USER MOD reduce.3.24.130724 H: found=0, std=0, add=1127, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1130 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 MET CE :methyl 146:sc= -0.344 (180deg=-1.32) USER MOD Set 1.2: A 72 MET CE :methyl -155:sc= -0.217 (180deg=-1.23) USER MOD Set 2.1: A 60 ASN : amide:sc= 0.646 K(o=2.1,f=-2.9!) USER MOD Set 2.2: A 62 THR OG1 : rot 76:sc= 1.46 USER MOD Set 3.1: A 36 MET CE :methyl 151:sc= -0.797 (180deg=-2.84!) USER MOD Set 3.2: A 51 MET CE :methyl -143:sc= -0.401 (180deg=-1.24) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.931 USER MOD Single : A 8 GLN : amide:sc= -0.0461 X(o=-0.046,f=-0.51) USER MOD Single : A 13 LYS NZ :NH3+ 168:sc=-0.00805 (180deg=-0.123) USER MOD Single : A 17 SER OG : rot 88:sc= 1.03 USER MOD Single : A 21 LYS NZ :NH3+ -140:sc= -0.112 (180deg=-0.306) USER MOD Single : A 26 THR OG1 : rot 6:sc= 1.18 USER MOD Single : A 28 THR OG1 : rot -84:sc= 0.666 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0236 USER MOD Single : A 30 LYS NZ :NH3+ 167:sc= -0.0383 (180deg=-0.247) USER MOD Single : A 34 THR OG1 : rot 61:sc= 1.25 USER MOD Single : A 38 SER OG : rot 72:sc= 0.809 USER MOD Single : A 41 GLN : amide:sc= -0.16 K(o=-0.16,f=-0.81) USER MOD Single : A 42 ASN : amide:sc= -3.18! K(o=-3.2!,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -1.6! USER MOD Single : A 49 GLN : amide:sc= -0.167 K(o=-0.17,f=-0.7) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 73:sc= 0.437 USER MOD Single : A 75 LYS NZ :NH3+ -138:sc= 0.258 (180deg=0) USER MOD Single : A 76 MET CE :methyl -173:sc= -0.72 (180deg=-0.945) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= -0.0311 (180deg=-0.0311) USER MOD Single : A 97 ASN : amide:sc= -0.236 X(o=-0.24,f=-0.08) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.00928 USER MOD Single : A 107 HIS : no HE2:sc= -1.6! C(o=-1.6!,f=-9.3!) USER MOD Single : A 109 MET CE :methyl -172:sc= -0.0066 (180deg=-0.0872) USER MOD Single : A 110 THR OG1 : rot -86:sc= 1.22 USER MOD Single : A 111 ASN : amide:sc= -1.15 K(o=-1.1,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.0271 USER MOD Single : A 124 MET CE :methyl 168:sc= -1.09 (180deg=-1.63) USER MOD Single : A 135 GLN : amide:sc= -0.906 K(o=-0.91,f=0) USER MOD Single : A 137 ASN : amide:sc= 0.366 K(o=0.37,f=-8.4!) USER MOD Single : A 138 TYR OH : rot 42:sc= 1.25 USER MOD Single : A 143 GLN : amide:sc= -0.567 K(o=-0.57,f=0) USER MOD Single : A 144 MET CE :methyl -164:sc= 0 (180deg=-0.427) USER MOD Single : A 145 MET CE :methyl 177:sc= 0 (180deg=-0.0112) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ -170:sc= 1.76 (180deg=1.25!) USER MOD Single : B 87 HIS : no HD1:sc=-0.00344 X(o=-0.0034,f=-0.055) USER MOD Single : B 90 GLN : amide:sc= -0.861 K(o=-0.86,f=0) USER MOD Single : B 91 LYS NZ :NH3+ 159:sc= 1.17 (180deg=1.05) USER MOD Single : B 93 LYS NZ :NH3+ -167:sc= -0.555 (180deg=-0.876) USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 4 -18.786 7.387 1.465 1.00 0.00 N ATOM 43 CA LEU A 4 -19.090 6.013 1.277 1.00 0.00 C ATOM 44 C LEU A 4 -20.567 5.862 1.022 1.00 0.00 C ATOM 45 O LEU A 4 -21.397 6.440 1.746 1.00 0.00 O ATOM 46 CB LEU A 4 -18.659 5.209 2.497 1.00 0.00 C ATOM 47 CG LEU A 4 -18.371 3.717 2.284 1.00 0.00 C ATOM 48 CD1 LEU A 4 -17.502 3.498 1.049 1.00 0.00 C ATOM 49 CD2 LEU A 4 -17.657 3.173 3.503 1.00 0.00 C ATOM 0 HA LEU A 4 -18.544 5.630 0.415 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -17.761 5.672 2.907 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -19.438 5.299 3.254 1.00 0.00 H new ATOM 0 HG LEU A 4 -19.317 3.197 2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -17.313 2.432 0.921 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -18.017 3.883 0.169 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -16.554 4.022 1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -17.449 2.113 3.360 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -16.720 3.711 3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -18.288 3.303 4.382 1.00 0.00 H new ATOM 61 N THR A 5 -20.891 5.144 -0.014 1.00 0.00 N ATOM 62 CA THR A 5 -22.245 4.891 -0.377 1.00 0.00 C ATOM 63 C THR A 5 -22.922 3.896 0.567 1.00 0.00 C ATOM 64 O THR A 5 -22.264 3.032 1.170 1.00 0.00 O ATOM 65 CB THR A 5 -22.342 4.476 -1.850 1.00 0.00 C ATOM 66 OG1 THR A 5 -21.216 3.660 -2.195 1.00 0.00 O ATOM 67 CG2 THR A 5 -22.387 5.694 -2.747 1.00 0.00 C ATOM 0 H THR A 5 -20.207 4.714 -0.637 1.00 0.00 H new ATOM 0 HA THR A 5 -22.802 5.822 -0.266 1.00 0.00 H new ATOM 0 HB THR A 5 -23.261 3.908 -1.993 1.00 0.00 H new ATOM 0 HG1 THR A 5 -21.281 3.394 -3.136 1.00 0.00 H new ATOM 0 HG21 THR A 5 -22.456 5.377 -3.788 1.00 0.00 H new ATOM 0 HG22 THR A 5 -23.257 6.300 -2.494 1.00 0.00 H new ATOM 0 HG23 THR A 5 -21.481 6.283 -2.606 1.00 0.00 H new ATOM 75 N GLU A 6 -24.223 4.044 0.688 1.00 0.00 N ATOM 76 CA GLU A 6 -25.057 3.306 1.624 1.00 0.00 C ATOM 77 C GLU A 6 -24.920 1.782 1.528 1.00 0.00 C ATOM 78 O GLU A 6 -24.815 1.115 2.559 1.00 0.00 O ATOM 79 CB GLU A 6 -26.523 3.757 1.509 1.00 0.00 C ATOM 80 CG GLU A 6 -26.830 5.145 2.119 1.00 0.00 C ATOM 81 CD GLU A 6 -25.936 6.276 1.618 1.00 0.00 C ATOM 82 OE1 GLU A 6 -25.134 6.830 2.419 1.00 0.00 O ATOM 83 OE2 GLU A 6 -25.983 6.604 0.418 1.00 0.00 O ATOM 0 H GLU A 6 -24.753 4.704 0.119 1.00 0.00 H new ATOM 0 HA GLU A 6 -24.687 3.553 2.619 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -26.802 3.770 0.455 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -27.155 3.015 1.997 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -27.868 5.399 1.904 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -26.735 5.079 3.203 1.00 0.00 H new ATOM 90 N GLU A 7 -24.881 1.228 0.318 1.00 0.00 N ATOM 91 CA GLU A 7 -24.734 -0.228 0.182 1.00 0.00 C ATOM 92 C GLU A 7 -23.357 -0.694 0.588 1.00 0.00 C ATOM 93 O GLU A 7 -23.211 -1.791 1.141 1.00 0.00 O ATOM 94 CB GLU A 7 -25.100 -0.768 -1.200 1.00 0.00 C ATOM 95 CG GLU A 7 -26.584 -0.858 -1.481 1.00 0.00 C ATOM 96 CD GLU A 7 -27.265 0.465 -1.517 1.00 0.00 C ATOM 97 OE1 GLU A 7 -27.160 1.172 -2.534 1.00 0.00 O ATOM 98 OE2 GLU A 7 -27.951 0.819 -0.542 1.00 0.00 O ATOM 0 H GLU A 7 -24.946 1.742 -0.560 1.00 0.00 H new ATOM 0 HA GLU A 7 -25.464 -0.647 0.874 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -24.641 -0.130 -1.955 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -24.664 -1.761 -1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -26.735 -1.361 -2.436 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -27.053 -1.478 -0.717 1.00 0.00 H new ATOM 105 N GLN A 8 -22.345 0.139 0.339 1.00 0.00 N ATOM 106 CA GLN A 8 -20.994 -0.175 0.777 1.00 0.00 C ATOM 107 C GLN A 8 -21.008 -0.267 2.279 1.00 0.00 C ATOM 108 O GLN A 8 -20.555 -1.235 2.851 1.00 0.00 O ATOM 109 CB GLN A 8 -19.979 0.906 0.380 1.00 0.00 C ATOM 110 CG GLN A 8 -19.848 1.195 -1.097 1.00 0.00 C ATOM 111 CD GLN A 8 -19.476 -0.007 -1.922 1.00 0.00 C ATOM 112 OE1 GLN A 8 -18.800 -0.907 -1.456 1.00 0.00 O ATOM 113 NE2 GLN A 8 -19.918 -0.030 -3.152 1.00 0.00 N ATOM 0 H GLN A 8 -22.438 1.025 -0.158 1.00 0.00 H new ATOM 0 HA GLN A 8 -20.693 -1.108 0.301 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -20.251 1.832 0.886 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -19.000 0.611 0.758 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -20.792 1.597 -1.464 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -19.094 1.969 -1.240 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -20.482 0.743 -3.506 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -19.699 -0.821 -3.758 1.00 0.00 H new ATOM 122 N ILE A 9 -21.598 0.744 2.907 1.00 0.00 N ATOM 123 CA ILE A 9 -21.690 0.816 4.353 1.00 0.00 C ATOM 124 C ILE A 9 -22.470 -0.380 4.932 1.00 0.00 C ATOM 125 O ILE A 9 -22.133 -0.880 5.988 1.00 0.00 O ATOM 126 CB ILE A 9 -22.263 2.191 4.823 1.00 0.00 C ATOM 127 CG1 ILE A 9 -21.316 3.307 4.338 1.00 0.00 C ATOM 128 CG2 ILE A 9 -22.424 2.238 6.347 1.00 0.00 C ATOM 129 CD1 ILE A 9 -21.668 4.703 4.791 1.00 0.00 C ATOM 0 H ILE A 9 -22.025 1.535 2.424 1.00 0.00 H new ATOM 0 HA ILE A 9 -20.678 0.748 4.753 1.00 0.00 H new ATOM 0 HB ILE A 9 -23.255 2.334 4.394 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -20.307 3.077 4.680 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -21.294 3.292 3.248 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -22.825 3.208 6.641 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -23.108 1.451 6.665 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -21.454 2.088 6.820 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -20.938 5.409 4.394 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -22.661 4.964 4.426 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -21.659 4.745 5.880 1.00 0.00 H new ATOM 141 N ALA A 10 -23.460 -0.860 4.197 1.00 0.00 N ATOM 142 CA ALA A 10 -24.218 -2.050 4.584 1.00 0.00 C ATOM 143 C ALA A 10 -23.311 -3.284 4.570 1.00 0.00 C ATOM 144 O ALA A 10 -23.370 -4.139 5.459 1.00 0.00 O ATOM 145 CB ALA A 10 -25.389 -2.231 3.644 1.00 0.00 C ATOM 0 H ALA A 10 -23.764 -0.441 3.318 1.00 0.00 H new ATOM 0 HA ALA A 10 -24.599 -1.923 5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -25.954 -3.118 3.933 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -26.036 -1.356 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -25.022 -2.350 2.625 1.00 0.00 H new ATOM 151 N GLU A 11 -22.465 -3.365 3.565 1.00 0.00 N ATOM 152 CA GLU A 11 -21.475 -4.438 3.467 1.00 0.00 C ATOM 153 C GLU A 11 -20.478 -4.310 4.587 1.00 0.00 C ATOM 154 O GLU A 11 -20.038 -5.302 5.170 1.00 0.00 O ATOM 155 CB GLU A 11 -20.746 -4.389 2.144 1.00 0.00 C ATOM 156 CG GLU A 11 -21.606 -4.700 0.959 1.00 0.00 C ATOM 157 CD GLU A 11 -20.855 -4.563 -0.324 1.00 0.00 C ATOM 158 OE1 GLU A 11 -21.236 -3.725 -1.147 1.00 0.00 O ATOM 159 OE2 GLU A 11 -19.861 -5.300 -0.540 1.00 0.00 O ATOM 0 H GLU A 11 -22.437 -2.698 2.794 1.00 0.00 H new ATOM 0 HA GLU A 11 -21.999 -5.391 3.539 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -20.315 -3.396 2.016 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -19.916 -5.095 2.172 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.992 -5.715 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -22.467 -4.031 0.949 1.00 0.00 H new ATOM 166 N PHE A 12 -20.137 -3.079 4.906 1.00 0.00 N ATOM 167 CA PHE A 12 -19.243 -2.812 5.989 1.00 0.00 C ATOM 168 C PHE A 12 -19.870 -3.114 7.320 1.00 0.00 C ATOM 169 O PHE A 12 -19.181 -3.397 8.230 1.00 0.00 O ATOM 170 CB PHE A 12 -18.607 -1.419 5.922 1.00 0.00 C ATOM 171 CG PHE A 12 -17.688 -1.294 4.748 1.00 0.00 C ATOM 172 CD1 PHE A 12 -16.621 -2.148 4.622 1.00 0.00 C ATOM 173 CD2 PHE A 12 -17.900 -0.359 3.765 1.00 0.00 C ATOM 174 CE1 PHE A 12 -15.782 -2.078 3.536 1.00 0.00 C ATOM 175 CE2 PHE A 12 -17.061 -0.280 2.679 1.00 0.00 C ATOM 176 CZ PHE A 12 -16.003 -1.144 2.568 1.00 0.00 C ATOM 0 H PHE A 12 -20.474 -2.248 4.420 1.00 0.00 H new ATOM 0 HA PHE A 12 -18.409 -3.504 5.876 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -19.389 -0.663 5.856 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -18.054 -1.225 6.841 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -16.438 -2.887 5.388 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -18.735 0.322 3.846 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -14.950 -2.761 3.450 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -17.235 0.462 1.914 1.00 0.00 H new ATOM 0 HZ PHE A 12 -15.345 -1.085 1.714 1.00 0.00 H new ATOM 186 N LYS A 13 -21.185 -3.073 7.406 1.00 0.00 N ATOM 187 CA LYS A 13 -21.885 -3.514 8.610 1.00 0.00 C ATOM 188 C LYS A 13 -21.557 -4.986 8.854 1.00 0.00 C ATOM 189 O LYS A 13 -21.159 -5.391 9.968 1.00 0.00 O ATOM 190 CB LYS A 13 -23.409 -3.343 8.457 1.00 0.00 C ATOM 191 CG LYS A 13 -23.907 -1.912 8.400 1.00 0.00 C ATOM 192 CD LYS A 13 -23.617 -1.160 9.676 1.00 0.00 C ATOM 193 CE LYS A 13 -24.292 0.202 9.691 1.00 0.00 C ATOM 194 NZ LYS A 13 -25.762 0.102 9.826 1.00 0.00 N ATOM 0 H LYS A 13 -21.796 -2.740 6.660 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.559 -2.906 9.454 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -23.724 -3.855 7.548 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -23.898 -3.846 9.291 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.437 -1.398 7.562 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -24.981 -1.909 8.214 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -23.959 -1.745 10.529 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.540 -1.034 9.787 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -23.894 0.793 10.516 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.050 0.735 8.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.156 1.042 10.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -26.169 -0.255 8.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.996 -0.551 10.601 1.00 0.00 H new ATOM 208 N GLU A 14 -21.672 -5.763 7.788 1.00 0.00 N ATOM 209 CA GLU A 14 -21.388 -7.190 7.818 1.00 0.00 C ATOM 210 C GLU A 14 -19.892 -7.435 8.123 1.00 0.00 C ATOM 211 O GLU A 14 -19.526 -8.111 9.116 1.00 0.00 O ATOM 212 CB GLU A 14 -21.755 -7.812 6.457 1.00 0.00 C ATOM 213 CG GLU A 14 -23.177 -7.504 5.998 1.00 0.00 C ATOM 214 CD GLU A 14 -23.522 -8.128 4.665 1.00 0.00 C ATOM 215 OE1 GLU A 14 -23.107 -7.607 3.607 1.00 0.00 O ATOM 216 OE2 GLU A 14 -24.252 -9.126 4.642 1.00 0.00 O ATOM 0 H GLU A 14 -21.966 -5.420 6.874 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.982 -7.656 8.604 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -21.055 -7.451 5.704 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.630 -8.893 6.517 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -23.880 -7.860 6.751 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -23.304 -6.424 5.929 1.00 0.00 H new ATOM 223 N ALA A 15 -19.046 -6.834 7.305 1.00 0.00 N ATOM 224 CA ALA A 15 -17.598 -7.007 7.376 1.00 0.00 C ATOM 225 C ALA A 15 -16.994 -6.480 8.675 1.00 0.00 C ATOM 226 O ALA A 15 -16.064 -7.060 9.201 1.00 0.00 O ATOM 227 CB ALA A 15 -16.937 -6.353 6.185 1.00 0.00 C ATOM 0 H ALA A 15 -19.345 -6.203 6.562 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.408 -8.080 7.359 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.857 -6.488 6.248 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.307 -6.810 5.267 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.170 -5.288 6.179 1.00 0.00 H new ATOM 233 N PHE A 16 -17.533 -5.394 9.189 1.00 0.00 N ATOM 234 CA PHE A 16 -17.046 -4.797 10.426 1.00 0.00 C ATOM 235 C PHE A 16 -17.296 -5.739 11.567 1.00 0.00 C ATOM 236 O PHE A 16 -16.414 -5.995 12.367 1.00 0.00 O ATOM 237 CB PHE A 16 -17.768 -3.479 10.696 1.00 0.00 C ATOM 238 CG PHE A 16 -17.259 -2.692 11.847 1.00 0.00 C ATOM 239 CD1 PHE A 16 -17.671 -2.965 13.132 1.00 0.00 C ATOM 240 CD2 PHE A 16 -16.383 -1.662 11.640 1.00 0.00 C ATOM 241 CE1 PHE A 16 -17.212 -2.225 14.175 1.00 0.00 C ATOM 242 CE2 PHE A 16 -15.919 -0.915 12.684 1.00 0.00 C ATOM 243 CZ PHE A 16 -16.333 -1.196 13.959 1.00 0.00 C ATOM 0 H PHE A 16 -18.318 -4.898 8.767 1.00 0.00 H new ATOM 0 HA PHE A 16 -15.977 -4.606 10.329 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -17.705 -2.861 9.800 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -18.824 -3.692 10.863 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -18.364 -3.773 13.312 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -16.054 -1.437 10.636 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -17.541 -2.449 15.179 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -15.228 -0.105 12.505 1.00 0.00 H new ATOM 0 HZ PHE A 16 -15.969 -0.610 14.790 1.00 0.00 H new ATOM 253 N SER A 17 -18.492 -6.283 11.607 1.00 0.00 N ATOM 254 CA SER A 17 -18.893 -7.174 12.666 1.00 0.00 C ATOM 255 C SER A 17 -18.138 -8.525 12.594 1.00 0.00 C ATOM 256 O SER A 17 -18.133 -9.298 13.549 1.00 0.00 O ATOM 257 CB SER A 17 -20.405 -7.336 12.644 1.00 0.00 C ATOM 258 OG SER A 17 -21.038 -6.048 12.689 1.00 0.00 O ATOM 0 H SER A 17 -19.213 -6.118 10.904 1.00 0.00 H new ATOM 0 HA SER A 17 -18.617 -6.739 13.627 1.00 0.00 H new ATOM 0 HB2 SER A 17 -20.709 -7.868 11.743 1.00 0.00 H new ATOM 0 HB3 SER A 17 -20.727 -7.938 13.494 1.00 0.00 H new ATOM 0 HG SER A 17 -21.139 -5.701 11.778 1.00 0.00 H new ATOM 264 N LEU A 18 -17.533 -8.813 11.439 1.00 0.00 N ATOM 265 CA LEU A 18 -16.644 -9.966 11.308 1.00 0.00 C ATOM 266 C LEU A 18 -15.451 -9.755 12.262 1.00 0.00 C ATOM 267 O LEU A 18 -15.023 -10.673 12.967 1.00 0.00 O ATOM 268 CB LEU A 18 -16.172 -10.079 9.838 1.00 0.00 C ATOM 269 CG LEU A 18 -15.393 -11.345 9.396 1.00 0.00 C ATOM 270 CD1 LEU A 18 -15.319 -11.359 7.898 1.00 0.00 C ATOM 271 CD2 LEU A 18 -13.970 -11.388 9.951 1.00 0.00 C ATOM 0 H LEU A 18 -17.643 -8.265 10.586 1.00 0.00 H new ATOM 0 HA LEU A 18 -17.155 -10.892 11.570 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -17.053 -9.995 9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -15.543 -9.214 9.627 1.00 0.00 H new ATOM 0 HG LEU A 18 -15.926 -12.212 9.786 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -14.774 -12.244 7.569 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -16.327 -11.379 7.484 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.802 -10.464 7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -13.473 -12.296 9.609 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.416 -10.517 9.600 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -14.004 -11.382 11.040 1.00 0.00 H new ATOM 283 N PHE A 19 -14.954 -8.536 12.290 