USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 144:sc= 1.97 USER MOD Set 1.2: A 128 TYR OH : rot 30:sc= 0.271 USER MOD Set 2.1: A 103 SER OG : rot 85:sc= 2.33 USER MOD Set 2.2: A 118 THR OG1 : rot 79:sc= 0.747 USER MOD Set 3.1: A 19 TYR OH : rot -159:sc= 0.642 USER MOD Set 3.2: A 102 THR OG1 : rot -70:sc= 1.8 USER MOD Set 4.1: A 100 GLN : amide:sc= 0.439 K(o=1.6,f=-4.8!) USER MOD Set 4.2: A 119 HIS : no HE2:sc= 1.11 K(o=1.6,f=-4!) USER MOD Set 5.1: A 82 SER OG : rot 14:sc= 0.178 USER MOD Set 5.2: A 93 HIS : no HD1:sc= -0.373 K(o=0.44,f=-6.4!) USER MOD Set 5.3: A 95 GLN : amide:sc= 0.639 K(o=0.44,f=-2.4) USER MOD Set 6.1: A 53 THR OG1 : rot 134:sc= 1.29 USER MOD Set 6.2: A 60 THR OG1 : rot 180:sc= 1.05 USER MOD Set 7.1: A 14 LYS NZ :NH3+ 173:sc= 0.974! (180deg=0.271!) USER MOD Set 7.2: A 125 THR OG1 : rot 48:sc= 1.38 USER MOD Single : A 1 VAL N :NH3+ -172:sc= -0.139 (180deg=-0.255) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 154:sc= 0.388 (180deg=0.00382) USER MOD Single : A 13 SER OG : rot -59:sc= 0.656 USER MOD Single : A 15 ASN : amide:sc= 1.22 K(o=1.2,f=-0.68) USER MOD Single : A 20 MET CE :methyl 178:sc= -1.45 (180deg=-1.48) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 29:sc= 1.15 USER MOD Single : A 29 THR OG1 : rot 21:sc= 1.02 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 1.73 K(o=1.7,f=-0.31) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 42:sc= 0.0908 USER MOD Single : A 37 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00804) USER MOD Single : A 39 THR OG1 : rot 35:sc= 0.955 USER MOD Single : A 45 ASN : amide:sc= -0.584 X(o=-0.58,f=-0.19) USER MOD Single : A 48 THR OG1 : rot -78:sc= 1.37 USER MOD Single : A 52 LYS NZ :NH3+ 139:sc= 2.17 (180deg=0.557) USER MOD Single : A 54 GLN : amide:sc= -0.471 X(o=-0.47,f=-0.64) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 131:sc= 0.445 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN :FLIP amide:sc= -0.243 F(o=-1.2,f=-0.24) USER MOD Single : A 63 SER OG : rot 37:sc= 0.409 USER MOD Single : A 65 LYS NZ :NH3+ -172:sc= 2.35 (180deg=1.99) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.111 USER MOD Single : A 74 THR OG1 : rot -156:sc= 1.52 USER MOD Single : A 79 LYS NZ :NH3+ -171:sc= 0.222 (180deg=-0.691!) USER MOD Single : A 81 LYS NZ :NH3+ -169:sc= 1.27 (180deg=1.04) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.24 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -173:sc= 1.09 (180deg=0.377) USER MOD Single : A 98 ASN : amide:sc= -1.6 X(o=-1.6,f=-1.5) USER MOD Single : A 108 MET CE :methyl -166:sc= 0 (180deg=-0.276) USER MOD Single : A 112 LYS NZ :NH3+ 147:sc= 1.16 (180deg=0.567) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.376 USER MOD Single : A 121 THR OG1 : rot -42:sc= 0.577 USER MOD Single : A 124 CYS SG : rot 68:sc= 0.828 USER MOD Single : A 127 THR OG1 : rot 44:sc= 1.04 USER MOD Single : A 130 LYS NZ :NH3+ 168:sc= 2.46 (180deg=2.27) USER MOD Single : A 131 GLN : amide:sc= 0.294 X(o=0.29,f=-0.1) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.809 -13.124 -3.374 1.00 0.00 N ATOM 2 CA VAL A 1 10.684 -12.320 -2.168 1.00 0.00 C ATOM 3 C VAL A 1 11.851 -11.335 -2.035 1.00 0.00 C ATOM 4 O VAL A 1 11.648 -10.213 -1.566 1.00 0.00 O ATOM 5 CB VAL A 1 10.506 -13.235 -0.941 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.710 -14.143 -0.663 1.00 0.00 C ATOM 7 CG2 VAL A 1 10.181 -12.426 0.322 1.00 0.00 C ATOM 0 H1 VAL A 1 9.943 -13.683 -3.510 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.950 -12.500 -4.194 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.623 -13.764 -3.282 1.00 0.00 H new ATOM 0 HA VAL A 1 9.788 -11.703 -2.234 1.00 0.00 H new ATOM 0 HB VAL A 1 9.665 -13.880 -1.195 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.508 -14.756 0.215 1.00 0.00 H new ATOM 0 HG12 VAL A 1 11.885 -14.789 -1.524 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.594 -13.531 -0.483 1.00 0.00 H new ATOM 0 HG21 VAL A 1 10.062 -13.104 1.168 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.994 -11.729 0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 1 9.256 -11.870 0.170 1.00 0.00 H new ATOM 19 N ASP A 2 13.049 -11.754 -2.461 1.00 0.00 N ATOM 20 CA ASP A 2 14.348 -11.090 -2.360 1.00 0.00 C ATOM 21 C ASP A 2 14.386 -9.802 -3.189 1.00 0.00 C ATOM 22 O ASP A 2 15.111 -9.665 -4.173 1.00 0.00 O ATOM 23 CB ASP A 2 15.447 -12.067 -2.813 1.00 0.00 C ATOM 24 CG ASP A 2 15.287 -13.457 -2.217 1.00 0.00 C ATOM 25 OD1 ASP A 2 14.284 -14.101 -2.607 1.00 0.00 O ATOM 26 OD2 ASP A 2 16.134 -13.830 -1.380 1.00 0.00 O ATOM 0 H ASP A 2 13.138 -12.655 -2.931 1.00 0.00 H new ATOM 0 HA ASP A 2 14.519 -10.805 -1.322 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.435 -12.140 -3.900 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.421 -11.666 -2.531 1.00 0.00 H new ATOM 31 N ALA A 3 13.572 -8.846 -2.768 1.00 0.00 N ATOM 32 CA ALA A 3 13.238 -7.618 -3.459 1.00 0.00 C ATOM 33 C ALA A 3 12.397 -6.800 -2.489 1.00 0.00 C ATOM 34 O ALA A 3 12.713 -5.638 -2.220 1.00 0.00 O ATOM 35 CB ALA A 3 12.451 -7.919 -4.740 1.00 0.00 C ATOM 0 H ALA A 3 13.095 -8.917 -1.869 1.00 0.00 H new ATOM 0 HA ALA A 3 14.134 -7.074 -3.758 1.00 0.00 H new ATOM 0 HB1 ALA A 3 12.209 -6.985 -5.246 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.054 -8.543 -5.399 1.00 0.00 H new ATOM 0 HB3 ALA A 3 11.530 -8.444 -4.486 1.00 0.00 H new ATOM 41 N PHE A 4 11.380 -7.445 -1.908 1.00 0.00 N ATOM 42 CA PHE A 4 10.409 -6.904 -0.966 1.00 0.00 C ATOM 43 C PHE A 4 11.014 -6.746 0.432 1.00 0.00 C ATOM 44 O PHE A 4 10.395 -7.095 1.434 1.00 0.00 O ATOM 45 CB PHE A 4 9.207 -7.861 -0.930 1.00 0.00 C ATOM 46 CG PHE A 4 8.579 -8.216 -2.270 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.702 -7.371 -3.393 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.898 -9.441 -2.401 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.188 -7.770 -4.638 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.388 -9.839 -3.648 1.00 0.00 C ATOM 51 CZ PHE A 4 7.535 -9.005 -4.767 1.00 0.00 C ATOM 0 H PHE A 4 11.206 -8.431 -2.102 1.00 0.00 H new ATOM 0 HA PHE A 4 10.097 -5.911 -1.289 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.522 -8.785 -0.446 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.437 -7.417 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.193 -6.414 -3.295 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.767 -10.078 -1.539 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.296 -7.125 -5.497 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.882 -10.788 -3.746 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.146 -9.313 -5.726 1.00 0.00 H new ATOM 61 N VAL A 5 12.228 -6.207 0.480 1.00 0.00 N ATOM 62 CA VAL A 5 12.996 -5.943 1.675 1.00 0.00 C ATOM 63 C VAL A 5 13.825 -4.699 1.362 1.00 0.00 C ATOM 64 O VAL A 5 14.841 -4.787 0.667 1.00 0.00 O ATOM 65 CB VAL A 5 13.819 -7.193 2.045 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.802 -7.684 0.972 1.00 0.00 C ATOM 67 CG2 VAL A 5 14.571 -6.967 3.363 1.00 0.00 C ATOM 0 H VAL A 5 12.724 -5.930 -0.367 1.00 0.00 H new ATOM 0 HA VAL A 5 12.389 -5.743 2.558 1.00 0.00 H new ATOM 0 HB VAL A 5 13.078 -7.986 2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.327 -8.567 1.336 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.254 -7.937 0.065 1.00 0.00 H new ATOM 0 HG13 VAL A 5 15.524 -6.897 0.752 1.00 0.00 H new ATOM 0 HG21 VAL A 5 15.147 -7.858 3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 5 15.245 -6.117 3.256 1.00 0.00 H new ATOM 0 HG23 VAL A 5 13.856 -6.765 4.160 1.00 0.00 H new ATOM 77 N GLY A 6 13.343 -3.524 1.767 1.00 0.00 N ATOM 78 CA GLY A 6 14.032 -2.258 1.564 1.00 0.00 C ATOM 79 C GLY A 6 13.047 -1.163 1.172 1.00 0.00 C ATOM 80 O GLY A 6 11.851 -1.279 1.436 1.00 0.00 O ATOM 0 H GLY A 6 12.451 -3.428 2.251 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.555 -1.973 2.477 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.787 -2.370 0.786 1.00 0.00 H new ATOM 84 N THR A 7 13.548 -0.107 0.529 1.00 0.00 N ATOM 85 CA THR A 7 12.809 1.124 0.307 1.00 0.00 C ATOM 86 C THR A 7 12.933 1.556 -1.147 1.00 0.00 C ATOM 87 O THR A 7 14.009 1.444 -1.741 1.00 0.00 O ATOM 88 CB THR A 7 13.324 2.205 1.268 1.00 0.00 C ATOM 89 OG1 THR A 7 13.393 1.667 2.576 1.00 0.00 O ATOM 90 CG2 THR A 7 12.408 3.433 1.260 1.00 0.00 C ATOM 0 H THR A 7 14.493 -0.089 0.145 1.00 0.00 H new ATOM 0 HA THR A 7 11.750 0.963 0.509 1.00 0.00 H new ATOM 0 HB THR A 7 14.314 2.521 0.940 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.723 2.352 3.194 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.797 4.182 1.950 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.369 3.851 0.254 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.405 3.141 1.570 1.00 0.00 H new ATOM 98 N TRP A 8 11.828 2.055 -1.706 1.00 0.00 N ATOM 99 CA TRP A 8 11.703 2.478 -3.087 1.00 0.00 C ATOM 100 C TRP A 8 11.179 3.917 -3.137 1.00 0.00 C ATOM 101 O TRP A 8 10.648 4.421 -2.141 1.00 0.00 O ATOM 102 CB TRP A 8 10.779 1.517 -3.847 1.00 0.00 C ATOM 103 CG TRP A 8 10.928 0.041 -3.605 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.602 -0.600 -2.459 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.341 -1.007 -4.537 1.00 0.00 C ATOM 106 NE1 TRP A 8 10.788 -1.957 -2.610 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.237 -2.266 -3.874 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.762 -1.032 -5.885 1.00 0.00 C ATOM 109 CZ2 TRP A 8 11.533 -3.479 -4.510 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.116 -2.240 -6.517 1.00 0.00 C ATOM 111 CH2 TRP A 8 11.990 -3.462 -5.835 1.00 0.00 C ATOM 0 H TRP A 8 10.963 2.177 -1.179 1.00 0.00 H new ATOM 0 HA TRP A 8 12.680 2.454 -3.570 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.750 1.790 -3.612 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.920 1.695 -4.913 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.248 -0.119 -1.559 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.615 -2.646 -1.878 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.813 -0.108 -6.441 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 11.411 -4.415 -3.986 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.486 -2.227 -7.531 1.00 0.00 H new ATOM 0 HH2 TRP A 8 12.245 -4.387 -6.331 1.00 0.00 H new ATOM 122 N LYS A 9 11.360 4.584 -4.281 1.00 0.00 N ATOM 123 CA LYS A 9 10.833 5.918 -4.553 1.00 0.00 C ATOM 124 C LYS A 9 10.065 5.872 -5.872 1.00 0.00 C ATOM 125 O LYS A 9 10.508 5.189 -6.796 1.00 0.00 O ATOM 126 CB LYS A 9 11.968 6.959 -4.536 1.00 0.00 C ATOM 127 CG LYS A 9 12.912 7.003 -5.755 1.00 0.00 C ATOM 128 CD LYS A 9 12.333 7.848 -6.908 1.00 0.00 C ATOM 129 CE LYS A 9 13.380 8.524 -7.808 1.00 0.00 C ATOM 130 NZ LYS A 9 13.936 7.623 -8.837 1.00 0.00 N ATOM 0 H LYS A 9 11.891 4.198 -5.061 1.00 0.00 H new ATOM 0 HA LYS A 9 10.138 6.231 -3.774 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.518 7.945 -4.423 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.574 6.782 -3.648 1.00 0.00 H new ATOM 0 HG2 LYS A 9 13.875 7.415 -5.452 1.00 0.00 H new ATOM 0 HG3 LYS A 9 13.096 5.988 -6.107 1.00 0.00 H new ATOM 0 HD2 LYS A 9 11.703 7.208 -7.526 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.688 8.618 -6.485 1.00 0.00 H new ATOM 0 HE2 LYS A 9 12.926 9.386 -8.297 1.00 0.00 H new ATOM 0 HE3 LYS A 9 14.193 8.901 -7.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.266 8.184 -9.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.734 7.090 -8.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 13.200 6.960 -9.152 1.00 0.00 H new ATOM 144 N LEU A 10 8.910 6.540 -5.956 1.00 0.00 N ATOM 145 CA LEU A 10 8.075 6.499 -7.153 1.00 0.00 C ATOM 146 C LEU A 10 8.763 7.206 -8.328 1.00 0.00 C ATOM 147 O LEU A 10 9.464 8.197 -8.118 1.00 0.00 O ATOM 148 CB LEU A 10 6.705 7.102 -6.828 1.00 0.00 C ATOM 149 CG LEU A 10 5.761 7.116 -8.044 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.327 6.720 -7.673 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.776 8.506 -8.690 1.00 0.00 C ATOM 0 H LEU A 10 8.534 7.117 -5.204 1.00 0.00 H new ATOM 0 HA LEU A 10 7.927 5.465 -7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.244 6.533 -6.021 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.838 8.121 -6.464 1.00 0.00 H new ATOM 0 HG LEU A 10 6.124 6.373 -8.754 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.700 6.745 -8.565 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.324 5.713 -7.256 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.936 7.420 -6.935 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.107 8.514 -9.551 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.443 9.248 -7.964 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.789 8.745 -9.015 1.00 0.00 H new ATOM 163 N VAL A 11 8.562 6.707 -9.555 1.00 0.00 N ATOM 164 CA VAL A 11 9.103 7.290 -10.781 1.00 0.00 C ATOM 165 C VAL A 11 8.023 7.634 -11.826 1.00 0.00 C ATOM 166 O VAL A 11 8.193 8.625 -12.532 1.00 0.00 O ATOM 167 CB VAL A 11 10.261 6.423 -11.314 1.00 0.00 C ATOM 168 CG1 VAL A 11 9.808 5.044 -11.803 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.036 7.140 -12.428 1.00 0.00 C ATOM 0 H VAL A 11 8.006 5.868 -9.722 1.00 0.00 H new ATOM 0 HA VAL A 11 9.525 8.265 -10.537 1.00 0.00 H new ATOM 0 HB VAL A 11 10.922 6.266 -10.461 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.671 4.485 -12.165 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.343 4.501 -10.980 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.088 5.163 -12.612 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.845 6.499 -12.779 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.362 7.361 -13.256 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.452 8.070 -12.041 1.00 0.00 H new ATOM 179 N ASP A 12 6.916 6.877 -11.922 1.00 0.00 N ATOM 180 CA ASP A 12 5.755 7.249 -12.746 1.00 0.00 C ATOM 181 C ASP A 12 4.485 7.056 -11.918 1.00 0.00 C ATOM 182 O ASP A 12 4.475 6.295 -10.949 1.00 0.00 O ATOM 183 CB ASP A 12 5.715 6.465 -14.068 1.00 0.00 C ATOM 184 CG ASP A 12 4.706 6.955 -15.109 1.00 0.00 C ATOM 185 OD1 ASP A 12 3.523 7.241 -14.786 1.00 0.00 O ATOM 186 OD2 ASP A 12 5.061 6.929 -16.306 1.00 0.00 O ATOM 0 H ASP A 12 6.802 5.991 -11.430 1.00 0.00 H new ATOM 0 HA ASP A 12 5.835 8.298 -13.031 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.709 6.493 -14.514 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.496 5.421 -13.842 1.00 0.00 H new ATOM 191 N SER A 13 3.453 7.817 -12.278 1.00 0.00 N ATOM 192 CA SER A 13 2.245 8.082 -11.521 1.00 0.00 C ATOM 193 C SER A 13 1.144 8.658 -12.429 1.00 0.00 C ATOM 194 O SER A 13 0.262 9.368 -11.938 1.00 0.00 O ATOM 195 CB SER A 13 2.607 9.042 -10.372 1.00 0.00 C ATOM 196 OG SER A 13 1.486 9.446 -9.620 1.00 0.00 O ATOM 0 H SER A 13 3.446 8.298 -13.177 1.00 0.00 H new ATOM 0 HA SER A 13 1.845 7.157 -11.105 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.325 8.555 -9.712 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.099 9.923 -10.783 1.00 0.00 H new ATOM 0 HG SER A 13 0.839 9.888 -10.209 1.00 0.00 H new ATOM 202 N LYS A 14 1.138 8.358 -13.734 1.00 0.00 N ATOM 203 CA LYS A 14 0.053 8.860 -14.583 1.00 0.00 C ATOM 204 C LYS A 14 -1.310 8.391 -14.046 1.00 0.00 C ATOM 205 O LYS A 14 -1.393 7.310 -13.462 1.00 0.00 O ATOM 206 CB LYS A 14 0.271 8.479 -16.054 1.00 0.00 C ATOM 207 CG LYS A 14 0.009 6.994 -16.336 1.00 0.00 C ATOM 208 CD LYS A 14 0.352 6.602 -17.783 1.00 0.00 C ATOM 209 CE LYS A 14 1.816 6.860 -18.173 1.00 0.00 C ATOM 210 NZ LYS A 14 2.746 6.367 -17.142 1.00 0.00 N ATOM 0 H LYS A 14 1.842 7.793 -14.209 1.00 0.00 H new ATOM 0 HA LYS A 14 0.058 9.949 -14.546 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.385 9.083 -16.681 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.295 8.722 -16.338 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.598 6.387 -15.649 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.040 6.769 -16.141 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.131 5.544 -17.924 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.297 7.156 -18.462 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.032 6.371 -19.123 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.971 7.929 -18.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.723 6.449 -17.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.637 6.933 -16.