USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1035 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 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 19 TYR OH : rot -67:sc= 1.55 USER MOD Set 2.2: A 102 THR OG1 : rot 174:sc= 1.31 USER MOD Set 3.1: A 80 CYS SG : rot -176:sc= -1.24 USER MOD Set 3.2: A 95 GLN : amide:sc= 1.14 K(o=-0.1,f=-6.1!) USER MOD Set 4.1: A 36 THR OG1 : rot 100:sc= 0.575 USER MOD Set 4.2: A 55 SER OG : rot -95:sc= 0.576 USER MOD Set 5.1: A 31 GLN : amide:sc=0.000891 K(o=0.49,f=-0.26) USER MOD Set 5.2: A 34 ASN : amide:sc= 0.494 K(o=0.49,f=-0.26) USER MOD Set 6.1: A 12 ASN : amide:sc= 0 X(o=0,f=0.28) USER MOD Set 6.2: A 14 GLN : amide:sc= 0 X(o=0,f=0.28) USER MOD Set 7.1: A 11 THR OG1 : rot -70:sc= 1.84 USER MOD Set 7.2: A 112 LYS NZ :NH3+ -160:sc= 0.722 (180deg=0) USER MOD Single : A 1 VAL N :NH3+ -134:sc= 0 (180deg=-0.0999) USER MOD Single : A 5 CYS SG : rot 91:sc= 0.743 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 31:sc= 1.03 USER MOD Single : A 15 ASN : amide:sc= 0.636 K(o=0.64,f=-0.42) USER MOD Single : A 20 MET CE :methyl -167:sc= 0 (180deg=-0.491) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -155:sc= 1.24 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 123:sc= 2.15 USER MOD Single : A 44 GLN : amide:sc= -0.378 X(o=-0.38,f=-0.02) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 60:sc= 0.18 USER MOD Single : A 58 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0103) USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 60 THR OG1 : rot -29:sc= 0.326 USER MOD Single : A 63 SER OG : rot 30:sc= 0.564 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 160:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0.381 K(o=0.38,f=-0.61) USER MOD Single : A 81 LYS NZ :NH3+ -135:sc= 0.241 (180deg=0) USER MOD Single : A 82 SER OG : rot 68:sc= 1.25 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -168:sc= 0.496 (180deg=0.414) USER MOD Single : A 93 HIS : no HE2:sc= -0.156 K(o=-0.16,f=-1) USER MOD Single : A 96 LYS NZ :NH3+ 155:sc= 0.786 (180deg=-0.502) USER MOD Single : A 100 LYS NZ :NH3+ -162:sc= 0.275 (180deg=0.155) USER MOD Single : A 103 ASN : amide:sc= -0.919 K(o=-0.92,f=-2.8!) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 100:sc= 0.0699 USER MOD Single : A 118 THR OG1 : rot 72:sc= 0.985 USER MOD Single : A 127 HIS : no HE2:sc= 0.3 K(o=0.3,f=-1) USER MOD Single : A 130 LYS NZ :NH3+ 162:sc= 0.125 (180deg=0.0485) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 0.790 -1.744 -3.425 1.00 0.00 N ATOM 2 CA VAL A 1 1.109 -0.456 -4.105 1.00 0.00 C ATOM 3 C VAL A 1 0.018 0.593 -3.715 1.00 0.00 C ATOM 4 O VAL A 1 -0.918 0.838 -4.480 1.00 0.00 O ATOM 5 CB VAL A 1 1.284 -0.676 -5.650 1.00 0.00 C ATOM 6 CG1 VAL A 1 1.515 0.625 -6.449 1.00 0.00 C ATOM 7 CG2 VAL A 1 2.442 -1.626 -6.033 1.00 0.00 C ATOM 0 H1 VAL A 1 1.653 -2.132 -2.994 1.00 0.00 H new ATOM 0 H2 VAL A 1 0.078 -1.579 -2.685 1.00 0.00 H new ATOM 0 H3 VAL A 1 0.416 -2.420 -4.121 1.00 0.00 H new ATOM 0 HA VAL A 1 2.067 -0.058 -3.772 1.00 0.00 H new ATOM 0 HB VAL A 1 0.326 -1.124 -5.916 1.00 0.00 H new ATOM 0 HG11 VAL A 1 1.626 0.387 -7.507 1.00 0.00 H new ATOM 0 HG12 VAL A 1 0.663 1.291 -6.314 1.00 0.00 H new ATOM 0 HG13 VAL A 1 2.419 1.116 -6.091 1.00 0.00 H new ATOM 0 HG21 VAL A 1 2.491 -1.721 -7.118 1.00 0.00 H new ATOM 0 HG22 VAL A 1 3.383 -1.221 -5.661 1.00 0.00 H new ATOM 0 HG23 VAL A 1 2.269 -2.607 -5.590 1.00 0.00 H new ATOM 18 N GLU A 2 0.135 1.220 -2.530 1.00 0.00 N ATOM 19 CA GLU A 2 -0.808 2.304 -2.085 1.00 0.00 C ATOM 20 C GLU A 2 -0.092 3.545 -1.458 1.00 0.00 C ATOM 21 O GLU A 2 -0.417 4.667 -1.852 1.00 0.00 O ATOM 22 CB GLU A 2 -2.002 1.750 -1.254 1.00 0.00 C ATOM 23 CG GLU A 2 -2.985 0.906 -2.112 1.00 0.00 C ATOM 24 CD GLU A 2 -4.301 0.451 -1.494 1.00 0.00 C ATOM 25 OE1 GLU A 2 -4.624 0.638 -0.323 1.00 0.00 O ATOM 26 OE2 GLU A 2 -5.078 -0.198 -2.416 1.00 0.00 O ATOM 0 H GLU A 2 0.867 1.006 -1.853 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.259 2.706 -2.992 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -1.619 1.137 -0.438 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -2.542 2.582 -0.801 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -3.223 1.485 -3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.451 0.015 -2.443 1.00 0.00 H new ATOM 34 N ALA A 3 0.946 3.394 -0.602 1.00 0.00 N ATOM 35 CA ALA A 3 1.986 4.458 -0.410 1.00 0.00 C ATOM 36 C ALA A 3 2.663 5.030 -1.711 1.00 0.00 C ATOM 37 O ALA A 3 2.909 6.235 -1.815 1.00 0.00 O ATOM 38 CB ALA A 3 3.050 3.885 0.549 1.00 0.00 C ATOM 0 H ALA A 3 1.094 2.559 -0.035 1.00 0.00 H new ATOM 0 HA ALA A 3 1.469 5.328 -0.006 1.00 0.00 H new ATOM 0 HB1 ALA A 3 3.828 4.630 0.716 1.00 0.00 H new ATOM 0 HB2 ALA A 3 2.583 3.629 1.500 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.492 2.991 0.110 1.00 0.00 H new ATOM 44 N PHE A 4 2.907 4.160 -2.706 1.00 0.00 N ATOM 45 CA PHE A 4 3.316 4.555 -4.079 1.00 0.00 C ATOM 46 C PHE A 4 2.214 5.154 -5.024 1.00 0.00 C ATOM 47 O PHE A 4 2.602 5.658 -6.078 1.00 0.00 O ATOM 48 CB PHE A 4 3.945 3.298 -4.749 1.00 0.00 C ATOM 49 CG PHE A 4 5.311 2.839 -4.214 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.479 3.493 -4.620 