1.00 0.00 N ATOM 284 CA PHE A 19 -13.847 -8.165 13.153 1.00 0.00 C ATOM 285 C PHE A 19 -14.361 -7.885 14.563 1.00 0.00 C ATOM 286 O PHE A 19 -13.859 -8.446 15.541 1.00 0.00 O ATOM 287 CB PHE A 19 -13.112 -6.931 12.602 1.00 0.00 C ATOM 288 CG PHE A 19 -12.407 -7.128 11.276 1.00 0.00 C ATOM 289 CD1 PHE A 19 -13.111 -7.122 10.080 1.00 0.00 C ATOM 290 CD2 PHE A 19 -11.035 -7.295 11.230 1.00 0.00 C ATOM 291 CE1 PHE A 19 -12.462 -7.284 8.872 1.00 0.00 C ATOM 292 CE2 PHE A 19 -10.378 -7.461 10.025 1.00 0.00 C ATOM 293 CZ PHE A 19 -11.093 -7.456 8.845 1.00 0.00 C ATOM 0 H PHE A 19 -15.306 -7.771 11.714 1.00 0.00 H new ATOM 0 HA PHE A 19 -13.141 -8.995 13.186 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -13.832 -6.120 12.493 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.377 -6.608 13.340 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -14.183 -6.989 10.094 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.468 -7.296 12.149 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -13.025 -7.276 7.950 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -9.306 -7.594 10.007 1.00 0.00 H new ATOM 0 HZ PHE A 19 -10.582 -7.586 7.902 1.00 0.00 H new ATOM 303 N ASP A 20 -15.378 -7.034 14.647 1.00 0.00 N ATOM 304 CA ASP A 20 -16.011 -6.659 15.913 1.00 0.00 C ATOM 305 C ASP A 20 -16.802 -7.816 16.473 1.00 0.00 C ATOM 306 O ASP A 20 -17.948 -8.071 16.084 1.00 0.00 O ATOM 307 CB ASP A 20 -16.904 -5.430 15.735 1.00 0.00 C ATOM 308 CG ASP A 20 -17.712 -5.048 16.969 1.00 0.00 C ATOM 309 OD1 ASP A 20 -18.831 -4.572 16.802 1.00 0.00 O ATOM 310 OD2 ASP A 20 -17.256 -5.236 18.123 1.00 0.00 O ATOM 0 H ASP A 20 -15.792 -6.579 13.833 1.00 0.00 H new ATOM 0 HA ASP A 20 -15.224 -6.404 16.623 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -16.281 -4.583 15.449 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.592 -5.613 14.909 1.00 0.00 H new ATOM 315 N LYS A 21 -16.197 -8.491 17.391 1.00 0.00 N ATOM 316 CA LYS A 21 -16.730 -9.676 17.967 1.00 0.00 C ATOM 317 C LYS A 21 -17.813 -9.412 18.986 1.00 0.00 C ATOM 318 O LYS A 21 -18.591 -10.311 19.333 1.00 0.00 O ATOM 319 CB LYS A 21 -15.625 -10.484 18.554 1.00 0.00 C ATOM 320 CG LYS A 21 -14.819 -11.235 17.535 1.00 0.00 C ATOM 321 CD LYS A 21 -15.551 -12.472 17.158 1.00 0.00 C ATOM 322 CE LYS A 21 -14.779 -13.338 16.166 1.00 0.00 C ATOM 323 NZ LYS A 21 -14.606 -12.682 14.846 1.00 0.00 N ATOM 0 H LYS A 21 -15.289 -8.224 17.772 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.212 -10.238 17.167 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.962 -9.824 19.114 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.045 -11.194 19.267 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -14.651 -10.614 16.655 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.839 -11.486 17.940 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.759 -13.054 18.056 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.514 -12.201 16.724 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -13.799 -13.573 16.581 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.303 -14.284 16.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.731 -13.385 14.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -15.313 -11.927 14.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.652 -12.273 14.784 1.00 0.00 H new ATOM 337 N ASP A 22 -17.907 -8.184 19.449 1.00 0.00 N ATOM 338 CA ASP A 22 -18.880 -7.879 20.495 1.00 0.00 C ATOM 339 C ASP A 22 -20.162 -7.342 19.892 1.00 0.00 C ATOM 340 O ASP A 22 -21.196 -7.318 20.555 1.00 0.00 O ATOM 341 CB ASP A 22 -18.362 -6.812 21.460 1.00 0.00 C ATOM 342 CG ASP A 22 -16.979 -7.040 22.006 1.00 0.00 C ATOM 343 OD1 ASP A 22 -16.801 -7.855 22.936 1.00 0.00 O ATOM 344 OD2 ASP A 22 -16.031 -6.357 21.536 1.00 0.00 O ATOM 0 H ASP A 22 -17.342 -7.395 19.134 1.00 0.00 H new ATOM 0 HA ASP A 22 -19.056 -8.813 21.030 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -18.377 -5.849 20.949 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -19.056 -6.739 22.298 1.00 0.00 H new ATOM 349 N GLY A 23 -20.113 -6.960 18.627 1.00 0.00 N ATOM 350 CA GLY A 23 -21.279 -6.375 17.978 1.00 0.00 C ATOM 351 C GLY A 23 -21.602 -4.999 18.559 1.00 0.00 C ATOM 352 O GLY A 23 -22.771 -4.651 18.761 1.00 0.00 O ATOM 0 H GLY A 23 -19.288 -7.042 18.032 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -21.096 -6.287 16.907 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -22.137 -7.036 18.102 1.00 0.00 H new ATOM 356 N ASP A 24 -20.567 -4.228 18.819 1.00 0.00 N ATOM 357 CA ASP A 24 -20.690 -2.922 19.472 1.00 0.00 C ATOM 358 C ASP A 24 -20.323 -1.762 18.550 1.00 0.00 C ATOM 359 O ASP A 24 -20.613 -0.605 18.862 1.00 0.00 O ATOM 360 CB ASP A 24 -19.868 -2.836 20.780 1.00 0.00 C ATOM 361 CG ASP A 24 -18.384 -3.131 20.612 1.00 0.00 C ATOM 362 OD1 ASP A 24 -17.823 -3.893 21.388 1.00 0.00 O ATOM 363 OD2 ASP A 24 -17.742 -2.654 19.681 1.00 0.00 O ATOM 0 H ASP A 24 -19.607 -4.482 18.586 1.00 0.00 H new ATOM 0 HA ASP A 24 -21.746 -2.828 19.724 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -19.982 -1.837 21.201 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -20.285 -3.536 21.504 1.00 0.00 H new ATOM 368 N GLY A 25 -19.670 -2.060 17.450 1.00 0.00 N ATOM 369 CA GLY A 25 -19.303 -1.028 16.496 1.00 0.00 C ATOM 370 C GLY A 25 -17.955 -0.400 16.774 1.00 0.00 C ATOM 371 O GLY A 25 -17.638 0.661 16.230 1.00 0.00 O ATOM 0 H GLY A 25 -19.381 -3.003 17.191 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -19.295 -1.457 15.494 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -20.066 -0.250 16.504 1.00 0.00 H new ATOM 375 N THR A 26 -17.174 -1.013 17.615 1.00 0.00 N ATOM 376 CA THR A 26 -15.825 -0.565 17.865 1.00 0.00 C ATOM 377 C THR A 26 -14.894 -1.771 17.859 1.00 0.00 C ATOM 378 O THR A 26 -15.196 -2.798 18.472 1.00 0.00 O ATOM 379 CB THR A 26 -15.702 0.201 19.216 1.00 0.00 C ATOM 380 OG1 THR A 26 -16.283 -0.575 20.284 1.00 0.00 O ATOM 381 CG2 THR A 26 -16.375 1.571 19.151 1.00 0.00 C ATOM 0 H THR A 26 -17.449 -1.837 18.149 1.00 0.00 H new ATOM 0 HA THR A 26 -15.545 0.133 17.076 1.00 0.00 H new ATOM 0 HB THR A 26 -14.641 0.354 19.411 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.549 -1.454 19.942 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.268 2.075 20.112 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.904 2.171 18.372 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.433 1.446 18.923 1.00 0.00 H new ATOM 389 N ILE A 27 -13.817 -1.685 17.150 1.00 0.00 N ATOM 390 CA ILE A 27 -12.878 -2.772 17.091 1.00 0.00 C ATOM 391 C ILE A 27 -11.664 -2.438 17.933 1.00 0.00 C ATOM 392 O ILE A 27 -11.016 -1.400 17.730 1.00 0.00 O ATOM 393 CB ILE A 27 -12.435 -3.075 15.636 1.00 0.00 C ATOM 394 CG1 ILE A 27 -13.642 -3.353 14.765 1.00 0.00 C ATOM 395 CG2 ILE A 27 -11.546 -4.286 15.614 1.00 0.00 C ATOM 396 CD1 ILE A 27 -13.327 -3.498 13.297 1.00 0.00 C ATOM 0 H ILE A 27 -13.558 -0.868 16.597 1.00 0.00 H new ATOM 0 HA ILE A 27 -13.372 -3.662 17.480 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.898 -2.206 15.255 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -14.124 -4.266 15.113 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.362 -2.544 14.892 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -11.239 -4.493 14.589 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.664 -4.101 16.227 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -12.090 -5.144 16.010 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -14.246 -3.695 12.745 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.874 -2.577 12.929 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -12.633 -4.326 13.154 1.00 0.00 H new ATOM 408 N THR A 28 -11.403 -3.274 18.896 1.00 0.00 N ATOM 409 CA THR A 28 -10.248 -3.138 19.748 1.00 0.00 C ATOM 410 C THR A 28 -9.083 -3.958 19.175 1.00 0.00 C ATOM 411 O THR A 28 -9.275 -4.743 18.221 1.00 0.00 O ATOM 412 CB THR A 28 -10.580 -3.651 21.169 1.00 0.00 C ATOM 413 OG1 THR A 28 -11.160 -4.963 21.079 1.00 0.00 O ATOM 414 CG2 THR A 28 -11.550 -2.724 21.876 1.00 0.00 C ATOM 0 H THR A 28 -11.989 -4.079 19.117 1.00 0.00 H new ATOM 0 HA THR A 28 -9.966 -2.086 19.798 1.00 0.00 H new ATOM 0 HB THR A 28 -9.655 -3.685 21.744 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.121 -4.885 20.905 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.764 -3.112 22.872 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.109 -1.731 21.960 1.00 0.00 H new ATOM 0 HG23 THR A 28 -12.476 -2.662 21.305 1.00 0.00 H new ATOM 422 N THR A 29 -7.901 -3.803 19.759 1.00 0.00 N ATOM 423 CA THR A 29 -6.724 -4.569 19.378 1.00 0.00 C ATOM 424 C THR A 29 -6.996 -6.066 19.577 1.00 0.00 C ATOM 425 O THR A 29 -6.577 -6.911 18.779 1.00 0.00 O ATOM 426 CB THR A 29 -5.531 -4.136 20.251 1.00 0.00 C ATOM 427 OG1 THR A 29 -5.969 -4.049 21.610 1.00 0.00 O ATOM 428 CG2 THR A 29 -4.984 -2.790 19.826 1.00 0.00 C ATOM 0 H THR A 29 -7.733 -3.138 20.514 1.00 0.00 H new ATOM 0 HA THR A 29 -6.492 -4.385 18.329 1.00 0.00 H new ATOM 0 HB THR A 29 -4.737 -4.874 20.138 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.219 -3.776 22.179 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.144 -2.520 20.466 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.648 -2.844 18.790 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.765 -2.035 19.915 1.00 0.00 H new ATOM 436 N LYS A 30 -7.765 -6.349 20.627 1.00 0.00 N ATOM 437 CA LYS A 30 -8.196 -7.684 21.013 1.00 0.00 C ATOM 438 C LYS A 30 -8.887 -8.379 19.848 1.00 0.00 C ATOM 439 O LYS A 30 -8.536 -9.498 19.464 1.00 0.00 O ATOM 440 CB LYS A 30 -9.202 -7.550 22.160 1.00 0.00 C ATOM 441 CG LYS A 30 -9.662 -8.860 22.769 1.00 0.00 C ATOM 442 CD LYS A 30 -10.629 -8.606 23.914 1.00 0.00 C ATOM 443 CE LYS A 30 -11.116 -9.900 24.539 1.00 0.00 C ATOM 444 NZ LYS A 30 -10.003 -10.724 25.058 1.00 0.00 N ATOM 0 H LYS A 30 -8.116 -5.625 21.253 1.00 0.00 H new ATOM 0 HA LYS A 30 -7.327 -8.269 21.313 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.755 -6.940 22.945 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.076 -7.010 21.795 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -10.145 -9.472 22.007 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -8.801 -9.422 23.131 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.140 -7.997 24.674 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.483 -8.035 23.549 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.806 -9.672 25.351 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.674 -10.472 23.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.383 -11.479 25.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.484 -11.147 24.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -9.358 -10.126 25.614 1.00 0.00 H new ATOM 458 N GLU A 31 -9.838 -7.685 19.278 1.00 0.00 N ATOM 459 CA GLU A 31 -10.672 -8.204 18.219 1.00 0.00 C ATOM 460 C GLU A 31 -9.891 -8.356 16.928 1.00 0.00 C ATOM 461 O GLU A 31 -10.085 -9.330 16.184 1.00 0.00 O ATOM 462 CB GLU A 31 -11.867 -7.299 18.064 1.00 0.00 C ATOM 463 CG GLU A 31 -12.660 -7.214 19.349 1.00 0.00 C ATOM 464 CD GLU A 31 -13.730 -6.177 19.314 1.00 0.00 C ATOM 465 OE1 GLU A 31 -14.846 -6.461 18.904 1.00 0.00 O ATOM 466 OE2 GLU A 31 -13.494 -5.032 19.763 1.00 0.00 O ATOM 0 H GLU A 31 -10.061 -6.725 19.540 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.020 -9.204 18.476 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -11.536 -6.303 17.771 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -12.506 -7.671 17.263 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.111 -8.185 19.554 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.981 -6.997 20.173 1.00 0.00 H new ATOM 473 N LEU A 32 -8.981 -7.423 16.685 1.00 0.00 N ATOM 474 CA LEU A 32 -8.093 -7.509 15.539 1.00 0.00 C ATOM 475 C LEU A 32 -7.240 -8.758 15.652 1.00 0.00 C ATOM 476 O LEU A 32 -7.216 -9.586 14.748 1.00 0.00 O ATOM 477 CB LEU A 32 -7.200 -6.268 15.437 1.00 0.00 C ATOM 478 CG LEU A 32 -7.888 -4.955 15.075 1.00 0.00 C ATOM 479 CD1 LEU A 32 -6.884 -3.819 15.089 1.00 0.00 C ATOM 480 CD2 LEU A 32 -8.545 -5.055 13.702 1.00 0.00 C ATOM 0 H LEU A 32 -8.840 -6.598 17.268 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.699 -7.561 14.634 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.693 -6.134 16.393 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.429 -6.464 14.692 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.662 -4.755 15.816 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.386 -2.887 14.829 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.448 -3.731 16.084 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.096 -4.021 14.364 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.030 -4.109 13.461 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.786 -5.275 12.951 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.288 -5.852 13.711 1.00 0.00 H new ATOM 492 N GLY A 33 -6.606 -8.922 16.803 1.00 0.00 N ATOM 493 CA GLY A 33 -5.772 -10.073 17.038 1.00 0.00 C ATOM 494 C GLY A 33 -6.553 -11.368 17.005 1.00 0.00 C ATOM 495 O GLY A 33 -6.007 -12.398 16.652 1.00 0.00 O ATOM 0 H GLY A 33 -6.658 -8.268 17.584 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.985 -10.108 16.285 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.282 -9.972 18.007 1.00 0.00 H new ATOM 499 N THR A 34 -7.830 -11.312 17.373 1.00 0.00 N ATOM 500 CA THR A 34 -8.704 -12.477 17.325 1.00 0.00 C ATOM 501 C THR A 34 -8.829 -12.999 15.874 1.00 0.00 C ATOM 502 O THR A 34 -8.537 -14.171 15.594 1.00 0.00 O ATOM 503 CB THR A 34 -10.123 -12.149 17.894 1.00 0.00 C ATOM 504 OG1 THR A 34 -10.031 -11.728 19.273 1.00 0.00 O ATOM 505 CG2 THR A 34 -11.051 -13.354 17.804 1.00 0.00 C ATOM 0 H THR A 34 -8.284 -10.463 17.710 1.00 0.00 H new ATOM 0 HA THR A 34 -8.256 -13.251 17.948 1.00 0.00 H new ATOM 0 HB THR A 34 -10.535 -11.342 17.289 1.00 0.00 H new ATOM 0 HG1 THR A 34 -9.484 -10.917 19.332 1.00 0.00 H new ATOM 0 HG21 THR A 34 -12.029 -13.091 18.208 1.00 0.00 H new ATOM 0 HG22 THR A 34 -11.158 -13.654 16.762 1.00 0.00 H new ATOM 0 HG23 THR A 34 -10.631 -14.180 18.378 1.00 0.00 H new ATOM 513 N VAL A 35 -9.195 -12.115 14.949 1.00 0.00 N ATOM 514 CA VAL A 35 -9.382 -12.523 13.564 1.00 0.00 C ATOM 515 C VAL A 35 -8.046 -12.844 12.893 1.00 0.00 C ATOM 516 O VAL A 35 -7.961 -13.735 12.056 1.00 0.00 O ATOM 517 CB VAL A 35 -10.209 -11.503 12.720 1.00 0.00 C ATOM 518 CG1 VAL A 35 -11.607 -11.325 13.299 1.00 0.00 C ATOM 519 CG2 VAL A 35 -9.508 -10.158 12.608 1.00 0.00 C ATOM 0 H VAL A 35 -9.365 -11.126 15.132 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.977 -13.435 13.600 1.00 0.00 H new ATOM 0 HB VAL A 35 -10.296 -11.916 11.715 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -12.163 -10.610 12.693 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -12.126 -12.283 13.297 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -11.533 -10.955 14.321 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -10.118 -9.478 12.013 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -9.364 -9.739 13.604 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.539 -10.292 12.127 1.00 0.00 H new ATOM 529 N MET A 36 -6.996 -12.156 13.312 1.00 0.00 N ATOM 530 CA MET A 36 -5.659 -12.401 12.791 1.00 0.00 C ATOM 531 C MET A 36 -5.166 -13.756 13.236 1.00 0.00 C ATOM 532 O MET A 36 -4.536 -14.478 12.469 1.00 0.00 O ATOM 533 CB MET A 36 -4.696 -11.313 13.237 1.00 0.00 C ATOM 534 CG MET A 36 -5.030 -9.969 12.668 1.00 0.00 C ATOM 535 SD MET A 36 -3.982 -8.686 13.311 1.00 0.00 S ATOM 536 CE MET A 36 -4.839 -7.276 12.667 1.00 0.00 C ATOM 0 H MET A 36 -7.044 -11.419 14.016 1.00 0.00 H new ATOM 0 HA MET A 36 -5.707 -12.385 11.702 1.00 0.00 H new ATOM 0 HB2 MET A 36 -4.703 -11.253 14.325 1.00 0.00 H new ATOM 0 HB3 MET A 36 -3.684 -11.587 12.939 1.00 0.00 H new ATOM 0 HG2 MET A 36 -4.935 -10.003 11.583 1.00 0.00 H new ATOM 0 HG3 MET A 36 -6.070 -9.731 12.890 1.00 0.00 H new ATOM 0 HE1 MET A 36 -4.687 -6.424 13.329 1.00 0.00 H new ATOM 0 HE2 MET A 36 -4.454 -7.038 11.675 1.00 0.00 H new ATOM 0 HE3 MET A 36 -5.904 -7.497 12.600 1.00 0.00 H new ATOM 546 N ARG A 37 -5.496 -14.115 14.461 1.00 0.00 N ATOM 547 CA ARG A 37 -5.141 -15.405 15.033 1.00 0.00 C ATOM 548 C ARG A 37 -5.859 -16.507 14.263 1.00 0.00 C ATOM 549 O ARG A 37 -5.325 -17.590 14.062 1.00 0.00 O ATOM 550 CB ARG A 37 -5.529 -15.424 16.510 1.00 0.00 C ATOM 551 CG ARG A 37 -5.100 -16.642 17.304 1.00 0.00 C ATOM 552 CD ARG A 37 -5.526 -16.469 18.745 1.00 0.00 C ATOM 553 NE ARG A 37 -5.115 -17.563 19.625 1.00 0.00 N ATOM 554 CZ ARG A 37 -5.348 -17.575 20.947 1.00 0.00 C ATOM 555 NH1 ARG A 37 -6.050 -16.593 21.507 1.00 0.00 N ATOM 556 NH2 ARG A 37 -4.895 -18.563 21.707 1.00 0.00 N ATOM 0 H ARG A 37 -6.023 -13.516 15.096 1.00 0.00 H new ATOM 0 HA ARG A 37 -4.067 -15.572 14.957 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -5.106 -14.539 16.986 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -6.613 -15.335 16.580 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -5.550 -17.542 16.884 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -4.019 -16.768 17.244 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -5.111 -15.536 19.126 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.611 -16.375 18.783 1.00 0.00 H new ATOM 0 HE ARG A 37 -4.626 -18.358 19.213 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -6.411 -15.832 20.932 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -6.227 -16.602 22.511 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -4.363 -19.326 21.288 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.079 -18.560 22.710 1.00 0.00 H new ATOM 570 N SER A 38 -7.041 -16.186 13.772 1.00 0.00 N ATOM 571 CA SER A 38 -7.825 -17.106 12.975 1.00 0.00 C ATOM 572 C SER A 38 -7.239 -17.221 11.541 1.00 0.00 C ATOM 573 O SER A 38 -7.579 -18.130 10.783 1.00 0.00 O ATOM 574 CB SER A 38 -9.272 -16.625 12.940 1.00 0.00 C ATOM 575 OG SER A 38 -9.757 -16.413 14.267 1.00 0.00 O ATOM 0 H SER A 38 -7.484 -15.278 13.916 1.00 0.00 H new ATOM 0 HA SER A 38 -7.791 -18.099 13.423 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.341 -15.699 12.368 1.00 0.00 H new ATOM 0 HB3 SER A 38 -9.895 -17.361 12.431 1.00 0.00 H new ATOM 0 HG SER A 38 -9.338 -15.612 14.644 1.00 0.00 H new ATOM 581 N LEU A 39 -6.353 -16.297 11.195 1.00 0.00 N ATOM 582 CA LEU A 39 -5.684 -16.295 9.899 1.00 0.00 C ATOM 583 C LEU A 39 -4.240 -16.778 10.050 1.00 0.00 C ATOM 584 O LEU A 39 -3.453 -16.737 9.096 1.00 0.00 O ATOM 585 CB LEU A 39 -5.698 -14.888 9.279 1.00 0.00 C ATOM 586 CG LEU A 39 -7.075 -14.277 8.984 1.00 0.00 C ATOM 587 CD1 LEU A 39 -6.923 -12.868 8.437 1.00 0.00 C ATOM 588 CD2 LEU A 39 -7.857 -15.143 8.004 1.00 0.00 C ATOM 0 H LEU A 39 -6.077 -15.527 11.804 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.223 -16.973 9.237 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -5.164 -14.215 9.950 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.134 -14.922 8.347 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.633 -14.232 9.919 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.908 -12.449 8.233 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.409 -12.247 9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.343 -12.896 7.515 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.829 -14.688 7.812 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.303 -15.225 7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.999 -16.136 8.430 1.00 0.00 H new ATOM 600 N GLY A 40 -3.899 -17.219 11.248 1.00 0.00 N ATOM 601 CA GLY A 40 -2.574 -17.738 11.516 1.00 0.00 C ATOM 602 C GLY A 40 -1.527 -16.654 11.718 1.00 0.00 C ATOM 603 O GLY A 40 -0.340 -16.887 11.516 1.00 0.00 O ATOM 0 H GLY A 40 -4.526 -17.227 12.052 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.612 -18.366 12.406 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.268 -18.377 10.688 1.00 0.00 H new ATOM 607 N GLN A 41 -1.953 -15.474 12.092 1.00 0.00 N ATOM 608 CA GLN A 41 -1.048 -14.403 12.340 1.00 0.00 C ATOM 609 C GLN A 41 -1.186 -13.916 13.751 1.00 0.00 C ATOM 610 O GLN A 41 -2.286 -13.712 14.231 1.00 0.00 O ATOM 611 CB GLN A 41 -1.323 -13.259 11.433 1.00 0.00 C ATOM 612 CG GLN A 41 -0.251 -12.238 11.581 1.00 0.00 C ATOM 613 CD GLN A 41 1.083 -12.661 10.992 1.00 0.00 C ATOM 614 OE1 GLN A 41 1.903 -13.262 11.678 1.00 0.00 O ATOM 615 NE2 GLN A 41 1.319 -12.350 9.753 1.00 0.00 N ATOM 0 H GLN A 41 -2.936 -15.239 12.230 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.040 -14.781 12.167 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.371 -13.604 10.400 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.293 -12.820 11.668 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -0.573 -11.314 11.101 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -0.116 -12.017 12.640 1.00 0.00 H new ATOM 0 HE21 GLN A 41 0.615 -11.850 9.210 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.208 -12.606 9.323 1.00 0.00 H new ATOM 624 N ASN A 42 -0.093 -13.770 14.432 1.00 0.00 N ATOM 625 CA ASN A 42 -0.096 -13.193 15.765 1.00 0.00 C ATOM 626 C ASN A 42 0.834 -11.986 15.800 1.00 0.00 C ATOM 627 O ASN A 42 2.006 -12.119 16.185 1.00 0.00 O ATOM 628 CB ASN A 42 0.331 -14.211 16.862 1.00 0.00 C ATOM 629 CG ASN A 42 -0.702 -15.292 17.233 1.00 0.00 C ATOM 630 OD1 ASN A 42 -0.695 -15.801 18.349 1.00 0.00 O ATOM 631 ND2 ASN A 42 -1.604 -15.620 16.350 1.00 0.00 N ATOM 0 H ASN A 42 0.830 -14.042 14.093 1.00 0.00 H new ATOM 0 HA ASN A 42 -1.121 -12.893 15.984 1.00 0.00 H new ATOM 0 HB2 ASN A 42 1.242 -14.709 16.530 1.00 0.00 H new ATOM 0 HB3 ASN A 42 0.583 -13.655 17.765 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.318 -16.310 16.583 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.595 -15.187 15.427 1.00 0.00 H new ATOM 638 N PRO A 43 0.382 -10.805 15.296 1.00 0.00 N ATOM 639 CA PRO A 43 1.174 -9.575 15.361 1.00 0.00 C ATOM 640 C PRO A 43 1.356 -9.125 16.800 1.00 0.00 C ATOM 641 O PRO A 43 0.639 -9.587 17.700 1.00 0.00 O ATOM 642 CB PRO A 43 0.326 -8.550 14.593 1.00 0.00 C ATOM 643 CG PRO A 43 -0.579 -9.369 13.755 1.00 0.00 C ATOM 644 CD PRO A 43 -0.895 -10.571 14.585 1.00 0.00 C ATOM 0 HA PRO A 43 2.174 -9.702 14.947 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -0.235 -7.910 15.274 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.950 -7.897 13.982 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -1.484 -8.819 13.497 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -0.100 -9.652 12.818 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -1.717 -10.384 15.276 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -1.182 -11.425 13.972 1.00 0.00 H new ATOM 652 N THR A 44 2.285 -8.246 17.021 1.00 0.00 N ATOM 653 CA THR A 44 2.565 -7.761 18.338 1.00 0.00 C ATOM 654 C THR A 44 1.495 -6.741 18.767 1.00 0.00 C ATOM 655 O THR A 44 0.714 -6.258 17.923 1.00 0.00 O ATOM 656 CB THR A 44 3.970 -7.118 18.368 1.00 0.00 C ATOM 657 OG1 THR A 44 4.053 -6.097 17.365 1.00 0.00 O ATOM 658 CG2 THR A 44 5.051 -8.161 18.115 1.00 0.00 C ATOM 0 H THR A 44 2.872 -7.843 16.291 1.00 0.00 H new ATOM 0 HA THR A 44 2.544 -8.595 19.039 1.00 0.00 H new ATOM 0 HB THR A 44 4.128 -6.684 19.356 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.944 -5.689 17.386 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.031 -7.684 18.141 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.002 -8.930 18.886 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.895 -8.616 17.137 1.00 0.00 H new ATOM 666 N GLU A 45 1.456 -6.421 20.058 1.00 0.00 N ATOM 667 CA GLU A 45 0.505 -5.447 20.606 1.00 0.00 C ATOM 668 C GLU A 45 0.742 -4.092 19.920 1.00 0.00 C ATOM 669 O GLU A 45 -0.198 -3.355 19.609 1.00 0.00 O ATOM 670 CB GLU A 45 0.727 -5.317 22.124 1.00 0.00 C ATOM 671 CG GLU A 45 -0.330 -4.514 22.875 1.00 0.00 C ATOM 672 CD GLU A 45 -1.663 -5.229 22.974 1.00 0.00 C ATOM 673 OE1 GLU A 45 -1.859 -6.022 23.930 1.00 0.00 O ATOM 674 OE2 GLU A 45 -2.556 -4.990 22.159 1.00 0.00 O ATOM 0 H GLU A 45 2.080 -6.827 20.756 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.519 -5.774 20.426 1.00 0.00 H new ATOM 0 HB2 GLU A 45 0.772 -6.318 22.554 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.699 -4.853 22.293 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.034 -4.296 23.879 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.474 -3.557 22.374 1.00 0.00 H new ATOM 681 N ALA A 46 2.019 -3.812 19.650 1.00 0.00 N ATOM 682 CA ALA A 46 2.438 -2.598 18.969 1.00 0.00 C ATOM 683 C ALA A 46 1.827 -2.525 17.577 1.00 0.00 C ATOM 684 O ALA A 46 1.278 -1.499 17.193 1.00 0.00 O ATOM 685 CB ALA A 46 3.956 -2.536 18.885 1.00 0.00 C ATOM 0 H ALA A 46 2.791 -4.429 19.902 1.00 0.00 H new ATOM 0 HA ALA A 46 2.085 -1.742 19.544 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.255 -1.622 18.373 1.00 0.00 H new ATOM 0 HB2 ALA A 46 4.377 -2.543 19.891 1.00 0.00 H new ATOM 0 HB3 ALA A 46 4.325 -3.399 18.332 1.00 0.00 H new ATOM 691 N GLU A 47 1.885 -3.640 16.845 1.00 0.00 N ATOM 692 CA GLU A 47 1.327 -3.717 15.499 1.00 0.00 C ATOM 693 C GLU A 47 -0.157 -3.447 15.501 1.00 0.00 C ATOM 694 O GLU A 47 -0.658 -2.710 14.655 1.00 0.00 O ATOM 695 CB GLU A 47 1.590 -5.080 14.876 1.00 0.00 C ATOM 696 CG GLU A 47 3.035 -5.336 14.544 1.00 0.00 C ATOM 697 CD GLU A 47 3.550 -4.376 13.519 1.00 0.00 C ATOM 698 OE1 GLU A 47 4.251 -3.431 13.873 1.00 0.00 O ATOM 699 OE2 GLU A 47 3.271 -4.566 12.326 1.00 0.00 O ATOM 0 H GLU A 47 2.317 -4.506 17.168 1.00 0.00 H new ATOM 0 HA GLU A 47 1.822 -2.949 14.904 1.00 0.00 H new ATOM 0 HB2 GLU A 47 1.243 -5.854 15.561 1.00 0.00 H new ATOM 0 HB3 GLU A 47 0.998 -5.172 13.966 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.635 -5.256 15.450 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.148 -6.356 14.176 1.00 0.00 H new ATOM 706 N LEU A 48 -0.845 -4.030 16.460 1.00 0.00 N ATOM 707 CA LEU A 48 -2.280 -3.876 16.584 1.00 0.00 C ATOM 708 C LEU A 48 -2.647 -2.433 16.925 1.00 0.00 C ATOM 709 O LEU A 48 -3.530 -1.841 16.300 1.00 0.00 O ATOM 710 CB LEU A 48 -2.824 -4.831 17.653 1.00 0.00 C ATOM 711 CG LEU A 48 -2.596 -6.326 17.408 1.00 0.00 C ATOM 712 CD1 LEU A 48 -3.088 -7.140 18.595 1.00 0.00 C ATOM 713 CD2 LEU A 48 -3.304 -6.771 16.140 1.00 0.00 C ATOM 0 H LEU A 48 -0.426 -4.624 17.176 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.735 -4.124 15.625 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.371 -4.568 18.609 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -3.896 -4.660 17.751 1.00 0.00 H new ATOM 0 HG LEU A 48 -1.526 -6.494 17.288 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -2.919 -8.200 18.405 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -2.545 -6.841 19.491 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.154 -6.963 18.741 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.131 -7.835 15.981 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.374 -6.587 16.237 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.915 -6.210 15.290 1.00 0.00 H new ATOM 725 N GLN A 49 -1.953 -1.864 17.889 1.00 0.00 N ATOM 726 CA GLN A 49 -2.236 -0.510 18.323 1.00 0.00 C ATOM 727 C GLN A 49 -1.874 0.531 17.261 1.00 0.00 C ATOM 728 O GLN A 49 -2.652 1.458 17.012 1.00 0.00 O ATOM 729 CB GLN A 49 -1.577 -0.204 19.680 1.00 0.00 C ATOM 730 CG GLN A 49 -1.785 1.228 20.167 1.00 0.00 C ATOM 731 CD GLN A 49 -3.250 1.652 20.192 1.00 0.00 C ATOM 732 OE1 GLN A 49 -4.155 0.844 20.397 1.00 0.00 O ATOM 733 NE2 GLN A 49 -3.487 2.912 19.970 1.00 0.00 N ATOM 0 H GLN A 49 -1.188 -2.318 18.388 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.315 -0.441 18.463 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.974 -0.891 20.427 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.507 -0.398 19.604 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.368 1.327 21.169 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.229 1.908 19.522 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -2.713 3.555 19.804 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.447 3.257 19.962 1.00 0.00 H new ATOM 742 N ASP A 50 -0.725 0.366 16.616 1.00 0.00 N ATOM 743 CA ASP A 50 -0.292 1.307 15.568 1.00 0.00 C ATOM 744 C ASP A 50 -1.289 1.308 14.437 1.00 0.00 C ATOM 745 O ASP A 50 -1.678 2.359 13.926 1.00 0.00 O ATOM 746 CB ASP A 50 1.087 0.941 15.024 1.00 0.00 C ATOM 747 CG ASP A 50 1.577 1.944 14.009 1.00 0.00 C ATOM 748 OD1 ASP A 50 1.420 1.722 12.789 1.00 0.00 O ATOM 749 OD2 ASP A 50 2.135 2.985 14.417 1.00 0.00 O ATOM 0 H ASP A 50 -0.076 -0.401 16.792 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.233 2.299 16.015 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.798 0.882 15.848 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.046 -0.048 14.567 1.00 0.00 H new ATOM 754 N MET A 51 -1.728 0.111 14.098 1.00 0.00 N ATOM 755 CA MET A 51 -2.732 -0.138 13.073 1.00 0.00 C ATOM 756 C MET A 51 -3.993 0.669 13.354 1.00 0.00 C ATOM 757 O MET A 51 -4.534 1.336 12.461 1.00 0.00 O ATOM 758 CB MET A 51 -3.046 -1.619 13.092 1.00 0.00 C ATOM 759 CG MET A 51 -4.113 -2.095 12.144 1.00 0.00 C ATOM 760 SD MET A 51 -4.366 -3.870 12.303 1.00 0.00 S ATOM 761 CE MET A 51 -2.721 -4.482 11.931 1.00 0.00 C ATOM 0 H MET A 51 -1.387 -0.743 14.540 1.00 0.00 H new ATOM 0 HA MET A 51 -2.357 0.163 12.095 1.00 0.00 H new ATOM 0 HB2 MET A 51 -2.128 -2.164 12.873 1.00 0.00 H new ATOM 0 HB3 MET A 51 -3.344 -1.891 14.105 1.00 0.00 H new ATOM 0 HG2 MET A 51 -5.047 -1.571 12.348 1.00 0.00 H new ATOM 0 HG3 MET A 51 -3.829 -1.854 11.120 1.00 0.00 H new ATOM 0 HE1 MET A 51 -2.798 -5.409 11.363 1.00 0.00 H new ATOM 0 HE2 MET A 51 -2.181 -3.740 11.344 1.00 0.00 H new ATOM 0 HE3 MET A 51 -2.184 -4.670 12.861 1.00 0.00 H new ATOM 771 N ILE A 52 -4.436 0.624 14.597 1.00 0.00 N ATOM 772 CA ILE A 52 -5.601 1.366 15.015 1.00 0.00 C ATOM 773 C ILE A 52 -5.343 2.848 14.980 1.00 0.00 C ATOM 774 O ILE A 52 -6.069 3.578 14.325 1.00 0.00 O ATOM 775 CB ILE A 52 -6.078 0.976 16.437 1.00 0.00 C ATOM 776 CG1 ILE A 52 -6.588 -0.469 16.448 1.00 0.00 C ATOM 777 CG2 ILE A 52 -7.144 1.960 16.951 1.00 0.00 C ATOM 778 CD1 ILE A 52 -7.173 -0.913 17.765 1.00 0.00 C ATOM 0 H ILE A 52 -3.999 0.075 15.337 1.00 0.00 H new ATOM 0 HA ILE A 52 -6.388 1.109 14.306 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.230 1.037 17.119 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -7.345 -0.580 15.672 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.765 -1.134 16.187 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -7.461 1.663 17.951 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.724 2.965 16.987 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -8.003 1.950 16.280 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.509 -1.947 17.684 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.414 -0.838 18.544 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -8.019 -0.276 18.021 1.00 0.00 H new ATOM 790 N ASN A 53 -4.281 3.272 15.647 1.00 0.00 N ATOM 791 CA ASN A 53 -3.981 4.691 15.847 1.00 0.00 C ATOM 792 C ASN A 53 -3.909 5.492 14.546 1.00 0.00 C ATOM 793 O ASN A 53 -4.202 6.683 14.535 1.00 0.00 O ATOM 794 CB ASN A 53 -2.722 4.883 16.714 1.00 0.00 C ATOM 795 CG ASN A 53 -2.412 6.349 17.012 1.00 0.00 C ATOM 796 OD1 ASN A 53 -2.983 6.937 17.941 1.00 0.00 O ATOM 797 ND2 ASN A 53 -1.474 6.925 16.292 1.00 0.00 N ATOM 0 H ASN A 53 -3.597 2.643 16.068 1.00 0.00 H new ATOM 0 HA ASN A 53 -4.829 5.104 16.393 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -2.852 4.348 17.655 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -1.868 4.434 16.207 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -1.196 7.886 16.491 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -1.025 6.411 15.534 1.00 0.00 H new ATOM 804 N GLU A 54 -3.560 4.833 13.454 1.00 0.00 N ATOM 805 CA GLU A 54 -3.492 5.419 12.200 1.00 0.00 C ATOM 806 C GLU A 54 -4.871 5.856 11.665 1.00 0.00 C ATOM 807 O GLU A 54 -5.002 6.940 11.114 1.00 0.00 O ATOM 808 CB GLU A 54 -2.844 4.430 11.307 1.00 0.00 C ATOM 809 CG GLU A 54 -1.342 4.324 11.482 1.00 0.00 C ATOM 810 CD GLU A 54 -0.668 5.668 11.383 1.00 0.00 C ATOM 811 OE1 GLU A 54 -0.191 6.174 12.417 1.00 0.00 O ATOM 812 OE2 GLU A 54 -0.637 6.264 10.284 1.00 0.00 O ATOM 0 H GLU A 54 -3.315 3.843 13.456 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.914 6.342 12.251 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -3.289 3.451 11.484 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.060 4.696 10.272 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -1.120 3.877 12.451 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -0.934 3.657 10.723 1.00 0.00 H new ATOM 819 N VAL A 55 -5.884 5.024 11.844 1.00 0.00 N ATOM 820 CA VAL A 55 -7.245 5.374 11.399 1.00 0.00 C ATOM 821 C VAL A 55 -8.048 5.982 12.519 1.00 0.00 C ATOM 822 O VAL A 55 -9.111 6.562 12.292 1.00 0.00 O ATOM 823 CB VAL A 55 -8.039 4.179 10.814 1.00 0.00 C ATOM 824 CG1 VAL A 55 -7.572 3.846 9.432 1.00 0.00 C ATOM 825 CG2 VAL A 55 -7.918 2.955 11.701 1.00 0.00 C ATOM 0 H VAL A 55 -5.803 4.109 12.288 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.098 6.099 10.599 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.086 4.478 10.769 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.147 3.004 9.047 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.714 4.710 8.782 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -6.515 3.582 9.459 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.485 2.132 11.265 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -6.870 2.669 11.785 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.312 3.183 12.691 1.00 0.00 H new ATOM 835 N ASP A 56 -7.549 5.827 13.713 1.00 0.00 N ATOM 836 CA ASP A 56 -8.171 6.350 14.903 1.00 0.00 C ATOM 837 C ASP A 56 -8.061 7.870 14.875 1.00 0.00 C ATOM 838 O ASP A 56 -6.987 8.436 15.087 1.00 0.00 O ATOM 839 CB ASP A 56 -7.476 5.753 16.137 1.00 0.00 C ATOM 840 CG ASP A 56 -8.128 6.087 17.440 1.00 0.00 C ATOM 841 OD1 ASP A 56 -9.254 6.598 17.450 1.00 0.00 O ATOM 842 OD2 ASP A 56 -7.537 5.814 18.490 1.00 0.00 O ATOM 0 H ASP A 56 -6.680 5.323 13.893 1.00 0.00 H new ATOM 0 HA ASP A 56 -9.226 6.079 14.949 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.442 4.669 16.030 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.444 6.103 16.162 1.00 0.00 H new ATOM 847 N ALA A 57 -9.160 8.513 14.581 1.00 0.00 N ATOM 848 CA ALA A 57 -9.194 9.937 14.372 1.00 0.00 C ATOM 849 C ALA A 57 -9.326 10.679 15.674 1.00 0.00 C ATOM 850 O ALA A 57 -8.740 11.753 15.851 1.00 0.00 O ATOM 851 CB ALA A 57 -10.328 10.305 13.428 1.00 0.00 C ATOM 0 H ALA A 57 -10.067 8.058 14.479 1.00 0.00 H new ATOM 0 HA ALA A 57 -8.249 10.233 13.917 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -10.342 11.385 13.279 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -10.179 9.808 12.469 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -11.277 9.986 13.858 1.00 0.00 H new ATOM 857 N ASP A 58 -10.067 10.116 16.601 1.00 0.00 N ATOM 858 CA ASP A 58 -10.268 10.787 17.875 1.00 0.00 C ATOM 859 C ASP A 