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.535 5.370 -16.933 1.00 0.00 H new ATOM 224 N ASN A 15 -2.359 9.204 -14.205 1.00 0.00 N ATOM 225 CA ASN A 15 -3.741 8.894 -13.818 1.00 0.00 C ATOM 226 C ASN A 15 -3.958 8.774 -12.304 1.00 0.00 C ATOM 227 O ASN A 15 -5.054 8.415 -11.884 1.00 0.00 O ATOM 228 CB ASN A 15 -4.264 7.625 -14.518 1.00 0.00 C ATOM 229 CG ASN A 15 -4.490 7.804 -16.013 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.535 7.888 -16.781 1.00 0.00 O ATOM 231 ND2 ASN A 15 -5.749 7.862 -16.435 1.00 0.00 N ATOM 0 H ASN A 15 -2.267 10.130 -14.622 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.316 9.757 -14.154 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.553 6.814 -14.361 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.201 7.322 -14.051 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.949 7.980 -17.428 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.515 7.788 -15.766 1.00 0.00 H new ATOM 238 N PHE A 16 -2.963 9.052 -11.451 1.00 0.00 N ATOM 239 CA PHE A 16 -3.145 8.879 -10.005 1.00 0.00 C ATOM 240 C PHE A 16 -4.325 9.716 -9.482 1.00 0.00 C ATOM 241 O PHE A 16 -5.079 9.255 -8.626 1.00 0.00 O ATOM 242 CB PHE A 16 -1.842 9.186 -9.249 1.00 0.00 C ATOM 243 CG PHE A 16 -1.549 8.300 -8.049 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.305 8.442 -6.874 1.00 0.00 C ATOM 245 CD2 PHE A 16 -0.386 7.505 -8.025 1.00 0.00 C ATOM 246 CE1 PHE A 16 -1.944 7.738 -5.711 1.00 0.00 C ATOM 247 CE2 PHE A 16 0.026 6.883 -6.835 1.00 0.00 C ATOM 248 CZ PHE A 16 -0.770 6.973 -5.684 1.00 0.00 C ATOM 0 H PHE A 16 -2.042 9.391 -11.730 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.393 7.834 -9.819 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.010 9.104 -9.949 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.875 10.222 -8.912 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.166 9.094 -6.863 1.00 0.00 H new ATOM 0 HD2 PHE A 16 0.192 7.373 -8.927 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.574 7.787 -4.835 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.956 6.335 -6.806 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.480 6.456 -4.782 1.00 0.00 H new ATOM 258 N ASP A 17 -4.479 10.938 -10.006 1.00 0.00 N ATOM 259 CA ASP A 17 -5.583 11.837 -9.690 1.00 0.00 C ATOM 260 C ASP A 17 -6.924 11.174 -10.037 1.00 0.00 C ATOM 261 O ASP A 17 -7.671 10.764 -9.143 1.00 0.00 O ATOM 262 CB ASP A 17 -5.361 13.166 -10.432 1.00 0.00 C ATOM 263 CG ASP A 17 -6.430 14.200 -10.111 1.00 0.00 C ATOM 264 OD1 ASP A 17 -7.633 13.894 -10.217 1.00 0.00 O ATOM 265 OD2 ASP A 17 -6.065 15.320 -9.699 1.00 0.00 O ATOM 0 H ASP A 17 -3.821 11.334 -10.677 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.615 12.050 -8.621 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.382 13.566 -10.168 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.350 12.981 -11.506 1.00 0.00 H new ATOM 270 N ASP A 18 -7.156 11.024 -11.347 1.00 0.00 N ATOM 271 CA ASP A 18 -8.241 10.286 -11.988 1.00 0.00 C ATOM 272 C ASP A 18 -8.677 9.095 -11.135 1.00 0.00 C ATOM 273 O ASP A 18 -9.821 9.019 -10.691 1.00 0.00 O ATOM 274 CB ASP A 18 -7.746 9.874 -13.389 1.00 0.00 C ATOM 275 CG ASP A 18 -8.427 8.638 -13.963 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.659 8.538 -13.806 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.688 7.820 -14.556 1.00 0.00 O ATOM 0 H ASP A 18 -6.538 11.451 -12.037 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.132 10.905 -12.089 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.899 10.708 -14.074 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.672 9.693 -13.342 1.00 0.00 H new ATOM 282 N TYR A 19 -7.726 8.209 -10.838 1.00 0.00 N ATOM 283 CA TYR A 19 -7.943 7.030 -10.015 1.00 0.00 C ATOM 284 C TYR A 19 -8.746 7.336 -8.744 1.00 0.00 C ATOM 285 O TYR A 19 -9.761 6.697 -8.462 1.00 0.00 O ATOM 286 CB TYR A 19 -6.582 6.412 -9.663 1.00 0.00 C ATOM 287 CG TYR A 19 -6.541 4.916 -9.812 1.00 0.00 C ATOM 288 CD1 TYR A 19 -6.237 4.354 -11.063 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.776 4.088 -8.703 1.00 0.00 C ATOM 290 CE1 TYR A 19 -6.106 2.965 -11.183 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.690 2.695 -8.838 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.324 2.142 -10.073 1.00 0.00 C ATOM 293 OH TYR A 19 -6.095 0.815 -10.197 1.00 0.00 O ATOM 0 H TYR A 19 -6.766 8.297 -11.172 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.540 6.321 -10.588 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.817 6.853 -10.301 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.329 6.673 -8.635 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.105 4.989 -11.927 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.023 4.524 -7.746 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -5.836 2.529 -12.133 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.904 2.053 -7.997 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.585 0.332 -9.500 1.00 0.00 H new ATOM 303 N MET A 20 -8.278 8.305 -7.950 1.00 0.00 N ATOM 304 CA MET A 20 -8.928 8.662 -6.696 1.00 0.00 C ATOM 305 C MET A 20 -10.261 9.347 -6.970 1.00 0.00 C ATOM 306 O MET A 20 -11.259 9.067 -6.290 1.00 0.00 O ATOM 307 CB MET A 20 -8.006 9.545 -5.846 1.00 0.00 C ATOM 308 CG MET A 20 -7.001 8.666 -5.099 1.00 0.00 C ATOM 309 SD MET A 20 -5.710 7.943 -6.122 1.00 0.00 S ATOM 310 CE MET A 20 -5.064 6.772 -4.921 1.00 0.00 C ATOM 0 H MET A 20 -7.446 8.856 -8.160 1.00 0.00 H new ATOM 0 HA MET A 20 -9.129 7.753 -6.129 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.480 10.257 -6.482 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.595 10.126 -5.136 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.532 9.262 -4.317 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.544 7.861 -4.604 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.264 6.188 -5.376 1.00 0.00 H new ATOM 0 HE2 MET A 20 -4.673 7.313 -4.059 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.863 6.104 -4.598 1.00 0.00 H new ATOM 320 N LYS A 21 -10.277 10.213 -7.984 1.00 0.00 N ATOM 321 CA LYS A 21 -11.459 10.883 -8.505 1.00 0.00 C ATOM 322 C LYS A 21 -12.329 9.903 -9.317 1.00 0.00 C ATOM 323 O LYS A 21 -12.795 10.232 -10.406 1.00 0.00 O ATOM 324 CB LYS A 21 -10.975 12.073 -9.351 1.00 0.00 C ATOM 325 CG LYS A 21 -12.083 13.094 -9.648 1.00 0.00 C ATOM 326 CD LYS A 21 -12.185 13.340 -11.158 1.00 0.00 C ATOM 327 CE LYS A 21 -13.295 14.353 -11.469 1.00 0.00 C ATOM 328 NZ LYS A 21 -13.563 14.444 -12.919 1.00 0.00 N ATOM 0 H LYS A 21 -9.427 10.475 -8.483 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.093 11.246 -7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.159 12.573 -8.829 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.571 11.701 -10.292 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.036 12.728 -9.266 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -11.872 14.031 -9.133 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.232 13.710 -11.536 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.389 12.400 -11.672 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.208 14.064 -10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -13.009 15.334 -11.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.319 15.138 -13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.699 14.744 -13.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.861 13.514 -13.276 1.00 0.00 H new ATOM 342 N SER A 22 -12.557 8.703 -8.776 1.00 0.00 N ATOM 343 CA SER A 22 -13.294 7.603 -9.385 1.00 0.00 C ATOM 344 C SER A 22 -13.499 6.503 -8.344 1.00 0.00 C ATOM 345 O SER A 22 -14.617 6.032 -8.161 1.00 0.00 O ATOM 346 CB SER A 22 -12.567 7.058 -10.621 1.00 0.00 C ATOM 347 OG SER A 22 -12.828 7.878 -11.738 1.00 0.00 O ATOM 0 H SER A 22 -12.210 8.464 -7.847 1.00 0.00 H new ATOM 0 HA SER A 22 -14.264 7.970 -9.721 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.494 7.017 -10.433 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.894 6.038 -10.824 1.00 0.00 H new ATOM 0 HG SER A 22 -13.002 8.795 -11.438 1.00 0.00 H new ATOM 353 N LEU A 23 -12.439 6.109 -7.626 1.00 0.00 N ATOM 354 CA LEU A 23 -12.600 5.252 -6.451 1.00 0.00 C ATOM 355 C LEU A 23 -13.510 5.914 -5.412 1.00 0.00 C ATOM 356 O LEU A 23 -14.238 5.231 -4.691 1.00 0.00 O ATOM 357 CB LEU A 23 -11.238 4.938 -5.814 1.00 0.00 C ATOM 358 CG LEU A 23 -10.359 3.976 -6.629 1.00 0.00 C ATOM 359 CD1 LEU A 23 -9.011 3.833 -5.915 1.00 0.00 C ATOM 360 CD2 LEU A 23 -11.009 2.595 -6.760 1.00 0.00 C ATOM 0 H LEU A 23 -11.475 6.367 -7.836 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.061 4.321 -6.783 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.695 5.872 -5.670 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.404 4.509 -4.826 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.231 4.382 -7.632 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.371 3.153 -6.478 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.531 4.809 -5.845 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.170 3.435 -4.913 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.360 1.941 -7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.159 2.168 -5.768 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.971 2.692 -7.263 1.00 0.00 H new ATOM 372 N GLY A 24 -13.440 7.244 -5.310 1.00 0.00 N ATOM 373 CA GLY A 24 -14.129 8.001 -4.279 1.00 0.00 C ATOM 374 C GLY A 24 -13.176 8.238 -3.114 1.00 0.00 C ATOM 375 O GLY A 24 -13.540 8.055 -1.952 1.00 0.00 O ATOM 0 H GLY A 24 -12.897 7.824 -5.950 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.476 8.953 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -15.011 7.458 -3.939 1.00 0.00 H new ATOM 379 N VAL A 25 -11.947 8.626 -3.456 1.00 0.00 N ATOM 380 CA VAL A 25 -10.985 9.259 -2.566 1.00 0.00 C ATOM 381 C VAL A 25 -10.904 10.748 -2.934 1.00 0.00 C ATOM 382 O VAL A 25 -10.636 11.573 -2.069 1.00 0.00 O ATOM 383 CB VAL A 25 -9.631 8.550 -2.718 1.00 0.00 C ATOM 384 CG1 VAL A 25 -8.499 9.284 -1.990 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.680 7.116 -2.189 1.00 0.00 C ATOM 0 H VAL A 25 -11.584 8.501 -4.401 1.00 0.00 H new ATOM 0 HA VAL A 25 -11.286 9.179 -1.521 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.427 8.547 -3.789 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.564 8.741 -2.130 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.398 10.291 -2.396 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -8.729 9.343 -0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.703 6.648 -2.314 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.944 7.127 -1.132 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.428 6.549 -2.744 1.00 0.00 H new ATOM 395 N GLY A 26 -11.136 11.070 -4.218 1.00 0.00 N ATOM 396 CA GLY A 26 -11.177 12.403 -4.810 1.00 0.00 C ATOM 397 C GLY A 26 -11.435 13.539 -3.819 1.00 0.00 C ATOM 398 O GLY A 26 -12.513 13.636 -3.239 1.00 0.00 O ATOM 0 H GLY A 26 -11.312 10.346 -4.915 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.230 12.590 -5.316 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -11.955 12.422 -5.573 1.00 0.00 H new ATOM 402 N PHE A 27 -10.438 14.411 -3.657 1.00 0.00 N ATOM 403 CA PHE A 27 -10.411 15.477 -2.667 1.00 0.00 C ATOM 404 C PHE A 27 -9.343 16.501 -3.066 1.00 0.00 C ATOM 405 O PHE A 27 -8.716 16.359 -4.120 1.00 0.00 O ATOM 406 CB PHE A 27 -10.217 14.895 -1.250 1.00 0.00 C ATOM 407 CG PHE A 27 -9.011 14.010 -0.937 1.00 0.00 C ATOM 408 CD1 PHE A 27 -8.031 13.678 -1.894 1.00 0.00 C ATOM 409 CD2 PHE A 27 -8.955 13.403 0.332 1.00 0.00 C ATOM 410 CE1 PHE A 27 -7.025 12.743 -1.592 1.00 0.00 C ATOM 411 CE2 PHE A 27 -7.944 12.478 0.639 1.00 0.00 C ATOM 412 CZ PHE A 27 -6.978 12.146 -0.324 1.00 0.00 C ATOM 0 H PHE A 27 -9.598 14.389 -4.236 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.366 16.001 -2.640 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -10.188 15.736 -0.557 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.111 14.318 -1.013 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.053 14.146 -2.867 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -9.697 13.651 1.077 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.288 12.484 -2.338 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -7.910 12.021 1.617 1.00 0.00 H new ATOM 0 HZ PHE A 27 -6.201 11.433 -0.089 1.00 0.00 H new ATOM 422 N ALA A 28 -9.123 17.532 -2.248 1.00 0.00 N ATOM 423 CA ALA A 28 -8.109 18.548 -2.499 1.00 0.00 C ATOM 424 C ALA A 28 -6.758 18.083 -1.948 1.00 0.00 C ATOM 425 O ALA A 28 -6.231 18.668 -1.007 1.00 0.00 O ATOM 426 CB ALA A 28 -8.557 19.875 -1.880 1.00 0.00 C ATOM 0 H ALA A 28 -9.649 17.683 -1.387 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.987 18.702 -3.571 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.800 20.637 -2.066 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.502 20.185 -2.327 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -8.688 19.749 -0.805 1.00 0.00 H new ATOM 432 N THR A 29 -6.201 17.013 -2.520 1.00 0.00 N ATOM 433 CA THR A 29 -4.878 16.497 -2.152 1.00 0.00 C ATOM 434 C THR A 29 -4.278 15.733 -3.333 1.00 0.00 C ATOM 435 O THR A 29 -3.163 16.022 -3.759 1.00 0.00 O ATOM 436 CB THR A 29 -4.961 15.659 -0.860 1.00 0.00 C ATOM 437 OG1 THR A 29 -5.099 16.507 0.261 1.00 0.00 O ATOM 438 CG2 THR A 29 -3.718 14.795 -0.620 1.00 0.00 C ATOM 0 H THR A 29 -6.658 16.476 -3.257 1.00 0.00 H new ATOM 0 HA THR A 29 -4.204 17.324 -1.930 1.00 0.00 H new ATOM 0 HB THR A 29 -5.825 15.006 -0.987 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.441 17.379 -0.028 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.840 14.231 0.305 1.00 0.00 H new ATOM 0 HG22 THR A 29 -3.589 14.104 -1.453 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.840 15.435 -0.541 1.00 0.00 H new ATOM 446 N ARG A 30 -5.039 14.792 -3.902 1.00 0.00 N ATOM 447 CA ARG A 30 -4.674 14.036 -5.103 1.00 0.00 C ATOM 448 C ARG A 30 -4.066 14.905 -6.213 1.00 0.00 C ATOM 449 O ARG A 30 -3.154 14.468 -6.910 1.00 0.00 O ATOM 450 CB ARG A 30 -5.866 13.193 -5.598 1.00 0.00 C ATOM 451 CG ARG A 30 -7.215 13.917 -5.695 1.00 0.00 C ATOM 452 CD ARG A 30 -7.458 14.668 -7.003 1.00 0.00 C ATOM 453 NE ARG A 30 -8.382 15.793 -6.801 1.00 0.00 N ATOM 454 CZ ARG A 30 -8.809 16.620 -7.770 1.00 0.00 C ATOM 455 NH1 ARG A 30 -8.341 16.519 -9.015 1.00 0.00 N ATOM 456 NH2 ARG A 30 -9.707 17.566 -7.472 1.00 0.00 N ATOM 0 H ARG A 30 -5.951 14.529 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 30 -3.874 13.353 -4.816 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.619 12.796 -6.583 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -5.983 12.340 -4.930 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -8.012 13.186 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -7.290 14.625 -4.869 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -6.511 15.037 -7.396 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -7.868 13.985 -7.748 1.00 0.00 H new ATOM 0 HE ARG A 30 -8.725 15.958 -5.855 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -7.648 15.806 -9.243 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -8.676 17.155 -9.739 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -10.059 17.653 -6.519 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -10.040 18.200 -8.198 1.00 0.00 H new ATOM 470 N GLN A 31 -4.540 16.146 -6.346 1.00 0.00 N ATOM 471 CA GLN A 31 -4.047 17.107 -7.324 1.00 0.00 C ATOM 472 C GLN A 31 -2.548 17.404 -7.161 1.00 0.00 C ATOM 473 O GLN A 31 -1.866 17.668 -8.149 1.00 0.00 O ATOM 474 CB GLN A 31 -4.917 18.372 -7.284 1.00 0.00 C ATOM 475 CG GLN A 31 -4.946 19.060 -5.910 1.00 0.00 C ATOM 476 CD GLN A 31 -5.898 20.251 -5.894 1.00 0.00 C ATOM 477 OE1 GLN A 31 -5.479 21.390 -5.734 1.00 0.00 O ATOM 478 NE2 GLN A 31 -7.195 19.998 -6.049 1.00 0.00 N ATOM 0 H GLN A 31 -5.292 16.514 -5.763 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.134 16.665 -8.317 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -4.548 19.079 -8.027 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -5.936 18.111 -7.571 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -5.250 18.341 -5.150 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.942 19.394 -5.649 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -7.515 19.039 -6.181 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -7.869 20.763 -6.036 1.00 0.00 H new ATOM 487 N VAL A 32 -2.026 17.329 -5.933 1.00 0.00 N ATOM 488 CA VAL A 32 -0.592 17.351 -5.647 1.00 0.00 C ATOM 489 C VAL A 32 -0.053 15.914 -5.610 1.00 0.00 C ATOM 490 O VAL A 32 1.070 15.655 -6.058 1.00 0.00 O ATOM 491 CB VAL A 32 -0.336 18.090 -4.320 1.00 0.00 C ATOM 492 CG1 VAL A 32 1.157 18.080 -3.965 1.00 0.00 C ATOM 493 CG2 VAL A 32 -0.808 19.549 -4.396 1.00 0.00 C ATOM 0 H VAL A 32 -2.602 17.250 -5.095 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.063 17.889 -6.434 