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.400 1.747 -3.343 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.716 3.069 -4.146 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.640 1.324 -2.874 1.00 0.00 C ATOM 54 CZ PHE A 4 7.796 1.985 -3.277 1.00 0.00 C ATOM 0 H PHE A 4 2.827 3.150 -2.586 1.00 0.00 H new ATOM 0 HA PHE A 4 4.006 5.388 -3.949 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.244 2.470 -4.645 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.047 3.497 -5.816 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.420 4.328 -5.302 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.503 1.231 -3.034 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.616 3.582 -4.453 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.705 0.484 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.759 1.656 -2.914 1.00 0.00 H new ATOM 64 N CYS A 5 0.894 5.110 -4.732 1.00 0.00 N ATOM 65 CA CYS A 5 -0.149 5.644 -5.655 1.00 0.00 C ATOM 66 C CYS A 5 -0.243 7.204 -5.628 1.00 0.00 C ATOM 67 O CYS A 5 -0.810 7.801 -4.707 1.00 0.00 O ATOM 68 CB CYS A 5 -1.492 4.955 -5.345 1.00 0.00 C ATOM 69 SG CYS A 5 -1.445 3.232 -5.934 1.00 0.00 S ATOM 0 H CYS A 5 0.521 4.713 -3.870 1.00 0.00 H new ATOM 0 HA CYS A 5 0.136 5.408 -6.680 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.685 4.978 -4.272 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -2.308 5.493 -5.828 1.00 0.00 H new ATOM 0 HG CYS A 5 -1.021 2.458 -4.979 1.00 0.00 H new ATOM 75 N ALA A 6 0.364 7.850 -6.640 1.00 0.00 N ATOM 76 CA ALA A 6 0.521 9.329 -6.703 1.00 0.00 C ATOM 77 C ALA A 6 1.008 9.816 -8.110 1.00 0.00 C ATOM 78 O ALA A 6 1.552 9.060 -8.926 1.00 0.00 O ATOM 79 CB ALA A 6 1.497 9.802 -5.594 1.00 0.00 C ATOM 0 H ALA A 6 0.764 7.366 -7.444 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.460 9.773 -6.537 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.608 10.885 -5.645 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.101 9.523 -4.618 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.469 9.330 -5.739 1.00 0.00 H new ATOM 85 N THR A 7 0.842 11.126 -8.361 1.00 0.00 N ATOM 86 CA THR A 7 1.444 11.834 -9.530 1.00 0.00 C ATOM 87 C THR A 7 2.922 12.216 -9.182 1.00 0.00 C ATOM 88 O THR A 7 3.156 13.143 -8.406 1.00 0.00 O ATOM 89 CB THR A 7 0.550 13.079 -9.838 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.805 12.705 -10.075 1.00 0.00 O ATOM 91 CG2 THR A 7 0.952 13.910 -11.064 1.00 0.00 C ATOM 0 H THR A 7 0.286 11.736 -7.762 1.00 0.00 H new ATOM 0 HA THR A 7 1.478 11.209 -10.422 1.00 0.00 H new ATOM 0 HB THR A 7 0.686 13.683 -8.941 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.337 13.506 -10.263 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.262 14.746 -11.179 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.964 14.291 -10.929 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.916 13.284 -11.956 1.00 0.00 H new ATOM 99 N TRP A 8 3.924 11.490 -9.705 1.00 0.00 N ATOM 100 CA TRP A 8 5.339 11.653 -9.255 1.00 0.00 C ATOM 101 C TRP A 8 6.164 12.557 -10.223 1.00 0.00 C ATOM 102 O TRP A 8 6.501 12.147 -11.338 1.00 0.00 O ATOM 103 CB TRP A 8 5.993 10.256 -9.103 1.00 0.00 C ATOM 104 CG TRP A 8 5.502 9.391 -7.939 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.652 8.274 -8.041 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.826 9.488 -6.602 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.454 7.655 -6.795 1.00 0.00 N ATOM 108 CE2 TRP A 8 5.194 8.420 -5.919 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.598 10.437 -5.890 1.00 0.00 C ATOM 110 CZ2 TRP A 8 5.341 8.284 -4.522 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.730 10.285 -4.511 1.00 0.00 C ATOM 112 CH2 TRP A 8 6.123 9.217 -3.839 1.00 0.00 C ATOM 0 H TRP A 8 3.795 10.788 -10.434 1.00 0.00 H new ATOM 0 HA TRP A 8 5.335 12.158 -8.289 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.834 9.703 -10.029 1.00 0.00 H new ATOM 0 HB3 TRP A 8 7.069 10.394 -8.995 1.00 0.00 H new ATOM 0 HD1 TRP A 8 4.206 7.934 -8.964 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.892 6.830 -6.587 1.00 0.00 H new ATOM 0 HE3 TRP A 8 7.074 11.260 -6.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.859 7.475 -3.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.310 11.003 -3.951 1.00 0.00 H new ATOM 0 HH2 TRP A 8 6.262 9.113 -2.773 1.00 0.00 H new ATOM 123 N LYS A 9 6.536 13.769 -9.781 1.00 0.00 N ATOM 124 CA LYS A 9 7.353 14.721 -10.590 1.00 0.00 C ATOM 125 C LYS A 9 8.871 14.633 -10.232 1.00 0.00 C ATOM 126 O LYS A 9 9.259 14.678 -9.058 1.00 0.00 O ATOM 127 CB LYS A 9 6.812 16.163 -10.385 1.00 0.00 C ATOM 128 CG LYS A 9 5.526 16.481 -11.182 1.00 0.00 C ATOM 129 CD LYS A 9 5.018 17.917 -10.940 1.00 0.00 C ATOM 130 CE LYS A 9 3.804 18.247 -11.822 1.00 0.00 C ATOM 131 NZ LYS A 9 3.354 19.629 -11.575 1.00 0.00 N ATOM 0 H LYS A 9 6.286 14.126 -8.859 1.00 0.00 H new ATOM 0 HA LYS A 9 7.264 14.448 -11.642 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.615 16.317 -9.324 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.588 16.873 -10.671 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.719 16.342 -12.246 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.746 15.772 -10.904 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.748 18.035 -9.891 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.820 18.626 -11.145 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.065 18.125 -12.873 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.993 17.550 -11.