58 -9.204 10.363 18.877 1.00 0.00 C ATOM 860 O ASP A 58 -9.044 10.987 19.933 1.00 0.00 O ATOM 861 CB ASP A 58 -11.693 10.568 18.426 1.00 0.00 C ATOM 862 CG ASP A 58 -11.971 9.180 18.958 1.00 0.00 C ATOM 863 OD1 ASP A 58 -12.555 9.068 20.047 1.00 0.00 O ATOM 864 OD2 ASP A 58 -11.637 8.186 18.301 1.00 0.00 O ATOM 0 H ASP A 58 -10.534 9.214 16.506 1.00 0.00 H new ATOM 0 HA ASP A 58 -10.164 11.859 17.706 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.871 11.288 19.224 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.409 10.786 17.634 1.00 0.00 H new ATOM 869 N GLY A 59 -8.447 9.336 18.514 1.00 0.00 N ATOM 870 CA GLY A 59 -7.335 8.874 19.323 1.00 0.00 C ATOM 871 C GLY A 59 -7.776 8.286 20.640 1.00 0.00 C ATOM 872 O GLY A 59 -7.278 8.682 21.703 1.00 0.00 O ATOM 0 H GLY A 59 -8.588 8.805 17.655 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -6.773 8.125 18.766 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.657 9.707 19.511 1.00 0.00 H new ATOM 876 N ASN A 60 -8.694 7.352 20.582 1.00 0.00 N ATOM 877 CA ASN A 60 -9.228 6.738 21.794 1.00 0.00 C ATOM 878 C ASN A 60 -8.723 5.305 21.964 1.00 0.00 C ATOM 879 O ASN A 60 -8.861 4.714 23.041 1.00 0.00 O ATOM 880 CB ASN A 60 -10.773 6.756 21.830 1.00 0.00 C ATOM 881 CG ASN A 60 -11.438 5.811 20.830 1.00 0.00 C ATOM 882 OD1 ASN A 60 -10.914 5.541 19.738 1.00 0.00 O ATOM 883 ND2 ASN A 60 -12.583 5.315 21.174 1.00 0.00 N ATOM 0 H ASN A 60 -9.093 6.994 19.714 1.00 0.00 H new ATOM 0 HA ASN A 60 -8.865 7.342 22.626 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -11.104 6.494 22.835 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -11.117 7.772 21.636 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.077 4.686 20.541 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.991 5.553 22.078 1.00 0.00 H new ATOM 890 N GLY A 61 -8.150 4.742 20.917 1.00 0.00 N ATOM 891 CA GLY A 61 -7.629 3.397 21.008 1.00 0.00 C ATOM 892 C GLY A 61 -8.457 2.374 20.255 1.00 0.00 C ATOM 893 O GLY A 61 -8.095 1.198 20.215 1.00 0.00 O ATOM 0 H GLY A 61 -8.036 5.189 20.008 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.610 3.384 20.621 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -7.575 3.107 22.057 1.00 0.00 H new ATOM 897 N THR A 62 -9.562 2.794 19.675 1.00 0.00 N ATOM 898 CA THR A 62 -10.393 1.884 18.905 1.00 0.00 C ATOM 899 C THR A 62 -10.674 2.447 17.524 1.00 0.00 C ATOM 900 O THR A 62 -10.702 3.688 17.334 1.00 0.00 O ATOM 901 CB THR A 62 -11.749 1.596 19.610 1.00 0.00 C ATOM 902 OG1 THR A 62 -12.410 2.824 19.935 1.00 0.00 O ATOM 903 CG2 THR A 62 -11.554 0.776 20.869 1.00 0.00 C ATOM 0 H THR A 62 -9.906 3.753 19.720 1.00 0.00 H new ATOM 0 HA THR A 62 -9.836 0.951 18.821 1.00 0.00 H new ATOM 0 HB THR A 62 -12.366 1.022 18.918 1.00 0.00 H new ATOM 0 HG1 THR A 62 -12.800 3.210 19.123 1.00 0.00 H new ATOM 0 HG21 THR A 62 -12.521 0.593 21.337 1.00 0.00 H new ATOM 0 HG22 THR A 62 -11.088 -0.176 20.615 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.913 1.320 21.562 1.00 0.00 H new ATOM 911 N ILE A 63 -10.876 1.563 16.569 1.00 0.00 N ATOM 912 CA ILE A 63 -11.290 1.970 15.251 1.00 0.00 C ATOM 913 C ILE A 63 -12.785 1.920 15.304 1.00 0.00 C ATOM 914 O ILE A 63 -13.375 0.842 15.343 1.00 0.00 O ATOM 915 CB ILE A 63 -10.824 0.990 14.131 1.00 0.00 C ATOM 916 CG1 ILE A 63 -9.339 0.663 14.272 1.00 0.00 C ATOM 917 CG2 ILE A 63 -11.096 1.608 12.749 1.00 0.00 C ATOM 918 CD1 ILE A 63 -8.837 -0.370 13.278 1.00 0.00 C ATOM 0 H ILE A 63 -10.759 0.557 16.686 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.864 2.944 15.011 1.00 0.00 H new ATOM 0 HB ILE A 63 -11.388 0.063 14.231 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -8.762 1.580 14.150 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -9.152 0.301 15.283 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -10.768 0.918 11.971 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -12.164 1.798 12.639 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.549 2.546 12.656 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -7.774 -0.547 13.443 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -9.386 -1.302 13.414 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.990 -0.003 12.263 1.00 0.00 H new ATOM 930 N ASP A 64 -13.384 3.052 15.381 1.00 0.00 N ATOM 931 CA ASP A 64 -14.803 3.127 15.543 1.00 0.00 C ATOM 932 C ASP A 64 -15.414 3.040 14.174 1.00 0.00 C ATOM 933 O ASP A 64 -14.730 3.314 13.177 1.00 0.00 O ATOM 934 CB ASP A 64 -15.217 4.437 16.251 1.00 0.00 C ATOM 935 CG ASP A 64 -14.392 4.747 17.500 1.00 0.00 C ATOM 936 OD1 ASP A 64 -13.834 5.881 17.596 1.00 0.00 O ATOM 937 OD2 ASP A 64 -14.209 3.883 18.354 1.00 0.00 O ATOM 0 H ASP A 64 -12.912 3.955 15.334 1.00 0.00 H new ATOM 0 HA ASP A 64 -15.155 2.309 16.172 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -15.122 5.265 15.549 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.269 4.373 16.528 1.00 0.00 H new ATOM 942 N PHE A 65 -16.670 2.664 14.109 1.00 0.00 N ATOM 943 CA PHE A 65 -17.360 2.457 12.835 1.00 0.00 C ATOM 944 C PHE A 65 -17.229 3.661 11.861 1.00 0.00 C ATOM 945 O PHE A 65 -16.843 3.461 10.710 1.00 0.00 O ATOM 946 CB PHE A 65 -18.824 2.053 13.050 1.00 0.00 C ATOM 947 CG PHE A 65 -19.505 1.606 11.786 1.00 0.00 C ATOM 948 CD1 PHE A 65 -19.147 0.412 11.182 1.00 0.00 C ATOM 949 CD2 PHE A 65 -20.489 2.373 11.201 1.00 0.00 C ATOM 950 CE1 PHE A 65 -19.755 -0.006 10.019 1.00 0.00 C ATOM 951 CE2 PHE A 65 -21.105 1.959 10.037 1.00 0.00 C ATOM 952 CZ PHE A 65 -20.735 0.770 9.447 1.00 0.00 C ATOM 0 H PHE A 65 -17.250 2.491 14.930 1.00 0.00 H new ATOM 0 HA PHE A 65 -16.852 1.626 12.346 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -18.868 1.248 13.784 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -19.370 2.898 13.470 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -18.379 -0.201 11.630 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -20.781 3.307 11.658 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.463 -0.939 9.559 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.877 2.567 9.589 1.00 0.00 H new ATOM 0 HZ PHE A 65 -21.215 0.448 8.535 1.00 0.00 H new ATOM 962 N PRO A 66 -17.542 4.923 12.294 1.00 0.00 N ATOM 963 CA PRO A 66 -17.359 6.123 11.456 1.00 0.00 C ATOM 964 C PRO A 66 -15.944 6.212 10.835 1.00 0.00 C ATOM 965 O PRO A 66 -15.799 6.459 9.631 1.00 0.00 O ATOM 966 CB PRO A 66 -17.592 7.291 12.442 1.00 0.00 C ATOM 967 CG PRO A 66 -17.629 6.661 13.799 1.00 0.00 C ATOM 968 CD PRO A 66 -18.160 5.286 13.579 1.00 0.00 C ATOM 0 HA PRO A 66 -18.037 6.124 10.603 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -16.793 8.029 12.373 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -18.525 7.810 12.224 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -16.636 6.632 14.247 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -18.268 7.226 14.478 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -17.871 4.604 14.378 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -19.249 5.272 13.527 1.00 0.00 H new ATOM 976 N GLU A 67 -14.925 5.943 11.647 1.00 0.00 N ATOM 977 CA GLU A 67 -13.526 6.017 11.219 1.00 0.00 C ATOM 978 C GLU A 67 -13.218 4.907 10.233 1.00 0.00 C ATOM 979 O GLU A 67 -12.471 5.091 9.264 1.00 0.00 O ATOM 980 CB GLU A 67 -12.618 5.864 12.416 1.00 0.00 C ATOM 981 CG GLU A 67 -12.880 6.852 13.524 1.00 0.00 C ATOM 982 CD GLU A 67 -12.085 6.534 14.748 1.00 0.00 C ATOM 983 OE1 GLU A 67 -12.089 5.382 15.202 1.00 0.00 O ATOM 984 OE2 GLU A 67 -11.480 7.421 15.358 1.00 0.00 O ATOM 0 H GLU A 67 -15.043 5.667 12.622 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.361 6.984 10.744 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -12.726 4.854 12.812 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -11.584 5.969 12.088 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.634 7.857 13.181 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -13.942 6.850 13.769 1.00 0.00 H new ATOM 991 N PHE A 68 -13.815 3.760 10.480 1.00 0.00 N ATOM 992 CA PHE A 68 -13.634 2.587 9.661 1.00 0.00 C ATOM 993 C PHE A 68 -14.170 2.870 8.256 1.00 0.00 C ATOM 994 O PHE A 68 -13.561 2.484 7.254 1.00 0.00 O ATOM 995 CB PHE A 68 -14.378 1.413 10.302 1.00 0.00 C ATOM 996 CG PHE A 68 -13.963 0.048 9.829 1.00 0.00 C ATOM 997 CD1 PHE A 68 -14.437 -0.483 8.644 1.00 0.00 C ATOM 998 CD2 PHE A 68 -13.110 -0.723 10.602 1.00 0.00 C ATOM 999 CE1 PHE A 68 -14.068 -1.741 8.246 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -12.737 -1.985 10.200 1.00 0.00 C ATOM 1001 CZ PHE A 68 -13.217 -2.495 9.022 1.00 0.00 C ATOM 0 H PHE A 68 -14.448 3.618 11.267 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.577 2.333 9.586 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -14.237 1.462 11.382 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -15.445 1.535 10.113 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -15.104 0.099 8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -12.732 -0.328 11.533 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -14.447 -2.143 7.318 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -12.068 -2.572 10.811 1.00 0.00 H new ATOM 0 HZ PHE A 68 -12.928 -3.486 8.703 1.00 0.00 H new ATOM 1011 N LEU A 69 -15.288 3.571 8.198 1.00 0.00 N ATOM 1012 CA LEU A 69 -15.899 3.964 6.935 1.00 0.00 C ATOM 1013 C LEU A 69 -14.997 4.942 6.199 1.00 0.00 C ATOM 1014 O LEU A 69 -14.779 4.802 4.989 1.00 0.00 O ATOM 1015 CB LEU A 69 -17.264 4.587 7.177 1.00 0.00 C ATOM 1016 CG LEU A 69 -18.288 3.707 7.885 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -19.551 4.494 8.135 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -18.600 2.469 7.066 1.00 0.00 C ATOM 0 H LEU A 69 -15.800 3.885 9.023 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.029 3.074 6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.127 5.495 7.765 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.678 4.889 6.215 1.00 0.00 H new ATOM 0 HG LEU A 69 -17.867 3.386 8.838 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -20.280 3.861 8.641 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -19.324 5.357 8.760 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.963 4.833 7.184 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.333 1.859 7.594 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -19.004 2.765 6.098 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -17.687 1.892 6.917 1.00 0.00 H new ATOM 1030 N THR A 70 -14.459 5.908 6.944 1.00 0.00 N ATOM 1031 CA THR A 70 -13.505 6.876 6.420 1.00 0.00 C ATOM 1032 C THR A 70 -12.324 6.141 5.781 1.00 0.00 C ATOM 1033 O THR A 70 -11.932 6.423 4.630 1.00 0.00 O ATOM 1034 CB THR A 70 -12.998 7.777 7.567 1.00 0.00 C ATOM 1035 OG1 THR A 70 -14.108 8.472 8.165 1.00 0.00 O ATOM 1036 CG2 THR A 70 -11.947 8.775 7.082 1.00 0.00 C ATOM 0 H THR A 70 -14.676 6.039 7.932 1.00 0.00 H new ATOM 0 HA THR A 70 -13.994 7.493 5.667 1.00 0.00 H new ATOM 0 HB THR A 70 -12.522 7.139 8.312 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.638 7.844 8.699 1.00 0.00 H new ATOM 0 HG21 THR A 70 -11.616 9.390 7.919 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.095 8.235 6.669 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.379 9.413 6.311 1.00 0.00 H new ATOM 1044 N MET A 71 -11.786 5.184 6.529 1.00 0.00 N ATOM 1045 CA MET A 71 -10.722 4.331 6.063 1.00 0.00 C ATOM 1046 C MET A 71 -11.103 3.655 4.766 1.00 0.00 C ATOM 1047 O MET A 71 -10.407 3.780 3.798 1.00 0.00 O ATOM 1048 CB MET A 71 -10.342 3.278 7.130 1.00 0.00 C ATOM 1049 CG MET A 71 -9.523 2.098 6.585 1.00 0.00 C ATOM 1050 SD MET A 71 -8.936 0.940 7.853 1.00 0.00 S ATOM 1051 CE MET A 71 -10.407 0.676 8.843 1.00 0.00 C ATOM 0 H MET A 71 -12.086 4.984 7.483 1.00 0.00 H new ATOM 0 HA MET A 71 -9.850 4.959 5.881 1.00 0.00 H new ATOM 0 HB2 MET A 71 -9.773 3.767 7.920 1.00 0.00 H new ATOM 0 HB3 MET A 71 -11.254 2.893 7.586 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.132 1.551 5.865 1.00 0.00 H new ATOM 0 HG3 MET A 71 -8.663 2.489 6.042 1.00 0.00 H new ATOM 0 HE1 MET A 71 -10.417 -0.349 9.214 1.00 0.00 H new ATOM 0 HE2 MET A 71 -10.407 1.367 9.686 1.00 0.00 H new ATOM 0 HE3 MET A 71 -11.293 0.849 8.232 1.00 0.00 H new ATOM 1061 N MET A 72 -12.243 3.004 4.748 1.00 0.00 N ATOM 1062 CA MET A 72 -12.662 2.220 3.591 1.00 0.00 C ATOM 1063 C MET A 72 -12.896 3.037 2.348 1.00 0.00 C ATOM 1064 O MET A 72 -12.435 2.650 1.268 1.00 0.00 O ATOM 1065 CB MET A 72 -13.837 1.323 3.916 1.00 0.00 C ATOM 1066 CG MET A 72 -13.464 0.295 4.944 1.00 0.00 C ATOM 1067 SD MET A 72 -12.037 -0.671 4.416 1.00 0.00 S ATOM 1068 CE MET A 72 -11.643 -1.498 5.931 1.00 0.00 C ATOM 0 H MET A 72 -12.906 2.997 5.523 1.00 0.00 H new ATOM 0 HA MET A 72 -11.814 1.579 3.351 1.00 0.00 H new ATOM 0 HB2 MET A 72 -14.667 1.925 4.284 1.00 0.00 H new ATOM 0 HB3 MET A 72 -14.181 0.826 3.009 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.242 0.788 5.891 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.310 -0.369 5.121 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.587 -1.770 5.933 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.849 -0.835 6.772 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.250 -2.399 6.022 1.00 0.00 H new ATOM 1078 N ALA A 73 -13.542 4.182 2.500 1.00 0.00 N ATOM 1079 CA ALA A 73 -13.810 5.086 1.381 1.00 0.00 C ATOM 1080 C ALA A 73 -12.501 5.512 0.711 1.00 0.00 C ATOM 1081 O ALA A 73 -12.425 5.685 -0.505 1.00 0.00 O ATOM 1082 CB ALA A 73 -14.572 6.302 1.876 1.00 0.00 C ATOM 0 H ALA A 73 -13.896 4.515 3.397 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.417 4.564 0.642 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.770 6.973 1.040 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.517 5.985 2.318 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.978 6.823 2.626 1.00 0.00 H new ATOM 1088 N ARG A 74 -11.486 5.665 1.520 1.00 0.00 N ATOM 1089 CA ARG A 74 -10.164 6.023 1.064 1.00 0.00 C ATOM 1090 C ARG A 74 -9.360 4.794 0.590 1.00 0.00 C ATOM 1091 O ARG A 74 -8.576 4.875 -0.346 1.00 0.00 O ATOM 1092 CB ARG A 74 -9.416 6.682 2.216 1.00 0.00 C ATOM 1093 CG ARG A 74 -9.902 8.066 2.610 1.00 0.00 C ATOM 1094 CD ARG A 74 -9.213 8.524 3.891 1.00 0.00 C ATOM 1095 NE ARG A 74 -7.750 8.362 3.820 1.00 0.00 N ATOM 1096 CZ ARG A 74 -6.920 8.326 4.876 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -7.373 8.594 6.099 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -5.634 8.064 4.699 1.00 0.00 N ATOM 0 H ARG A 74 -11.553 5.543 2.530 1.00 0.00 H new ATOM 0 HA ARG A 74 -10.271 6.701 0.217 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -9.483 6.031 3.088 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.361 6.750 1.949 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.697 8.773 1.806 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -10.982 8.052 2.755 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -9.453 9.571 4.077 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.600 7.953 4.735 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.333 8.270 2.894 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.356 8.828 6.239 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -6.737 8.565 6.896 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -5.273 7.890 3.761 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.004 8.037 5.501 1.00 0.00 H new ATOM 1112 N LYS A 75 -9.601 3.671 1.215 1.00 0.00 N ATOM 1113 CA LYS A 75 -8.764 2.477 1.066 1.00 0.00 C ATOM 1114 C LYS A 75 -9.133 1.667 -0.164 1.00 0.00 C ATOM 1115 O LYS A 75 -8.269 1.105 -0.819 1.00 0.00 O ATOM 1116 CB LYS A 75 -8.901 1.642 2.346 1.00 0.00 C ATOM 1117 CG LYS A 75 -7.893 0.525 2.573 1.00 0.00 C ATOM 1118 CD LYS A 75 -8.055 0.003 3.950 1.00 0.00 C ATOM 1119 CE LYS A 75 -6.988 -0.991 4.359 1.00 0.00 C ATOM 1120 NZ LYS A 75 -7.099 -1.319 5.801 1.00 0.00 N ATOM 0 H LYS A 75 -10.388 3.544 1.851 1.00 0.00 H new ATOM 0 HA LYS A 75 -7.727 2.779 0.922 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.846 2.321 3.197 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.898 1.201 2.354 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.046 -0.274 1.847 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.879 0.898 2.428 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.045 0.840 4.649 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.032 -0.472 4.035 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -7.085 -1.900 3.766 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -6.001 -0.578 4.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.149 -1.351 6.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.667 -0.591 6.