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.901 17.565 -3.550 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.311 18.608 -3.024 1.00 0.00 H new ATOM 0 HG12 VAL A 32 1.500 17.050 -3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.722 18.574 -4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.614 20.044 -3.445 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.269 20.065 -5.190 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.877 19.575 -4.607 1.00 0.00 H new ATOM 503 N GLY A 33 -0.856 14.990 -5.064 1.00 0.00 N ATOM 504 CA GLY A 33 -0.597 13.559 -4.936 1.00 0.00 C ATOM 505 C GLY A 33 -0.502 12.850 -6.290 1.00 0.00 C ATOM 506 O GLY A 33 -1.313 11.989 -6.621 1.00 0.00 O ATOM 0 H GLY A 33 -1.764 15.246 -4.675 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.333 13.410 -4.387 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.392 13.102 -4.347 1.00 0.00 H new ATOM 510 N ASN A 34 0.526 13.218 -7.050 1.00 0.00 N ATOM 511 CA ASN A 34 0.882 12.748 -8.382 1.00 0.00 C ATOM 512 C ASN A 34 2.166 13.462 -8.818 1.00 0.00 C ATOM 513 O ASN A 34 3.025 12.853 -9.449 1.00 0.00 O ATOM 514 CB ASN A 34 -0.240 12.978 -9.410 1.00 0.00 C ATOM 515 CG ASN A 34 -0.476 14.457 -9.691 1.00 0.00 C ATOM 516 OD1 ASN A 34 0.132 15.031 -10.588 1.00 0.00 O ATOM 517 ND2 ASN A 34 -1.336 15.093 -8.908 1.00 0.00 N ATOM 0 H ASN A 34 1.190 13.917 -6.717 1.00 0.00 H new ATOM 0 HA ASN A 34 1.038 11.670 -8.338 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.014 12.470 -10.340 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -1.163 12.529 -9.043 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.508 16.089 -9.043 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.826 14.586 -8.171 1.00 0.00 H new ATOM 524 N MET A 35 2.295 14.749 -8.464 1.00 0.00 N ATOM 525 CA MET A 35 3.450 15.574 -8.784 1.00 0.00 C ATOM 526 C MET A 35 4.499 15.489 -7.672 1.00 0.00 C ATOM 527 O MET A 35 5.689 15.651 -7.940 1.00 0.00 O ATOM 528 CB MET A 35 2.983 17.016 -9.020 1.00 0.00 C ATOM 529 CG MET A 35 4.120 17.902 -9.541 1.00 0.00 C ATOM 530 SD MET A 35 3.598 19.553 -10.077 1.00 0.00 S ATOM 531 CE MET A 35 5.208 20.222 -10.571 1.00 0.00 C ATOM 0 H MET A 35 1.579 15.248 -7.936 1.00 0.00 H new ATOM 0 HA MET A 35 3.925 15.209 -9.695 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.161 17.020 -9.736 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.596 17.430 -8.089 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.870 18.008 -8.757 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.603 17.398 -10.378 1.00 0.00 H new ATOM 0 HE1 MET A 35 5.083 21.243 -10.932 1.00 0.00 H new ATOM 0 HE2 MET A 35 5.881 20.221 -9.714 1.00 0.00 H new ATOM 0 HE3 MET A 35 5.630 19.606 -11.365 1.00 0.00 H new ATOM 541 N THR A 36 4.067 15.276 -6.423 1.00 0.00 N ATOM 542 CA THR A 36 5.000 15.030 -5.328 1.00 0.00 C ATOM 543 C THR A 36 5.777 13.721 -5.546 1.00 0.00 C ATOM 544 O THR A 36 5.592 13.025 -6.543 1.00 0.00 O ATOM 545 CB THR A 36 4.279 15.088 -3.972 1.00 0.00 C ATOM 546 OG1 THR A 36 5.227 15.050 -2.924 1.00 0.00 O ATOM 547 CG2 THR A 36 3.290 13.938 -3.763 1.00 0.00 C ATOM 0 H THR A 36 3.084 15.270 -6.151 1.00 0.00 H new ATOM 0 HA THR A 36 5.744 15.826 -5.316 1.00 0.00 H new ATOM 0 HB THR A 36 3.715 16.020 -3.967 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.989 15.623 -3.151 1.00 0.00 H new ATOM 0 HG21 THR A 36 2.816 14.039 -2.787 1.00 0.00 H new ATOM 0 HG22 THR A 36 2.528 13.968 -4.542 1.00 0.00 H new ATOM 0 HG23 THR A 36 3.822 12.988 -3.812 1.00 0.00 H new ATOM 555 N LYS A 37 6.655 13.389 -4.599 1.00 0.00 N ATOM 556 CA LYS A 37 7.530 12.224 -4.649 1.00 0.00 C ATOM 557 C LYS A 37 7.109 11.205 -3.586 1.00 0.00 C ATOM 558 O LYS A 37 7.721 11.165 -2.520 1.00 0.00 O ATOM 559 CB LYS A 37 8.984 12.672 -4.436 1.00 0.00 C ATOM 560 CG LYS A 37 9.449 13.625 -5.542 1.00 0.00 C ATOM 561 CD LYS A 37 10.934 13.958 -5.340 1.00 0.00 C ATOM 562 CE LYS A 37 11.435 15.035 -6.312 1.00 0.00 C ATOM 563 NZ LYS A 37 11.293 14.634 -7.727 1.00 0.00 N ATOM 0 H LYS A 37 6.778 13.942 -3.751 1.00 0.00 H new ATOM 0 HA LYS A 37 7.450 11.745 -5.625 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.075 13.165 -3.468 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.635 11.798 -4.411 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.298 13.166 -6.519 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.855 14.539 -5.523 1.00 0.00 H new ATOM 0 HD2 LYS A 37 11.090 14.297 -4.316 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.527 13.052 -5.470 1.00 0.00 H new ATOM 0 HE2 LYS A 37 10.881 15.958 -6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 37 12.483 15.249 -6.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.677 15.382 -8.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 11.815 13.750 -7.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.287 14.488 -7.947 1.00 0.00 H new ATOM 577 N PRO A 38 6.081 10.382 -3.837 1.00 0.00 N ATOM 578 CA PRO A 38 5.684 9.357 -2.892 1.00 0.00 C ATOM 579 C PRO A 38 6.799 8.317 -2.722 1.00 0.00 C ATOM 580 O PRO A 38 7.496 7.949 -3.674 1.00 0.00 O ATOM 581 CB PRO A 38 4.378 8.770 -3.423 1.00 0.00 C ATOM 582 CG PRO A 38 4.398 9.093 -4.910 1.00 0.00 C ATOM 583 CD PRO A 38 5.228 10.369 -5.015 1.00 0.00 C ATOM 0 HA PRO A 38 5.520 9.757 -1.891 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.326 7.695 -3.250 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.513 9.215 -2.931 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.843 8.282 -5.486 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.390 9.243 -5.297 1.00 0.00 H new ATOM 0 HD2 PRO A 38 5.822 10.375 -5.929 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.588 11.251 -5.045 1.00 0.00 H new ATOM 591 N THR A 39 6.968 7.879 -1.475 1.00 0.00 N ATOM 592 CA THR A 39 8.035 7.012 -1.009 1.00 0.00 C ATOM 593 C THR A 39 7.388 5.771 -0.408 1.00 0.00 C ATOM 594 O THR A 39 6.303 5.878 0.167 1.00 0.00 O ATOM 595 CB THR A 39 8.861 7.769 0.045 1.00 0.00 C ATOM 596 OG1 THR A 39 8.031 8.562 0.877 1.00 0.00 O ATOM 597 CG2 THR A 39 9.858 8.711 -0.633 1.00 0.00 C ATOM 0 H THR A 39 6.325 8.137 -0.726 1.00 0.00 H new ATOM 0 HA THR A 39 8.701 6.718 -1.820 1.00 0.00 H new ATOM 0 HB THR A 39 9.379 7.018 0.641 1.00 0.00 H new ATOM 0 HG1 THR A 39 7.175 8.106 1.015 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.434 9.239 0.127 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.533 8.133 -1.264 1.00 0.00 H new ATOM 0 HG23 THR A 39 9.318 9.433 -1.245 1.00 0.00 H new ATOM 605 N THR A 40 8.035 4.609 -0.537 1.00 0.00 N ATOM 606 CA THR A 40 7.423 3.362 -0.110 1.00 0.00 C ATOM 607 C THR A 40 8.479 2.406 0.447 1.00 0.00 C ATOM 608 O THR A 40 9.393 2.007 -0.275 1.00 0.00 O ATOM 609 CB THR A 40 6.619 2.783 -1.283 1.00 0.00 C ATOM 610 OG1 THR A 40 5.551 3.663 -1.572 1.00 0.00 O ATOM 611 CG2 THR A 40 5.992 1.444 -0.927 1.00 0.00 C ATOM 0 H THR A 40 8.971 4.513 -0.930 1.00 0.00 H new ATOM 0 HA THR A 40 6.727 3.533 0.711 1.00 0.00 H new ATOM 0 HB THR A 40 7.301 2.657 -2.124 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.395 3.682 -2.539 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.431 1.066 -1.782 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.776 0.734 -0.664 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.319 1.571 -0.079 1.00 0.00 H new ATOM 619 N ILE A 41 8.342 2.033 1.725 1.00 0.00 N ATOM 620 CA ILE A 41 9.153 1.001 2.365 1.00 0.00 C ATOM 621 C ILE A 41 8.398 -0.319 2.224 1.00 0.00 C ATOM 622 O ILE A 41 7.220 -0.369 2.572 1.00 0.00 O ATOM 623 CB ILE A 41 9.412 1.347 3.846 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.187 2.669 3.986 1.00 0.00 C ATOM 625 CG2 ILE A 41 10.190 0.212 4.531 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.118 3.268 5.394 1.00 0.00 C ATOM 0 H ILE A 41 7.652 2.449 2.350 1.00 0.00 H new ATOM 0 HA ILE A 41 10.131 0.927 1.889 1.00 0.00 H new ATOM 0 HB ILE A 41 8.444 1.466 4.333 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.231 2.499 3.722 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.791 3.391 3.272 1.00 0.00 H new ATOM 0 HG21 ILE A 41 10.366 0.470 5.575 1.00 0.00 H new ATOM 0 HG22 ILE A 41 9.611 -0.710 4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.146 0.070 4.027 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.685 4.198 5.422 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.079 3.469 5.653 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.541 2.564 6.110 1.00 0.00 H new ATOM 638 N ILE A 42 9.060 -1.371 1.728 1.00 0.00 N ATOM 639 CA ILE A 42 8.550 -2.736 1.718 1.00 0.00 C ATOM 640 C ILE A 42 9.399 -3.537 2.708 1.00 0.00 C ATOM 641 O ILE A 42 10.588 -3.757 2.470 1.00 0.00 O ATOM 642 CB ILE A 42 8.613 -3.352 0.307 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.983 -2.475 -0.787 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.933 -4.726 0.324 1.00 0.00 C ATOM 645 CD1 ILE A 42 6.527 -2.102 -0.520 1.00 0.00 C ATOM 0 H ILE A 42 9.988 -1.288 1.313 1.00 0.00 H new ATOM 0 HA ILE A 42 7.500 -2.751 2.009 1.00 0.00 H new ATOM 0 HB ILE A 42 9.669 -3.440 0.053 1.00 0.00 H new ATOM 0 HG12 ILE A 42 8.569 -1.561 -0.889 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.044 -3.001 -1.740 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.975 -5.165 -0.673 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.447 -5.378 1.030 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.892 -4.613 0.627 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.154 -1.483 -1.336 1.00 0.00 H new ATOM 0 HD12 ILE A 42 5.926 -3.009 -0.449 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.459 -1.547 0.416 1.00 0.00 H new ATOM 657 N GLU A 43 8.792 -3.940 3.824 1.00 0.00 N ATOM 658 CA GLU A 43 9.476 -4.515 4.970 1.00 0.00 C ATOM 659 C GLU A 43 8.925 -5.926 5.208 1.00 0.00 C ATOM 660 O GLU A 43 7.803 -6.097 5.693 1.00 0.00 O ATOM 661 CB GLU A 43 9.267 -3.534 6.131 1.00 0.00 C ATOM 662 CG GLU A 43 9.715 -3.995 7.519 1.00 0.00 C ATOM 663 CD GLU A 43 9.226 -2.977 8.535 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.907 -1.945 8.702 1.00 0.00 O ATOM 665 OE2 GLU A 43 8.091 -3.150 9.028 1.00 0.00 O ATOM 0 H GLU A 43 7.783 -3.871 3.954 1.00 0.00 H new ATOM 0 HA GLU A 43 10.550 -4.643 4.833 1.00 0.00 H new ATOM 0 HB2 GLU A 43 9.796 -2.611 5.894 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.206 -3.290 6.181 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.308 -4.981 7.742 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.801 -4.082 7.559 1.00 0.00 H new ATOM 672 N VAL A 44 9.703 -6.948 4.833 1.00 0.00 N ATOM 673 CA VAL A 44 9.335 -8.338 5.063 1.00 0.00 C ATOM 674 C VAL A 44 9.296 -8.604 6.572 1.00 0.00 C ATOM 675 O VAL A 44 10.321 -8.625 7.251 1.00 0.00 O ATOM 676 CB VAL A 44 10.234 -9.298 4.257 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.692 -9.351 4.723 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.663 -10.721 4.252 1.00 0.00 C ATOM 0 H VAL A 44 10.601 -6.829 4.364 1.00 0.00 H new ATOM 0 HA VAL A 44 8.331 -8.535 4.686 1.00 0.00 H new ATOM 0 HB VAL A 44 10.238 -8.882 3.250 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.248 -10.051 4.099 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.137 -8.359 4.641 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.730 -9.681 5.761 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.319 -11.374 3.676 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.593 -11.089 5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.671 -10.713 3.801 1.00 0.00 H new ATOM 688 N ASN A 45 8.098 -8.805 7.116 1.00 0.00 N ATOM 689 CA ASN A 45 7.886 -9.122 8.519 1.00 0.00 C ATOM 690 C ASN A 45 8.076 -10.630 8.679 1.00 0.00 C ATOM 691 O ASN A 45 7.167 -11.355 9.078 1.00 0.00 O ATOM 692 CB ASN A 45 6.501 -8.620 8.960 1.00 0.00 C ATOM 693 CG ASN A 45 6.520 -7.139 9.341 1.00 0.00 C ATOM 694 OD1 ASN A 45 6.109 -6.782 10.440 1.00 0.00 O ATOM 695 ND2 ASN A 45 7.005 -6.262 8.466 1.00 0.00 N ATOM 0 H ASN A 45 7.232 -8.750 6.580 1.00 0.00 H new ATOM 0 HA ASN A 45 8.602 -8.620 9.170 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.785 -8.777 8.153 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.157 -9.208 9.811 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.040 -5.271 8.704 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.342 -6.581 7.557 1.00 0.00 H new ATOM 702 N GLY A 46 9.281 -11.099 8.341 1.00 0.00 N ATOM 703 CA GLY A 46 9.673 -12.500 8.380 1.00 0.00 C ATOM 704 C GLY A 46 8.792 -13.374 7.487 1.00 0.00 C ATOM 705 O GLY A 46 9.174 -13.714 6.369 1.00 0.00 O ATOM 0 H GLY A 46 10.032 -10.487 8.022 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.712 -12.593 8.064 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.618 -12.862 9.407 1.00 0.00 H new ATOM 709 N ASP A 47 7.620 -13.749 8.001 1.00 0.00 N ATOM 710 CA ASP A 47 6.622 -14.550 7.309 1.00 0.00 C ATOM 711 C ASP A 47 5.716 -13.651 6.460 1.00 0.00 C ATOM 712 O ASP A 47 5.267 -14.058 5.384 1.00 0.00 O ATOM 713 CB ASP A 47 5.831 -15.383 8.339 1.00 0.00 C ATOM 714 CG ASP A 47 4.350 -15.031 8.389 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.018 -13.992 8.996 1.00 0.00 O ATOM 716 OD2 ASP A 47 3.589 -15.778 7.738 1.00 0.00 O ATOM 0 H ASP A 47 7.334 -13.491 8.946 1.00 0.00 H new ATOM 0 HA ASP A 47 7.108 -15.244 6.624 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.938 -16.441 8.099 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.266 -15.234 9.327 1.00 0.00 H new ATOM 721 N THR A 48 5.415 -12.463 6.981 1.00 0.00 N ATOM 722 CA THR A 48 4.475 -11.496 6.444 1.00 0.00 C ATOM 723 C THR A 48 5.270 -10.395 5.743 1.00 0.00 C ATOM 724 O THR A 48 6.498 -10.443 5.695 1.00 0.00 O ATOM 725 CB THR A 48 3.635 -10.942 7.616 1.00 0.00 C ATOM 726 OG1 THR A 48 4.169 -11.330 8.867 1.00 0.00 O ATOM 727 CG2 THR A 48 2.203 -11.462 7.576 1.00 0.00 C ATOM 0 H THR A 48 5.851 -12.135 7.843 1.00 0.00 H new ATOM 0 HA THR A 48 3.798 -11.944 5.717 1.00 0.00 H new ATOM 0 HB THR A 48 3.655 -9.858 7.505 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.917 -12.258 9.056 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.643 -11.051 8.416 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.731 -11.158 6.642 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.209 -12.550 7.642 1.00 0.00 H new ATOM 735 N VAL A 49 4.596 -9.375 5.213 1.00 0.00 N ATOM 736 CA VAL A 49 5.263 -8.218 4.644 1.00 0.00 C ATOM 737 C VAL A 49 4.370 -7.003 4.857 1.00 0.00 C ATOM 738 O VAL A 49 3.147 -7.125 4.836 1.00 0.00 O ATOM 739 CB VAL A 49 5.638 -8.499 3.178 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.455 -9.033 2.367 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.227 -7.264 2.482 1.00 0.00 C ATOM 0 H VAL A 49 3.578 -9.333 5.169 1.00 0.00 H new ATOM 0 HA VAL A 49 6.209 -8.004 5.140 1.00 0.00 H new ATOM 0 HB VAL A 49 6.405 -9.272 3.215 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.771 -9.215 1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.102 -9.965 2.809 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.649 -8.300 2.374 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.476 -7.512 1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.496 -6.456 2.495 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.128 -6.946 3.006 1.00 0.00 H new ATOM 751 N ILE A 50 4.973 -5.843 5.118 1.00 0.00 N ATOM 752 CA ILE A 50 4.241 -4.609 5.342 1.00 0.00 C ATOM 753 C ILE A 50 4.755 -3.567 4.353 1.00 0.00 C ATOM 754 O ILE A 50 5.966 -3.449 4.148 1.00 0.00 O ATOM 755 CB ILE A 50 4.334 -4.225 6.832 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.264 -3.222 7.272 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.704 -3.662 7.198 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.086 -3.224 8.796 1.00 0.00 C ATOM 0 H ILE A 50 5.986 -5.739 5.179 1.00 0.00 H new ATOM 0 HA ILE A 50 3.173 -4.706 5.147 1.00 0.00 H new ATOM 0 HB ILE A 50 4.166 -5.162 7.363 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.541 -2.222 6.938 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.316 -3.466 6.793 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.721 -3.406 8.257 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.471 -4.409 6.993 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.900 -2.768 6.606 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.319 -2.501 9.074 1.00 0.00 H new ATOM 0 HD12 ILE A 50 2.784 -4.218 9.126 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.028 -2.955 9.273 1.00 0.00 H new ATOM 770 N ILE A 51 3.828 -2.869 3.689 1.00 0.00 N ATOM 771 CA ILE A 51 4.128 -1.762 2.795 1.00 0.00 C ATOM 772 C ILE A 51 3.774 -0.479 3.539 1.00 0.00 C ATOM 773 O ILE A 51 2.640 -0.340 3.993 1.00 0.00 O ATOM 774 CB ILE A 51 3.408 -1.924 1.438 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.700 -0.751 0.486 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.902 -2.186 1.529 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.698 0.407 0.516 1.00 0.00 C ATOM 0 H ILE A 51 2.830 -3.067 3.764 1.00 0.00 H new ATOM 0 HA ILE A 51 5.186 -1.733 2.533 1.00 0.00 H new ATOM 0 HB ILE A 51 3.837 -2.835 1.020 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.688 -0.356 0.722 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.746 -1.138 -0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 51 1.489 -2.285 0.525 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.726 -3.106 2.086 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.418 -1.354 2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.007 1.174 -0.195 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.708 0.039 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.665 0.834 1.518 1.00 0.00 H new ATOM 789 N LYS A 52 4.743 0.429 3.692 1.00 0.00 N ATOM 790 CA LYS A 52 4.553 1.711 4.354 1.00 0.00 C ATOM 791 C LYS A 52 4.411 2.790 3.285 1.00 0.00 C ATOM 792 O LYS A 52 5.408 3.215 2.698 1.00 0.00 O ATOM 793 CB LYS A 52 5.710 2.023 5.313 1.00 0.00 C ATOM 794 CG LYS A 52 6.159 0.790 6.106 1.00 0.00 C ATOM 795 CD LYS A 52 7.094 1.210 7.249 1.00 0.00 C ATOM 796 CE LYS A 52 7.790 0.001 7.893 1.00 0.00 C ATOM 797 NZ LYS A 52 6.925 -0.751 8.827 1.00 0.00 N ATOM 0 H LYS A 52 5.694 0.286 3.352 1.00 0.00 H new ATOM 0 HA LYS A 52 3.648 1.677 4.961 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.554 2.414 4.745 1.00 0.00 H new ATOM 0 HB3 LYS A 52 5.403 2.806 6.006 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.290 0.271 6.509 1.00 0.00 H new ATOM 0 HG3 LYS A 52 6.671 0.090 5.446 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.846 1.901 6.868 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.523 1.746 8.007 1.00 0.00 H new ATOM 0 HE2 LYS A 52 8.133 -0.672 7.107 1.00 0.00 H new ATOM 0 HE3 LYS A 52 8.676 0.344 8.