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.533 19.840 -12.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.086 19.733 -10.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.125 20.290 -11.798 1.00 0.00 H new ATOM 144 N LEU A 10 9.733 14.531 -11.264 1.00 0.00 N ATOM 145 CA LEU A 10 11.214 14.440 -11.080 1.00 0.00 C ATOM 146 C LEU A 10 11.860 15.763 -10.522 1.00 0.00 C ATOM 147 O LEU A 10 11.802 16.822 -11.152 1.00 0.00 O ATOM 148 CB LEU A 10 11.861 14.031 -12.441 1.00 0.00 C ATOM 149 CG LEU A 10 13.197 13.229 -12.422 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.817 13.228 -13.832 1.00 0.00 C ATOM 151 CD2 LEU A 10 14.278 13.701 -11.443 1.00 0.00 C ATOM 0 H LEU A 10 9.437 14.509 -12.240 1.00 0.00 H new ATOM 0 HA LEU A 10 11.411 13.683 -10.321 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.128 13.440 -12.991 1.00 0.00 H new ATOM 0 HB3 LEU A 10 12.031 14.943 -13.014 1.00 0.00 H new ATOM 0 HG LEU A 10 12.896 12.241 -12.075 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.751 12.667 -13.818 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.125 12.763 -14.534 1.00 0.00 H new ATOM 0 HD13 LEU A 10 14.014 14.254 -14.143 1.00 0.00 H new ATOM 0 HD21 LEU A 10 15.154 13.058 -11.531 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.557 14.729 -11.677 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.893 13.652 -10.424 1.00 0.00 H new ATOM 163 N THR A 11 12.513 15.665 -9.354 1.00 0.00 N ATOM 164 CA THR A 11 13.288 16.784 -8.726 1.00 0.00 C ATOM 165 C THR A 11 14.817 16.809 -9.072 1.00 0.00 C ATOM 166 O THR A 11 15.359 17.881 -9.348 1.00 0.00 O ATOM 167 CB THR A 11 13.086 16.814 -7.175 1.00 0.00 C ATOM 168 OG1 THR A 11 13.602 15.642 -6.547 1.00 0.00 O ATOM 169 CG2 THR A 11 11.635 16.981 -6.700 1.00 0.00 C ATOM 0 H THR A 11 12.528 14.807 -8.802 1.00 0.00 H new ATOM 0 HA THR A 11 12.870 17.687 -9.172 1.00 0.00 H new ATOM 0 HB THR A 11 13.639 17.706 -6.880 1.00 0.00 H new ATOM 0 HG1 THR A 11 13.040 14.873 -6.777 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.607 16.989 -5.610 1.00 0.00 H new ATOM 0 HG22 THR A 11 11.234 17.920 -7.080 1.00 0.00 H new ATOM 0 HG23 THR A 11 11.033 16.152 -7.072 1.00 0.00 H new ATOM 177 N ASN A 12 15.523 15.662 -8.993 1.00 0.00 N ATOM 178 CA ASN A 12 17.008 15.591 -9.114 1.00 0.00 C ATOM 179 C ASN A 12 17.409 14.258 -9.828 1.00 0.00 C ATOM 180 O ASN A 12 17.193 13.165 -9.292 1.00 0.00 O ATOM 181 CB ASN A 12 17.618 15.752 -7.688 1.00 0.00 C ATOM 182 CG ASN A 12 19.145 15.653 -7.561 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.909 15.796 -8.510 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.634 15.383 -6.375 1.00 0.00 N ATOM 0 H ASN A 12 15.085 14.753 -8.843 1.00 0.00 H new ATOM 0 HA ASN A 12 17.407 16.395 -9.732 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.309 16.721 -7.296 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.176 14.992 -7.044 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.642 15.294 -6.247 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.006 15.262 -5.580 1.00 0.00 H new ATOM 191 N SER A 13 18.004 14.359 -11.030 1.00 0.00 N ATOM 192 CA SER A 13 18.502 13.186 -11.800 1.00 0.00 C ATOM 193 C SER A 13 20.056 13.071 -11.724 1.00 0.00 C ATOM 194 O SER A 13 20.777 13.677 -12.527 1.00 0.00 O ATOM 195 CB SER A 13 17.993 13.314 -13.256 1.00 0.00 C ATOM 196 OG SER A 13 18.644 14.374 -13.960 1.00 0.00 O ATOM 0 H SER A 13 18.157 15.251 -11.501 1.00 0.00 H new ATOM 0 HA SER A 13 18.117 12.263 -11.366 1.00 0.00 H new ATOM 0 HB2 SER A 13 18.159 12.374 -13.782 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.917 13.490 -13.250 1.00 0.00 H new ATOM 0 HG SER A 13 19.556 14.482 -13.619 1.00 0.00 H new ATOM 202 N GLN A 14 20.563 12.276 -10.773 1.00 0.00 N ATOM 203 CA GLN A 14 22.027 12.076 -10.579 1.00 0.00 C ATOM 204 C GLN A 14 22.578 10.975 -11.538 1.00 0.00 C ATOM 205 O GLN A 14 22.125 9.828 -11.509 1.00 0.00 O ATOM 206 CB GLN A 14 22.309 11.733 -9.090 1.00 0.00 C ATOM 207 CG GLN A 14 22.238 12.952 -8.129 1.00 0.00 C ATOM 208 CD GLN A 14 22.429 12.680 -6.632 1.00 0.00 C ATOM 209 OE1 GLN A 14 21.617 13.071 -5.802 1.00 0.00 O ATOM 210 NE2 GLN A 14 23.503 12.055 -6.212 1.00 0.00 N ATOM 0 H GLN A 14 19.986 11.752 -10.115 1.00 0.00 H new ATOM 0 HA GLN A 14 22.549 13.000 -10.828 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.591 10.982 -8.760 1.00 0.00 H new ATOM 0 HB3 GLN A 14 23.299 11.282 -9.014 1.00 0.00 H new ATOM 0 HG2 GLN A 14 22.995 13.671 -8.440 1.00 0.00 H new ATOM 0 HG3 GLN A 14 21.268 13.432 -8.264 1.00 0.00 H new ATOM 0 HE21 GLN A 14 24.194 11.720 -6.884 1.00 0.00 H new ATOM 0 HE22 GLN A 14 23.648 11.904 -5.214 1.00 0.00 H new ATOM 219 N ASN A 15 23.550 11.340 -12.399 1.00 0.00 N ATOM 220 CA ASN A 15 24.167 10.421 -13.414 1.00 0.00 C ATOM 221 C ASN A 15 23.238 9.823 -14.544 1.00 0.00 C ATOM 222 O ASN A 15 23.606 8.848 -15.208 1.00 0.00 O ATOM 223 CB ASN A 15 