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -7.559 -2.245 5.912 1.00 0.00 H new ATOM 1134 N MET A 76 -10.400 1.622 -0.485 1.00 0.00 N ATOM 1135 CA MET A 76 -10.843 0.843 -1.638 1.00 0.00 C ATOM 1136 C MET A 76 -10.613 1.612 -2.917 1.00 0.00 C ATOM 1137 O MET A 76 -10.170 1.066 -3.922 1.00 0.00 O ATOM 1138 CB MET A 76 -12.327 0.513 -1.544 1.00 0.00 C ATOM 1139 CG MET A 76 -12.735 -0.309 -0.347 1.00 0.00 C ATOM 1140 SD MET A 76 -14.504 -0.663 -0.341 1.00 0.00 S ATOM 1141 CE MET A 76 -15.207 0.994 -0.342 1.00 0.00 C ATOM 0 H MET A 76 -11.143 2.104 0.021 1.00 0.00 H new ATOM 0 HA MET A 76 -10.263 -0.080 -1.643 1.00 0.00 H new ATOM 0 HB2 MET A 76 -12.889 1.447 -1.530 1.00 0.00 H new ATOM 0 HB3 MET A 76 -12.620 -0.022 -2.447 1.00 0.00 H new ATOM 0 HG2 MET A 76 -12.178 -1.246 -0.344 1.00 0.00 H new ATOM 0 HG3 MET A 76 -12.469 0.223 0.566 1.00 0.00 H new ATOM 0 HE1 MET A 76 -16.288 0.931 -0.213 1.00 0.00 H new ATOM 0 HE2 MET A 76 -14.777 1.572 0.476 1.00 0.00 H new ATOM 0 HE3 MET A 76 -14.982 1.484 -1.289 1.00 0.00 H new ATOM 1222 N GLU A 82 -0.032 9.581 -3.509 1.00 0.00 N ATOM 1223 CA GLU A 82 1.164 10.244 -2.978 1.00 0.00 C ATOM 1224 C GLU A 82 1.282 9.973 -1.479 1.00 0.00 C ATOM 1225 O GLU A 82 2.326 9.536 -0.997 1.00 0.00 O ATOM 1226 CB GLU A 82 1.080 11.752 -3.239 1.00 0.00 C ATOM 1227 CG GLU A 82 2.308 12.560 -2.847 1.00 0.00 C ATOM 1228 CD GLU A 82 3.529 12.174 -3.637 1.00 0.00 C ATOM 1229 OE1 GLU A 82 3.461 12.191 -4.891 1.00 0.00 O ATOM 1230 OE2 GLU A 82 4.572 11.876 -3.033 1.00 0.00 O ATOM 0 HA GLU A 82 2.048 9.849 -3.478 1.00 0.00 H new ATOM 0 HB2 GLU A 82 0.889 11.908 -4.301 1.00 0.00 H new ATOM 0 HB3 GLU A 82 0.220 12.148 -2.699 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.104 13.620 -2.995 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.507 12.419 -1.785 1.00 0.00 H new ATOM 1237 N GLU A 83 0.187 10.175 -0.755 1.00 0.00 N ATOM 1238 CA GLU A 83 0.172 9.920 0.679 1.00 0.00 C ATOM 1239 C GLU A 83 0.378 8.445 0.986 1.00 0.00 C ATOM 1240 O GLU A 83 0.891 8.086 2.032 1.00 0.00 O ATOM 1241 CB GLU A 83 -1.101 10.341 1.299 1.00 0.00 C ATOM 1242 CG GLU A 83 -1.513 11.774 1.075 1.00 0.00 C ATOM 1243 CD GLU A 83 -2.717 12.116 1.904 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -2.549 12.683 3.008 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -3.848 11.777 1.506 1.00 0.00 O ATOM 0 H GLU A 83 -0.697 10.513 -1.136 1.00 0.00 H new ATOM 0 HA GLU A 83 0.993 10.504 1.095 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.894 9.695 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.031 10.169 2.373 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.688 12.439 1.331 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.735 11.933 0.020 1.00 0.00 H new ATOM 1252 N GLU A 84 -0.012 7.597 0.062 1.00 0.00 N ATOM 1253 CA GLU A 84 0.151 6.172 0.228 1.00 0.00 C ATOM 1254 C GLU A 84 1.592 5.762 -0.009 1.00 0.00 C ATOM 1255 O GLU A 84 2.057 4.749 0.534 1.00 0.00 O ATOM 1256 CB GLU A 84 -0.785 5.369 -0.667 1.00 0.00 C ATOM 1257 CG GLU A 84 -2.250 5.343 -0.229 1.00 0.00 C ATOM 1258 CD GLU A 84 -2.963 6.676 -0.265 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -3.535 7.019 -1.316 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -2.997 7.374 0.768 1.00 0.00 O ATOM 0 H GLU A 84 -0.447 7.873 -0.818 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.117 5.944 1.260 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.733 5.776 -1.677 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.420 4.343 -0.718 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.790 4.644 -0.868 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.301 4.951 0.787 1.00 0.00 H new ATOM 1267 N ILE A 85 2.294 6.534 -0.819 1.00 0.00 N ATOM 1268 CA ILE A 85 3.711 6.310 -1.036 1.00 0.00 C ATOM 1269 C ILE A 85 4.420 6.742 0.236 1.00 0.00 C ATOM 1270 O ILE A 85 5.352 6.100 0.697 1.00 0.00 O ATOM 1271 CB ILE A 85 4.277 7.127 -2.243 1.00 0.00 C ATOM 1272 CG1 ILE A 85 3.417 6.953 -3.511 1.00 0.00 C ATOM 1273 CG2 ILE A 85 5.716 6.733 -2.534 1.00 0.00 C ATOM 1274 CD1 ILE A 85 3.154 5.517 -3.918 1.00 0.00 C ATOM 0 H ILE A 85 1.905 7.322 -1.337 1.00 0.00 H new ATOM 0 HA ILE A 85 3.873 5.258 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 85 4.245 8.179 -1.959 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.460 7.451 -3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.910 7.464 -4.338 1.00 0.00 H new ATOM 0 HG21 ILE A 85 6.089 7.314 -3.377 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.332 6.931 -1.657 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.761 5.671 -2.777 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.542 5.501 -4.820 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.101 5.015 -4.114 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.630 5.001 -3.114 1.00 0.00 H new ATOM 1286 N ARG A 86 3.922 7.822 0.806 1.00 0.00 N ATOM 1287 CA ARG A 86 4.383 8.337 2.077 1.00 0.00 C ATOM 1288 C ARG A 86 4.149 7.322 3.169 1.00 0.00 C ATOM 1289 O ARG A 86 4.999 7.119 4.006 1.00 0.00 O ATOM 1290 CB ARG A 86 3.656 9.617 2.400 1.00 0.00 C ATOM 1291 CG ARG A 86 4.107 10.268 3.673 1.00 0.00 C ATOM 1292 CD ARG A 86 3.303 11.514 3.938 1.00 0.00 C ATOM 1293 NE ARG A 86 1.900 11.242 4.280 1.00 0.00 N ATOM 1294 CZ ARG A 86 0.877 11.980 3.831 1.00 0.00 C ATOM 1295 NH1 ARG A 86 1.068 12.850 2.835 1.00 0.00 N ATOM 1296 NH2 ARG A 86 -0.341 11.811 4.327 1.00 0.00 N ATOM 0 H ARG A 86 3.172 8.375 0.390 1.00 0.00 H new ATOM 0 HA ARG A 86 5.452 8.537 2.011 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.792 10.318 1.577 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.588 9.409 2.468 1.00 0.00 H new ATOM 0 HG2 ARG A 86 3.996 9.572 4.504 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.166 10.518 3.606 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.767 12.070 4.753 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.337 12.154 3.056 1.00 0.00 H new ATOM 0 HE ARG A 86 1.695 10.451 4.890 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.993 12.952 2.417 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.289 13.412 2.493 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.503 11.115 5.055 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.116 12.377 3.980 1.00 0.00 H new ATOM 1310 N GLU A 87 2.985 6.699 3.144 1.00 0.00 N ATOM 1311 CA GLU A 87 2.626 5.646 4.079 1.00 0.00 C ATOM 1312 C GLU A 87 3.657 4.552 4.006 1.00 0.00 C ATOM 1313 O GLU A 87 4.216 4.139 5.009 1.00 0.00 O ATOM 1314 CB GLU A 87 1.292 5.046 3.685 1.00 0.00 C ATOM 1315 CG GLU A 87 0.700 4.135 4.736 1.00 0.00 C ATOM 1316 CD GLU A 87 0.409 4.880 6.004 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -0.624 5.574 6.056 1.00 0.00 O ATOM 1318 OE2 GLU A 87 1.199 4.799 6.965 1.00 0.00 O ATOM 0 H GLU A 87 2.253 6.912 2.466 1.00 0.00 H new ATOM 0 HA GLU A 87 2.572 6.066 5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.588 5.852 3.478 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.416 4.485 2.759 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.218 3.687 4.356 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.391 3.318 4.943 1.00 0.00 H new ATOM 1325 N ALA A 88 3.899 4.112 2.792 1.00 0.00 N ATOM 1326 CA ALA A 88 4.869 3.073 2.517 1.00 0.00 C ATOM 1327 C ALA A 88 6.268 3.480 2.995 1.00 0.00 C ATOM 1328 O ALA A 88 6.956 2.695 3.612 1.00 0.00 O ATOM 1329 CB ALA A 88 4.875 2.721 1.041 1.00 0.00 C ATOM 0 H ALA A 88 3.426 4.467 1.961 1.00 0.00 H new ATOM 0 HA ALA A 88 4.577 2.183 3.075 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.611 1.938 0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.887 2.366 0.747 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.131 3.605 0.457 1.00 0.00 H new ATOM 1335 N PHE A 89 6.656 4.711 2.735 1.00 0.00 N ATOM 1336 CA PHE A 89 7.949 5.215 3.170 1.00 0.00 C ATOM 1337 C PHE A 89 8.026 5.173 4.695 1.00 0.00 C ATOM 1338 O PHE A 89 8.935 4.574 5.271 1.00 0.00 O ATOM 1339 CB PHE A 89 8.155 6.655 2.682 1.00 0.00 C ATOM 1340 CG PHE A 89 9.535 7.169 2.947 1.00 0.00 C ATOM 1341 CD1 PHE A 89 10.533 6.930 2.041 1.00 0.00 C ATOM 1342 CD2 PHE A 89 9.839 7.859 4.114 1.00 0.00 C ATOM 1343 CE1 PHE A 89 11.816 7.360 2.275 1.00 0.00 C ATOM 1344 CE2 PHE A 89 11.120 8.301 4.352 1.00 0.00 C ATOM 1345 CZ PHE A 89 12.111 8.048 3.430 1.00 0.00 C ATOM 0 H PHE A 89 6.092 5.388 2.221 1.00 0.00 H new ATOM 0 HA PHE A 89 8.733 4.587 2.746 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.955 6.702 1.612 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.430 7.306 3.171 1.00 0.00 H new ATOM 0 HD1 PHE A 89 10.308 6.396 1.130 1.00 0.00 H new ATOM 0 HD2 PHE A 89 9.063 8.050 4.841 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.593 7.158 1.553 1.00 0.00 H new ATOM 0 HE2 PHE A 89 11.347 8.844 5.258 1.00 0.00 H new ATOM 0 HZ PHE A 89 13.119 8.389 3.613 1.00 0.00 H new ATOM 1355 N ARG A 90 7.039 5.789 5.311 1.00 0.00 N ATOM 1356 CA ARG A 90 6.879 5.879 6.749 1.00 0.00 C ATOM 1357 C ARG A 90 6.910 4.518 7.430 1.00 0.00 C ATOM 1358 O ARG A 90 7.552 4.350 8.466 1.00 0.00 O ATOM 1359 CB ARG A 90 5.572 6.675 7.050 1.00 0.00 C ATOM 1360 CG ARG A 90 4.991 6.568 8.444 1.00 0.00 C ATOM 1361 CD ARG A 90 4.056 5.433 8.562 1.00 0.00 C ATOM 1362 NE ARG A 90 3.722 5.094 9.939 1.00 0.00 N ATOM 1363 CZ ARG A 90 2.782 4.207 10.291 1.00 0.00 C ATOM 1364 NH1 ARG A 90 1.860 3.805 9.406 1.00 0.00 N ATOM 1365 NH2 ARG A 90 2.730 3.775 11.549 1.00 0.00 N ATOM 0 H ARG A 90 6.293 6.262 4.801 1.00 0.00 H new ATOM 0 HA ARG A 90 7.729 6.415 7.172 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.766 7.728 6.847 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.810 6.349 6.342 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.799 6.450 9.166 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.472 7.494 8.694 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.139 5.671 8.022 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.494 4.560 8.078 1.00 0.00 H new ATOM 0 HE ARG A 90 4.238 5.563 10.684 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.870 4.175 8.455 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.148 3.129 9.683 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.402 4.119 12.235 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.018 3.100 11.827 1.00 0.00 H new ATOM 1379 N VAL A 91 6.231 3.563 6.856 1.00 0.00 N ATOM 1380 CA VAL A 91 6.139 2.261 7.453 1.00 0.00 C ATOM 1381 C VAL A 91 7.471 1.495 7.347 1.00 0.00 C ATOM 1382 O VAL A 91 7.772 0.642 8.185 1.00 0.00 O ATOM 1383 CB VAL A 91 4.937 1.450 6.891 1.00 0.00 C ATOM 1384 CG1 VAL A 91 5.101 1.107 5.438 1.00 0.00 C ATOM 1385 CG2 VAL A 91 4.665 0.233 7.723 1.00 0.00 C ATOM 0 H VAL A 91 5.732 3.664 5.972 1.00 0.00 H new ATOM 0 HA VAL A 91 5.943 2.401 8.516 1.00 0.00 H new ATOM 0 HB VAL A 91 4.062 2.097 6.955 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.234 0.541 5.098 1.00 0.00 H new ATOM 0 HG12 VAL A 91 5.188 2.024 4.855 1.00 0.00 H new ATOM 0 HG13 VAL A 91 6.001 0.507 5.305 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.819 -0.312 7.304 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.545 -0.410 7.726 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.432 0.535 8.744 1.00 0.00 H new ATOM 1395 N PHE A 92 8.280 1.826 6.346 1.00 0.00 N ATOM 1396 CA PHE A 92 9.587 1.219 6.233 1.00 0.00 C ATOM 1397 C PHE A 92 10.561 1.943 7.148 1.00 0.00 C ATOM 1398 O PHE A 92 11.159 1.336 8.025 1.00 0.00 O ATOM 1399 CB PHE A 92 10.119 1.207 4.786 1.00 0.00 C ATOM 1400 CG PHE A 92 9.326 0.368 3.807 1.00 0.00 C ATOM 1401 CD1 PHE A 92 8.930 -0.921 4.129 1.00 0.00 C ATOM 1402 CD2 PHE A 92 9.008 0.864 2.555 1.00 0.00 C ATOM 1403 CE1 PHE A 92 8.230 -1.692 3.223 1.00 0.00 C ATOM 1404 CE2 PHE A 92 8.302 0.100 1.647 1.00 0.00 C ATOM 1405 CZ PHE A 92 7.913 -1.181 1.983 1.00 0.00 C ATOM 0 H PHE A 92 8.053 2.501 5.616 1.00 0.00 H new ATOM 0 HA PHE A 92 9.491 0.176 6.536 1.00 0.00 H new ATOM 0 HB2 PHE A 92 10.147 2.233 4.419 1.00 0.00 H new ATOM 0 HB3 PHE A 92 11.147 0.845 4.798 1.00 0.00 H new ATOM 0 HD1 PHE A 92 9.172 -1.327 5.100 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.316 1.863 2.284 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.931 -2.696 3.486 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.055 0.504 0.676 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.361 -1.782 1.275 1.00 0.00 H new ATOM 1415 N ASP A 93 10.678 3.248 6.968 1.00 0.00 N ATOM 1416 CA ASP A 93 11.577 4.058 7.776 1.00 0.00 C ATOM 1417 C ASP A 93 10.909 4.462 9.080 1.00 0.00 C ATOM 1418 O ASP A 93 10.252 5.522 9.191 1.00 0.00 O ATOM 1419 CB ASP A 93 12.111 5.277 6.999 1.00 0.00 C ATOM 1420 CG ASP A 93 12.910 6.247 7.861 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.725 7.471 7.721 1.00 0.00 O ATOM 1422 OD2 ASP A 93 13.700 5.812 8.723 1.00 0.00 O ATOM 0 H ASP A 93 10.158 3.773 6.265 1.00 0.00 H new ATOM 0 HA ASP A 93 12.445 3.447 8.022 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.740 4.928 6.180 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.271 5.809 6.551 1.00 0.00 H new ATOM 1427 N LYS A 94 11.005 3.574 10.035 1.00 0.00 N ATOM 1428 CA LYS A 94 10.419 3.749 11.336 1.00 0.00 C ATOM 1429 C LYS A 94 11.235 4.663 12.230 1.00 0.00 C ATOM 1430 O LYS A 94 10.671 5.406 13.034 1.00 0.00 O ATOM 1431 CB LYS A 94 10.173 2.408 12.023 1.00 0.00 C ATOM 1432 CG LYS A 94 9.130 1.539 11.340 1.00 0.00 C ATOM 1433 CD LYS A 94 8.816 0.342 12.134 1.00 0.00 C ATOM 1434 CE LYS A 94 7.667 -0.448 11.536 1.00 0.00 C ATOM 1435 NZ LYS A 94 7.276 -1.594 12.391 1.00 0.00 N ATOM 0 H LYS A 94 11.504 2.691 9.926 1.00 0.00 H new ATOM 0 HA LYS A 94 9.458 4.236 11.171 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.113 1.859 12.069 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.860 2.591 13.051 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.221 2.119 11.181 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.493 1.239 10.357 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.699 -0.294 12.198 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.562 0.638 13.152 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.809 0.210 11.397 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.953 -0.813 10.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.488 -2.106 11.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.087 -2.236 12.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.978 -1.245 13.324 1.00 0.00 H new ATOM 1449 N ASP A 95 12.558 4.613 12.108 1.00 0.00 N ATOM 1450 CA ASP A 95 13.428 5.450 12.966 1.00 0.00 C ATOM 1451 C ASP A 95 13.371 6.913 12.540 1.00 0.00 C ATOM 1452 O ASP A 95 13.764 7.814 13.290 1.00 0.00 O ATOM 1453 CB ASP A 95 14.889 4.961 12.929 1.00 0.00 C ATOM 1454 CG ASP A 95 15.793 5.661 13.935 1.00 0.00 C ATOM 1455 OD1 ASP A 95 15.746 5.293 15.125 1.00 0.00 O ATOM 1456 OD2 ASP A 95 16.582 6.563 13.548 1.00 0.00 O ATOM 0 H ASP A 95 13.054 4.020 11.443 1.00 0.00 H new ATOM 0 HA ASP A 95 13.054 5.361 13.986 1.00 0.00 H new ATOM 0 HB2 ASP A 95 14.909 3.888 13.120 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.289 5.113 11.927 1.00 0.00 H new ATOM 1461 N GLY A 96 12.825 7.157 11.374 1.00 0.00 N ATOM 1462 CA GLY A 96 12.734 8.498 10.885 1.00 0.00 C ATOM 1463 C GLY A 96 14.091 8.984 10.469 1.00 0.00 C ATOM 1464 O GLY A 96 14.576 10.015 10.938 1.00 0.00 O ATOM 0 H GLY A 96 12.441 6.444 10.754 1.00 0.00 H new ATOM 0 HA2 GLY A 96 12.048 8.540 10.039 1.00 0.00 H new ATOM 0 HA3 GLY A 96 12.326 9.149 11.658 1.00 0.00 H new ATOM 1468 N ASN A 97 14.728 8.210 9.639 1.00 0.00 N ATOM 1469 CA ASN A 97 16.044 8.525 9.134 1.00 0.00 C ATOM 1470 C ASN A 97 15.893 9.375 7.884 1.00 0.00 C ATOM 1471 O ASN A 97 16.810 10.085 7.483 1.00 0.00 O ATOM 1472 CB ASN A 97 16.800 7.208 8.821 1.00 0.00 C ATOM 1473 CG ASN A 97 18.224 7.370 8.259 1.00 0.00 C ATOM 1474 OD1 ASN A 97 18.676 6.539 7.478 1.00 0.00 O ATOM 1475 ND2 ASN A 97 18.954 8.371 8.687 1.00 0.00 N ATOM 0 H ASN A 97 14.349 7.331 9.286 1.00 0.00 H new ATOM 0 HA ASN A 97 16.618 9.082 9.875 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.856 6.617 9.735 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.211 6.634 8.106 1.00 0.00 H new ATOM 0 HD21 ASN A 97 19.919 8.471 8.371 1.00 0.00 H new ATOM 0 HD22 ASN A 97 18.557 9.050 9.336 1.00 0.00 H new ATOM 1482 N GLY A 98 14.705 9.336 7.299 1.00 0.00 N ATOM 1483 CA GLY A 98 14.438 10.105 6.102 1.00 0.00 C ATOM 1484 C GLY A 98 14.921 9.361 4.891 1.00 0.00 C ATOM 1485 O GLY A 98 14.894 9.863 3.772 1.00 0.00 O ATOM 0 H GLY A 98 13.917 8.782 7.635 1.00 0.00 H new ATOM 0 HA2 GLY A 98 13.369 10.299 6.016 1.00 0.00 H new ATOM 0 HA3 GLY A 98 14.934 11.074 6.165 1.00 0.00 H new ATOM 1489 N TYR A 99 15.354 8.156 5.133 1.00 0.00 N ATOM 1490 CA TYR A 99 15.879 7.273 4.145 1.00 0.00 C ATOM 1491 C TYR A 99 15.511 5.889 4.564 1.00 0.00 C ATOM 1492 O TYR A 99 15.372 5.631 5.761 1.00 0.00 O ATOM 1493 CB TYR A 99 17.415 7.335 4.075 1.00 0.00 C ATOM 1494 CG TYR A 99 18.024 8.657 3.682 1.00 0.00 C ATOM 1495 CD1 TYR A 99 18.241 8.970 2.352 1.00 0.00 C ATOM 1496 CD2 TYR A 99 18.403 9.583 4.640 1.00 0.00 C ATOM 1497 CE1 TYR A 99 18.812 10.169 1.987 1.00 0.00 C ATOM 1498 CE2 TYR A 99 18.968 10.783 4.282 1.00 0.00 C ATOM 1499 CZ TYR A 99 19.170 11.070 2.952 1.00 0.00 C ATOM 1500 OH TYR A 99 19.745 12.264 2.585 1.00 0.00 O ATOM 0 H TYR A 99 15.348 7.750 6.069 1.00 0.00 H new ATOM 0 HA TYR A 99 15.477 7.554 3.171 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.811 7.055 5.051 1.00 0.00 H new ATOM 0 HB3 TYR A 99 17.754 6.580 3.365 1.00 0.00 H new ATOM 0 HD1 TYR A 99 17.958 8.262 1.587 1.00 0.00 H new ATOM 0 HD2 TYR A 99 18.252 9.358 5.685 1.00 0.00 H new ATOM 0 HE1 TYR A 99 18.976 10.397 0.944 1.00 0.00 H new ATOM 0 HE2 TYR A 99 19.252 11.497 5.041 1.00 0.00 H new ATOM 0 HH TYR A 99 19.940 12.793 3.386 1.00 0.00 H new ATOM 1510 N ILE A 100 15.330 5.020 3.624 1.00 0.00 N ATOM 1511 CA ILE A 100 15.076 3.652 3.936 1.00 0.00 C ATOM 1512 C ILE A 100 16.425 2.940 3.921 1.00 0.00 C ATOM 1513 O ILE A 100 17.171 3.024 2.924 1.00 0.00 O ATOM 1514 CB ILE A 100 14.124 2.958 2.919 1.00 0.00 C ATOM 1515 CG1 ILE A 100 13.005 3.921 2.443 1.00 0.00 C ATOM 1516 CG2 ILE A 100 13.516 1.716 3.570 1.00 0.00 C ATOM 1517 CD1 ILE A 100 12.005 3.303 1.477 1.00 0.00 C ATOM 0 H ILE A 100 15.354 5.235 2.627 1.00 0.00 H new ATOM 0 HA ILE A 100 14.581 3.601 4.906 1.00 0.00 H new ATOM 0 HB ILE A 100 14.701 2.669 2.041 1.00 0.00 H new ATOM 