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.077 -1.771 8.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.160 -0.489 9.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.928 -0.523 8.637 1.00 0.00 H new ATOM 811 N THR A 53 3.183 3.232 3.030 1.00 0.00 N ATOM 812 CA THR A 53 2.866 4.358 2.172 1.00 0.00 C ATOM 813 C THR A 53 3.258 5.638 2.920 1.00 0.00 C ATOM 814 O THR A 53 2.404 6.399 3.366 1.00 0.00 O ATOM 815 CB THR A 53 1.358 4.307 1.844 1.00 0.00 C ATOM 816 OG1 THR A 53 0.685 3.469 2.759 1.00 0.00 O ATOM 817 CG2 THR A 53 1.054 3.709 0.477 1.00 0.00 C ATOM 0 H THR A 53 2.354 2.796 3.433 1.00 0.00 H new ATOM 0 HA THR A 53 3.412 4.330 1.229 1.00 0.00 H new ATOM 0 HB THR A 53 1.031 5.346 1.884 1.00 0.00 H new ATOM 0 HG1 THR A 53 -0.129 3.915 3.074 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.024 3.704 0.313 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.536 4.306 -0.297 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.432 2.687 0.435 1.00 0.00 H new ATOM 825 N GLN A 54 4.560 5.879 3.083 1.00 0.00 N ATOM 826 CA GLN A 54 5.042 7.087 3.740 1.00 0.00 C ATOM 827 C GLN A 54 4.972 8.275 2.775 1.00 0.00 C ATOM 828 O GLN A 54 5.441 8.187 1.642 1.00 0.00 O ATOM 829 CB GLN A 54 6.431 6.883 4.353 1.00 0.00 C ATOM 830 CG GLN A 54 7.425 6.143 3.447 1.00 0.00 C ATOM 831 CD GLN A 54 8.864 6.254 3.939 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.800 6.127 3.156 1.00 0.00 O ATOM 833 NE2 GLN A 54 9.062 6.486 5.235 1.00 0.00 N ATOM 0 H GLN A 54 5.298 5.250 2.767 1.00 0.00 H new ATOM 0 HA GLN A 54 4.387 7.318 4.580 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.848 7.857 4.609 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.325 6.327 5.285 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.145 5.091 3.390 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.359 6.546 2.436 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.264 6.587 5.863 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.011 6.563 5.600 1.00 0.00 H new ATOM 842 N SER A 55 4.355 9.382 3.207 1.00 0.00 N ATOM 843 CA SER A 55 4.032 10.556 2.396 1.00 0.00 C ATOM 844 C SER A 55 2.840 10.258 1.481 1.00 0.00 C ATOM 845 O SER A 55 1.836 10.972 1.513 1.00 0.00 O ATOM 846 CB SER A 55 5.253 11.077 1.614 1.00 0.00 C ATOM 847 OG SER A 55 5.019 12.397 1.162 1.00 0.00 O ATOM 0 H SER A 55 4.055 9.485 4.176 1.00 0.00 H new ATOM 0 HA SER A 55 3.744 11.363 3.070 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.138 11.055 2.250 1.00 0.00 H new ATOM 0 HB3 SER A 55 5.455 10.425 0.764 1.00 0.00 H new ATOM 0 HG SER A 55 5.803 12.717 0.668 1.00 0.00 H new ATOM 853 N THR A 56 2.974 9.198 0.682 1.00 0.00 N ATOM 854 CA THR A 56 2.037 8.635 -0.274 1.00 0.00 C ATOM 855 C THR A 56 0.580 8.627 0.207 1.00 0.00 C ATOM 856 O THR A 56 0.062 7.596 0.624 1.00 0.00 O ATOM 857 CB THR A 56 2.570 7.228 -0.584 1.00 0.00 C ATOM 858 OG1 THR A 56 3.969 7.320 -0.774 1.00 0.00 O ATOM 859 CG2 THR A 56 1.952 6.604 -1.834 1.00 0.00 C ATOM 0 H THR A 56 3.840 8.659 0.696 1.00 0.00 H new ATOM 0 HA THR A 56 1.987 9.255 -1.169 1.00 0.00 H new ATOM 0 HB THR A 56 2.304 6.587 0.257 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.417 6.629 -0.244 1.00 0.00 H new ATOM 0 HG21 THR A 56 2.374 5.612 -1.992 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.873 6.523 -1.704 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.167 7.232 -2.699 1.00 0.00 H new ATOM 867 N PHE A 57 -0.088 9.777 0.064 1.00 0.00 N ATOM 868 CA PHE A 57 -1.471 10.020 0.459 1.00 0.00 C ATOM 869 C PHE A 57 -1.598 9.940 1.979 1.00 0.00 C ATOM 870 O PHE A 57 -2.460 9.234 2.498 1.00 0.00 O ATOM 871 CB PHE A 57 -2.464 9.118 -0.299 1.00 0.00 C ATOM 872 CG PHE A 57 -2.706 9.544 -1.736 1.00 0.00 C ATOM 873 CD1 PHE A 57 -1.634 9.664 -2.641 1.00 0.00 C ATOM 874 CD2 PHE A 57 -3.993 9.949 -2.131 1.00 0.00 C ATOM 875 CE1 PHE A 57 -1.831 10.265 -3.893 1.00 0.00 C ATOM 876 CE2 PHE A 57 -4.192 10.521 -3.395 1.00 0.00 C ATOM 877 CZ PHE A 57 -3.115 10.681 -4.278 1.00 0.00 C ATOM 0 H PHE A 57 0.347 10.601 -0.351 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.749 11.033 0.166 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.089 8.095 -0.292 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -3.415 9.113 0.234 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.657 9.292 -2.370 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.829 9.819 -1.460 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.994 10.408 -4.561 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -5.181 10.840 -3.690 1.00 0.00 H new ATOM 0 HZ PHE A 57 -3.273 11.123 -5.251 1.00 0.00 H new ATOM 887 N LYS A 58 -0.745 10.716 2.663 1.00 0.00 N ATOM 888 CA LYS A 58 -0.553 10.715 4.108 1.00 0.00 C ATOM 889 C LYS A 58 0.316 9.507 4.461 1.00 0.00 C ATOM 890 O LYS A 58 0.414 8.564 3.683 1.00 0.00 O ATOM 891 CB LYS A 58 -1.898 10.764 4.862 1.00 0.00 C ATOM 892 CG LYS A 58 -1.790 11.209 6.326 1.00 0.00 C ATOM 893 CD LYS A 58 -3.203 11.384 6.902 1.00 0.00 C ATOM 894 CE LYS A 58 -3.151 11.795 8.382 1.00 0.00 C ATOM 895 NZ LYS A 58 -4.501 11.984 8.953 1.00 0.00 N ATOM 0 H LYS A 58 -0.143 11.393 2.194 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.034 11.617 4.432 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.570 11.443 4.337 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.355 9.775 4.829 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.237 10.469 6.904 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.237 12.146 6.395 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.741 12.140 6.330 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.759 10.452 6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.620 11.032 8.951 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.583 12.720 8.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.420 12.260 9.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.999 12.730 8.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.035 11.095 8.882 1.00 0.00 H new ATOM 909 N ASN A 59 0.988 9.536 5.615 1.00 0.00 N ATOM 910 CA ASN A 59 1.751 8.373 6.050 1.00 0.00 C ATOM 911 C ASN A 59 0.764 7.284 6.457 1.00 0.00 C ATOM 912 O ASN A 59 0.144 7.397 7.513 1.00 0.00 O ATOM 913 CB ASN A 59 2.721 8.716 7.190 1.00 0.00 C ATOM 914 CG ASN A 59 4.020 9.327 6.672 1.00 0.00 C ATOM 915 OD1 ASN A 59 3.958 10.527 6.101 1.00 0.00 O flip ATOM 916 ND2 ASN A 59 5.078 8.715 6.746 1.00 0.00 N flip ATOM 0 H ASN A 59 1.018 10.334 6.249 1.00 0.00 H new ATOM 0 HA ASN A 59 2.374 8.018 5.229 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.241 9.413 7.877 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.946 7.813 7.758 1.00 0.00 H new ATOM 0 HD21 ASN A 59 5.106 7.796 7.188 1.00 0.00 H new ATOM 0 HD22 ASN A 59 5.932 9.124 6.366 1.00 0.00 H new ATOM 923 N THR A 60 0.597 6.262 5.617 1.00 0.00 N ATOM 924 CA THR A 60 -0.241 5.103 5.892 1.00 0.00 C ATOM 925 C THR A 60 0.598 3.831 5.740 1.00 0.00 C ATOM 926 O THR A 60 1.791 3.902 5.436 1.00 0.00 O ATOM 927 CB THR A 60 -1.501 5.140 5.006 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.167 5.202 3.631 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.364 6.350 5.384 1.00 0.00 C ATOM 0 H THR A 60 1.053 6.220 4.706 1.00 0.00 H new ATOM 0 HA THR A 60 -0.605 5.116 6.919 1.00 0.00 H new ATOM 0 HB THR A 60 -2.060 4.220 5.176 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.988 5.222 3.096 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.254 6.373 4.755 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.661 6.273 6.430 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.792 7.266 5.236 1.00 0.00 H new ATOM 937 N GLU A 61 0.002 2.666 6.011 1.00 0.00 N ATOM 938 CA GLU A 61 0.713 1.403 6.053 1.00 0.00 C ATOM 939 C GLU A 61 -0.298 0.272 5.853 1.00 0.00 C ATOM 940 O GLU A 61 -1.441 0.409 6.291 1.00 0.00 O ATOM 941 CB GLU A 61 1.451 1.317 7.400 1.00 0.00 C ATOM 942 CG GLU A 61 2.343 0.081 7.520 1.00 0.00 C ATOM 943 CD GLU A 61 3.261 0.158 8.737 1.00 0.00 C ATOM 944 OE1 GLU A 61 2.824 0.726 9.758 1.00 0.00 O ATOM 945 OE2 GLU A 61 4.402 -0.344 8.623 1.00 0.00 O ATOM 0 H GLU A 61 -0.995 2.582 6.208 1.00 0.00 H new ATOM 0 HA GLU A 61 1.456 1.319 5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.061 2.211 7.531 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.719 1.309 8.208 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.720 -0.811 7.591 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.945 -0.021 6.617 1.00 0.00 H new ATOM 952 N ILE A 62 0.101 -0.809 5.173 1.00 0.00 N ATOM 953 CA ILE A 62 -0.728 -1.989 4.934 1.00 0.00 C ATOM 954 C ILE A 62 0.125 -3.233 5.200 1.00 0.00 C ATOM 955 O ILE A 62 1.147 -3.436 4.543 1.00 0.00 O ATOM 956 CB ILE A 62 -1.281 -2.008 3.492 1.00 0.00 C ATOM 957 CG1 ILE A 62 -1.962 -0.683 3.097 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.248 -3.189 3.312 1.00 0.00 C ATOM 959 CD1 ILE A 62 -2.395 -0.664 1.626 1.00 0.00 C ATOM 0 H ILE A 62 1.033 -0.886 4.765 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.588 -1.970 5.604 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.429 -2.132 2.823 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.834 -0.522 3.732 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.276 0.144 3.282 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.632 -3.193 2.292 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.721 -4.123 3.505 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.078 -3.090 4.012 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.869 0.291 1.399 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.521 -0.796 0.988 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.103 -1.473 1.445 1.00 0.00 H new ATOM 971 N SER A 63 -0.293 -4.068 6.154 1.00 0.00 N ATOM 972 CA SER A 63 0.288 -5.368 6.453 1.00 0.00 C ATOM 973 C SER A 63 -0.408 -6.425 5.602 1.00 0.00 C ATOM 974 O SER A 63 -1.637 -6.434 5.569 1.00 0.00 O ATOM 975 CB SER A 63 0.028 -5.642 7.935 1.00 0.00 C ATOM 976 OG SER A 63 -1.345 -5.404 8.200 1.00 0.00 O ATOM 0 H SER A 63 -1.080 -3.842 6.762 1.00 0.00 H new ATOM 0 HA SER A 63 1.357 -5.390 6.239 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.289 -6.671 8.182 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.651 -4.997 8.555 1.00 0.00 H new ATOM 0 HG SER A 63 -1.881 -5.694 7.433 1.00 0.00 H new ATOM 982 N PHE A 64 0.340 -7.316 4.948 1.00 0.00 N ATOM 983 CA PHE A 64 -0.218 -8.356 4.098 1.00 0.00 C ATOM 984 C PHE A 64 0.637 -9.625 4.163 1.00 0.00 C ATOM 985 O PHE A 64 1.812 -9.585 4.533 1.00 0.00 O ATOM 986 CB PHE A 64 -0.396 -7.819 2.669 1.00 0.00 C ATOM 987 CG PHE A 64 0.871 -7.437 1.924 1.00 0.00 C ATOM 988 CD1 PHE A 64 1.517 -6.219 2.207 1.00 0.00 C ATOM 989 CD2 PHE A 64 1.341 -8.240 0.870 1.00 0.00 C ATOM 990 CE1 PHE A 64 2.628 -5.817 1.450 1.00 0.00 C ATOM 991 CE2 PHE A 64 2.396 -7.794 0.056 1.00 0.00 C ATOM 992 CZ PHE A 64 3.047 -6.586 0.351 1.00 0.00 C ATOM 0 H PHE A 64 1.359 -7.331 4.998 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.206 -8.638 4.460 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.921 -8.574 2.084 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.043 -6.943 2.712 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.157 -5.592 3.009 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.889 -9.203 0.685 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.162 -4.915 1.712 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.706 -8.380 -0.796 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.868 -6.249 -0.265 1.00 0.00 H new ATOM 1002 N LYS A 65 0.026 -10.765 3.829 1.00 0.00 N ATOM 1003 CA LYS A 65 0.674 -12.065 3.773 1.00 0.00 C ATOM 1004 C LYS A 65 0.441 -12.629 2.380 1.00 0.00 C ATOM 1005 O LYS A 65 -0.688 -12.976 2.050 1.00 0.00 O ATOM 1006 CB LYS A 65 0.067 -12.999 4.834 1.00 0.00 C ATOM 1007 CG LYS A 65 0.551 -14.455 4.718 1.00 0.00 C ATOM 1008 CD LYS A 65 2.046 -14.614 5.007 1.00 0.00 C ATOM 1009 CE LYS A 65 2.504 -16.035 4.654 1.00 0.00 C ATOM 1010 NZ LYS A 65 3.847 -16.299 5.197 1.00 0.00 N ATOM 0 H LYS A 65 -0.963 -10.803 3.584 1.00 0.00 H new ATOM 0 HA LYS A 65 1.741 -11.975 3.975 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.315 -12.620 5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.019 -12.977 4.747 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.015 -15.077 5.411 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.340 -14.823 3.714 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.615 -13.886 4.429 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.244 -14.411 6.059 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.796 -16.761 5.054 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.513 -16.161 3.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.195 -17.210 4.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.495 -15.540 4.