25.093 9.395 -12.682 1.00 0.00 C ATOM 224 CG ASN A 15 26.206 8.759 -13.519 1.00 0.00 C ATOM 225 OD1 ASN A 15 26.181 7.580 -13.852 1.00 0.00 O ATOM 226 ND2 ASN A 15 27.215 9.513 -13.889 1.00 0.00 N ATOM 0 H ASN A 15 23.940 12.282 -12.421 1.00 0.00 H new ATOM 0 HA ASN A 15 24.777 11.055 -14.057 1.00 0.00 H new ATOM 0 HB2 ASN A 15 25.552 9.897 -11.830 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.468 8.596 -12.283 1.00 0.00 H new ATOM 0 HD21 ASN A 15 27.970 9.116 -14.449 1.00 0.00 H new ATOM 0 HD22 ASN A 15 27.244 10.495 -13.616 1.00 0.00 H new ATOM 233 N PHE A 16 22.076 10.444 -14.833 1.00 0.00 N ATOM 234 CA PHE A 16 21.122 9.948 -15.869 1.00 0.00 C ATOM 235 C PHE A 16 21.619 10.021 -17.355 1.00 0.00 C ATOM 236 O PHE A 16 21.377 9.071 -18.103 1.00 0.00 O ATOM 237 CB PHE A 16 19.740 10.611 -15.594 1.00 0.00 C ATOM 238 CG PHE A 16 18.544 10.098 -16.426 1.00 0.00 C ATOM 239 CD1 PHE A 16 18.222 8.735 -16.466 1.00 0.00 C ATOM 240 CD2 PHE A 16 17.773 11.002 -17.166 1.00 0.00 C ATOM 241 CE1 PHE A 16 17.183 8.280 -17.273 1.00 0.00 C ATOM 242 CE2 PHE A 16 16.723 10.547 -17.960 1.00 0.00 C ATOM 243 CZ PHE A 16 16.439 9.186 -18.024 1.00 0.00 C ATOM 0 H PHE A 16 21.767 11.296 -14.365 1.00 0.00 H new ATOM 0 HA PHE A 16 21.030 8.867 -15.766 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.502 10.476 -14.539 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.838 11.683 -15.764 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.783 8.033 -15.867 1.00 0.00 H new ATOM 0 HD2 PHE A 16 17.994 12.058 -17.121 1.00 0.00 H new ATOM 0 HE1 PHE A 16 16.954 7.225 -17.316 1.00 0.00 H new ATOM 0 HE2 PHE A 16 16.130 11.250 -18.526 1.00 0.00 H new ATOM 0 HZ PHE A 16 15.639 8.832 -18.658 1.00 0.00 H new ATOM 253 N ASP A 17 22.352 11.072 -17.777 1.00 0.00 N ATOM 254 CA ASP A 17 23.049 11.105 -19.103 1.00 0.00 C ATOM 255 C ASP A 17 24.041 9.924 -19.386 1.00 0.00 C ATOM 256 O ASP A 17 23.976 9.310 -20.453 1.00 0.00 O ATOM 257 CB ASP A 17 23.752 12.482 -19.240 1.00 0.00 C ATOM 258 CG ASP A 17 24.079 12.917 -20.676 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.511 12.488 -21.682 1.00 0.00 O ATOM 260 OD2 ASP A 17 25.075 13.849 -20.713 1.00 0.00 O ATOM 0 H ASP A 17 22.484 11.919 -17.224 1.00 0.00 H new ATOM 0 HA ASP A 17 22.282 10.967 -19.865 1.00 0.00 H new ATOM 0 HB2 ASP A 17 23.117 13.242 -18.785 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.679 12.456 -18.667 1.00 0.00 H new ATOM 266 N GLU A 18 24.921 9.600 -18.419 1.00 0.00 N ATOM 267 CA GLU A 18 25.752 8.359 -18.460 1.00 0.00 C ATOM 268 C GLU A 18 24.952 7.017 -18.526 1.00 0.00 C ATOM 269 O GLU A 18 25.257 6.196 -19.391 1.00 0.00 O ATOM 270 CB GLU A 18 26.750 8.365 -17.275 1.00 0.00 C ATOM 271 CG GLU A 18 27.931 7.368 -17.417 1.00 0.00 C ATOM 272 CD GLU A 18 28.800 7.250 -16.164 1.00 0.00 C ATOM 273 OE1 GLU A 18 29.291 8.210 -15.577 1.00 0.00 O ATOM 274 OE2 GLU A 18 28.968 5.958 -15.766 1.00 0.00 O ATOM 0 H GLU A 18 25.082 10.176 -17.593 1.00 0.00 H new ATOM 0 HA GLU A 18 26.288 8.389 -19.409 1.00 0.00 H new ATOM 0 HB2 GLU A 18 27.153 9.371 -17.162 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.206 8.135 -16.359 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.534 6.384 -17.665 1.00 0.00 H new ATOM 0 HG3 GLU A 18 28.557 7.679 -18.253 1.00 0.00 H new ATOM 282 N TYR A 19 23.923 6.803 -17.680 1.00 0.00 N ATOM 283 CA TYR A 19 22.931 5.700 -17.874 1.00 0.00 C ATOM 284 C TYR A 19 22.277 5.630 -19.305 1.00 0.00 C ATOM 285 O TYR A 19 22.271 4.562 -19.922 1.00 0.00 O ATOM 286 CB TYR A 19 21.917 5.775 -16.692 1.00 0.00 C ATOM 287 CG TYR A 19 20.756 4.764 -16.746 1.00 0.00 C ATOM 288 CD1 TYR A 19 19.576 5.118 -17.412 1.00 0.00 C ATOM 289 CD2 TYR A 19 20.913 3.458 -16.273 1.00 0.00 C ATOM 290 CE1 TYR A 19 18.592 4.163 -17.651 1.00 0.00 C ATOM 291 CE2 TYR A 19 19.920 2.507 -16.504 1.00 0.00 C ATOM 292 CZ TYR A 19 18.770 2.858 -17.209 1.00 0.00 C ATOM 293 OH TYR A 19 17.822 1.918 -17.507 1.00 0.00 O ATOM 0 H TYR A 19 23.749 7.374 -16.853 1.00 0.00 H new ATOM 0 HA TYR A 19 23.451 4.743 -17.847 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.462 5.626 -15.760 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.498 6.781 -16.659 1.00 0.00 H new ATOM 0 HD1 TYR A 19 19.429 6.136 -17.741 1.00 0.00 H new ATOM 0 HD2 TYR A 19 21.805 3.185 -15.728 1.00 0.00 H new ATOM 0 HE1 TYR A 19 17.691 4.436 -18.180 1.00 0.00 H new ATOM 0 HE2 TYR A 19 20.042 1.499 -16.137 1.00 0.00 H new ATOM 0 HH TYR A 19 16.993 2.126 -17.027 1.00 0.00 H new ATOM 303 N MET A 20 21.758 6.755 -19.829 1.00 0.00 N ATOM 304 CA MET A 20 21.204 6.837 -21.212 1.00 0.00 C ATOM 305 C MET A 20 22.217 6.557 -22.372 1.00 0.00 C ATOM 306 O MET A 20 21.891 5.803 -23.295 1.00 0.00 O ATOM 307 CB MET A 20 20.495 8.210 -21.373 1.00 0.00 C ATOM 308 CG MET A 20 19.162 8.354 -20.605 1.00 0.00 C ATOM 309 SD MET A 20 18.275 9.848 -21.095 1.00 0.00 S ATOM 310 CE MET A 20 19.348 11.141 -20.449 1.00 0.00 C ATOM 0 H MET A 20 21.706 7.635 -19.316 1.00 0.00 H new ATOM 0 HA MET A 20 20.494 6.016 -21.316 1.00 0.00 H new ATOM 0 HB2 MET A 20 21.175 8.994 -21.039 1.00 0.00 H new ATOM 0 HB3 MET A 20 20.306 8.382 -22.433 1.00 0.00 H new ATOM 0 HG2 MET A 20 18.537 7.481 -20.792 1.00 0.00 H