0 HG12 ILE A 100 12.466 4.290 3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 100 13.467 4.785 1.964 1.00 0.00 H new ATOM 0 HG21 ILE A 100 12.848 1.225 2.863 1.00 0.00 H new ATOM 0 HG22 ILE A 100 14.312 1.028 3.855 1.00 0.00 H new ATOM 0 HG23 ILE A 100 12.954 2.008 4.457 1.00 0.00 H new ATOM 0 HD11 ILE A 100 11.260 4.048 1.198 1.00 0.00 H new ATOM 0 HD12 ILE A 100 12.527 2.960 0.584 1.00 0.00 H new ATOM 0 HD13 ILE A 100 11.511 2.458 1.956 1.00 0.00 H new ATOM 1529 N SER A 101 16.752 2.317 5.015 1.00 0.00 N ATOM 1530 CA SER A 101 17.981 1.599 5.185 1.00 0.00 C ATOM 1531 C SER A 101 17.713 0.113 5.094 1.00 0.00 C ATOM 1532 O SER A 101 16.619 -0.351 5.429 1.00 0.00 O ATOM 1533 CB SER A 101 18.586 1.934 6.560 1.00 0.00 C ATOM 1534 OG SER A 101 19.722 1.124 6.851 1.00 0.00 O ATOM 0 H SER A 101 16.152 2.294 5.839 1.00 0.00 H new ATOM 0 HA SER A 101 18.683 1.888 4.403 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.874 2.985 6.584 1.00 0.00 H new ATOM 0 HB3 SER A 101 17.831 1.792 7.333 1.00 0.00 H new ATOM 0 HG SER A 101 20.080 1.366 7.731 1.00 0.00 H new ATOM 1540 N ALA A 102 18.712 -0.631 4.663 1.00 0.00 N ATOM 1541 CA ALA A 102 18.618 -2.076 4.562 1.00 0.00 C ATOM 1542 C ALA A 102 18.489 -2.682 5.952 1.00 0.00 C ATOM 1543 O ALA A 102 17.750 -3.648 6.156 1.00 0.00 O ATOM 1544 CB ALA A 102 19.836 -2.640 3.843 1.00 0.00 C ATOM 0 H ALA A 102 19.613 -0.252 4.372 1.00 0.00 H new ATOM 0 HA ALA A 102 17.732 -2.334 3.982 1.00 0.00 H new ATOM 0 HB1 ALA A 102 19.749 -3.724 3.776 1.00 0.00 H new ATOM 0 HB2 ALA A 102 19.894 -2.218 2.840 1.00 0.00 H new ATOM 0 HB3 ALA A 102 20.738 -2.382 4.398 1.00 0.00 H new ATOM 1550 N ALA A 103 19.160 -2.061 6.917 1.00 0.00 N ATOM 1551 CA ALA A 103 19.144 -2.524 8.294 1.00 0.00 C ATOM 1552 C ALA A 103 17.741 -2.400 8.871 1.00 0.00 C ATOM 1553 O ALA A 103 17.218 -3.334 9.490 1.00 0.00 O ATOM 1554 CB ALA A 103 20.137 -1.734 9.125 1.00 0.00 C ATOM 0 H ALA A 103 19.727 -1.227 6.764 1.00 0.00 H new ATOM 0 HA ALA A 103 19.436 -3.574 8.318 1.00 0.00 H new ATOM 0 HB1 ALA A 103 20.115 -2.091 10.155 1.00 0.00 H new ATOM 0 HB2 ALA A 103 21.139 -1.865 8.717 1.00 0.00 H new ATOM 0 HB3 ALA A 103 19.872 -0.677 9.102 1.00 0.00 H new ATOM 1560 N GLU A 104 17.121 -1.264 8.624 1.00 0.00 N ATOM 1561 CA GLU A 104 15.768 -1.024 9.076 1.00 0.00 C ATOM 1562 C GLU A 104 14.803 -1.906 8.335 1.00 0.00 C ATOM 1563 O GLU A 104 13.866 -2.445 8.922 1.00 0.00 O ATOM 1564 CB GLU A 104 15.345 0.394 8.817 1.00 0.00 C ATOM 1565 CG GLU A 104 13.904 0.607 9.195 1.00 0.00 C ATOM 1566 CD GLU A 104 13.734 1.104 10.615 1.00 0.00 C ATOM 1567 OE1 GLU A 104 13.815 0.273 11.570 1.00 0.00 O ATOM 1568 OE2 GLU A 104 13.544 2.314 10.818 1.00 0.00 O ATOM 0 H GLU A 104 17.537 -0.488 8.109 1.00 0.00 H new ATOM 0 HA GLU A 104 15.755 -1.233 10.146 1.00 0.00 H new ATOM 0 HB2 GLU A 104 15.978 1.075 9.386 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.487 0.632 7.763 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.456 1.325 8.508 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.360 -0.330 9.076 1.00 0.00 H new ATOM 1575 N LEU A 105 15.023 -2.046 7.052 1.00 0.00 N ATOM 1576 CA LEU A 105 14.115 -2.786 6.237 1.00 0.00 C ATOM 1577 C LEU A 105 14.075 -4.259 6.761 1.00 0.00 C ATOM 1578 O LEU A 105 13.007 -4.862 6.867 1.00 0.00 O ATOM 1579 CB LEU A 105 14.519 -2.660 4.736 1.00 0.00 C ATOM 1580 CG LEU A 105 13.492 -3.059 3.638 1.00 0.00 C ATOM 1581 CD1 LEU A 105 13.290 -4.550 3.543 1.00 0.00 C ATOM 1582 CD2 LEU A 105 12.165 -2.371 3.868 1.00 0.00 C ATOM 0 H LEU A 105 15.824 -1.655 6.557 1.00 0.00 H new ATOM 0 HA LEU A 105 13.103 -2.387 6.303 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.803 -1.623 4.559 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.413 -3.265 4.585 1.00 0.00 H new ATOM 0 HG LEU A 105 13.912 -2.727 2.688 1.00 0.00 H new ATOM 0 HD11 LEU A 105 12.563 -4.770 2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.238 -5.031 3.303 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.922 -4.929 4.497 1.00 0.00 H new ATOM 0 HD21 LEU A 105 11.463 -2.665 3.088 1.00 0.00 H new ATOM 0 HD22 LEU A 105 11.769 -2.661 4.841 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.306 -1.290 3.841 1.00 0.00 H new ATOM 1594 N ARG A 106 15.260 -4.784 7.155 1.00 0.00 N ATOM 1595 CA ARG A 106 15.369 -6.103 7.819 1.00 0.00 C ATOM 1596 C ARG A 106 14.500 -6.138 9.088 1.00 0.00 C ATOM 1597 O ARG A 106 13.792 -7.128 9.344 1.00 0.00 O ATOM 1598 CB ARG A 106 16.823 -6.402 8.235 1.00 0.00 C ATOM 1599 CG ARG A 106 17.791 -6.786 7.193 1.00 0.00 C ATOM 1600 CD ARG A 106 19.103 -7.277 7.801 1.00 0.00 C ATOM 1601 NE ARG A 106 19.675 -6.308 8.758 1.00 0.00 N ATOM 1602 CZ ARG A 106 20.942 -5.866 8.767 1.00 0.00 C ATOM 1603 NH1 ARG A 106 21.809 -6.257 7.843 1.00 0.00 N ATOM 1604 NH2 ARG A 106 21.340 -5.039 9.730 1.00 0.00 N ATOM 0 H ARG A 106 16.155 -4.312 7.024 1.00 0.00 H new ATOM 0 HA ARG A 106 15.031 -6.851 7.102 1.00 0.00 H new ATOM 0 HB2 ARG A 106 17.212 -5.516 8.738 1.00 0.00 H new ATOM 0 HB3 ARG A 106 16.798 -7.203 8.974 1.00 0.00 H new ATOM 0 HG2 ARG A 106 17.363 -7.570 6.568 1.00 0.00 H new ATOM 0 HG3 ARG A 106 17.987 -5.932 6.544 1.00 0.00 H new ATOM 0 HD2 ARG A 106 18.933 -8.227 8.307 1.00 0.00 H new ATOM 0 HD3 ARG A 106 19.822 -7.465 7.004 1.00 0.00 H new ATOM 0 HE ARG A 106 19.051 -5.942 9.477 1.00 0.00 H new ATOM 0 HH11 ARG A 106 21.517 -6.904 7.110 1.00 0.00 H new ATOM 0 HH12 ARG A 106 22.768 -5.911 7.865 1.00 0.00 H new ATOM 0 HH21 ARG A 106 20.684 -4.746 10.454 1.00 0.00 H new ATOM 0 HH22 ARG A 106 22.301 -4.698 9.745 1.00 0.00 H new ATOM 1618 N HIS A 107 14.551 -5.033 9.863 1.00 0.00 N ATOM 1619 CA HIS A 107 13.790 -4.882 11.130 1.00 0.00 C ATOM 1620 C HIS A 107 12.313 -5.128 10.900 1.00 0.00 C ATOM 1621 O HIS A 107 11.707 -5.995 11.537 1.00 0.00 O ATOM 1622 CB HIS A 107 13.904 -3.455 11.742 1.00 0.00 C ATOM 1623 CG HIS A 107 15.249 -2.980 12.168 1.00 0.00 C ATOM 1624 ND1 HIS A 107 15.553 -1.645 12.255 1.00 0.00 N ATOM 1625 CD2 HIS A 107 16.352 -3.638 12.573 1.00 0.00 C ATOM 1626 CE1 HIS A 107 16.779 -1.502 12.689 1.00 0.00 C ATOM 1627 NE2 HIS A 107 17.288 -2.691 12.891 1.00 0.00 N ATOM 0 H HIS A 107 15.120 -4.219 9.631 1.00 0.00 H new ATOM 0 HA HIS A 107 14.225 -5.611 11.813 1.00 0.00 H new ATOM 0 HB2 HIS A 107 13.517 -2.746 11.010 1.00 0.00 H new ATOM 0 HB3 HIS A 107 13.245 -3.410 12.609 1.00 0.00 H new ATOM 0 HD1 HIS A 107 14.920 -0.881 12.018 1.00 0.00 H new ATOM 0 HD2 HIS A 107 16.475 -4.709 12.635 1.00 0.00 H new ATOM 0 HE1 HIS A 107 17.285 -0.562 12.853 1.00 0.00 H new ATOM 1636 N VAL A 108 11.732 -4.379 9.977 1.00 0.00 N ATOM 1637 CA VAL A 108 10.305 -4.451 9.768 1.00 0.00 C ATOM 1638 C VAL A 108 9.909 -5.773 9.118 1.00 0.00 C ATOM 1639 O VAL A 108 8.906 -6.345 9.471 1.00 0.00 O ATOM 1640 CB VAL A 108 9.730 -3.231 8.966 1.00 0.00 C ATOM 1641 CG1 VAL A 108 10.057 -3.298 7.491 1.00 0.00 C ATOM 1642 CG2 VAL A 108 8.234 -3.100 9.171 1.00 0.00 C ATOM 0 H VAL A 108 12.224 -3.723 9.370 1.00 0.00 H new ATOM 0 HA VAL A 108 9.852 -4.402 10.758 1.00 0.00 H new ATOM 0 HB VAL A 108 10.219 -2.342 9.364 1.00 0.00 H new ATOM 0 HG11 VAL A 108 9.635 -2.430 6.985 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.139 -3.305 7.358 1.00 0.00 H new ATOM 0 HG13 VAL A 108 9.633 -4.207 7.065 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.862 -2.247 8.604 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.739 -4.008 8.827 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.024 -2.951 10.230 1.00 0.00 H new ATOM 1652 N MET A 109 10.744 -6.289 8.229 1.00 0.00 N ATOM 1653 CA MET A 109 10.422 -7.514 7.513 1.00 0.00 C ATOM 1654 C MET A 109 10.295 -8.704 8.417 1.00 0.00 C ATOM 1655 O MET A 109 9.319 -9.465 8.316 1.00 0.00 O ATOM 1656 CB MET A 109 11.377 -7.769 6.369 1.00 0.00 C ATOM 1657 CG MET A 109 11.138 -6.785 5.273 1.00 0.00 C ATOM 1658 SD MET A 109 9.465 -6.919 4.641 1.00 0.00 S ATOM 1659 CE MET A 109 9.380 -5.434 3.684 1.00 0.00 C ATOM 0 H MET A 109 11.647 -5.880 7.987 1.00 0.00 H new ATOM 0 HA MET A 109 9.434 -7.360 7.078 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.406 -7.692 6.720 1.00 0.00 H new ATOM 0 HB3 MET A 109 11.244 -8.783 5.993 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.311 -5.774 5.643 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.850 -6.955 4.465 1.00 0.00 H new ATOM 0 HE1 MET A 109 8.359 -5.285 3.334 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.680 -4.586 4.300 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.049 -5.515 2.827 1.00 0.00 H new ATOM 1669 N THR A 110 11.229 -8.852 9.331 1.00 0.00 N ATOM 1670 CA THR A 110 11.176 -9.911 10.286 1.00 0.00 C ATOM 1671 C THR A 110 9.972 -9.730 11.204 1.00 0.00 C ATOM 1672 O THR A 110 9.290 -10.684 11.547 1.00 0.00 O ATOM 1673 CB THR A 110 12.478 -9.974 11.088 1.00 0.00 C ATOM 1674 OG1 THR A 110 12.941 -8.643 11.389 1.00 0.00 O ATOM 1675 CG2 THR A 110 13.540 -10.743 10.342 1.00 0.00 C ATOM 0 H THR A 110 12.039 -8.239 9.424 1.00 0.00 H new ATOM 0 HA THR A 110 11.062 -10.858 9.758 1.00 0.00 H new ATOM 0 HB THR A 110 12.277 -10.499 12.022 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.479 -8.307 10.642 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.454 -10.771 10.936 1.00 0.00 H new ATOM 0 HG22 THR A 110 13.193 -11.760 10.161 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.742 -10.254 9.389 1.00 0.00 H new ATOM 1683 N ASN A 111 9.674 -8.483 11.513 1.00 0.00 N ATOM 1684 CA ASN A 111 8.536 -8.130 12.347 1.00 0.00 C ATOM 1685 C ASN A 111 7.217 -8.480 11.642 1.00 0.00 C ATOM 1686 O ASN A 111 6.252 -8.902 12.275 1.00 0.00 O ATOM 1687 CB ASN A 111 8.587 -6.631 12.682 1.00 0.00 C ATOM 1688 CG ASN A 111 7.498 -6.187 13.640 1.00 0.00 C ATOM 1689 OD1 ASN A 111 7.635 -6.320 14.859 1.00 0.00 O ATOM 1690 ND2 ASN A 111 6.457 -5.599 13.123 1.00 0.00 N ATOM 0 H ASN A 111 10.216 -7.680 11.192 1.00 0.00 H new ATOM 0 HA ASN A 111 8.585 -8.704 13.273 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.559 -6.397 13.116 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.504 -6.058 11.759 1.00 0.00 H new ATOM 0 HD21 ASN A 111 5.724 -5.232 13.731 1.00 0.00 H new ATOM 0 HD22 ASN A 111 6.374 -5.505 12.111 1.00 0.00 H new ATOM 1697 N LEU A 112 7.224 -8.374 10.323 1.00 0.00 N ATOM 1698 CA LEU A 112 6.043 -8.614 9.498 1.00 0.00 C ATOM 1699 C LEU A 112 5.894 -10.092 9.186 1.00 0.00 C ATOM 1700 O LEU A 112 4.827 -10.559 8.786 1.00 0.00 O ATOM 1701 CB LEU A 112 6.168 -7.824 8.184 1.00 0.00 C ATOM 1702 CG LEU A 112 6.122 -6.295 8.303 1.00 0.00 C ATOM 1703 CD1 LEU A 112 6.573 -5.630 7.004 1.00 0.00 C ATOM 1704 CD2 LEU A 112 4.721 -5.833 8.675 1.00 0.00 C ATOM 0 H LEU A 112 8.053 -8.117 9.788 1.00 0.00 H new ATOM 0 HA LEU A 112 5.162 -8.285 10.049 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.107 -8.102 7.706 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.365 -8.140 7.517 1.00 0.00 H new ATOM 0 HG LEU A 112 6.811 -5.997 9.093 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.531 -4.547 7.116 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.595 -5.932 6.777 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.915 -5.937 6.191 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.706 -4.746 8.755 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.017 -6.150 7.905 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.435 -6.272 9.631 1.00 0.00 H new ATOM 1716 N GLY A 113 6.973 -10.821 9.362 1.00 0.00 N ATOM 1717 CA GLY A 113 6.975 -12.223 9.057 1.00 0.00 C ATOM 1718 C GLY A 113 7.152 -12.466 7.577 1.00 0.00 C ATOM 1719 O GLY A 113 6.746 -13.498 7.059 1.00 0.00 O ATOM 0 H GLY A 113 7.859 -10.460 9.716 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.778 -12.715 9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 113 6.039 -12.671 9.391 1.00 0.00 H new ATOM 1723 N GLU A 114 7.746 -11.500 6.889 1.00 0.00 N ATOM 1724 CA GLU A 114 7.994 -11.636 5.459 1.00 0.00 C ATOM 1725 C GLU A 114 9.306 -12.386 5.292 1.00 0.00 C ATOM 1726 O GLU A 114 9.457 -13.214 4.399 1.00 0.00 O ATOM 1727 CB GLU A 114 8.079 -10.249 4.795 1.00 0.00 C ATOM 1728 CG GLU A 114 7.987 -10.260 3.273 1.00 0.00 C ATOM 1729 CD GLU A 114 6.722 -10.915 2.771 1.00 0.00 C ATOM 1730 OE1 GLU A 114 6.813 -11.963 2.090 1.00 0.00 O ATOM 1731 OE2 GLU A 114 5.631 -10.427 3.072 1.00 0.00 O ATOM 0 H GLU A 114 8.063 -10.619 7.294 1.00 0.00 H new ATOM 0 HA GLU A 114 7.180 -12.181 4.980 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.277 -9.624 5.189 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.020 -9.781 5.084 1.00 0.00 H new ATOM 0 HG2 GLU A 114 8.033 -9.236 2.903 1.00 0.00 H new ATOM 0 HG3 GLU A 114 8.850 -10.785 2.865 1.00 0.00 H new ATOM 1738 N LYS A 115 10.222 -12.104 6.224 1.00 0.00 N ATOM 1739 CA LYS A 115 11.549 -12.687 6.310 1.00 0.00 C ATOM 1740 C LYS A 115 12.303 -12.691 4.981 1.00 0.00 C ATOM 1741 O LYS A 115 12.229 -13.640 4.193 1.00 0.00 O ATOM 1742 CB LYS A 115 11.503 -14.070 6.957 1.00 0.00 C ATOM 1743 CG LYS A 115 12.860 -14.701 7.209 1.00 0.00 C ATOM 1744 CD LYS A 115 13.752 -13.815 8.071 1.00 0.00 C ATOM 1745 CE LYS A 115 15.083 -14.482 8.365 1.00 0.00 C ATOM 1746 NZ LYS A 115 15.988 -13.590 9.116 1.00 0.00 N ATOM 0 H LYS A 115 10.042 -11.431 6.969 1.00 0.00 H new ATOM 0 HA LYS A 115 12.130 -12.034 6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.972 -13.994 7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.922 -14.735 6.318 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.726 -15.666 7.699 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.353 -14.893 6.256 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.924 -12.866 7.563 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.244 -13.587 9.008 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.914 -15.394 8.937 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.557 -14.776 7.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 16.887 -14.081 9.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.169 -12.731 8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.546 -13.329 10.021 1.00 0.00 H new ATOM 1760 N LEU A 116 12.990 -11.630 4.736 1.00 0.00 N ATOM 1761 CA LEU A 116 13.774 -11.492 3.541 1.00 0.00 C ATOM 1762 C LEU A 116 15.215 -11.761 3.897 1.00 0.00 C ATOM 1763 O LEU A 116 15.606 -11.614 5.067 1.00 0.00 O ATOM 1764 CB LEU A 116 13.660 -10.066 2.999 1.00 0.00 C ATOM 1765 CG LEU A 116 12.252 -9.537 2.730 1.00 0.00 C ATOM 1766 CD1 LEU A 116 12.325 -8.149 2.151 1.00 0.00 C ATOM 1767 CD2 LEU A 116 11.486 -10.449 1.800 1.00 0.00 C ATOM 0 H LEU A 116 13.029 -10.823 5.359 1.00 0.00 H new ATOM 0 HA LEU A 116 13.419 -12.190 2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.145 -9.394 3.708 1.00 0.00 H new ATOM 0 HB3 LEU A 116 14.226 -10.011 2.069 1.00 0.00 H new ATOM 0 HG LEU A 116 11.718 -9.505 3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.317 -7.780 1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.828 -7.487 2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.883 -8.174 1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.489 -10.042 1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.013 -10.525 0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.402 -11.439 2.248 1.00 0.00 H new ATOM 1779 N THR A 117 15.995 -12.160 2.951 1.00 0.00 N ATOM 1780 CA THR A 117 17.389 -12.340 3.188 1.00 0.00 C ATOM 1781 C THR A 117 18.064 -10.979 3.240 1.00 0.00 C ATOM 1782 O THR A 117 17.462 -9.960 2.833 1.00 0.00 O ATOM 1783 CB THR A 117 18.027 -13.218 2.100 1.00 0.00 C ATOM 1784 OG1 THR A 117 17.661 -12.723 0.803 1.00 0.00 O ATOM 1785 CG2 THR A 117 17.591 -14.667 2.253 1.00 0.00 C ATOM 0 H THR A 117 15.690 -12.369 2.000 1.00 0.00 H new ATOM 0 HA THR A 117 17.524 -12.851 4.141 1.00 0.00 H new ATOM 0 HB THR A 117 19.111 -13.177 2.207 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.071 -13.284 0.111 1.00 0.00 H new ATOM 0 HG21 THR A 117 18.054 -15.271 1.473 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.899 -15.038 3.230 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.506 -14.732 2.166 1.00 0.00 H new ATOM 1793 N ASP A 118 19.284 -10.942 3.725 1.00 0.00 N ATOM 1794 CA ASP A 118 20.025 -9.697 3.827 1.00 0.00 C ATOM 1795 C ASP A 118 20.252 -9.147 2.433 1.00 0.00 C ATOM 1796 O ASP A 118 20.203 -7.951 2.200 1.00 0.00 O ATOM 1797 CB ASP A 118 21.360 -9.925 4.517 1.00 0.00 C ATOM 1798 CG ASP A 118 22.043 -8.634 4.876 1.00 0.00 C ATOM 1799 OD1 ASP A 118 21.727 -8.079 5.940 1.00 0.00 O ATOM 1800 OD2 ASP A 118 22.917 -8.159 4.112 1.00 0.00 O ATOM 0 H ASP A 118 19.790 -11.763 4.058 1.00 0.00 H new ATOM 0 HA ASP A 118 19.452 -8.984 4.420 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.204 -10.515 5.420 1.00 0.00 H new ATOM 0 HB3 ASP A 118 22.009 -10.508 3.864 1.00 0.00 H new ATOM 1805 N GLU A 119 20.429 -10.065 1.501 1.00 0.00 N ATOM 1806 CA GLU A 119 20.596 -9.739 0.099 1.00 0.00 C ATOM 1807 C GLU A 119 19.330 -9.088 -0.443 1.00 0.00 C ATOM 1808 O GLU A 119 19.381 -8.077 -1.138 1.00 0.00 O ATOM 1809 CB GLU A 119 20.838 -11.003 -0.698 1.00 0.00 C ATOM 1810 CG GLU A 119 22.025 -11.827 -0.273 1.00 0.00 C ATOM 1811 CD GLU A 119 22.111 -13.085 -1.082 1.00 0.00 C ATOM 1812 OE1 GLU A 119 22.824 -13.107 -2.111 1.00 0.00 O ATOM 1813 OE2 GLU A 119 21.432 -14.065 -0.744 1.00 0.00 O ATOM 0 H GLU A 119 20.461 -11.065 1.698 1.00 0.00 H new ATOM 0 HA GLU A 119 21.442 -9.058 0.007 1.00 0.00 H new ATOM 0 HB2 GLU A 119 19.946 -11.626 -0.636 1.00 0.00 H new ATOM 0 HB3 GLU A 119 20.964 -10.731 -1.746 1.00 0.00 H new ATOM 0 HG2 GLU A 