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.801 -16.334 6.235 1.00 0.00 H new ATOM 1024 N LEU A 66 1.499 -12.752 1.577 1.00 0.00 N ATOM 1025 CA LEU A 66 1.433 -13.461 0.308 1.00 0.00 C ATOM 1026 C LEU A 66 0.816 -14.855 0.497 1.00 0.00 C ATOM 1027 O LEU A 66 1.425 -15.729 1.111 1.00 0.00 O ATOM 1028 CB LEU A 66 2.817 -13.515 -0.361 1.00 0.00 C ATOM 1029 CG LEU A 66 3.960 -13.970 0.569 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.818 -15.040 -0.109 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.870 -12.791 0.926 1.00 0.00 C ATOM 0 H LEU A 66 2.418 -12.364 1.790 1.00 0.00 H new ATOM 0 HA LEU A 66 0.777 -12.912 -0.368 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.768 -14.192 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.056 -12.526 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 66 3.501 -14.375 1.471 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.618 -15.346 0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.198 -15.903 -0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.250 -14.634 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.669 -13.134 1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.302 -12.376 0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.287 -12.023 1.434 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.401 -15.036 -0.020 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.148 -16.285 -0.024 1.00 0.00 C ATOM 1045 C GLY A 67 -2.312 -16.250 0.966 1.00 0.00 C ATOM 1046 O GLY A 67 -2.590 -17.260 1.607 1.00 0.00 O ATOM 0 H GLY A 67 -0.913 -14.276 -0.468 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.529 -16.478 -1.027 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.481 -17.109 0.228 1.00 0.00 H new ATOM 1050 N VAL A 68 -2.992 -15.104 1.100 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.097 -14.911 2.037 1.00 0.00 C ATOM 1052 C VAL A 68 -5.102 -13.933 1.420 1.00 0.00 C ATOM 1053 O VAL A 68 -4.712 -13.071 0.628 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.568 -14.399 3.397 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.696 -14.009 4.361 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.717 -15.451 4.119 1.00 0.00 C ATOM 0 H VAL A 68 -2.783 -14.272 0.548 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.598 -15.861 2.223 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.969 -13.524 3.145 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.267 -13.657 5.299 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.297 -13.216 3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.327 -14.877 4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.368 -15.047 5.069 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.318 -16.342 4.303 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -1.860 -15.713 3.499 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.379 -14.076 1.807 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.435 -13.088 1.637 1.00 0.00 C ATOM 1068 C GLU A 69 -7.755 -12.507 3.012 1.00 0.00 C ATOM 1069 O GLU A 69 -7.820 -13.254 3.987 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.681 -13.723 1.000 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.759 -12.664 0.732 1.00 0.00 C ATOM 1072 CD GLU A 69 -11.026 -13.271 0.159 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.887 -13.654 0.983 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.157 -13.271 -1.081 1.00 0.00 O ATOM 0 H GLU A 69 -6.710 -14.924 2.267 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.106 -12.295 0.965 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.407 -14.213 0.066 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.079 -14.494 1.660 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.995 -12.144 1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.369 -11.918 0.039 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.929 -11.187 3.100 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.192 -10.483 4.346 1.00 0.00 C ATOM 1083 C PHE A 70 -8.750 -9.088 4.036 1.00 0.00 C ATOM 1084 O PHE A 70 -9.066 -8.791 2.883 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.926 -10.449 5.221 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.813 -9.565 4.696 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.131 -9.903 3.510 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.508 -8.360 5.356 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.200 -9.012 2.955 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.534 -7.499 4.829 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.904 -7.812 3.616 1.00 0.00 C ATOM 0 H PHE A 70 -7.889 -10.570 2.289 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.948 -11.012 4.925 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.201 -10.109 6.219 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.546 -11.465 5.324 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.325 -10.849 3.027 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.024 -8.098 6.268 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.713 -9.250 2.021 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.269 -6.595 5.357 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.188 -7.126 3.189 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.919 -8.262 5.072 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.574 -6.963 5.017 1.00 0.00 C ATOM 1103 C ASP A 71 -8.523 -5.870 5.223 1.00 0.00 C ATOM 1104 O ASP A 71 -7.791 -5.914 6.212 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.644 -6.952 6.114 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.691 -5.871 5.935 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.350 -4.669 5.897 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.893 -6.216 5.958 1.00 0.00 O ATOM 0 H ASP A 71 -8.588 -8.495 6.008 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.049 -6.778 4.054 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.138 -7.923 6.137 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.159 -6.819 7.081 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.420 -4.929 4.282 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.520 -3.785 4.324 1.00 0.00 C ATOM 1115 C GLU A 72 -8.342 -2.503 4.455 1.00 0.00 C ATOM 1116 O GLU A 72 -9.529 -2.457 4.122 1.00 0.00 O ATOM 1117 CB GLU A 72 -6.664 -3.730 3.051 1.00 0.00 C ATOM 1118 CG GLU A 72 -5.679 -4.900 2.950 1.00 0.00 C ATOM 1119 CD GLU A 72 -4.899 -4.894 1.641 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -4.804 -3.829 0.999 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.404 -5.973 1.252 1.00 0.00 O ATOM 0 H GLU A 72 -8.988 -4.949 3.435 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.855 -3.884 5.182 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.317 -3.734 2.178 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.110 -2.791 3.031 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.981 -4.856 3.786 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.225 -5.839 3.040 1.00 0.00 H new ATOM 1128 N THR A 73 -7.700 -1.439 4.937 1.00 0.00 N ATOM 1129 CA THR A 73 -8.307 -0.125 5.053 1.00 0.00 C ATOM 1130 C THR A 73 -7.224 0.928 4.827 1.00 0.00 C ATOM 1131 O THR A 73 -6.409 1.165 5.714 1.00 0.00 O ATOM 1132 CB THR A 73 -9.028 0.008 6.403 1.00 0.00 C ATOM 1133 OG1 THR A 73 -9.865 -1.109 6.614 1.00 0.00 O ATOM 1134 CG2 THR A 73 -9.944 1.227 6.415 1.00 0.00 C ATOM 0 H THR A 73 -6.733 -1.472 5.260 1.00 0.00 H new ATOM 0 HA THR A 73 -9.074 0.025 4.294 1.00 0.00 H new ATOM 0 HB THR A 73 -8.258 0.091 7.170 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.320 -1.018 7.477 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.442 1.298 7.382 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.354 2.127 6.244 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.692 1.128 5.628 1.00 0.00 H new ATOM 1142 N THR A 74 -7.188 1.512 3.626 1.00 0.00 N ATOM 1143 CA THR A 74 -6.125 2.410 3.184 1.00 0.00 C ATOM 1144 C THR A 74 -6.702 3.771 2.804 1.00 0.00 C ATOM 1145 O THR A 74 -7.856 3.875 2.403 1.00 0.00 O ATOM 1146 CB THR A 74 -5.343 1.778 2.016 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.562 2.770 1.378 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.231 1.105 0.963 1.00 0.00 C ATOM 0 H THR A 74 -7.912 1.369 2.922 1.00 0.00 H new ATOM 0 HA THR A 74 -5.426 2.566 4.006 1.00 0.00 H new ATOM 0 HB THR A 74 -4.723 0.998 2.457 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.380 2.499 0.454 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.606 0.685 0.175 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.810 0.308 1.431 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.909 1.843 0.534 1.00 0.00 H new ATOM 1156 N ALA A 75 -5.893 4.829 2.884 1.00 0.00 N ATOM 1157 CA ALA A 75 -6.283 6.141 2.390 1.00 0.00 C ATOM 1158 C ALA A 75 -6.534 6.111 0.880 1.00 0.00 C ATOM 1159 O ALA A 75 -7.366 6.870 0.386 1.00 0.00 O ATOM 1160 CB ALA A 75 -5.207 7.173 2.733 1.00 0.00 C ATOM 0 H ALA A 75 -4.958 4.797 3.290 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.215 6.426 2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.509 8.151 2.359 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.081 7.221 3.815 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.264 6.883 2.270 1.00 0.00 H new ATOM 1166 N ASP A 76 -5.808 5.265 0.140 1.00 0.00 N ATOM 1167 CA ASP A 76 -5.833 5.296 -1.317 1.00 0.00 C ATOM 1168 C ASP A 76 -6.977 4.472 -1.919 1.00 0.00 C ATOM 1169 O ASP A 76 -7.175 4.545 -3.133 1.00 0.00 O ATOM 1170 CB ASP A 76 -4.447 4.955 -1.894 1.00 0.00 C ATOM 1171 CG ASP A 76 -4.173 3.474 -2.101 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -4.601 2.684 -1.235 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -3.504 3.166 -3.118 1.00 0.00 O ATOM 0 H ASP A 76 -5.196 4.550 0.533 1.00 0.00 H new ATOM 0 HA ASP A 76 -6.057 6.318 -1.621 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -4.335 5.465 -2.851 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -3.685 5.358 -1.227 1.00 0.00 H new ATOM 1178 N ASP A 77 -7.753 3.751 -1.094 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.905 2.971 -1.557 1.00 0.00 C ATOM 1180 C ASP A 77 -9.989 2.731 -0.487 1.00 0.00 C ATOM 1181 O ASP A 77 -11.023 2.126 -0.765 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.417 1.645 -2.157 1.00 0.00 C ATOM 1183 CG ASP A 77 -9.330 1.088 -3.243 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -10.426 1.649 -3.468 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -8.873 0.101 -3.860 1.00 0.00 O ATOM 0 H ASP A 77 -7.597 3.694 -0.088 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.399 3.572 -2.320 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.420 1.790 -2.573 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.325 0.908 -1.359 1.00 0.00 H new ATOM 1190 N ARG A 78 -9.841 3.276 0.723 1.00 0.00 N ATOM 1191 CA ARG A 78 -10.750 3.073 1.849 1.00 0.00 C ATOM 1192 C ARG A 78 -10.724 1.599 2.277 1.00 0.00 C ATOM 1193 O ARG A 78 -9.675 0.960 2.194 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.171 3.628 1.608 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.252 5.110 1.198 1.00 0.00 C ATOM 1196 CD ARG A 78 -11.894 5.400 -0.264 1.00 0.00 C ATOM 1197 NE ARG A 78 -12.467 4.398 -1.177 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.638 4.435 -1.819 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -14.406 5.529 -1.796 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -14.027 3.347 -2.490 1.00 0.00 N ATOM 0 H ARG A 78 -9.059 3.890 0.951 1.00 0.00 H new ATOM 0 HA ARG A 78 -10.387 3.670 2.686 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.647 3.029 0.832 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -12.754 3.490 2.519 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.264 5.468 1.386 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.586 5.686 1.840 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -12.257 6.391 -0.537 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.810 5.416 -0.376 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.897 3.568 -1.341 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.101 6.355 -1.282 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -15.297 5.537 -2.293 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.435 2.517 -2.503 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.916 3.347 -2.989 1.00 0.00 H new ATOM 1214 N LYS A 79 -11.853 1.078 2.775 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.001 -0.297 3.224 1.00 0.00 C ATOM 1216 C LYS A 79 -12.196 -1.207 2.014 1.00 0.00 C ATOM 1217 O LYS A 79 -13.089 -0.954 1.207 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.198 -0.398 4.179 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.303 -1.810 4.769 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.558 -1.934 5.643 1.00 0.00 C ATOM 1221 CE LYS A 79 -14.793 -3.398 6.030 1.00 0.00 C ATOM 1222 NZ LYS A 79 -13.676 -3.956 6.812 1.00 0.00 N ATOM 0 H LYS A 79 -12.709 1.624 2.876 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.104 -0.613 3.757 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.091 0.330 4.983 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.116 -0.152 3.646 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.338 -2.545 3.965 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.416 -2.030 5.363 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.446 -1.327 6.541 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.424 -1.549 5.104 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.713 -3.475 6.609 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -14.934 -3.992 5.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.806 -4.982 6.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.780 -3.771 6.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -13.652 -3.509 7.751 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.397 -2.271 1.910 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.413 -3.185 0.777 1.00 0.00 C ATOM 1238 C VAL A 80 -11.061 -4.590 1.278 1.00 0.00 C ATOM 1239 O VAL A 80 -10.177 -4.733 2.117 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.425 -2.688 -0.298 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -10.822 -1.315 -0.853 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -8.988 -2.574 0.228 1.00 0.00 C ATOM 0 H VAL A 80 -10.712 -2.521 2.623 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.401 -3.222 0.319 1.00 0.00 H new ATOM 0 HB VAL A 80 -10.468 -3.440 -1.086 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.099 -1.004 -1.607 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -11.812 -1.377 -1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.838 -0.586 -0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.335 -2.220 -0.570 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -8.960 -1.869 1.059 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.647 -3.551 0.569 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.736 -5.629 0.781 1.00 0.00 N ATOM 1253 CA LYS A 81 -11.305 -7.007 0.980 1.00 0.00 C ATOM 1254 C LYS A 81 -10.257 -7.285 -0.088 1.00 0.00 C ATOM 1255 O LYS A 81 -10.544 -7.115 -1.268 1.00 0.00 O ATOM 1256 CB LYS A 81 -12.496 -7.977 0.875 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.025 -9.400 0.528 1.00 0.00 C ATOM 1258 CD LYS A 81 -13.091 -10.471 0.781 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.099 -10.923 2.251 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.635 -12.291 2.395 1.00 0.00 N ATOM 0 H LYS A 81 -12.591 -5.536 0.233 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.887 -7.153 1.976 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.041 -7.991 1.819 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -13.190 -7.624 0.112 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.730 -9.432 -0.521 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.138 -9.635 1.116 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.072 -10.079 0.515 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.905 -11.330 0.136 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.085 -10.885 2.650 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.700 -10.232 2.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.801 -12.495 3.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.531 -12.369 1.