new ATOM 0 HG3 MET A 20 19.359 8.382 -19.533 1.00 0.00 H new ATOM 0 HE1 MET A 20 18.822 12.095 -20.471 1.00 0.00 H new ATOM 0 HE2 MET A 20 19.626 10.904 -19.422 1.00 0.00 H new ATOM 0 HE3 MET A 20 20.247 11.208 -21.062 1.00 0.00 H new ATOM 320 N LYS A 21 23.441 7.113 -22.311 1.00 0.00 N ATOM 321 CA LYS A 21 24.567 6.700 -23.194 1.00 0.00 C ATOM 322 C LYS A 21 25.051 5.214 -23.036 1.00 0.00 C ATOM 323 O LYS A 21 25.262 4.546 -24.050 1.00 0.00 O ATOM 324 CB LYS A 21 25.691 7.757 -23.001 1.00 0.00 C ATOM 325 CG LYS A 21 26.908 7.671 -23.954 1.00 0.00 C ATOM 326 CD LYS A 21 26.544 7.780 -25.452 1.00 0.00 C ATOM 327 CE LYS A 21 27.734 7.953 -26.410 1.00 0.00 C ATOM 328 NZ LYS A 21 28.364 9.287 -26.294 1.00 0.00 N ATOM 0 H LYS A 21 23.685 7.856 -21.656 1.00 0.00 H new ATOM 0 HA LYS A 21 24.220 6.686 -24.227 1.00 0.00 H new ATOM 0 HB2 LYS A 21 25.247 8.747 -23.107 1.00 0.00 H new ATOM 0 HB3 LYS A 21 26.056 7.680 -21.977 1.00 0.00 H new ATOM 0 HG2 LYS A 21 27.610 8.466 -23.703 1.00 0.00 H new ATOM 0 HG3 LYS A 21 27.423 6.726 -23.784 1.00 0.00 H new ATOM 0 HD2 LYS A 21 25.994 6.884 -25.741 1.00 0.00 H new ATOM 0 HD3 LYS A 21 25.868 8.625 -25.583 1.00 0.00 H new ATOM 0 HE2 LYS A 21 28.478 7.184 -26.203 1.00 0.00 H new ATOM 0 HE3 LYS A 21 27.396 7.802 -27.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 29.160 9.354 -26.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 27.663 10.022 -26.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 28.712 9.423 -25.323 1.00 0.00 H new ATOM 341 N ALA A 22 25.186 4.686 -21.802 1.00 0.00 N ATOM 342 CA ALA A 22 25.482 3.248 -21.548 1.00 0.00 C ATOM 343 C ALA A 22 24.425 2.217 -22.055 1.00 0.00 C ATOM 344 O ALA A 22 24.806 1.212 -22.659 1.00 0.00 O ATOM 345 CB ALA A 22 25.719 3.096 -20.035 1.00 0.00 C ATOM 0 H ALA A 22 25.094 5.238 -20.950 1.00 0.00 H new ATOM 0 HA ALA A 22 26.361 2.997 -22.142 1.00 0.00 H new ATOM 0 HB1 ALA A 22 25.940 2.054 -19.804 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.560 3.721 -19.734 1.00 0.00 H new ATOM 0 HB3 ALA A 22 24.825 3.406 -19.494 1.00 0.00 H new ATOM 351 N LEU A 23 23.117 2.469 -21.853 1.00 0.00 N ATOM 352 CA LEU A 23 22.036 1.688 -22.518 1.00 0.00 C ATOM 353 C LEU A 23 21.961 1.801 -24.084 1.00 0.00 C ATOM 354 O LEU A 23 21.532 0.850 -24.743 1.00 0.00 O ATOM 355 CB LEU A 23 20.682 2.119 -21.877 1.00 0.00 C ATOM 356 CG LEU A 23 19.614 0.996 -21.866 1.00 0.00 C ATOM 357 CD1 LEU A 23 19.821 0.085 -20.653 1.00 0.00 C ATOM 358 CD2 LEU A 23 18.183 1.534 -21.834 1.00 0.00 C ATOM 0 H LEU A 23 22.775 3.206 -21.236 1.00 0.00 H new ATOM 0 HA LEU A 23 22.266 0.636 -22.351 1.00 0.00 H new ATOM 0 HB2 LEU A 23 20.863 2.447 -20.853 1.00 0.00 H new ATOM 0 HB3 LEU A 23 20.289 2.977 -22.422 1.00 0.00 H new ATOM 0 HG LEU A 23 19.743 0.441 -22.795 1.00 0.00 H new ATOM 0 HD11 LEU A 23 19.065 -0.701 -20.655 1.00 0.00 H new ATOM 0 HD12 LEU A 23 20.813 -0.365 -20.701 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.733 0.671 -19.738 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.481 0.700 -21.828 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.040 2.135 -20.936 1.00 0.00 H new ATOM 0 HD23 LEU A 23 18.006 2.150 -22.715 1.00 0.00 H new ATOM 370 N GLY A 24 22.316 2.967 -24.659 1.00 0.00 N ATOM 371 CA GLY A 24 22.115 3.263 -26.098 1.00 0.00 C ATOM 372 C GLY A 24 20.718 3.782 -26.499 1.00 0.00 C ATOM 373 O GLY A 24 20.186 3.332 -27.516 1.00 0.00 O ATOM 0 H GLY A 24 22.750 3.732 -24.142 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.855 4.003 -26.402 1.00 0.00 H new ATOM 0 HA3 GLY A 24 22.319 2.355 -26.666 1.00 0.00 H new ATOM 377 N VAL A 25 20.144 4.767 -25.776 1.00 0.00 N ATOM 378 CA VAL A 25 18.802 5.342 -26.130 1.00 0.00 C ATOM 379 C VAL A 25 18.906 6.450 -27.244 1.00 0.00 C ATOM 380 O VAL A 25 18.607 7.627 -27.030 1.00 0.00 O ATOM 381 CB VAL A 25 17.946 5.735 -24.869 1.00 0.00 C ATOM 382 CG1 VAL A 25 17.687 4.577 -23.883 1.00 0.00 C ATOM 383 CG2 VAL A 25 18.480 6.906 -24.026 1.00 0.00 C ATOM 0 H VAL A 25 20.573 5.186 -24.950 1.00 0.00 H new ATOM 0 HA VAL A 25 18.221 4.543 -26.591 1.00 0.00 H new ATOM 0 HB VAL A 25 17.023 6.040 -25.362 1.00 0.00 H new ATOM 0 HG11 VAL A 25 17.090 4.939 -23.046 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.149 3.778 -24.393 1.00 0.00 H new ATOM 0 HG13 VAL A 25 18.638 4.195 -23.512 1.00 0.00 H new ATOM 0 HG21 VAL A 25 17.809 7.085 -23.186 1.00 0.00 H new ATOM 0 HG22 VAL A 25 19.474 6.661 -23.651 1.00 0.00 H new ATOM 0 HG23 VAL A 25 18.536 7.803 -24.643 1.00 0.00 H new ATOM 393 N GLY A 26 19.342 6.062 -28.460 1.00 0.00 N ATOM 394 CA GLY A 26 19.580 7.010 -29.583 1.00 0.00 C ATOM 395 C GLY A 26 20.558 8.192 -29.343 1.00 0.00 C ATOM 396 O GLY A 26 21.327 8.241 -28.378 1.00 0.00 O ATOM 0 H GLY A 26 19.540 5.090 -28.697 1.00 0.00 H new ATOM 0 HA2 GLY A 26 19.952 6.436 -30.432 1.00 0.00 H new ATOM 0 HA3 GLY A 26 18.617 7.428 -29.878 1.00 0.00 H new ATOM 400 N PHE A 27 20.455 9.190 -30.225 1.00 0.00 N ATOM 401 CA PHE A 27 20.857 10.594 -29.908 1.00 0.00 C ATOM 402 C PHE A 27 19.630 11.505 -29.541 1.00 0.00 C ATOM 403 O PHE A 27 19.713 12.266 -28.573 1.00 0.00 O ATOM 404 CB PHE A 27 21.716 11.127 -31.091 1.00 0.00 C ATOM 405 CG PHE A 27 22.475 12.435 -30.808 