119 22.940 -11.247 -0.395 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.943 -12.074 0.785 1.00 0.00 H new ATOM 1820 N GLU A 120 18.192 -9.667 -0.093 1.00 0.00 N ATOM 1821 CA GLU A 120 16.925 -9.226 -0.618 1.00 0.00 C ATOM 1822 C GLU A 120 16.521 -7.856 -0.059 1.00 0.00 C ATOM 1823 O GLU A 120 15.980 -7.023 -0.788 1.00 0.00 O ATOM 1824 CB GLU A 120 15.855 -10.320 -0.434 1.00 0.00 C ATOM 1825 CG GLU A 120 14.522 -10.038 -1.098 1.00 0.00 C ATOM 1826 CD GLU A 120 13.790 -11.299 -1.460 1.00 0.00 C ATOM 1827 OE1 GLU A 120 13.949 -11.790 -2.605 1.00 0.00 O ATOM 1828 OE2 GLU A 120 13.066 -11.847 -0.630 1.00 0.00 O ATOM 0 H GLU A 120 18.128 -10.449 0.558 1.00 0.00 H new ATOM 0 HA GLU A 120 17.024 -9.071 -1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 120 16.247 -11.258 -0.826 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.687 -10.466 0.633 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.904 -9.441 -0.428 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.684 -9.443 -1.997 1.00 0.00 H new ATOM 1835 N VAL A 121 16.841 -7.586 1.203 1.00 0.00 N ATOM 1836 CA VAL A 121 16.539 -6.263 1.754 1.00 0.00 C ATOM 1837 C VAL A 121 17.499 -5.215 1.158 1.00 0.00 C ATOM 1838 O VAL A 121 17.116 -4.069 0.904 1.00 0.00 O ATOM 1839 CB VAL A 121 16.578 -6.193 3.329 1.00 0.00 C ATOM 1840 CG1 VAL A 121 15.651 -7.202 3.971 1.00 0.00 C ATOM 1841 CG2 VAL A 121 17.966 -6.352 3.890 1.00 0.00 C ATOM 0 H VAL A 121 17.293 -8.236 1.846 1.00 0.00 H new ATOM 0 HA VAL A 121 15.509 -6.047 1.470 1.00 0.00 H new ATOM 0 HB VAL A 121 16.229 -5.191 3.577 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.713 -7.115 5.056 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.627 -7.011 3.650 1.00 0.00 H new ATOM 0 HG13 VAL A 121 15.944 -8.208 3.671 1.00 0.00 H new ATOM 0 HG21 VAL A 121 17.928 -6.295 4.978 1.00 0.00 H new ATOM 0 HG22 VAL A 121 18.371 -7.319 3.591 1.00 0.00 H new ATOM 0 HG23 VAL A 121 18.606 -5.557 3.507 1.00 0.00 H new ATOM 1851 N ASP A 122 18.723 -5.645 0.886 1.00 0.00 N ATOM 1852 CA ASP A 122 19.767 -4.773 0.362 1.00 0.00 C ATOM 1853 C ASP A 122 19.485 -4.379 -1.087 1.00 0.00 C ATOM 1854 O ASP A 122 19.644 -3.205 -1.466 1.00 0.00 O ATOM 1855 CB ASP A 122 21.131 -5.453 0.497 1.00 0.00 C ATOM 1856 CG ASP A 122 22.287 -4.598 0.048 1.00 0.00 C ATOM 1857 OD1 ASP A 122 22.520 -3.529 0.642 1.00 0.00 O ATOM 1858 OD2 ASP A 122 23.040 -5.019 -0.848 1.00 0.00 O ATOM 0 H ASP A 122 19.022 -6.611 1.023 1.00 0.00 H new ATOM 0 HA ASP A 122 19.778 -3.854 0.948 1.00 0.00 H new ATOM 0 HB2 ASP A 122 21.284 -5.735 1.539 1.00 0.00 H new ATOM 0 HB3 ASP A 122 21.126 -6.374 -0.085 1.00 0.00 H new ATOM 1863 N GLU A 123 19.033 -5.340 -1.896 1.00 0.00 N ATOM 1864 CA GLU A 123 18.682 -5.054 -3.269 1.00 0.00 C ATOM 1865 C GLU A 123 17.434 -4.175 -3.344 1.00 0.00 C ATOM 1866 O GLU A 123 17.300 -3.395 -4.270 1.00 0.00 O ATOM 1867 CB GLU A 123 18.452 -6.306 -4.087 1.00 0.00 C ATOM 1868 CG GLU A 123 19.634 -7.234 -4.257 1.00 0.00 C ATOM 1869 CD GLU A 123 20.855 -6.564 -4.853 1.00 0.00 C ATOM 1870 OE1 GLU A 123 21.860 -6.388 -4.141 1.00 0.00 O ATOM 1871 OE2 GLU A 123 20.839 -6.228 -6.047 1.00 0.00 O ATOM 0 H GLU A 123 18.906 -6.313 -1.617 1.00 0.00 H new ATOM 0 HA GLU A 123 19.536 -4.525 -3.692 1.00 0.00 H new ATOM 0 HB2 GLU A 123 17.641 -6.869 -3.626 1.00 0.00 H new ATOM 0 HB3 GLU A 123 18.109 -6.007 -5.078 1.00 0.00 H new ATOM 0 HG2 GLU A 123 19.898 -7.653 -3.286 1.00 0.00 H new ATOM 0 HG3 GLU A 123 19.341 -8.068 -4.895 1.00 0.00 H new ATOM 1878 N MET A 124 16.515 -4.310 -2.369 1.00 0.00 N ATOM 1879 CA MET A 124 15.335 -3.432 -2.328 1.00 0.00 C ATOM 1880 C MET A 124 15.758 -1.999 -2.233 1.00 0.00 C ATOM 1881 O MET A 124 15.308 -1.156 -3.010 1.00 0.00 O ATOM 1882 CB MET A 124 14.374 -3.753 -1.180 1.00 0.00 C ATOM 1883 CG MET A 124 13.504 -4.957 -1.417 1.00 0.00 C ATOM 1884 SD MET A 124 12.280 -5.187 -0.121 1.00 0.00 S ATOM 1885 CE MET A 124 11.368 -6.562 -0.796 1.00 0.00 C ATOM 0 H MET A 124 16.565 -5.000 -1.619 1.00 0.00 H new ATOM 0 HA MET A 124 14.794 -3.610 -3.257 1.00 0.00 H new ATOM 0 HB2 MET A 124 14.954 -3.912 -0.271 1.00 0.00 H new ATOM 0 HB3 MET A 124 13.735 -2.887 -1.004 1.00 0.00 H new ATOM 0 HG2 MET A 124 12.997 -4.852 -2.376 1.00 0.00 H new ATOM 0 HG3 MET A 124 14.130 -5.847 -1.483 1.00 0.00 H new ATOM 0 HE1 MET A 124 10.709 -6.972 -0.031 1.00 0.00 H new ATOM 0 HE2 MET A 124 10.773 -6.223 -1.644 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.064 -7.333 -1.127 1.00 0.00 H new ATOM 1895 N ILE A 125 16.664 -1.733 -1.312 1.00 0.00 N ATOM 1896 CA ILE A 125 17.184 -0.402 -1.129 1.00 0.00 C ATOM 1897 C ILE A 125 17.892 0.044 -2.386 1.00 0.00 C ATOM 1898 O ILE A 125 17.627 1.103 -2.884 1.00 0.00 O ATOM 1899 CB ILE A 125 18.142 -0.311 0.080 1.00 0.00 C ATOM 1900 CG1 ILE A 125 17.412 -0.721 1.368 1.00 0.00 C ATOM 1901 CG2 ILE A 125 18.743 1.095 0.211 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.140 0.061 1.639 1.00 0.00 C ATOM 0 H ILE A 125 17.054 -2.430 -0.677 1.00 0.00 H new ATOM 0 HA ILE A 125 16.341 0.258 -0.924 1.00 0.00 H new ATOM 0 HB ILE A 125 18.967 -1.004 -0.086 1.00 0.00 H new ATOM 0 HG12 ILE A 125 17.168 -1.782 1.312 1.00 0.00 H new ATOM 0 HG13 ILE A 125 18.090 -0.594 2.212 1.00 0.00 H new ATOM 0 HG21 ILE A 125 19.412 1.126 1.071 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.302 1.337 -0.693 1.00 0.00 H new ATOM 0 HG23 ILE A 125 17.942 1.822 0.348 1.00 0.00 H new ATOM 0 HD11 ILE A 125 15.687 -0.291 2.566 1.00 0.00 H new ATOM 0 HD12 ILE A 125 16.377 1.121 1.730 1.00 0.00 H new ATOM 0 HD13 ILE A 125 15.441 -0.085 0.816 1.00 0.00 H new ATOM 1914 N ARG A 126 18.723 -0.825 -2.921 1.00 0.00 N ATOM 1915 CA ARG A 126 19.484 -0.560 -4.138 1.00 0.00 C ATOM 1916 C ARG A 126 18.557 -0.167 -5.311 1.00 0.00 C ATOM 1917 O ARG A 126 18.826 0.790 -6.022 1.00 0.00 O ATOM 1918 CB ARG A 126 20.286 -1.805 -4.498 1.00 0.00 C ATOM 1919 CG ARG A 126 21.183 -1.668 -5.703 1.00 0.00 C ATOM 1920 CD ARG A 126 21.843 -2.989 -6.013 1.00 0.00 C ATOM 1921 NE ARG A 126 22.780 -2.894 -7.123 1.00 0.00 N ATOM 1922 CZ ARG A 126 23.220 -3.933 -7.832 1.00 0.00 C ATOM 1923 NH1 ARG A 126 22.728 -5.161 -7.615 1.00 0.00 N ATOM 1924 NH2 ARG A 126 24.130 -3.741 -8.776 1.00 0.00 N ATOM 0 H ARG A 126 18.896 -1.748 -2.523 1.00 0.00 H new ATOM 0 HA ARG A 126 20.155 0.280 -3.956 1.00 0.00 H new ATOM 0 HB2 ARG A 126 20.898 -2.084 -3.640 1.00 0.00 H new ATOM 0 HB3 ARG A 126 19.591 -2.626 -4.674 1.00 0.00 H new ATOM 0 HG2 ARG A 126 20.602 -1.333 -6.562 1.00 0.00 H new ATOM 0 HG3 ARG A 126 21.942 -0.909 -5.516 1.00 0.00 H new ATOM 0 HD2 ARG A 126 22.368 -3.346 -5.127 1.00 0.00 H new ATOM 0 HD3 ARG A 126 21.077 -3.728 -6.249 1.00 0.00 H new ATOM 0 HE ARG A 126 23.124 -1.968 -7.376 1.00 0.00 H new ATOM 0 HH11 ARG A 126 22.012 -5.305 -6.903 1.00 0.00 H new ATOM 0 HH12 ARG A 126 23.070 -5.951 -8.162 1.00 0.00 H new ATOM 0 HH21 ARG A 126 24.489 -2.803 -8.956 1.00 0.00 H new ATOM 0 HH22 ARG A 126 24.472 -4.531 -9.323 1.00 0.00 H new ATOM 1938 N GLU A 127 17.465 -0.895 -5.467 1.00 0.00 N ATOM 1939 CA GLU A 127 16.495 -0.661 -6.537 1.00 0.00 C ATOM 1940 C GLU A 127 15.783 0.695 -6.363 1.00 0.00 C ATOM 1941 O GLU A 127 15.383 1.321 -7.337 1.00 0.00 O ATOM 1942 CB GLU A 127 15.476 -1.826 -6.562 1.00 0.00 C ATOM 1943 CG GLU A 127 14.391 -1.750 -7.640 1.00 0.00 C ATOM 1944 CD GLU A 127 14.931 -1.718 -9.056 1.00 0.00 C ATOM 1945 OE1 GLU A 127 15.433 -2.738 -9.543 1.00 0.00 O ATOM 1946 OE2 GLU A 127 14.799 -0.679 -9.733 1.00 0.00 O ATOM 0 H GLU A 127 17.219 -1.672 -4.853 1.00 0.00 H new ATOM 0 HA GLU A 127 17.022 -0.623 -7.491 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.025 -2.759 -6.693 1.00 0.00 H new ATOM 0 HB3 GLU A 127 14.989 -1.877 -5.588 1.00 0.00 H new ATOM 0 HG2 GLU A 127 13.727 -2.608 -7.534 1.00 0.00 H new ATOM 0 HG3 GLU A 127 13.788 -0.858 -7.472 1.00 0.00 H new ATOM 1953 N ALA A 128 15.650 1.149 -5.137 1.00 0.00 N ATOM 1954 CA ALA A 128 14.970 2.404 -4.884 1.00 0.00 C ATOM 1955 C ALA A 128 15.954 3.570 -4.723 1.00 0.00 C ATOM 1956 O ALA A 128 15.581 4.730 -4.869 1.00 0.00 O ATOM 1957 CB ALA A 128 14.042 2.271 -3.693 1.00 0.00 C ATOM 0 H ALA A 128 16.000 0.675 -4.304 1.00 0.00 H new ATOM 0 HA ALA A 128 14.362 2.640 -5.758 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.539 3.222 -3.516 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.299 1.499 -3.895 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.620 1.996 -2.810 1.00 0.00 H new ATOM 1963 N ASP A 129 17.191 3.240 -4.415 1.00 0.00 N ATOM 1964 CA ASP A 129 18.283 4.203 -4.265 1.00 0.00 C ATOM 1965 C ASP A 129 18.665 4.786 -5.626 1.00 0.00 C ATOM 1966 O ASP A 129 19.379 4.165 -6.423 1.00 0.00 O ATOM 1967 CB ASP A 129 19.493 3.522 -3.569 1.00 0.00 C ATOM 1968 CG ASP A 129 20.774 4.340 -3.561 1.00 0.00 C ATOM 1969 OD1 ASP A 129 21.549 4.261 -4.531 1.00 0.00 O ATOM 1970 OD2 ASP A 129 21.047 5.038 -2.581 1.00 0.00 O ATOM 0 H ASP A 129 17.481 2.275 -4.257 1.00 0.00 H new ATOM 0 HA ASP A 129 17.956 5.030 -3.635 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.219 3.294 -2.539 1.00 0.00 H new ATOM 0 HB3 ASP A 129 19.690 2.571 -4.064 1.00 0.00 H new ATOM 1975 N ILE A 130 18.065 5.897 -5.934 1.00 0.00 N ATOM 1976 CA ILE A 130 18.284 6.602 -7.174 1.00 0.00 C ATOM 1977 C ILE A 130 19.512 7.526 -7.109 1.00 0.00 C ATOM 1978 O ILE A 130 20.304 7.614 -8.068 1.00 0.00 O ATOM 1979 CB ILE A 130 17.009 7.386 -7.617 1.00 0.00 C ATOM 1980 CG1 ILE A 130 15.851 6.398 -7.838 1.00 0.00 C ATOM 1981 CG2 ILE A 130 17.267 8.199 -8.886 1.00 0.00 C ATOM 1982 CD1 ILE A 130 14.547 7.036 -8.266 1.00 0.00 C ATOM 0 H ILE A 130 17.392 6.354 -5.319 1.00 0.00 H new ATOM 0 HA ILE A 130 18.493 5.848 -7.932 1.00 0.00 H new ATOM 0 HB ILE A 130 16.742 8.088 -6.827 1.00 0.00 H new ATOM 0 HG12 ILE A 130 16.150 5.672 -8.594 1.00 0.00 H new ATOM 0 HG13 ILE A 130 15.683 5.844 -6.914 1.00 0.00 H new ATOM 0 HG21 ILE A 130 16.359 8.733 -9.167 1.00 0.00 H new ATOM 0 HG22 ILE A 130 18.067 8.916 -8.702 1.00 0.00 H new ATOM 0 HG23 ILE A 130 17.559 7.529 -9.694 1.00 0.00 H new ATOM 0 HD11 ILE A 130 13.790 6.263 -8.398 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.218 7.740 -7.501 1.00 0.00 H new ATOM 0 HD13 ILE A 130 14.693 7.565 -9.208 1.00 0.00 H new ATOM 1994 N ASP A 131 19.686 8.198 -5.985 1.00 0.00 N ATOM 1995 CA ASP A 131 20.728 9.230 -5.875 1.00 0.00 C ATOM 1996 C ASP A 131 22.101 8.637 -5.537 1.00 0.00 C ATOM 1997 O ASP A 131 23.135 9.299 -5.669 1.00 0.00 O ATOM 1998 CB ASP A 131 20.308 10.293 -4.841 1.00 0.00 C ATOM 1999 CG ASP A 131 21.187 11.526 -4.850 1.00 0.00 C ATOM 2000 OD1 ASP A 131 21.007 12.382 -5.750 1.00 0.00 O ATOM 2001 OD2 ASP A 131 22.032 11.691 -3.947 1.00 0.00 O ATOM 0 H ASP A 131 19.132 8.058 -5.140 1.00 0.00 H new ATOM 0 HA ASP A 131 20.830 9.706 -6.850 1.00 0.00 H new ATOM 0 HB2 ASP A 131 19.277 10.590 -5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.329 9.849 -3.846 1.00 0.00 H new ATOM 2006 N GLY A 132 22.114 7.380 -5.181 1.00 0.00 N ATOM 2007 CA GLY A 132 23.356 6.696 -4.915 1.00 0.00 C ATOM 2008 C GLY A 132 23.952 7.076 -3.587 1.00 0.00 C ATOM 2009 O GLY A 132 25.084 7.552 -3.520 1.00 0.00 O ATOM 0 H GLY A 132 21.278 6.806 -5.068 1.00 0.00 H new ATOM 0 HA2 GLY A 132 23.186 5.620 -4.938 1.00 0.00 H new ATOM 0 HA3 GLY A 132 24.069 6.923 -5.708 1.00 0.00 H new ATOM 2013 N ASP A 133 23.196 6.913 -2.540 1.00 0.00 N ATOM 2014 CA ASP A 133 23.693 7.208 -1.197 1.00 0.00 C ATOM 2015 C ASP A 133 23.818 5.904 -0.428 1.00 0.00 C ATOM 2016 O ASP A 133 24.566 5.794 0.549 1.00 0.00 O ATOM 2017 CB ASP A 133 22.714 8.154 -0.471 1.00 0.00 C ATOM 2018 CG ASP A 133 23.182 8.605 0.905 1.00 0.00 C ATOM 2019 OD1 ASP A 133 23.859 9.663 1.002 1.00 0.00 O ATOM 2020 OD2 ASP A 133 22.868 7.938 1.917 1.00 0.00 O ATOM 0 H ASP A 133 22.233 6.579 -2.574 1.00 0.00 H new ATOM 0 HA ASP A 133 24.666 7.695 -1.261 1.00 0.00 H new ATOM 0 HB2 ASP A 133 22.550 9.034 -1.092 1.00 0.00 H new ATOM 0 HB3 ASP A 133 21.752 7.652 -0.368 1.00 0.00 H new ATOM 2025 N GLY A 134 23.158 4.888 -0.941 1.00 0.00 N ATOM 2026 CA GLY A 134 23.142 3.591 -0.318 1.00 0.00 C ATOM 2027 C GLY A 134 21.918 3.457 0.544 1.00 0.00 C ATOM 2028 O GLY A 134 21.726 2.465 1.253 1.00 0.00 O ATOM 0 H GLY A 134 22.617 4.943 -1.804 1.00 0.00 H new ATOM 0 HA2 GLY A 134 23.149 2.811 -1.080 1.00 0.00 H new ATOM 0 HA3 GLY A 134 24.040 3.456 0.285 1.00 0.00 H new ATOM 2032 N GLN A 135 21.092 4.478 0.477 1.00 0.00 N ATOM 2033 CA GLN A 135 19.863 4.586 1.205 1.00 0.00 C ATOM 2034 C GLN A 135 18.903 5.372 0.338 1.00 0.00 C ATOM 2035 O GLN A 135 19.322 6.270 -0.377 1.00 0.00 O ATOM 2036 CB GLN A 135 20.061 5.308 2.545 1.00 0.00 C ATOM 2037 CG GLN A 135 20.962 4.595 3.549 1.00 0.00 C ATOM 2038 CD GLN A 135 21.091 5.346 4.860 1.00 0.00 C ATOM 2039 OE1 GLN A 135 21.251 4.742 5.920 1.00 0.00 O ATOM 2040 NE2 GLN A 135 21.071 6.649 4.808 1.00 0.00 N ATOM 0 H GLN A 135 21.274 5.288 -0.115 1.00 0.00 H new ATOM 0 HA GLN A 135 19.479 3.591 1.431 1.00 0.00 H new ATOM 0 HB2 GLN A 135 20.477 6.296 2.347 1.00 0.00 H new ATOM 0 HB3 GLN A 135 19.084 5.460 3.004 1.00 0.00 H new ATOM 0 HG2 GLN A 135 20.564 3.599 3.744 1.00 0.00 H new ATOM 0 HG3 GLN A 135 21.952 4.463 3.112 1.00 0.00 H new ATOM 0 HE21 GLN A 135 20.936 7.122 3.914 1.00 0.00 H new ATOM 0 HE22 GLN A 135 21.190 7.195 5.661 1.00 0.00 H new ATOM 2049 N VAL A 136 17.649 5.039 0.396 1.00 0.00 N ATOM 2050 CA VAL A 136 16.645 5.671 -0.458 1.00 0.00 C ATOM 2051 C VAL A 136 15.794 6.722 0.288 1.00 0.00 C ATOM 2052 O VAL A 136 15.132 6.407 1.265 1.00 0.00 O ATOM 2053 CB VAL A 136 15.754 4.587 -1.166 1.00 0.00 C ATOM 2054 CG1 VAL A 136 15.431 3.445 -0.228 1.00 0.00 C ATOM 2055 CG2 VAL A 136 14.452 5.186 -1.661 1.00 0.00 C ATOM 0 H VAL A 136 17.278 4.328 1.027 1.00 0.00 H new ATOM 0 HA VAL A 136 17.184 6.223 -1.229 1.00 0.00 H new ATOM 0 HB VAL A 136 16.329 4.212 -2.013 1.00 0.00 H new ATOM 0 HG11 VAL A 136 14.814 2.712 -0.747 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.356 2.972 0.102 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.890 3.827 0.638 1.00 0.00 H new ATOM 0 HG21 VAL A 136 13.857 4.412 -2.146 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.896 5.596 -0.818 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.666 5.981 -2.376 1.00 0.00 H new ATOM 2065 N ASN A 137 15.831 7.961 -0.181 1.00 0.00 N ATOM 2066 CA ASN A 137 15.043 9.060 0.411 1.00 0.00 C ATOM 2067 C ASN A 137 13.633 9.059 -0.222 1.00 0.00 C ATOM 2068 O ASN A 137 13.402 8.388 -1.236 1.00 0.00 O ATOM 2069 CB ASN A 137 15.777 10.408 0.163 1.00 0.00 C ATOM 2070 CG ASN A 137 15.320 11.617 1.012 1.00 0.00 C ATOM 2071 OD1 ASN A 137 14.165 11.756 1.406 1.00 0.00 O ATOM 2072 ND2 ASN A 137 16.238 12.512 1.282 1.00 0.00 N ATOM 0 H ASN A 137 16.401 8.243 -0.978 1.00 0.00 H new ATOM 0 HA ASN A 137 14.939 8.925 1.488 1.00 0.00 H new ATOM 0 HB2 ASN A 137 16.841 10.253 0.339 1.00 0.00 H new ATOM 0 HB3 ASN A 137 15.662 10.669 -0.889 1.00 0.00 H new ATOM 0 HD21 ASN A 137 15.998 13.340 1.827 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.192 12.381 0.947 1.00 0.00 H new ATOM 2079 N TYR A 138 12.717 9.822 0.358 1.00 0.00 N ATOM 2080 CA TYR A 138 11.308 9.857 -0.042 1.00 0.00 C ATOM 2081 C TYR A 138 11.120 10.185 -1.517 1.00 0.00 C ATOM 2082 O TYR A 138 10.386 9.495 -2.216 1.00 0.00 O ATOM 2083 CB TYR A 138 10.514 10.841 0.842 1.00 0.00 C ATOM 2084 CG TYR A 138 9.042 10.942 0.482 1.00 0.00 C ATOM 2085 CD1 TYR A 138 8.503 12.115 -0.040 1.00 0.00 C ATOM 2086 CD2 TYR A 138 8.199 9.855 0.646 1.00 0.00 C ATOM 2087 CE1 TYR A 138 7.162 12.193 -0.383 1.00 0.00 C ATOM 2088 CE2 TYR A 138 6.877 9.923 0.307 1.00 0.00 C ATOM 2089 CZ TYR A 138 6.353 11.091 -0.211 1.00 0.00 C ATOM 2090 OH TYR A 138 5.009 11.161 -0.539 1.00 0.00 O ATOM 0 H TYR A 138 12.931 10.447 1.135 1.00 0.00 H new ATOM 0 HA TYR A 138 10.916 8.851 0.107 1.00 0.00 H new ATOM 0 HB2 TYR A 138 10.603 10.531 1.883 1.00 0.00 H new ATOM 0 HB3 TYR A 138 10.966 11.830 0.764 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.139 12.977 -0.180 1.00 0.00 H new ATOM 0 HD2 TYR A 138 8.595 8.935 1.050 1.00 0.00 H new ATOM 0 HE1 TYR A 138 6.755 13.110 -0.782 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.241 9.061 0.444 1.00 0.00 H new ATOM 0 HH TYR A 138 4.903 11.653 -1.380 1.00 0.00 H new ATOM 2100 N GLU A 139 11.808 11.196 -1.990 1.00 0.00 N ATOM 2101 CA GLU A 139 11.675 11.623 -3.368 1.00 0.00 C ATOM 2102 C GLU A 139 12.211 10.602 -4.362 1.00 0.00 C ATOM 2103 O GLU A 139 11.749 10.522 -5.500 1.00 0.00 O ATOM 2104 CB GLU A 139 12.295 12.978 -3.558 1.00 0.00 C ATOM 2105 CG GLU A 139 11.486 14.082 -2.917 1.00 0.00 C ATOM 2106 CD GLU A 139 10.125 14.218 -3.558 1.00 0.00 C ATOM 2107 OE1 GLU A 139 9.131 13.720 -3.002 1.00 0.00 O ATOM 2108 OE2 GLU A 139 10.034 14.823 -4.653 1.00 0.00 O ATOM 0 H GLU A 139 12.470 11.743 -1.440 1.00 0.00 H new ATOM 0 HA GLU A 139 10.609 11.702 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 139 13.300 12.976 -3.135 1.00 0.00 H new ATOM 0 HB3 GLU A 139 12.398 13.180 -4.624 1.00 0.00 H new ATOM 0 HG2 GLU A 139 11.369 13.877 -1.853 1.00 0.00 H new ATOM 0 HG3 GLU A 139 12.025 15.026 -3.002 1.00 0.00 H new ATOM 2115 N GLU A 140 13.149 9.804 -3.927 1.00 0.00 N ATOM 2116 CA GLU A 140 13.665 8.740 -4.751 1.00 0.00 C ATOM 2117 C GLU A 140 12.626 7.649 -4.817 1.00 0.00 C ATOM 2118 O GLU A 140 12.295 7.144 -5.885 1.00 0.00 O ATOM 2119 CB GLU A 140 14.933 8.191 -4.154 1.00 0.00 C ATOM 2120 CG GLU A 140 16.041 9.192 -4.058 1.00 0.00 C ATOM 2121 CD GLU A 140 17.210 8.632 -3.341 1.00 0.00 C ATOM 