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.951 -12.974 2.012 1.00 0.00 H new ATOM 1274 N SER A 82 -9.060 -7.726 0.291 1.00 0.00 N ATOM 1275 CA SER A 82 -7.999 -7.981 -0.665 1.00 0.00 C ATOM 1276 C SER A 82 -7.480 -9.402 -0.523 1.00 0.00 C ATOM 1277 O SER A 82 -7.454 -9.944 0.580 1.00 0.00 O ATOM 1278 CB SER A 82 -6.885 -6.957 -0.473 1.00 0.00 C ATOM 1279 OG SER A 82 -6.000 -7.023 -1.570 1.00 0.00 O ATOM 0 H SER A 82 -8.805 -7.913 1.261 1.00 0.00 H new ATOM 0 HA SER A 82 -8.391 -7.880 -1.677 1.00 0.00 H new ATOM 0 HB2 SER A 82 -7.306 -5.955 -0.390 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.348 -7.155 0.455 1.00 0.00 H new ATOM 0 HG SER A 82 -6.417 -7.532 -2.296 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.064 -9.979 -1.653 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.377 -11.254 -1.733 1.00 0.00 C ATOM 1287 C ILE A 83 -5.020 -10.996 -2.363 1.00 0.00 C ATOM 1288 O ILE A 83 -4.918 -10.220 -3.316 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.239 -12.296 -2.476 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -6.646 -13.719 -2.433 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.608 -11.874 -3.904 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -5.650 -14.066 -3.548 1.00 0.00 C ATOM 0 H ILE A 83 -7.206 -9.549 -2.567 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.215 -11.691 -0.748 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.173 -12.333 -1.916 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.148 -13.855 -1.473 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.467 -14.435 -2.471 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.214 -12.652 -4.368 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.174 -10.943 -3.873 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.698 -11.727 -4.486 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.299 -15.090 -3.417 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.141 -13.972 -4.517 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -4.802 -13.383 -3.503 1.00 0.00 H new ATOM 1304 N VAL A 84 -3.971 -11.608 -1.810 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.625 -11.478 -2.339 1.00 0.00 C ATOM 1306 C VAL A 84 -1.983 -12.856 -2.474 1.00 0.00 C ATOM 1307 O VAL A 84 -2.176 -13.711 -1.609 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.814 -10.500 -1.474 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.783 -10.933 -0.012 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -0.387 -10.305 -1.989 1.00 0.00 C ATOM 0 H VAL A 84 -4.037 -12.205 -0.985 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.651 -11.052 -3.342 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.329 -9.542 -1.546 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -1.200 -10.217 0.567 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.800 -10.973 0.377 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.326 -11.920 0.066 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.141 -9.605 -1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.134 -11.263 -1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.417 -9.908 -3.004 1.00 0.00 H new ATOM 1320 N THR A 85 -1.213 -13.066 -3.545 1.00 0.00 N ATOM 1321 CA THR A 85 -0.396 -14.254 -3.760 1.00 0.00 C ATOM 1322 C THR A 85 0.661 -13.924 -4.819 1.00 0.00 C ATOM 1323 O THR A 85 0.802 -12.759 -5.192 1.00 0.00 O ATOM 1324 CB THR A 85 -1.266 -15.476 -4.115 1.00 0.00 C ATOM 1325 OG1 THR A 85 -0.446 -16.634 -4.164 1.00 0.00 O ATOM 1326 CG2 THR A 85 -2.024 -15.300 -5.438 1.00 0.00 C ATOM 0 H THR A 85 -1.142 -12.391 -4.307 1.00 0.00 H new ATOM 0 HA THR A 85 0.120 -14.536 -2.842 1.00 0.00 H new ATOM 0 HB THR A 85 -2.022 -15.583 -3.338 1.00 0.00 H new ATOM 0 HG1 THR A 85 -0.995 -17.414 -4.388 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.620 -16.191 -5.637 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.680 -14.432 -5.369 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.311 -15.152 -6.249 1.00 0.00 H new ATOM 1334 N LEU A 86 1.404 -14.928 -5.292 1.00 0.00 N ATOM 1335 CA LEU A 86 2.489 -14.759 -6.250 1.00 0.00 C ATOM 1336 C LEU A 86 2.325 -15.688 -7.450 1.00 0.00 C ATOM 1337 O LEU A 86 2.007 -16.865 -7.284 1.00 0.00 O ATOM 1338 CB LEU A 86 3.846 -14.904 -5.540 1.00 0.00 C ATOM 1339 CG LEU A 86 4.190 -16.335 -5.085 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.077 -17.049 -6.114 1.00 0.00 C ATOM 1341 CD2 LEU A 86 4.965 -16.290 -3.765 1.00 0.00 C ATOM 0 H LEU A 86 1.262 -15.898 -5.012 1.00 0.00 H new ATOM 0 HA LEU A 86 2.452 -13.750 -6.660 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.630 -14.553 -6.211 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.856 -14.249 -4.669 1.00 0.00 H new ATOM 0 HG LEU A 86 3.249 -16.874 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.302 -18.056 -5.764 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.554 -17.105 -7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.006 -16.493 -6.242 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.205 -17.305 -3.449 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.887 -15.726 -3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.355 -15.807 -3.001 1.00 0.00 H new ATOM 1353 N ASP A 87 2.535 -15.151 -8.654 1.00 0.00 N ATOM 1354 CA ASP A 87 2.471 -15.854 -9.923 1.00 0.00 C ATOM 1355 C ASP A 87 3.896 -15.999 -10.461 1.00 0.00 C ATOM 1356 O ASP A 87 4.422 -15.134 -11.161 1.00 0.00 O ATOM 1357 CB ASP A 87 1.538 -15.115 -10.895 1.00 0.00 C ATOM 1358 CG ASP A 87 1.961 -13.676 -11.153 1.00 0.00 C ATOM 1359 OD1 ASP A 87 2.122 -12.955 -10.144 1.00 0.00 O ATOM 1360 OD2 ASP A 87 2.109 -13.326 -12.345 1.00 0.00 O ATOM 0 H ASP A 87 2.765 -14.164 -8.768 1.00 0.00 H new ATOM 0 HA ASP A 87 2.049 -16.851 -9.797 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.509 -15.654 -11.842 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.525 -15.123 -10.493 1.00 0.00 H new ATOM 1365 N GLY A 88 4.543 -17.112 -10.110 1.00 0.00 N ATOM 1366 CA GLY A 88 5.871 -17.463 -10.595 1.00 0.00 C ATOM 1367 C GLY A 88 6.952 -16.573 -9.982 1.00 0.00 C ATOM 1368 O GLY A 88 7.749 -17.039 -9.172 1.00 0.00 O ATOM 0 H GLY A 88 4.149 -17.803 -9.471 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.081 -18.506 -10.358 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.897 -17.372 -11.681 1.00 0.00 H new ATOM 1372 N GLY A 89 6.987 -15.301 -10.385 1.00 0.00 N ATOM 1373 CA GLY A 89 7.946 -14.318 -9.905 1.00 0.00 C ATOM 1374 C GLY A 89 7.378 -12.899 -9.880 1.00 0.00 C ATOM 1375 O GLY A 89 8.148 -11.952 -9.741 1.00 0.00 O ATOM 0 H GLY A 89 6.332 -14.923 -11.070 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.269 -14.593 -8.901 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.831 -14.339 -10.542 1.00 0.00 H new ATOM 1379 N LYS A 90 6.052 -12.737 -9.986 1.00 0.00 N ATOM 1380 CA LYS A 90 5.385 -11.480 -9.664 1.00 0.00 C ATOM 1381 C LYS A 90 4.473 -11.732 -8.466 1.00 0.00 C ATOM 1382 O LYS A 90 4.252 -12.884 -8.089 1.00 0.00 O ATOM 1383 CB LYS A 90 4.609 -10.908 -10.861 1.00 0.00 C ATOM 1384 CG LYS A 90 5.399 -10.927 -12.172 1.00 0.00 C ATOM 1385 CD LYS A 90 5.054 -12.152 -13.017 1.00 0.00 C ATOM 1386 CE LYS A 90 5.916 -12.153 -14.282 1.00 0.00 C ATOM 1387 NZ LYS A 90 5.495 -13.214 -15.210 1.00 0.00 N ATOM 0 H LYS A 90 5.419 -13.474 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 90 6.130 -10.724 -9.416 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.690 -11.478 -10.993 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.318 -9.882 -10.637 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.186 -10.021 -12.739 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.467 -10.923 -11.954 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.227 -13.063 -12.445 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.997 -12.138 -13.283 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.843 -11.184 -14.776 1.00 0.00 H new ATOM 0 HE3 LYS A 90 6.962 -12.296 -14.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.096 -13.192 -16.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.588 -14.139 -14.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 4.503 -13.062 -15.484 1.00 0.00 H new ATOM 1401 N LEU A 91 3.998 -10.655 -7.839 1.00 0.00 N ATOM 1402 CA LEU A 91 3.102 -10.694 -6.697 1.00 0.00 C ATOM 1403 C LEU A 91 1.796 -10.022 -7.108 1.00 0.00 C ATOM 1404 O LEU A 91 1.790 -8.824 -7.391 1.00 0.00 O ATOM 1405 CB LEU A 91 3.792 -10.047 -5.488 1.00 0.00 C ATOM 1406 CG LEU A 91 2.913 -10.041 -4.224 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.769 -10.032 -2.951 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.961 -8.835 -4.209 1.00 0.00 C ATOM 0 H LEU A 91 4.237 -9.706 -8.125 1.00 0.00 H new ATOM 0 HA LEU A 91 2.861 -11.712 -6.390 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.718 -10.581 -5.277 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.065 -9.022 -5.738 1.00 0.00 H new ATOM 0 HG LEU A 91 2.321 -10.956 -4.246 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.119 -10.028 -2.076 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.400 -10.921 -2.930 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.397 -9.141 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.355 -8.861 -3.303 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.542 -7.913 -4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.310 -8.874 -5.082 1.00 0.00 H new ATOM 1420 N VAL A 92 0.695 -10.777 -7.142 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.624 -10.238 -7.431 1.00 0.00 C ATOM 1422 C VAL A 92 -1.265 -9.850 -6.102 1.00 0.00 C ATOM 1423 O VAL A 92 -1.429 -10.703 -5.233 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.487 -11.220 -8.256 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.714 -11.793 -9.451 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -2.060 -12.393 -7.449 1.00 0.00 C ATOM 0 H VAL A 92 0.700 -11.782 -6.968 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.540 -9.353 -8.062 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.323 -10.610 -8.597 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.356 -12.478 -10.005 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.401 -10.980 -10.106 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.165 -12.329 -9.093 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.652 -13.031 -8.105 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.243 -12.972 -7.019 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.693 -12.009 -6.649 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.596 -8.569 -5.926 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.438 -8.070 -4.848 1.00 0.00 C ATOM 1438 C HIS A 93 -3.704 -7.571 -5.541 1.00 0.00 C ATOM 1439 O HIS A 93 -3.624 -6.627 -6.322 1.00 0.00 O ATOM 1440 CB HIS A 93 -1.666 -6.975 -4.088 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.424 -6.213 -3.024 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.328 -4.853 -2.770 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.210 -6.759 -2.050 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.057 -4.581 -1.670 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -3.588 -5.726 -1.218 1.00 0.00 N ATOM 0 H HIS A 93 -1.273 -7.831 -6.552 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.706 -8.814 -4.098 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.797 -7.437 -3.620 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.291 -6.257 -4.817 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -3.483 -7.799 -1.950 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.191 -3.605 -1.227 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -4.178 -5.818 -0.391 1.00 0.00 H new ATOM 1454 N VAL A 94 -4.835 -8.251 -5.343 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.107 -7.952 -5.992 1.00 0.00 C ATOM 1456 C VAL A 94 -7.073 -7.504 -4.899 1.00 0.00 C ATOM 1457 O VAL A 94 -7.107 -8.102 -3.823 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.621 -9.185 -6.754 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -7.991 -8.896 -7.384 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -5.654 -9.611 -7.866 1.00 0.00 C ATOM 0 H VAL A 94 -4.890 -9.047 -4.708 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.001 -7.159 -6.732 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.703 -9.994 -6.028 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.339 -9.780 -7.919 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.705 -8.641 -6.601 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -7.903 -8.062 -8.080 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.053 -10.485 -8.380 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.535 -8.794 -8.578 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.685 -9.857 -7.431 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.791 -6.407 -5.136 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.388 -5.593 -4.090 1.00 0.00 C ATOM 1472 C GLN A 95 -9.847 -5.311 -4.452 1.00 0.00 C ATOM 1473 O GLN A 95 -10.122 -4.558 -5.382 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.501 -4.352 -3.977 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.809 -3.422 -2.806 1.00 0.00 C ATOM 1476 CD GLN A 95 -6.624 -2.488 -2.559 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -5.559 -2.938 -2.147 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.761 -1.197 -2.836 1.00 0.00 N ATOM 0 H GLN A 95 -7.974 -6.057 -6.077 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.429 -6.075 -3.113 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.463 -4.676 -3.897 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.586 -3.782 -4.902 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.705 -2.839 -3.019 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.015 -4.007 -1.910 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -7.654 -0.841 -3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.974 -0.561 -2.707 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.764 -5.977 -3.747 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.197 -6.037 -3.988 1.00 0.00 C ATOM 1489 C LYS A 96 -12.928 -5.190 -2.942 1.00 0.00 C ATOM 1490 O LYS A 96 -12.467 -5.069 -1.810 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.632 -7.513 -3.854 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.951 -7.849 -4.566 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.699 -8.123 -6.054 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.481 -9.612 -6.359 1.00 0.00 C ATOM 1495 NZ LYS A 96 -13.027 -9.799 -7.752 1.00 0.00 N ATOM 0 H LYS A 96 -10.498 -6.529 -2.932 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.437 -5.654 -4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.844 -8.150 -4.255 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.731 -7.756 -2.796 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.411 -8.721 -4.102 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.653 -7.022 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.547 -7.759 -6.634 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.825 -7.559 -6.379 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.742 -10.025 -5.672 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.409 -10.161 -6.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.999 -10.814 -7.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.686 -9.320 -8.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -12.076 -9.394 -7.864 1.00 0.00 H new ATOM 1509 N TRP A 97 -14.095 -4.640 -3.285 1.00 0.00 N ATOM 1510 CA TRP A 97 -15.019 -4.121 -2.279 1.00 0.00 C ATOM 1511 C TRP A 97 -16.414 -4.673 -2.534 1.00 0.00 C ATOM 1512 O TRP A 97 -16.935 -5.419 -1.708 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.972 -2.593 -2.196 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.728 -1.857 -3.473 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.652 -1.204 -4.206 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.459 -1.648 -4.156 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.040 -0.586 -5.271 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.686 -0.819 -5.289 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.135 -2.064 -3.925 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.654 -0.400 -6.137 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.094 -1.657 -4.771 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.341 -0.806 -5.861 1.00 0.00 C ATOM 0 H TRP A 97 -14.420 -4.544 -4.247 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.707 -4.465 -1.293 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.917 -2.246 -1.779 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.191 -2.315 -1.489 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.710 -1.171 -3.990 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.532 -0.022 -5.964 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.918 -2.706 -3.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.866 0.226 -6.