1.00 0.00 C ATOM 406 CD1 PHE A 27 23.766 12.400 -30.267 1.00 0.00 C ATOM 407 CD2 PHE A 27 21.891 13.671 -31.105 1.00 0.00 C ATOM 408 CE1 PHE A 27 24.462 13.584 -30.032 1.00 0.00 C ATOM 409 CE2 PHE A 27 22.587 14.854 -30.867 1.00 0.00 C ATOM 410 CZ PHE A 27 23.873 14.809 -30.333 1.00 0.00 C ATOM 0 H PHE A 27 20.097 9.067 -31.172 1.00 0.00 H new ATOM 0 HA PHE A 27 21.466 10.615 -29.004 1.00 0.00 H new ATOM 0 HB2 PHE A 27 22.438 10.359 -31.371 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.065 11.281 -31.952 1.00 0.00 H new ATOM 0 HD1 PHE A 27 24.224 11.451 -30.031 1.00 0.00 H new ATOM 0 HD2 PHE A 27 20.895 13.708 -31.521 1.00 0.00 H new ATOM 0 HE1 PHE A 27 25.458 13.551 -29.616 1.00 0.00 H new ATOM 0 HE2 PHE A 27 22.130 15.805 -31.096 1.00 0.00 H new ATOM 0 HZ PHE A 27 24.414 15.726 -30.152 1.00 0.00 H new ATOM 420 N ALA A 28 18.502 11.429 -30.280 1.00 0.00 N ATOM 421 CA ALA A 28 17.256 12.168 -29.943 1.00 0.00 C ATOM 422 C ALA A 28 16.561 11.764 -28.601 1.00 0.00 C ATOM 423 O ALA A 28 16.291 12.654 -27.792 1.00 0.00 O ATOM 424 CB ALA A 28 16.317 12.059 -31.159 1.00 0.00 C ATOM 0 H ALA A 28 18.425 10.859 -31.122 1.00 0.00 H new ATOM 0 HA ALA A 28 17.527 13.205 -29.744 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.388 12.590 -30.950 1.00 0.00 H new ATOM 0 HB2 ALA A 28 16.799 12.500 -32.032 1.00 0.00 H new ATOM 0 HB3 ALA A 28 16.098 11.010 -31.357 1.00 0.00 H new ATOM 430 N THR A 29 16.316 10.463 -28.324 1.00 0.00 N ATOM 431 CA THR A 29 15.754 9.996 -27.015 1.00 0.00 C ATOM 432 C THR A 29 16.624 10.362 -25.758 1.00 0.00 C ATOM 433 O THR A 29 16.054 10.804 -24.757 1.00 0.00 O ATOM 434 CB THR A 29 15.355 8.488 -27.116 1.00 0.00 C ATOM 435 OG1 THR A 29 14.360 8.309 -28.124 1.00 0.00 O ATOM 436 CG2 THR A 29 14.757 7.894 -25.828 1.00 0.00 C ATOM 0 H THR A 29 16.496 9.708 -28.986 1.00 0.00 H new ATOM 0 HA THR A 29 14.843 10.565 -26.828 1.00 0.00 H new ATOM 0 HB THR A 29 16.292 7.976 -27.336 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.840 7.501 -27.930 1.00 0.00 H new ATOM 0 HG21 THR A 29 14.510 6.845 -25.991 1.00 0.00 H new ATOM 0 HG22 THR A 29 15.483 7.974 -25.019 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.853 8.442 -25.560 1.00 0.00 H new ATOM 444 N ARG A 30 17.969 10.246 -25.799 1.00 0.00 N ATOM 445 CA ARG A 30 18.862 10.794 -24.733 1.00 0.00 C ATOM 446 C ARG A 30 18.772 12.342 -24.488 1.00 0.00 C ATOM 447 O ARG A 30 18.682 12.763 -23.333 1.00 0.00 O ATOM 448 CB ARG A 30 20.320 10.272 -24.899 1.00 0.00 C ATOM 449 CG ARG A 30 21.132 10.769 -26.113 1.00 0.00 C ATOM 450 CD ARG A 30 22.638 10.443 -26.090 1.00 0.00 C ATOM 451 NE ARG A 30 23.341 11.289 -25.080 1.00 0.00 N ATOM 452 CZ ARG A 30 24.635 11.600 -25.086 1.00 0.00 C ATOM 453 NH1 ARG A 30 25.460 11.261 -26.045 1.00 0.00 N ATOM 454 NH2 ARG A 30 25.108 12.279 -24.082 1.00 0.00 N ATOM 0 H ARG A 30 18.469 9.779 -26.556 1.00 0.00 H new ATOM 0 HA ARG A 30 18.466 10.394 -23.799 1.00 0.00 H new ATOM 0 HB2 ARG A 30 20.873 10.534 -23.997 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.282 9.184 -24.945 1.00 0.00 H new ATOM 0 HG2 ARG A 30 20.700 10.339 -27.016 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.014 11.850 -26.187 1.00 0.00 H new ATOM 0 HD2 ARG A 30 22.784 9.389 -25.855 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.068 10.612 -27.077 1.00 0.00 H new ATOM 0 HE ARG A 30 22.778 11.663 -24.316 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.120 10.728 -26.846 1.00 0.00 H new ATOM 0 HH12 ARG A 30 26.442 11.530 -25.991 1.00 0.00 H new ATOM 0 HH21 ARG A 30 24.491 12.558 -23.319 1.00 0.00 H new ATOM 0 HH22 ARG A 30 26.096 12.532 -24.058 1.00 0.00 H new ATOM 468 N GLN A 31 18.747 13.178 -25.544 1.00 0.00 N ATOM 469 CA GLN A 31 18.496 14.645 -25.415 1.00 0.00 C ATOM 470 C GLN A 31 17.043 15.036 -24.984 1.00 0.00 C ATOM 471 O GLN A 31 16.904 15.893 -24.108 1.00 0.00 O ATOM 472 CB GLN A 31 19.002 15.366 -26.699 1.00 0.00 C ATOM 473 CG GLN A 31 20.483 15.842 -26.657 1.00 0.00 C ATOM 474 CD GLN A 31 21.555 14.786 -26.352 1.00 0.00 C ATOM 475 OE1 GLN A 31 21.914 14.526 -25.207 1.00 0.00 O ATOM 476 NE2 GLN A 31 22.094 14.136 -27.350 1.00 0.00 N ATOM 0 H GLN A 31 18.897 12.870 -26.505 1.00 0.00 H new ATOM 0 HA GLN A 31 19.077 15.004 -24.566 1.00 0.00 H new ATOM 0 HB2 GLN A 31 18.879 14.692 -27.546 1.00 0.00 H new ATOM 0 HB3 GLN A 31 18.365 16.231 -26.885 1.00 0.00 H new ATOM 0 HG2 GLN A 31 20.719 16.294 -27.620 1.00 0.00 H new ATOM 0 HG3 GLN A 31 20.563 16.630 -25.908 1.00 0.00 H new ATOM 0 HE21 GLN A 31 21.806 14.341 -28.307 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.802 13.424 -27.172 1.00 0.00 H new ATOM 485 N VAL A 32 15.988 14.371 -25.501 1.00 0.00 N ATOM 486 CA VAL A 32 14.619 14.361 -24.882 1.00 0.00 C ATOM 487 C VAL A 32 14.626 14.000 -23.352 1.00 0.00 C ATOM 488 O VAL A 32 14.159 14.812 -22.552 1.00 0.00 O ATOM 489 CB VAL A 32 13.659 13.482 -25.767 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.308 13.112 -25.112 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.329 14.145 -27.127 1.00 0.00 C ATOM 0 H VAL A 32 16.048 13.822 -26.359 1.00 0.00 H new ATOM 0 HA VAL A 32 14.222 15.376 -24.881 1.00 0.00 H new ATOM 0 HB VAL A 32 14.241 12.570 -25.898 