 5.544 1.00 21.12 H new HETATM 0 H8A PIO A 300 31.557 -13.249 10.523 1.00 22.32 H new HETATM 0 H7B PIO A 300 32.811 4.865 5.840 1.00 31.12 H new HETATM 0 H7A PIO A 300 30.152 -11.730 9.136 1.00 11.40 H new HETATM 0 H6B PIO A 300 30.375 4.120 7.545 1.00 53.35 H new HETATM 0 H6A PIO A 300 29.887 -9.417 10.725 1.00 40.14 H new HETATM 0 H6 PIO A 300 36.132 -7.210 10.848 1.00 35.24 H new HETATM 0 H5B PIO A 300 31.586 1.783 6.943 1.00 45.32 H new HETATM 0 H5A PIO A 300 31.714 -8.785 8.638 1.00 12.33 H new HETATM 0 H5 PIO A 300 33.765 -9.076 10.960 1.00 74.25 H new HETATM 0 H4B PIO A 300 33.138 2.320 9.041 1.00 2.34 H new HETATM 0 H4A PIO A 300 28.809 -9.045 7.938 1.00 60.15 H new HETATM 0 H4 PIO A 300 36.233 -9.025 12.787 1.00 44.32 H new HETATM 0 H3C PIO A 300 30.979 -1.852 10.534 1.00 4.22 H new HETATM 0 H3B PIO A 300 30.422 2.853 9.981 1.00 3.44 H new HETATM 0 H3A PIO A 300 30.795 -7.561 6.915 1.00 62.52 H new HETATM 0 H3 PIO A 300 33.270 -8.502 13.361 1.00 43.30 H new HETATM 0 H2C PIO A 300 31.576 -4.037 10.034 1.00 55.42 H new HETATM 0 H2B PIO A 300 31.950 1.500 11.285 1.00 2.40 H new HETATM 0 H2A PIO A 300 29.666 -5.522 8.851 1.00 41.22 H new HETATM 0 H2 PIO A 300 33.885 -6.120 13.789 1.00 1.14 H new HETATM 0 H1C PIO A 300 33.890 -4.175 9.137 1.00 44.23 H new HETATM 0 H1 PIO A 300 33.192 -6.670 11.652 1.00 64.01 H new