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.088 -2.002 -4.582 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.525 -0.467 -6.482 1.00 0.00 H new ATOM 1533 N ASN A 98 -17.012 -4.348 -3.683 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.334 -4.861 -4.024 1.00 0.00 C ATOM 1535 C ASN A 98 -18.588 -4.789 -5.528 1.00 0.00 C ATOM 1536 O ASN A 98 -18.321 -5.758 -6.231 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.449 -4.240 -3.155 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.487 -2.713 -3.155 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.603 -2.057 -2.618 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.500 -2.120 -3.781 1.00 0.00 N ATOM 0 H ASN A 98 -16.601 -3.735 -4.387 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.358 -5.922 -3.775 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.412 -4.613 -3.504 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.326 -4.586 -2.129 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.550 -1.102 -3.820 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -21.227 -2.683 -4.222 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.098 -3.668 -6.044 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.499 -3.580 -7.440 1.00 0.00 C ATOM 1549 C GLY A 99 -18.297 -3.580 -8.382 1.00 0.00 C ATOM 1550 O GLY A 99 -18.431 -3.916 -9.555 1.00 0.00 O ATOM 0 H GLY A 99 -19.241 -2.810 -5.511 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.150 -4.419 -7.684 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.080 -2.671 -7.594 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.136 -3.143 -7.885 1.00 0.00 N ATOM 1555 CA GLN A 100 -15.899 -3.088 -8.637 1.00 0.00 C ATOM 1556 C GLN A 100 -14.725 -3.323 -7.684 1.00 0.00 C ATOM 1557 O GLN A 100 -14.926 -3.595 -6.496 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.769 -1.782 -9.454 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.898 -0.748 -9.318 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.911 -0.088 -7.943 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -15.979 0.633 -7.598 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.935 -0.335 -7.129 1.00 0.00 N ATOM 0 H GLN A 100 -17.038 -2.812 -6.925 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.896 -3.883 -9.383 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.834 -1.299 -9.171 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.683 -2.050 -10.507 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.782 0.017 -10.086 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.857 -1.234 -9.495 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.698 -0.937 -7.438 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.956 0.078 -6.197 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.513 -3.245 -8.237 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.280 -3.681 -7.615 1.00 0.00 C ATOM 1573 C GLU A 101 -11.092 -2.988 -8.290 1.00 0.00 C ATOM 1574 O GLU A 101 -11.289 -2.144 -9.175 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.221 -5.209 -7.726 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.277 -5.776 -9.151 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.406 -7.288 -9.074 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.444 -7.949 -8.621 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -13.523 -7.805 -9.296 1.00 0.00 O ATOM 0 H GLU A 101 -13.367 -2.859 -9.170 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.238 -3.409 -6.560 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.301 -5.554 -7.254 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.049 -5.629 -7.155 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.123 -5.353 -9.692 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.377 -5.502 -9.701 1.00 0.00 H new ATOM 1586 N THR A 102 -9.870 -3.339 -7.881 1.00 0.00 N ATOM 1587 CA THR A 102 -8.640 -2.971 -8.568 1.00 0.00 C ATOM 1588 C THR A 102 -7.601 -4.091 -8.477 1.00 0.00 C ATOM 1589 O THR A 102 -7.585 -4.862 -7.515 1.00 0.00 O ATOM 1590 CB THR A 102 -8.089 -1.633 -8.040 1.00 0.00 C ATOM 1591 OG1 THR A 102 -6.943 -1.228 -8.758 1.00 0.00 O ATOM 1592 CG2 THR A 102 -7.677 -1.671 -6.576 1.00 0.00 C ATOM 0 H THR A 102 -9.710 -3.899 -7.044 1.00 0.00 H new ATOM 0 HA THR A 102 -8.872 -2.831 -9.624 1.00 0.00 H new ATOM 0 HB THR A 102 -8.919 -0.938 -8.167 1.00 0.00 H new ATOM 0 HG1 THR A 102 -6.193 -1.820 -8.538 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.300 -0.693 -6.279 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.540 -1.929 -5.962 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.896 -2.419 -6.437 1.00 0.00 H new ATOM 1600 N SER A 103 -6.703 -4.138 -9.465 1.00 0.00 N ATOM 1601 CA SER A 103 -5.448 -4.865 -9.382 1.00 0.00 C ATOM 1602 C SER A 103 -4.423 -3.977 -8.681 1.00 0.00 C ATOM 1603 O SER A 103 -4.540 -2.752 -8.750 1.00 0.00 O ATOM 1604 CB SER A 103 -4.959 -5.213 -10.796 1.00 0.00 C ATOM 1605 OG SER A 103 -4.579 -4.052 -11.521 1.00 0.00 O ATOM 0 H SER A 103 -6.837 -3.662 -10.357 1.00 0.00 H new ATOM 0 HA SER A 103 -5.584 -5.790 -8.822 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.111 -5.895 -10.730 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.748 -5.737 -11.335 1.00 0.00 H new ATOM 0 HG SER A 103 -3.650 -3.823 -11.308 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.411 -4.591 -8.063 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.149 -3.982 -7.671 1.00 0.00 C ATOM 1613 C LEU A 104 -1.048 -5.021 -7.913 1.00 0.00 C ATOM 1614 O LEU A 104 -0.437 -5.514 -6.966 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.148 -3.548 -6.190 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.227 -2.537 -5.781 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.485 -3.245 -5.265 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.708 -1.600 -4.682 1.00 0.00 C ATOM 0 H LEU A 104 -3.458 -5.578 -7.812 1.00 0.00 H new ATOM 0 HA LEU A 104 -1.985 -3.080 -8.260 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.261 -4.439 -5.572 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.172 -3.121 -5.959 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.477 -1.959 -6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.231 -2.502 -4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.889 -3.886 -6.049 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.231 -3.851 -4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.490 -0.892 -4.408 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.427 -2.186 -3.807 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.838 -1.055 -5.049 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.806 -5.401 -9.171 1.00 0.00 N ATOM 1631 CA VAL A 105 0.260 -6.362 -9.458 1.00 0.00 C ATOM 1632 C VAL A 105 1.609 -5.698 -9.176 1.00 0.00 C ATOM 1633 O VAL A 105 1.755 -4.510 -9.464 1.00 0.00 O ATOM 1634 CB VAL A 105 0.132 -6.942 -10.889 1.00 0.00 C ATOM 1635 CG1 VAL A 105 1.290 -6.618 -11.848 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.020 -8.469 -10.800 1.00 0.00 C ATOM 0 H VAL A 105 -1.319 -5.068 -9.987 1.00 0.00 H new ATOM 0 HA VAL A 105 0.174 -7.228 -8.801 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.755 -6.464 -11.306 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.096 -7.073 -12.819 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.375 -5.538 -11.964 1.00 0.00 H new ATOM 0 HG13 VAL A 105 2.221 -7.014 -11.441 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.071 -8.886 -11.803 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.911 -8.872 -10.319 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -0.860 -8.736 -10.215 1.00 0.00 H new ATOM 1646 N ARG A 106 2.567 -6.442 -8.613 1.00 0.00 N ATOM 1647 CA ARG A 106 3.925 -5.979 -8.361 1.00 0.00 C ATOM 1648 C ARG A 106 4.920 -6.930 -9.019 1.00 0.00 C ATOM 1649 O ARG A 106 4.867 -8.130 -8.755 1.00 0.00 O ATOM 1650 CB ARG A 106 4.224 -5.913 -6.860 1.00 0.00 C ATOM 1651 CG ARG A 106 3.098 -5.265 -6.049 1.00 0.00 C ATOM 1652 CD ARG A 106 3.602 -4.877 -4.654 1.00 0.00 C ATOM 1653 NE ARG A 106 4.294 -6.002 -4.001 1.00 0.00 N ATOM 1654 CZ ARG A 106 5.111 -5.892 -2.943 1.00 0.00 C ATOM 1655 NH1 ARG A 106 5.216 -4.725 -2.303 1.00 0.00 N ATOM 1656 NH2 ARG A 106 5.820 -6.944 -2.531 1.00 0.00 N ATOM 0 H ARG A 106 2.410 -7.405 -8.315 1.00 0.00 H new ATOM 0 HA ARG A 106 4.020 -4.977 -8.780 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.398 -6.922 -6.486 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.145 -5.352 -6.704 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.729 -4.381 -6.569 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.260 -5.956 -5.961 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.280 -4.027 -4.734 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.762 -4.557 -4.038 1.00 0.00 H new ATOM 0 HE ARG A 106 4.140 -6.935 -4.383 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.676 -3.920 -2.619 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.837 -4.639 -1.498 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.742 -7.835 -3.021 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.440 -6.857 -1.726 1.00 0.00 H new ATOM 1670 N GLU A 107 5.852 -6.401 -9.814 1.00 0.00 N ATOM 1671 CA GLU A 107 6.993 -7.149 -10.325 1.00 0.00 C ATOM 1672 C GLU A 107 8.203 -6.226 -10.313 1.00 0.00 C ATOM 1673 O GLU A 107 8.053 -5.043 -10.614 1.00 0.00 O ATOM 1674 CB GLU A 107 6.691 -7.650 -11.741 1.00 0.00 C ATOM 1675 CG GLU A 107 7.871 -8.411 -12.369 1.00 0.00 C ATOM 1676 CD GLU A 107 7.508 -9.054 -13.703 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.556 -8.560 -14.343 1.00 0.00 O ATOM 1678 OE2 GLU A 107 8.151 -10.071 -14.038 1.00 0.00 O ATOM 0 H GLU A 107 5.832 -5.429 -10.122 1.00 0.00 H new ATOM 0 HA GLU A 107 7.197 -8.021 -9.703 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.818 -8.302 -11.712 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.434 -6.801 -12.375 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.705 -7.725 -12.515 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.211 -9.183 -11.678 1.00 0.00 H new ATOM 1685 N MET A 108 9.379 -6.762 -9.962 1.00 0.00 N ATOM 1686 CA MET A 108 10.663 -6.112 -10.167 1.00 0.00 C ATOM 1687 C MET A 108 11.330 -6.787 -11.358 1.00 0.00 C ATOM 1688 O MET A 108 11.941 -7.841 -11.196 1.00 0.00 O ATOM 1689 CB MET A 108 11.538 -6.196 -8.904 1.00 0.00 C ATOM 1690 CG MET A 108 12.901 -5.483 -9.019 1.00 0.00 C ATOM 1691 SD MET A 108 14.189 -6.250 -10.059 1.00 0.00 S ATOM 1692 CE MET A 108 15.642 -6.039 -8.995 1.00 0.00 C ATOM 0 H MET A 108 9.457 -7.678 -9.520 1.00 0.00 H new ATOM 0 HA MET A 108 10.524 -5.050 -10.369 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.987 -5.766 -8.067 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.711 -7.246 -8.667 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.720 -4.478 -9.400 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.306 -5.374 -8.013 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.547 -6.224 -9.574 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.663 -5.021 -8.605 1.00 0.00 H new ATOM 0 HE3 MET A 108 15.591 -6.745 -8.166 1.00 0.00 H new ATOM 1702 N VAL A 109 11.310 -6.130 -12.513 1.00 0.00 N ATOM 1703 CA VAL A 109 12.317 -6.339 -13.545 1.00 0.00 C ATOM 1704 C VAL A 109 13.165 -5.071 -13.584 1.00 0.00 C ATOM 1705 O VAL A 109 12.882 -4.130 -12.836 1.00 0.00 O ATOM 1706 CB VAL A 109 11.685 -6.735 -14.890 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.248 -8.201 -14.829 1.00 0.00 C ATOM 1708 CG2 VAL A 109 10.465 -5.888 -15.251 1.00 0.00 C ATOM 0 H VAL A 109 10.599 -5.441 -12.759 1.00 0.00 H new ATOM 0 HA VAL A 109 12.963 -7.187 -13.318 1.00 0.00 H new ATOM 0 HB VAL A 109 12.444 -6.570 -15.655 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.799 -8.487 -15.780 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.115 -8.831 -14.633 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.518 -8.330 -14.030 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.065 -6.216 -16.210 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.702 -6.003 -14.481 1.00 0.00 H new ATOM 0 HG23 VAL A 109 10.757 -4.840 -15.319 1.00 0.00 H new ATOM 1718 N ASP A 110 14.253 -5.082 -14.360 1.00 0.00 N ATOM 1719 CA ASP A 110 15.288 -4.061 -14.265 1.00 0.00 C ATOM 1720 C ASP A 110 15.656 -3.903 -12.777 1.00 0.00 C ATOM 1721 O ASP A 110 15.939 -4.903 -12.113 1.00 0.00 O ATOM 1722 CB ASP A 110 14.789 -2.792 -14.978 1.00 0.00 C ATOM 1723 CG ASP A 110 15.829 -1.686 -15.004 1.00 0.00 C ATOM 1724 OD1 ASP A 110 16.723 -1.749 -15.870 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.711 -0.817 -14.112 1.00 0.00 O ATOM 0 H ASP A 110 14.436 -5.796 -15.065 1.00 0.00 H new ATOM 0 HA ASP A 110 16.215 -4.325 -14.774 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.506 -3.042 -16.000 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.891 -2.429 -14.478 1.00 0.00 H new ATOM 1730 N GLY A 111 15.537 -2.702 -12.214 1.00 0.00 N ATOM 1731 CA GLY A 111 15.593 -2.431 -10.788 1.00 0.00 C ATOM 1732 C GLY A 111 14.341 -1.673 -10.356 1.00 0.00 C ATOM 1733 O GLY A 111 14.401 -0.870 -9.422 1.00 0.00 O ATOM 0 H GLY A 111 15.393 -1.858 -12.768 1.00 0.00 H new ATOM 0 HA2 GLY A 111 15.672 -3.366 -10.234 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.482 -1.846 -10.554 1.00 0.00 H new ATOM 1737 N LYS A 112 13.217 -1.906 -11.048 1.00 0.00 N ATOM 1738 CA LYS A 112 12.027 -1.078 -10.939 1.00 0.00 C ATOM 1739 C LYS A 112 10.798 -1.929 -10.660 1.00 0.00 C ATOM 1740 O LYS A 112 10.522 -2.890 -11.372 1.00 0.00 O ATOM 1741 CB LYS A 112 11.861 -0.215 -12.197 1.00 0.00 C ATOM 1742 CG LYS A 112 13.112 0.659 -12.330 1.00 0.00 C ATOM 1743 CD LYS A 112 12.950 1.891 -13.229 1.00 0.00 C ATOM 1744 CE LYS A 112 13.958 2.907 -12.679 1.00 0.00 C ATOM 1745 NZ LYS A 112 13.983 4.213 -13.354 1.00 0.00 N ATOM 0 H LYS A 112 13.116 -2.682 -11.702 1.00 0.00 H new ATOM 0 HA LYS A 112 12.144 -0.403 -10.091 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.738 -0.844 -13.079 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.968 0.405 -12.121 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.413 0.990 -11.336 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.925 0.047 -12.721 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.158 1.651 -14.272 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.933 2.280 -13.188 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.742 3.069 -11.623 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.955 2.470 -12.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.213 4.956 -12.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.703 4.202 -14.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.050 4.406 -13.772 1.00 0.00 H new ATOM 1759 N LEU A 113 10.082 -1.566 -9.596 1.00 0.00 N ATOM 1760 CA LEU A 113 8.863 -2.213 -9.166 1.00 0.00 C ATOM 1761 C LEU A 113 7.726 -1.608 -9.986 1.00 0.00 C ATOM 1762 O LEU A 113 7.405 -0.434 -9.797 1.00 0.00 O ATOM 1763 CB LEU A 113 8.682 -1.976 -7.659 1.00 0.00 C ATOM 1764 CG LEU A 113 7.727 -2.950 -6.958 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.281 -4.372 -6.899 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.522 -2.500 -5.510 1.00 0.00 C ATOM 0 H LEU A 113 10.352 -0.786 -8.996 1.00 0.00 H new ATOM 0 HA LEU A 113 8.884 -3.291 -9.324 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.658 -2.038 -7.177 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.316 -0.960 -7.508 1.00 0.00 H new ATOM 0 HG LEU A 113 6.801 -2.948 -7.532 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.566 -5.020 -6.393 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.450 -4.739 -7.911 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.223 -4.373 -6.350 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.844 -3.189 -5.007 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.481 -2.492 -4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.095 -1.497 -5.498 1.00 0.00 H new ATOM 1778 N ILE A 114 7.135 -2.359 -10.915 1.00 0.00 N ATOM 1779 CA ILE A 114 5.939 -1.907 -11.619 1.00 0.00 C ATOM 1780 C ILE A 114 4.723 -2.237 -10.752 1.00 0.00 C ATOM 1781 O ILE A 114 4.529 -3.401 -10.415 1.00 0.00 O ATOM 1782 CB ILE A 114 5.841 -2.473 -13.052 1.00 0.00 C ATOM 1783 CG1 ILE A 114 6.204 -3.964 -13.189 1.00 0.00 C ATOM 1784 CG2 ILE A 114 6.648 -1.601 -14.025 1.00 0.00 C ATOM 1785 CD1 ILE A 114 7.676 -4.239 -13.522 1.00 0.00 C ATOM 0 H ILE A 114 7.466 -3.282 -11.196 1.00 0.00 H new ATOM 0 HA ILE A 114 5.986 -0.828 -11.765 1.00 0.00 H new ATOM 0 HB ILE A 114 4.784 -2.430 -13.316 1.00 0.00 H new ATOM 0 HG12 ILE A 114 5.956 -4.471 -12.257 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.581 -4.405 -13.967 1.00 0.00 H new ATOM 0 HG21 ILE A 114 6.570 -2.012 -15.032 1.00 0.00 H new ATOM 0 HG22 ILE A 114 6.253 -0.585 -14.016 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.694 -1.587 -13.719 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.837 -5.314 -13.599 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.929 -3.766 -14.471 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.309 -3.833 -12.734 1.00 0.00 H new ATOM 1797 N LEU A 115 3.944 -1.219 -10.360 1.00 0.00 N ATOM 1798 CA LEU A 115 2.730 -1.347 -9.562 1.00 0.00 C ATOM 1799 C LEU A 115 1.529 -1.159 -10.493 1.00 0.00 C ATOM 1800 O LEU A 115 1.035 -0.045 -10.692 1.00 0.00 O ATOM 1801 CB LEU A 115 2.734 -0.334 -8.401 1.00 0.00 C ATOM 1802 CG LEU A 115 3.171 -0.890 -7.041 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.041 -1.710 -6.409 1.00 0.00 C ATOM 1804 CD2 LEU A 115 4.473 -1.686 -7.122 1.00 0.00 C ATOM 0 H LEU A 115 4.155 -0.251 -10.602 1.00 0.00 H new ATOM 0 HA LEU A 115 2.672 -2.335 -9.105 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.394 0.492 -8.665 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.731 0.080 -8.299 1.00 0.00 H new ATOM 0 HG LEU A 115 3.380 -0.039 -6.393 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.368 -2.097 -5.444 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.166 -1.075 -6.268 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.784 -2.541 -7.065 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.735 -2.056 -6.131 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.343 -2.528 -7.801 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.271 -1.042 -7.492 1.00 0.00 H new ATOM 1816 N THR A 116 1.052 -2.258 -11.077 1.00 0.00 N ATOM 1817 CA THR A 116 -0.010 -2.215 -12.069 1.00 0.00 C ATOM 1818 C THR A 116 -1.358 -2.001 -11.375 1.00 0.00 C ATOM 1819 O THR A 116 -2.098 -2.951 -11.109 1.00 0.00 O ATOM 1820 CB THR A 116 0.041 -3.476 -12.940 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.370 -3.665 -13.379 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.844 -3.355 -14.181 1.00 0.00 C ATOM 0 H THR A 116 1.393 -3.198 -10.873 1.00 0.00 H new ATOM 0 HA THR A 116 0.128 -1.369 -12.743 1.00 0.00 H new ATOM 0 HB THR A 116 -0.317 -4.311 -12.337 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.419 -4.470 -13.936 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.776 -4.271 -14.767 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.878 -3.195 -13.876 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.510 -2.512 -14.786 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.657 -0.734 -11.077 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.950 -0.280 -10.590 1.00 0.00 C ATOM 1832 C LEU A 117 -3.920 -0.208 -11.776 1.00 0.00 C ATOM 1833 O LEU A 117 -3.874 0.756 -12.545 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.789 1.087 -9.894 1.00 0.00 C ATOM 1835 CG LEU A 117 -2.528 1.052 -8.382 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -3.782 0.728 -7.577 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -1.403 0.094 -8.010 1.00 0.00 C ATOM 0 H LEU A 117 -0.980 0.023 -11.173 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.354 -0.975 -9.854 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.966 1.619 -10.371 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.692 1.670 -10.072 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.214 2.062 -8.119 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.539 0.716 -6.514 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.542 1.485 -7.767 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.162 -0.250 -7.873 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.257 0.106 -6.930 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.663 -0.915 -8.330 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.482 0.405 -8.504 1.00 0.00 H new ATOM 1849 N THR A 118 -4.794 -1.213 -11.914 1.00 0.00 N ATOM 1850 CA THR A 118 -5.889 -1.222 -12.880 1.00 0.00 C ATOM 1851 C THR A 118 -7.206 -1.301 -12.110 1.00 0.00 C ATOM 1852 O THR A 118 -7.475 -2.325 -11.486 1.00 0.00 O ATOM 1853 CB THR A 118 -5.759 -2.426 -13.831 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.409 -2.784 -14.004 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.375 -2.136 -15.198 1.00 0.00 C ATOM 0 H THR A 118 -4.755 -2.058 -11.344 1.00 0.00 H new ATOM 0 HA THR A 118 -5.858 -0.314 -13.482 1.00 0.00 H new ATOM 0 HB THR A 118 -6.302 -3.252 -13.370 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.105 -3.298 -13.227 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.263 -3.010 -15.840 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.434 -1.907 -15.079 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.868 -1.285 -15.652 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.022 -0.245 -12.144 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.334 -0.189 -11.514 1.00 0.00 C ATOM 1865 C HIS A 119 -10.400 -0.159 -12.605 1.00 0.00 C ATOM 1866 O HIS A 119 -10.193 0.423 -13.668 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.429 1.060 -10.622 1.00 0.00 C ATOM 1868 CG HIS A 119 -10.832 1.411 -10.183 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -11.724 0.567 -9.544 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -11.495 2.565 -10.502 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -12.915 1.195 -9.499 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -12.796 2.411 -10.061 1.00 0.00 N ATOM 0 H HIS A 119 -7.776 0.619 -12.627 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.489 -1.066 -10.886 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -8.812 0.906 -9.736 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.007 1.909 -11.161 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -11.517 -0.361 -9.175 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.082 3.429 -11.002 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -13.822 0.787 -9.078 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.570 -0.736 -12.315 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.759 -0.598 -13.142 1.00 0.00 C ATOM 1883 C GLY A 120 -13.136 0.874 -13.346 1.00 0.00 C ATOM 1884 O GLY A 120 -13.962 1.398 -12.602 1.00 0.00 O ATOM 0 H GLY A 120 -11.713 -1.317 -11.489 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.586 -1.068 -14.110 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.591 -1.126 -12.676 1.00 0.00 H new ATOM 1888 N THR A 121 -12.503 1.503 -14.344 1.00 0.00 N ATOM 1889 CA THR A 121 -12.721 2.813 -14.962 1.00 0.00 C ATOM 1890 C THR A 121 -11.456 3.683 -14.999 1.00 0.00 C ATOM 1891 O THR A 121 -11.534 4.791 -15.526 1.00 0.00 O ATOM 1892 CB THR A 121 -13.937 3.602 -14.432 1.00 0.00 C ATOM 1893 OG1 THR A 121 -14.297 4.563 -15.401 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.665 4.375 -13.136 1.00 0.00 C ATOM 0 H THR A 121 -11.717 1.037 -14.797 1.00 0.00 H new ATOM 0 HA THR A 121 -12.977 2.559 -15.990 1.00 0.00 H new ATOM 0 HB THR A 121 -14.714 2.865 -14.230 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.488 4.982 -15.763 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.569 4.902 -12.830 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.369 3.678 -12.352 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.864 5.095 -13.303 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.318 3.230 -14.453 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.097 4.032 -14.422 1.00 0.00 C ATOM 1904 C ALA A 122 -7.880 3.113 -14.348 1.00 0.00 C ATOM 1905 O ALA A 122 -7.919 2.106 -13.645 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.125 4.984 -13.221 1.00 0.00 C ATOM 0 H ALA A 122 -10.223 2.308 -14.027 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.033 4.627 -15.333 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.211 5.578 -13.206 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -9.987 5.646 -13.302 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.197 4.406 -12.300 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.802 3.449 -15.061 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.567 2.676 -15.103 1.00 0.00 C ATOM 1914 C VAL A 123 -4.407 3.618 -14.802 1.00 0.00 C ATOM 1915 O VAL A 123 -4.331 4.696 -15.381 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.429 1.958 -16.458 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.414 2.903 -17.669 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.168 1.083 -16.477 1.00 0.00 C ATOM 0 H VAL A 123 -6.767 4.289 -15.639 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.571 1.889 -14.349 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.323 1.342 -16.554 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -5.314 2.320 -18.584 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.344 3.470 -17.700 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.573 3.591 -17.583 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.087 0.583 -17.442 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.289 1.708 -16.317 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.232 0.336 -15.686 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.524 3.239 -13.873 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.424 4.076 -13.421 1.00 0.00 C ATOM 1930 C CYS A 124 -1.165 3.233 -13.263 1.00 0.00 C ATOM 1931 O CYS A 124 -1.049 2.482 -12.300 1.00 0.00 O ATOM 1932 CB CYS A 124 -2.812 4.740 -12.091 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.358 5.445 -11.262 1.00 0.00 S ATOM 0 H CYS A 124 -3.559 2.330 -13.412 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.220 4.854 -14.157 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.546 5.525 -12.274 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.285 4.006 -11.439 1.00 0.00 H new ATOM 0 HG CYS A 124 -0.906 6.447 -11.956 1.00 0.00 H new ATOM 1939 N THR A 125 -0.167 3.437 -14.121 1.00 0.00 N ATOM 1940 CA THR A 125 1.148 2.853 -13.916 1.00 0.00 C ATOM 1941 C THR A 125 1.820 3.548 -12.728 1.00 0.00 C ATOM 1942 O THR A 125 2.640 4.440 -12.932 1.00 0.00 O ATOM 1943 CB THR A 125 1.982 3.001 -15.202 1.00 0.00 C ATOM 1944 OG1 THR A 125 2.097 4.362 -15.554 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.336 2.303 -16.388 1.00 0.00 C ATOM 0 H THR A 125 -0.249 4.004 -14.965 1.00 0.00 H new ATOM 0 HA THR A 125 1.064 1.790 -13.692 1.00 0.00 H new ATOM 0 HB THR A 125 2.952 2.552 -14.989 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.360 4.883 -14.766 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.960 2.435 -17.272 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.232 1.240 -16.172 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.352 2.733 -16.572 1.00 0.00 H new ATOM 1953 N ARG A 126 1.470 3.178 -11.491 1.00 0.00 N ATOM 1954 CA ARG A 126 2.373 3.452 -10.384 1.00 0.00 C ATOM 1955 C ARG A 126 3.628 2.620 -10.658 1.00 0.00 C ATOM 1956 O ARG A 126 3.517 1.456 -11.041 1.00 0.00 O ATOM 1957 CB ARG A 126 1.765 3.032 -9.033 1.00 0.00 C ATOM 1958 CG ARG A 126 0.500 3.782 -8.600 1.00 0.00 C ATOM 1959 CD ARG A 126 0.146 3.449 -7.137 1.00 0.00 C ATOM 1960 NE ARG A 126 -1.193 3.950 -6.772 1.00 0.00 N ATOM 1961 CZ ARG A 126 -1.902 3.619 -5.675 1.00 0.00 C ATOM 1962 NH1 ARG A 126 -1.344 3.023 -4.622 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -3.207 3.879 -5.610 1.00 0.00 N ATOM 0 H ARG A 126 0.600 2.706 -11.243 1.00 0.00 H new ATOM 0 HA ARG A 126 2.581 4.520 -10.317 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.535 1.968 -9.077 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.523 3.163 -8.260 1.00 0.00 H new ATOM 0 HG2 ARG A 126 0.653 4.856 -8.708 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -0.331 3.511 -9.252 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.183 2.370 -6.990 1.00 0.00 H new ATOM 0 HD3 ARG A 126 0.892 3.887 -6.473 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.625 4.614 -7.415 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.348 2.802 -4.629 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.913 2.787 -3.809 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.676 4.332 -6.394 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -3.737 3.625 -4.776 1.00 0.00 H new ATOM 1977 N THR A 127 4.823 3.169 -10.472 1.00 0.00 N ATOM 1978 CA THR A 127 6.017 2.341 -10.499 1.00 0.00 C ATOM 1979 C THR A 127 7.119 3.041 -9.723 1.00 0.00 C ATOM 1980 O THR A 127 7.144 4.273 -9.667 1.00 0.00 O ATOM 1981 CB THR A 127 6.413 1.958 -11.936 1.00 0.00 C ATOM 1982 OG1 THR A 127 7.667 1.314 -11.965 1.00 0.00 O ATOM 1983 CG2 THR A 127 6.463 3.148 -12.876 1.00 0.00 C ATOM 0 H THR A 127 4.987 4.162 -10.305 1.00 0.00 H new ATOM 0 HA THR A 127 5.820 1.389 -10.007 1.00 0.00 H new ATOM 0 HB THR A 127 5.632 1.281 -12.281 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.715 0.658 -11.238 1.00 0.00 H new ATOM 0 HG21 THR A 127 6.748 2.812 -13.873 1.00 0.00 H new ATOM 0 HG22 THR A 127 5.481 3.619 -12.919 1.00 0.00 H new ATOM 0 HG23 THR A 127 7.196 3.868 -12.512 1.00 0.00 H new ATOM 1991 N TYR A 128 7.975 2.245 -9.078 1.00 0.00 N ATOM 1992 CA TYR A 128 8.989 2.700 -8.151 1.00 0.00 C ATOM 1993 C TYR A 128 10.355 2.144 -8.530 1.00 0.00 C ATOM 1994 O TYR A 128 10.459 1.139 -9.227 1.00 0.00 O ATOM 1995 CB TYR A 128 8.640 2.265 -6.724 1.00 0.00 C ATOM 1996 CG TYR A 128 7.355 2.814 -6.139 1.00 0.00 C ATOM 1997 CD1 TYR A 128 6.112 2.267 -6.504 1.00 0.00 C ATOM 1998 CD2 TYR A 128 7.424 3.748 -5.089 1.00 0.00 C ATOM 1999 CE1 TYR A 128 4.944 2.658 -5.822 1.00 0.00 C ATOM 2000 CE2 TYR A 128 6.255 4.174 -4.447 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.026 3.584 -4.773 1.00 0.00 C ATOM 2002 OH TYR A 128 3.967 3.761 -3.931 1.00 0.00 O ATOM 0 H TYR A 128 7.973 1.232 -9.198 1.00 0.00 H new ATOM 0 HA TYR A 128 9.024 3.788 -8.198 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.585 1.177 -6.704 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.462 2.554 -6.070 1.00 0.00 H new ATOM 0 HD1 TYR A 128 6.053 1.547 -7.307 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.382 4.138 -4.777 1.00 0.00 H new ATOM 0 HE1 TYR A 128 3.987 2.245 -6.106 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.300 4.955 -3.703 1.00 0.00 H new ATOM 0 HH TYR A 128 3.464 2.923 -3.858 1.00 0.00 H new ATOM 2012 N GLU A 129 11.392 2.806 -8.026 1.00 0.00 N ATOM 2013 CA GLU A 129 12.802 2.528 -8.228 1.00 0.00 C ATOM 2014 C GLU A 129 13.393 2.288 -6.840 1.00 0.00 C ATOM 2015 O GLU A 129 13.105 3.071 -5.931 1.00 0.00 O ATOM 2016 CB GLU A 129 13.385 3.782 -8.886 1.00 0.00 C ATOM 2017 CG GLU A 129 14.861 3.699 -9.283 1.00 0.00 C ATOM 2018 CD GLU A 129 15.256 5.012 -9.938 1.00 0.00 C ATOM 2019 OE1 GLU A 129 14.926 5.202 -11.132 1.00 0.00 O ATOM 2020 OE2 GLU A 129 15.716 5.890 -9.177 1.00 0.00 O ATOM 0 H GLU A 129 11.252 3.613 -7.419 1.00 0.00 H new ATOM 0 HA GLU A 129 13.009 1.661 -8.856 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.800 4.007 -9.778 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.259 4.621 -8.202 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.480 3.512 -8.405 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.023 2.869 -9.970 1.00 0.00 H new ATOM 2027 N LYS A 130 14.150 1.201 -6.642 1.00 0.00 N ATOM 2028 CA LYS A 130 14.647 0.865 -5.313 1.00 0.00 C ATOM 2029 C LYS A 130 15.711 1.881 -4.890 1.00 0.00 C ATOM 2030 O LYS A 130 16.727 2.015 -5.567 1.00 0.00 O ATOM 2031 CB LYS A 130 15.157 -0.584 -5.248 1.00 0.00 C ATOM 2032 CG LYS A 130 15.203 -1.065 -3.787 1.00 0.00 C ATOM 2033 CD LYS A 130 15.265 -2.595 -3.679 1.00 0.00 C ATOM 2034 CE LYS A 130 15.293 -2.993 -2.195 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.118 -4.443 -1.976 1.00 0.00 N ATOM 0 H LYS A 130 14.426 0.551 -7.378 1.00 0.00 H new ATOM 0 HA LYS A 130 13.823 0.923 -4.601 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.505 -1.233 -5.832 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.151 -0.648 -5.691 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.072 -0.633 -3.292 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.322 -0.701 -3.259 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.402 -3.042 -4.172 1.00 0.00 H new ATOM 0 HD3 LYS A 130 16.153 -2.972 -4.186 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.241 -2.679 -1.759 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.506 -2.455 -1.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.347 -4.675 -0.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 14.132 -4.708 -2.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 15.752 -4.969 -2.611 1.00 0.00 H new ATOM 2049 N GLN A 131 15.479 2.593 -3.783 1.00 0.00 N ATOM 2050 CA GLN A 131 16.396 3.604 -3.270 1.00 0.00 C ATOM 2051 C GLN A 131 17.330 3.018 -2.209 1.00 0.00 C ATOM 2052 O GLN A 131 18.467 3.464 -2.089 1.00 0.00 O ATOM 2053 CB GLN A 131 15.647 4.856 -2.787 1.00 0.00 C ATOM 2054 CG GLN A 131 14.618 4.612 -1.676 1.00 0.00 C ATOM 2055 CD GLN A 131 14.072 5.925 -1.117 1.00 0.00 C ATOM 2056 OE1 GLN A 131 14.836 6.784 -0.695 1.00 0.00 O ATOM 2057 NE2 GLN A 131 12.753 6.107 -1.091 1.00 0.00 N ATOM 0 H GLN A 131 14.639 2.479 -3.215 1.00 0.00 H new ATOM 0 HA GLN A 131 17.031 3.932 -4.093 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.378 5.582 -2.431 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.138 5.307 -3.639 1.00 0.00 H new ATOM 0 HG2 GLN A 131 13.796 4.012 -2.066 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.079 4.037 -0.872 1.00 0.00 H new ATOM 0 HE21 GLN A 131 12.131 5.381 -1.447 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.365 6.972 -0.716 1.00 0.00 H new ATOM 2066 N ALA A 132 16.874 2.022 -1.438 1.00 0.00 N ATOM 2067 CA ALA A 132 17.713 1.371 -0.435 1.00 0.00 C ATOM 2068 C ALA A 132 17.278 -0.073 -0.224 1.00 0.00 C ATOM 2069 O ALA A 132 16.140 -0.431 -0.522 1.00 0.00 O ATOM 2070 CB ALA A 132 17.666 2.153 0.881 1.00 0.00 C ATOM 2071 OXT ALA A 132 18.167 -0.986 0.306 1.00 0.00 O ATOM 0 H ALA A 132 15.925 1.652 -1.494 1.00 0.00 H new ATOM 0 HA ALA A 132 18.742 1.362 -0.794 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.295 1.658 1.621 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.030 3.167 0.715 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.639 2.191 1.245 1.00 0.00 H new TER 2077 ALA A 132