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.722 12.507 -25.804 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.490 12.546 -24.198 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.759 14.022 -24.872 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.664 13.496 -27.696 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.840 15.104 -26.955 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.250 14.302 -27.688 1.00 0.00 H new ATOM 501 N GLY A 33 15.197 12.846 -22.944 1.00 0.00 N ATOM 502 CA GLY A 33 15.470 12.529 -21.512 1.00 0.00 C ATOM 503 C GLY A 33 16.231 13.560 -20.637 1.00 0.00 C ATOM 504 O GLY A 33 15.867 13.744 -19.475 1.00 0.00 O ATOM 0 H GLY A 33 15.483 12.108 -23.588 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.511 12.336 -21.031 1.00 0.00 H new ATOM 0 HA3 GLY A 33 16.034 11.597 -21.485 1.00 0.00 H new ATOM 508 N ASN A 34 17.260 14.228 -21.185 1.00 0.00 N ATOM 509 CA ASN A 34 17.936 15.378 -20.515 1.00 0.00 C ATOM 510 C ASN A 34 17.069 16.677 -20.369 1.00 0.00 C ATOM 511 O ASN A 34 17.069 17.264 -19.285 1.00 0.00 O ATOM 512 CB ASN A 34 19.286 15.683 -21.229 1.00 0.00 C ATOM 513 CG ASN A 34 20.408 14.646 -21.061 1.00 0.00 C ATOM 514 OD1 ASN A 34 20.677 14.133 -19.980 1.00 0.00 O ATOM 515 ND2 ASN A 34 21.142 14.335 -22.103 1.00 0.00 N ATOM 0 H ASN A 34 17.653 13.997 -22.098 1.00 0.00 H new ATOM 0 HA ASN A 34 18.111 15.058 -19.488 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.088 15.800 -22.294 1.00 0.00 H new ATOM 0 HB3 ASN A 34 19.653 16.643 -20.866 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.917 13.679 -22.004 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.938 14.749 -23.013 1.00 0.00 H new ATOM 522 N VAL A 35 16.356 17.142 -21.417 1.00 0.00 N ATOM 523 CA VAL A 35 15.480 18.361 -21.325 1.00 0.00 C ATOM 524 C VAL A 35 14.109 18.185 -20.577 1.00 0.00 C ATOM 525 O VAL A 35 13.604 19.168 -20.028 1.00 0.00 O ATOM 526 CB VAL A 35 15.295 19.089 -22.705 1.00 0.00 C ATOM 527 CG1 VAL A 35 16.621 19.558 -23.348 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.469 18.322 -23.763 1.00 0.00 C ATOM 0 H VAL A 35 16.360 16.704 -22.338 1.00 0.00 H new ATOM 0 HA VAL A 35 16.057 19.012 -20.668 1.00 0.00 H new ATOM 0 HB VAL A 35 14.710 19.960 -22.411 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.411 20.051 -24.297 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.122 20.257 -22.679 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.266 18.697 -23.522 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.405 18.916 -24.675 1.00 0.00 H new ATOM 0 HG22 VAL A 35 14.953 17.370 -23.983 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.466 18.138 -23.378 1.00 0.00 H new ATOM 538 N THR A 36 13.481 16.992 -20.579 1.00 0.00 N ATOM 539 CA THR A 36 12.116 16.788 -20.005 1.00 0.00 C ATOM 540 C THR A 36 12.088 16.649 -18.445 1.00 0.00 C ATOM 541 O THR A 36 12.971 16.031 -17.840 1.00 0.00 O ATOM 542 CB THR A 36 11.414 15.600 -20.742 1.00 0.00 C ATOM 543 OG1 THR A 36 10.019 15.618 -20.463 1.00 0.00 O ATOM 544 CG2 THR A 36 11.884 14.173 -20.407 1.00 0.00 C ATOM 0 H THR A 36 13.892 16.145 -20.972 1.00 0.00 H new ATOM 0 HA THR A 36 11.545 17.699 -20.185 1.00 0.00 H new ATOM 0 HB THR A 36 11.680 15.782 -21.783 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.540 16.025 -21.215 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.310 13.454 -20.992 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.943 14.073 -20.647 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.733 13.980 -19.345 1.00 0.00 H new ATOM 552 N LYS A 37 11.014 17.152 -17.806 1.00 0.00 N ATOM 553 CA LYS A 37 10.622 16.715 -16.437 1.00 0.00 C ATOM 554 C LYS A 37 9.522 15.597 -16.569 1.00 0.00 C ATOM 555 O LYS A 37 8.353 15.946 -16.780 1.00 0.00 O ATOM 556 CB LYS A 37 10.171 17.947 -15.605 1.00 0.00 C ATOM 557 CG LYS A 37 9.875 17.626 -14.116 1.00 0.00 C ATOM 558 CD LYS A 37 9.405 18.829 -13.275 1.00 0.00 C ATOM 559 CE LYS A 37 10.525 19.825 -12.929 1.00 0.00 C ATOM 560 NZ LYS A 37 9.991 20.901 -12.072 1.00 0.00 N ATOM 0 H LYS A 37 10.399 17.860 -18.208 1.00 0.00 H new ATOM 0 HA LYS A 37 11.462 16.280 -15.896 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.947 18.710 -15.654 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.276 18.372 -16.060 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.111 16.849 -14.071 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.776 17.213 -13.662 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.620 19.355 -13.818 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.961 18.461 -12.350 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.337 19.309 -12.417 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.942 20.249 -13.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.752 21.571 -11.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.231 21.401 -12.