2122 OE1 GLU A 140 17.935 7.828 -3.924 1.00 0.00 O ATOM 2123 OE2 GLU A 140 17.425 9.002 -2.177 1.00 0.00 O ATOM 0 H GLU A 140 13.574 9.870 -3.002 1.00 0.00 H new ATOM 0 HA GLU A 140 13.886 9.118 -5.749 1.00 0.00 H new ATOM 0 HB2 GLU A 140 14.717 7.806 -3.157 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.270 7.347 -4.755 1.00 0.00 H new ATOM 0 HG2 GLU A 140 16.340 9.504 -5.059 1.00 0.00 H new ATOM 0 HG3 GLU A 140 15.686 10.083 -3.540 1.00 0.00 H new ATOM 2130 N PHE A 141 12.073 7.342 -3.666 1.00 0.00 N ATOM 2131 CA PHE A 141 11.069 6.325 -3.543 1.00 0.00 C ATOM 2132 C PHE A 141 9.789 6.690 -4.317 1.00 0.00 C ATOM 2133 O PHE A 141 9.198 5.829 -4.958 1.00 0.00 O ATOM 2134 CB PHE A 141 10.805 6.005 -2.058 1.00 0.00 C ATOM 2135 CG PHE A 141 9.725 4.981 -1.819 1.00 0.00 C ATOM 2136 CD1 PHE A 141 8.708 5.240 -0.926 1.00 0.00 C ATOM 2137 CD2 PHE A 141 9.723 3.766 -2.498 1.00 0.00 C ATOM 2138 CE1 PHE A 141 7.712 4.318 -0.707 1.00 0.00 C ATOM 2139 CE2 PHE A 141 8.723 2.840 -2.282 1.00 0.00 C ATOM 2140 CZ PHE A 141 7.716 3.117 -1.386 1.00 0.00 C ATOM 0 H PHE A 141 12.313 7.798 -2.786 1.00 0.00 H new ATOM 0 HA PHE A 141 11.443 5.412 -4.006 1.00 0.00 H new ATOM 0 HB2 PHE A 141 11.731 5.649 -1.606 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.533 6.927 -1.544 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.693 6.178 -0.392 1.00 0.00 H new ATOM 0 HD2 PHE A 141 10.512 3.546 -3.201 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.924 4.535 -0.001 1.00 0.00 H new ATOM 0 HE2 PHE A 141 8.731 1.901 -2.815 1.00 0.00 H new ATOM 0 HZ PHE A 141 6.931 2.396 -1.215 1.00 0.00 H new ATOM 2150 N VAL A 142 9.389 7.961 -4.303 1.00 0.00 N ATOM 2151 CA VAL A 142 8.197 8.364 -5.067 1.00 0.00 C ATOM 2152 C VAL A 142 8.448 8.231 -6.562 1.00 0.00 C ATOM 2153 O VAL A 142 7.560 7.836 -7.315 1.00 0.00 O ATOM 2154 CB VAL A 142 7.666 9.806 -4.739 1.00 0.00 C ATOM 2155 CG1 VAL A 142 7.414 9.977 -3.271 1.00 0.00 C ATOM 2156 CG2 VAL A 142 8.571 10.909 -5.262 1.00 0.00 C ATOM 0 H VAL A 142 9.852 8.712 -3.791 1.00 0.00 H new ATOM 0 HA VAL A 142 7.411 7.677 -4.753 1.00 0.00 H new ATOM 0 HB VAL A 142 6.717 9.902 -5.267 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.048 10.986 -3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 142 6.669 9.252 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.342 9.818 -2.722 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.149 11.880 -5.003 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.560 10.812 -4.813 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.655 10.828 -6.346 1.00 0.00 H new ATOM 2166 N GLN A 143 9.669 8.504 -6.971 1.00 0.00 N ATOM 2167 CA GLN A 143 10.036 8.441 -8.358 1.00 0.00 C ATOM 2168 C GLN A 143 10.115 6.976 -8.804 1.00 0.00 C ATOM 2169 O GLN A 143 9.685 6.623 -9.901 1.00 0.00 O ATOM 2170 CB GLN A 143 11.361 9.190 -8.564 1.00 0.00 C ATOM 2171 CG GLN A 143 11.771 9.383 -10.013 1.00 0.00 C ATOM 2172 CD GLN A 143 12.978 10.299 -10.178 1.00 0.00 C ATOM 2173 OE1 GLN A 143 13.106 10.999 -11.183 1.00 0.00 O ATOM 2174 NE2 GLN A 143 13.856 10.326 -9.203 1.00 0.00 N ATOM 0 H GLN A 143 10.429 8.775 -6.347 1.00 0.00 H new ATOM 0 HA GLN A 143 9.282 8.926 -8.977 1.00 0.00 H new ATOM 0 HB2 GLN A 143 11.285 10.169 -8.090 1.00 0.00 H new ATOM 0 HB3 GLN A 143 12.152 8.646 -8.048 1.00 0.00 H new ATOM 0 HG2 GLN A 143 11.997 8.412 -10.452 1.00 0.00 H new ATOM 0 HG3 GLN A 143 10.930 9.797 -10.570 1.00 0.00 H new ATOM 0 HE21 GLN A 143 13.725 9.735 -8.382 1.00 0.00 H new ATOM 0 HE22 GLN A 143 14.670 10.938 -9.266 1.00 0.00 H new ATOM 2183 N MET A 144 10.614 6.131 -7.921 1.00 0.00 N ATOM 2184 CA MET A 144 10.736 4.701 -8.186 1.00 0.00 C ATOM 2185 C MET A 144 9.379 4.000 -8.168 1.00 0.00 C ATOM 2186 O MET A 144 9.032 3.301 -9.116 1.00 0.00 O ATOM 2187 CB MET A 144 11.732 4.043 -7.189 1.00 0.00 C ATOM 2188 CG MET A 144 11.894 2.511 -7.301 1.00 0.00 C ATOM 2189 SD MET A 144 10.517 1.561 -6.586 1.00 0.00 S ATOM 2190 CE MET A 144 11.048 -0.105 -6.953 1.00 0.00 C ATOM 0 H MET A 144 10.947 6.412 -6.999 1.00 0.00 H new ATOM 0 HA MET A 144 11.136 4.583 -9.193 1.00 0.00 H new ATOM 0 HB2 MET A 144 12.711 4.502 -7.328 1.00 0.00 H new ATOM 0 HB3 MET A 144 11.410 4.281 -6.175 1.00 0.00 H new ATOM 0 HG2 MET A 144 11.997 2.244 -8.353 1.00 0.00 H new ATOM 0 HG3 MET A 144 12.819 2.218 -6.805 1.00 0.00 H new ATOM 0 HE1 MET A 144 10.205 -0.788 -6.844 1.00 0.00 H new ATOM 0 HE2 MET A 144 11.422 -0.151 -7.976 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.841 -0.394 -6.264 1.00 0.00 H new ATOM 2200 N MET A 145 8.605 4.218 -7.109 1.00 0.00 N ATOM 2201 CA MET A 145 7.320 3.524 -6.891 1.00 0.00 C ATOM 2202 C MET A 145 6.326 3.856 -8.024 1.00 0.00 C ATOM 2203 O MET A 145 5.598 2.984 -8.510 1.00 0.00 O ATOM 2204 CB MET A 145 6.759 3.924 -5.503 1.00 0.00 C ATOM 2205 CG MET A 145 5.764 2.951 -4.852 1.00 0.00 C ATOM 2206 SD MET A 145 4.255 2.645 -5.789 1.00 0.00 S ATOM 2207 CE MET A 145 3.354 1.636 -4.615 1.00 0.00 C ATOM 0 H MET A 145 8.843 4.880 -6.371 1.00 0.00 H new ATOM 0 HA MET A 145 7.475 2.445 -6.907 1.00 0.00 H new ATOM 0 HB2 MET A 145 7.600 4.056 -4.822 1.00 0.00 H new ATOM 0 HB3 MET A 145 6.272 4.894 -5.600 1.00 0.00 H new ATOM 0 HG2 MET A 145 6.268 1.999 -4.687 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.490 3.340 -3.872 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.369 1.402 -5.018 1.00 0.00 H new ATOM 0 HE2 MET A 145 3.902 0.711 -4.435 1.00 0.00 H new ATOM 0 HE3 MET A 145 3.243 2.180 -3.677 1.00 0.00 H new ATOM 2385 N LYS B 82 10.018 -6.379 -8.386 1.00 0.00 N ATOM 2386 CA LYS B 82 8.686 -5.834 -8.611 1.00 0.00 C ATOM 2387 C LYS B 82 7.659 -6.723 -7.921 1.00 0.00 C ATOM 2388 O LYS B 82 6.588 -6.266 -7.501 1.00 0.00 O ATOM 2389 CB LYS B 82 8.370 -5.707 -10.100 1.00 0.00 C ATOM 2390 CG LYS B 82 7.123 -4.894 -10.393 1.00 0.00 C ATOM 2391 CD LYS B 82 6.917 -4.724 -11.878 1.00 0.00 C ATOM 2392 CE LYS B 82 5.738 -3.819 -12.169 1.00 0.00 C ATOM 2393 NZ LYS B 82 5.536 -3.638 -13.611 1.00 0.00 N ATOM 0 HA LYS B 82 8.648 -4.830 -8.189 1.00 0.00 H new ATOM 0 HB2 LYS B 82 9.220 -5.247 -10.604 1.00 0.00 H new ATOM 0 HB3 LYS B 82 8.250 -6.704 -10.523 1.00 0.00 H new ATOM 0 HG2 LYS B 82 6.254 -5.387 -9.957 1.00 0.00 H new ATOM 0 HG3 LYS B 82 7.205 -3.915 -9.920 1.00 0.00 H new ATOM 0 HD2 LYS B 82 7.818 -4.307 -12.327 1.00 0.00 H new ATOM 0 HD3 LYS B 82 6.753 -5.698 -12.339 1.00 0.00 H new ATOM 0 HE2 LYS B 82 4.837 -4.242 -11.725 1.00 0.00 H new ATOM 0 HE3 LYS B 82 5.899 -2.849 -11.699 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 4.721 -3.013 -13.772 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 6.387 -3.212 -14.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 5.357 -4.561 -14.055 1.00 0.00 H new ATOM 2407 N GLU B 83 7.984 -7.996 -7.804 1.00 0.00 N ATOM 2408 CA GLU B 83 7.133 -8.924 -7.090 1.00 0.00 C ATOM 2409 C GLU B 83 7.338 -8.704 -5.611 1.00 0.00 C ATOM 2410 O GLU B 83 6.377 -8.592 -4.834 1.00 0.00 O ATOM 2411 CB GLU B 83 7.468 -10.373 -7.453 1.00 0.00 C ATOM 2412 CG GLU B 83 7.369 -10.677 -8.933 1.00 0.00 C ATOM 2413 CD GLU B 83 6.044 -10.257 -9.504 1.00 0.00 C ATOM 2414 OE1 GLU B 83 5.983 -9.213 -10.179 1.00 0.00 O ATOM 2415 OE2 GLU B 83 5.034 -10.927 -9.259 1.00 0.00 O ATOM 0 H GLU B 83 8.831 -8.410 -8.194 1.00 0.00 H new ATOM 0 HA GLU B 83 6.093 -8.748 -7.365 1.00 0.00 H new ATOM 0 HB2 GLU B 83 8.479 -10.597 -7.114 1.00 0.00 H new ATOM 0 HB3 GLU B 83 6.795 -11.037 -6.911 1.00 0.00 H new ATOM 0 HG2 GLU B 83 8.172 -10.165 -9.463 1.00 0.00 H new ATOM 0 HG3 GLU B 83 7.512 -11.746 -9.094 1.00 0.00 H new ATOM 2422 N ALA B 84 8.602 -8.587 -5.243 1.00 0.00 N ATOM 2423 CA ALA B 84 9.003 -8.361 -3.878 1.00 0.00 C ATOM 2424 C ALA B 84 8.373 -7.088 -3.312 1.00 0.00 C ATOM 2425 O ALA B 84 7.762 -7.129 -2.259 1.00 0.00 O ATOM 2426 CB ALA B 84 10.513 -8.323 -3.775 1.00 0.00 C ATOM 0 H ALA B 84 9.383 -8.648 -5.896 1.00 0.00 H new ATOM 0 HA ALA B 84 8.639 -9.192 -3.274 1.00 0.00 H new ATOM 0 HB1 ALA B 84 10.803 -8.152 -2.738 1.00 0.00 H new ATOM 0 HB2 ALA B 84 10.925 -9.273 -4.114 1.00 0.00 H new ATOM 0 HB3 ALA B 84 10.900 -7.517 -4.398 1.00 0.00 H new ATOM 2432 N TRP B 85 8.481 -5.973 -4.039 1.00 0.00 N ATOM 2433 CA TRP B 85 7.893 -4.700 -3.606 1.00 0.00 C ATOM 2434 C TRP B 85 6.375 -4.775 -3.436 1.00 0.00 C ATOM 2435 O TRP B 85 5.841 -4.204 -2.486 1.00 0.00 O ATOM 2436 CB TRP B 85 8.283 -3.516 -4.511 1.00 0.00 C ATOM 2437 CG TRP B 85 9.680 -2.984 -4.292 1.00 0.00 C ATOM 2438 CD1 TRP B 85 10.787 -3.214 -5.054 1.00 0.00 C ATOM 2439 CD2 TRP B 85 10.106 -2.116 -3.235 1.00 0.00 C ATOM 2440 NE1 TRP B 85 11.868 -2.545 -4.541 1.00 0.00 N ATOM 2441 CE2 TRP B 85 11.477 -1.866 -3.423 1.00 0.00 C ATOM 2442 CE3 TRP B 85 9.462 -1.527 -2.146 1.00 0.00 C ATOM 2443 CZ2 TRP B 85 12.207 -1.051 -2.570 1.00 0.00 C ATOM 2444 CZ3 TRP B 85 10.192 -0.721 -1.299 1.00 0.00 C ATOM 2445 CH2 TRP B 85 11.552 -0.492 -1.517 1.00 0.00 C ATOM 0 H TRP B 85 8.971 -5.925 -4.932 1.00 0.00 H new ATOM 0 HA TRP B 85 8.325 -4.512 -2.623 1.00 0.00 H new ATOM 0 HB2 TRP B 85 8.186 -3.825 -5.552 1.00 0.00 H new ATOM 0 HB3 TRP B 85 7.572 -2.706 -4.352 1.00 0.00 H new ATOM 0 HD1 TRP B 85 10.809 -3.835 -5.937 1.00 0.00 H new ATOM 0 HE1 TRP B 85 12.811 -2.553 -4.931 1.00 0.00 H new ATOM 0 HE3 TRP B 85 8.411 -1.700 -1.970 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 13.258 -0.867 -2.736 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.704 -0.259 -0.453 1.00 0.00 H new ATOM 0 HH2 TRP B 85 12.096 0.143 -0.834 1.00 0.00 H new ATOM 2456 N LYS B 86 5.679 -5.510 -4.327 1.00 0.00 N ATOM 2457 CA LYS B 86 4.213 -5.663 -4.201 1.00 0.00 C ATOM 2458 C LYS B 86 3.854 -6.383 -2.921 1.00 0.00 C ATOM 2459 O LYS B 86 2.793 -6.173 -2.348 1.00 0.00 O ATOM 2460 CB LYS B 86 3.573 -6.402 -5.384 1.00 0.00 C ATOM 2461 CG LYS B 86 3.493 -5.611 -6.675 1.00 0.00 C ATOM 2462 CD LYS B 86 2.623 -6.331 -7.714 1.00 0.00 C ATOM 2463 CE LYS B 86 3.242 -7.633 -8.203 1.00 0.00 C ATOM 2464 NZ LYS B 86 4.482 -7.389 -8.961 1.00 0.00 N ATOM 0 H LYS B 86 6.094 -5.996 -5.122 1.00 0.00 H new ATOM 0 HA LYS B 86 3.814 -4.649 -4.190 1.00 0.00 H new ATOM 0 HB2 LYS B 86 4.139 -7.314 -5.571 1.00 0.00 H new ATOM 0 HB3 LYS B 86 2.565 -6.705 -5.100 1.00 0.00 H new ATOM 0 HG2 LYS B 86 3.081 -4.622 -6.474 1.00 0.00 H new ATOM 0 HG3 LYS B 86 4.495 -5.463 -7.076 1.00 0.00 H new ATOM 0 HD2 LYS B 86 1.645 -6.540 -7.280 1.00 0.00 H new ATOM 0 HD3 LYS B 86 2.460 -5.670 -8.565 1.00 0.00 H new ATOM 0 HE2 LYS B 86 3.456 -8.278 -7.351 1.00 0.00 H new ATOM 0 HE3 LYS B 86 2.527 -8.163 -8.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 4.786 -8.270 -9.422 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 4.309 -6.662 -9.684 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 5.227 -7.062 -8.313 1.00 0.00 H new ATOM 2478 N HIS B 87 4.731 -7.240 -2.481 1.00 0.00 N ATOM 2479 CA HIS B 87 4.504 -7.944 -1.254 1.00 0.00 C ATOM 2480 C HIS B 87 4.943 -7.103 -0.087 1.00 0.00 C ATOM 2481 O HIS B 87 4.220 -6.970 0.868 1.00 0.00 O ATOM 2482 CB HIS B 87 5.190 -9.309 -1.242 1.00 0.00 C ATOM 2483 CG HIS B 87 4.617 -10.269 -2.239 1.00 0.00 C ATOM 2484 ND1 HIS B 87 5.366 -10.928 -3.188 1.00 0.00 N ATOM 2485 CD2 HIS B 87 3.347 -10.681 -2.425 1.00 0.00 C ATOM 2486 CE1 HIS B 87 4.582 -11.691 -3.912 1.00 0.00 C ATOM 2487 NE2 HIS B 87 3.353 -11.558 -3.467 1.00 0.00 N ATOM 0 H HIS B 87 5.607 -7.467 -2.953 1.00 0.00 H new ATOM 0 HA HIS B 87 3.434 -8.131 -1.168 1.00 0.00 H new ATOM 0 HB2 HIS B 87 6.252 -9.176 -1.446 1.00 0.00 H new ATOM 0 HB3 HIS B 87 5.108 -9.740 -0.244 1.00 0.00 H new ATOM 0 HD2 HIS B 87 2.484 -10.373 -1.853 1.00 0.00 H new ATOM 0 HE1 HIS B 87 4.893 -12.320 -4.733 1.00 0.00 H new ATOM 0 HE2 HIS B 87 2.534 -12.036 -3.842 1.00 0.00 H new ATOM 2496 N ALA B 88 6.095 -6.479 -0.224 1.00 0.00 N ATOM 2497 CA ALA B 88 6.707 -5.667 0.824 1.00 0.00 C ATOM 2498 C ALA B 88 5.815 -4.519 1.258 1.00 0.00 C ATOM 2499 O ALA B 88 5.464 -4.414 2.426 1.00 0.00 O ATOM 2500 CB ALA B 88 8.043 -5.119 0.350 1.00 0.00 C ATOM 0 H ALA B 88 6.648 -6.519 -1.080 1.00 0.00 H new ATOM 0 HA ALA B 88 6.855 -6.317 1.686 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.490 -4.515 1.140 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.709 -5.946 0.105 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.890 -4.502 -0.535 1.00 0.00 H new ATOM 2506 N ILE B 89 5.431 -3.683 0.305 1.00 0.00 N ATOM 2507 CA ILE B 89 4.630 -2.500 0.588 1.00 0.00 C ATOM 2508 C ILE B 89 3.274 -2.894 1.176 1.00 0.00 C ATOM 2509 O ILE B 89 2.844 -2.358 2.201 1.00 0.00 O ATOM 2510 CB ILE B 89 4.432 -1.638 -0.694 1.00 0.00 C ATOM 2511 CG1 ILE B 89 5.800 -1.188 -1.240 1.00 0.00 C ATOM 2512 CG2 ILE B 89 3.544 -0.432 -0.401 1.00 0.00 C ATOM 2513 CD1 ILE B 89 5.734 -0.406 -2.538 1.00 0.00 C ATOM 0 H ILE B 89 5.664 -3.804 -0.681 1.00 0.00 H new ATOM 0 HA ILE B 89 5.168 -1.901 1.323 1.00 0.00 H new ATOM 0 HB ILE B 89 3.935 -2.244 -1.451 1.00 0.00 H new ATOM 0 HG12 ILE B 89 6.294 -0.575 -0.486 1.00 0.00 H new ATOM 0 HG13 ILE B 89 6.423 -2.069 -1.393 1.00 0.00 H new ATOM 0 HG21 ILE B 89 3.418 0.157 -1.310 1.00 0.00 H new ATOM 0 HG22 ILE B 89 2.569 -0.774 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE B 89 4.009 0.184 0.369 1.00 0.00 H new ATOM 0 HD11 ILE B 89 6.742 -0.130 -2.848 1.00 0.00 H new ATOM 0 HD12 ILE B 89 5.272 -1.021 -3.310 1.00 0.00 H new ATOM 0 HD13 ILE B 89 5.141 0.496 -2.389 1.00 0.00 H new ATOM 2525 N GLN B 90 2.657 -3.871 0.558 1.00 0.00 N ATOM 2526 CA GLN B 90 1.353 -4.362 0.958 1.00 0.00 C ATOM 2527 C GLN B 90 1.411 -5.042 2.339 1.00 0.00 C ATOM 2528 O GLN B 90 0.489 -4.918 3.139 1.00 0.00 O ATOM 2529 CB GLN B 90 0.853 -5.311 -0.123 1.00 0.00 C ATOM 2530 CG GLN B 90 -0.509 -5.946 0.107 1.00 0.00 C ATOM 2531 CD GLN B 90 -0.970 -6.758 -1.101 1.00 0.00 C ATOM 2532 OE1 GLN B 90 -2.171 -6.929 -1.342 1.00 0.00 O ATOM 2533 NE2 GLN B 90 -0.035 -7.210 -1.902 1.00 0.00 N ATOM 0 H GLN B 90 3.049 -4.357 -0.249 1.00 0.00 H new ATOM 0 HA GLN B 90 0.656 -3.531 1.060 1.00 0.00 H new ATOM 0 HB2 GLN B 90 0.820 -4.766 -1.066 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.586 -6.109 -0.241 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.465 -6.592 0.983 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -1.241 -5.167 0.322 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.948 -7.054 -1.678 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -0.291 -7.717 -2.749 1.00 0.00 H new ATOM 2542 N LYS B 91 2.503 -5.737 2.618 1.00 0.00 N ATOM 2543 CA LYS B 91 2.675 -6.396 3.901 1.00 0.00 C ATOM 2544 C LYS B 91 2.957 -5.368 4.987 1.00 0.00 C ATOM 2545 O LYS B 91 2.449 -5.481 6.100 1.00 0.00 O ATOM 2546 CB LYS B 91 3.806 -7.438 3.840 1.00 0.00 C ATOM 2547 CG LYS B 91 3.997 -8.260 5.117 1.00 0.00 C ATOM 2548 CD LYS B 91 2.744 -9.061 5.485 1.00 0.00 C ATOM 2549 CE LYS B 91 2.356 -10.070 4.405 1.00 0.00 C ATOM 2550 NZ LYS B 91 3.390 -11.099 4.186 1.00 0.00 N ATOM 0 H LYS B 91 3.283 -5.859 1.972 1.00 0.00 H new ATOM 0 HA LYS B 91 1.749 -6.918 4.143 1.00 0.00 H new ATOM 0 HB2 LYS B 91 3.607 -8.120 3.013 1.00 0.00 H new ATOM 0 HB3 LYS B 91 4.741 -6.925 3.613 1.00 0.00 H new ATOM 0 HG2 LYS B 91 4.836 -8.943 4.985 1.00 0.00 H new ATOM 0 HG3 LYS B 91 4.255 -7.594 5.940 1.00 0.00 H new ATOM 0 HD2 LYS B 91 2.916 -9.587 6.424 1.00 0.00 H new ATOM 0 HD3 LYS B 91 1.914 -8.375 5.651 1.00 0.00 H new ATOM 0 HE2 LYS B 91 1.421 -10.555 4.686 1.00 0.00 H new ATOM 0 HE3 LYS B 91 2.172 -9.541 3.470 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 2.961 -11.931 3.734 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 4.136 -10.716 3.570 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 3.803 -11.376 5.099 1.00 0.00 H new ATOM 2564 N ALA B 92 3.737 -4.357 4.645 1.00 0.00 N ATOM 2565 CA ALA B 92 4.090 -3.292 5.570 1.00 0.00 C ATOM 2566 C ALA B 92 2.861 -2.480 5.962 1.00 0.00 C ATOM 2567 O ALA B 92 2.669 -2.155 7.140 1.00 0.00 O ATOM 2568 CB ALA B 92 5.162 -2.407 4.973 1.00 0.00 C ATOM 0 H ALA B 92 4.145 -4.251 3.716 1.00 0.00 H new ATOM 0 HA ALA B 92 4.490 -3.744 6.478 1.00 0.00 H new ATOM 0 HB1 ALA B 92 5.414 -1.615 5.678 1.00 0.00 H new ATOM 0 HB2 ALA B 92 6.050 -3.003 4.763 1.00 0.00 H new ATOM 0 HB3 ALA B 92 4.795 -1.965 4.047 1.00 0.00 H new ATOM 2574 N LYS B 93 1.994 -2.200 4.977 1.00 0.00 N ATOM 2575 CA LYS B 93 0.725 -1.492 5.236 1.00 0.00 C ATOM 2576 C LYS B 93 -0.251 -2.416 5.964 1.00 0.00 C ATOM 2577 O LYS B 93 -1.324 -1.993 6.398 1.00 0.00 O ATOM 2578 CB LYS B 93 0.077 -0.992 3.941 1.00 0.00 C ATOM 2579 CG LYS B 93 0.874 0.047 3.164 1.00 0.00 C ATOM 2580 CD LYS B 93 0.083 0.490 1.947 1.00 0.00 C ATOM 2581 CE LYS B 93 0.820 1.509 1.098 1.00 0.00 C ATOM 2582 NZ LYS B 93 -0.021 1.987 -0.018 1.00 0.00 N ATOM 0 H LYS B 93 2.144 -2.450 4.000 1.00 0.00 H new ATOM 0 HA LYS B 93 0.955 -0.627 5.858 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.100 -1.848 3.291 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -0.898 -0.569 4.184 1.00 0.00 H new ATOM 0 HG2 LYS B 93 1.091 0.904 3.801 1.00 0.00 H new ATOM 0 HG3 LYS B 93 1.832 -0.371 2.855 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -0.151 -0.382 1.336 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -0.866 0.915 2.273 1.00 0.00 H new ATOM 0 HE2 LYS B 93 1.119 2.354 1.718 1.00 0.00 H new ATOM 0 HE3 LYS B 93 1.733 1.064 0.703 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 0.569 2.505 -0.700 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -0.465 1.174 -0.491 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -0.760 2.619 0.350 1.00 0.00 H new