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.613 20.491 -11.194 1.00 0.00 H new ATOM 573 N PRO A 38 9.813 14.265 -16.467 1.00 0.00 N ATOM 574 CA PRO A 38 8.787 13.210 -16.643 1.00 0.00 C ATOM 575 C PRO A 38 7.876 13.024 -15.388 1.00 0.00 C ATOM 576 O PRO A 38 8.344 12.915 -14.247 1.00 0.00 O ATOM 577 CB PRO A 38 9.656 11.987 -16.987 1.00 0.00 C ATOM 578 CG PRO A 38 10.956 12.210 -16.214 1.00 0.00 C ATOM 579 CD PRO A 38 11.172 13.723 -16.291 1.00 0.00 C ATOM 0 HA PRO A 38 8.046 13.432 -17.411 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.170 11.058 -16.687 1.00 0.00 H new ATOM 0 HB3 PRO A 38 9.839 11.919 -18.059 1.00 0.00 H new ATOM 0 HG2 PRO A 38 10.871 11.870 -15.182 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.786 11.664 -16.662 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.641 14.106 -15.385 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.821 13.992 -17.124 1.00 0.00 H new ATOM 587 N THR A 39 6.560 12.998 -15.634 1.00 0.00 N ATOM 588 CA THR A 39 5.537 12.812 -14.569 1.00 0.00 C ATOM 589 C THR A 39 5.116 11.310 -14.541 1.00 0.00 C ATOM 590 O THR A 39 4.487 10.807 -15.479 1.00 0.00 O ATOM 591 CB THR A 39 4.361 13.800 -14.818 1.00 0.00 C ATOM 592 OG1 THR A 39 4.850 15.137 -14.902 1.00 0.00 O ATOM 593 CG2 THR A 39 3.319 13.811 -13.694 1.00 0.00 C ATOM 0 H THR A 39 6.165 13.104 -16.568 1.00 0.00 H new ATOM 0 HA THR A 39 5.928 13.046 -13.579 1.00 0.00 H new ATOM 0 HB THR A 39 3.897 13.457 -15.743 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.102 15.750 -15.060 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.530 14.523 -13.936 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.889 12.815 -13.587 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.796 14.103 -12.758 1.00 0.00 H new ATOM 601 N VAL A 40 5.495 10.595 -13.471 1.00 0.00 N ATOM 602 CA VAL A 40 5.260 9.124 -13.342 1.00 0.00 C ATOM 603 C VAL A 40 3.963 8.904 -12.491 1.00 0.00 C ATOM 604 O VAL A 40 4.007 8.940 -11.260 1.00 0.00 O ATOM 605 CB VAL A 40 6.560 8.431 -12.791 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.389 6.922 -12.506 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.786 8.564 -13.728 1.00 0.00 C ATOM 0 H VAL A 40 5.971 11.005 -12.668 1.00 0.00 H new ATOM 0 HA VAL A 40 5.074 8.644 -14.303 1.00 0.00 H new ATOM 0 HB VAL A 40 6.735 8.973 -11.862 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.327 6.514 -12.129 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.606 6.779 -11.761 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.113 6.407 -13.426 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.643 8.061 -13.280 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.559 8.106 -14.691 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.020 9.619 -13.874 1.00 0.00 H new ATOM 617 N ILE A 41 2.796 8.690 -13.127 1.00 0.00 N ATOM 618 CA ILE A 41 1.487 8.626 -12.397 1.00 0.00 C ATOM 619 C ILE A 41 1.153 7.130 -12.091 1.00 0.00 C ATOM 620 O ILE A 41 0.753 6.373 -12.983 1.00 0.00 O ATOM 621 CB ILE A 41 0.296 9.385 -13.094 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.681 10.751 -13.738 1.00 0.00 C ATOM 623 CG2 ILE A 41 -0.865 9.591 -12.077 1.00 0.00 C ATOM 624 CD1 ILE A 41 -0.426 11.503 -14.500 1.00 0.00 C ATOM 0 H ILE A 41 2.718 8.558 -14.135 1.00 0.00 H new ATOM 0 HA ILE A 41 1.611 9.176 -11.464 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.016 8.747 -13.921 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.053 11.405 -12.949 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.509 10.580 -14.426 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.686 10.117 -12.564 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.214 8.621 -11.722 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.508 10.180 -11.232 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.025 12.436 -14.897 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.787 10.884 -15.322 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.250 11.722 -13.821 1.00 0.00 H new ATOM 636 N ILE A 42 1.307 6.720 -10.821 1.00 0.00 N ATOM 637 CA ILE A 42 1.024 5.324 -10.367 1.00 0.00 C ATOM 638 C ILE A 42 -0.453 5.270 -9.851 1.00 0.00 C ATOM 639 O ILE A 42 -0.809 5.991 -8.913 1.00 0.00 O ATOM 640 CB ILE A 42 2.071 4.868 -9.277 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.554 4.925 -9.765 1.00 0.00 C ATOM 642 CG2 ILE A 42 1.755 3.460 -8.696 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.650 4.568 -8.743 1.00 0.00 C ATOM 0 H ILE A 42 1.629 7.335 -10.073 1.00 0.00 H new ATOM 0 HA ILE A 42 1.129 4.620 -11.193 1.00 0.00 H new ATOM 0 HB ILE A 42 1.966 5.603 -8.479 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.655 4.252 -10.616 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.750 5.933 -10.131 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.506 3.197 -7.951 1.00 0.00 H new ATOM 0 HG22 ILE A 42 0.770 3.472 -8.229 1.00 0.00 H new ATOM 0 HG23 ILE A 42 1.767 2.724 -9.500 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.629 4.649 -9.216 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.597 5.255 -7.898 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.501 3.547 -8.391 1.00 0.00 H new ATOM 655 N SER A 43 -1.298 4.384 -10.414 1.00 0.00 N ATOM 656 CA SER A 43 -2.652 4.105 -9.848 1.00 0.00 C ATOM 657 C SER A 43 -3.095 2.616 -10.042 1.00 0.00 C ATOM 658 O SER A 43 -2.742 1.959 -11.028 1.00 0.00 O ATOM 659 CB SER A 43 -3.694 5.102 -10.419 1.00 0.00 C ATOM 660 OG SER A 43 -3.952 4.890 -11.809 1.00 0.00 O ATOM 0 H SER A 43 -1.078 3.848 -11.254 1.00 0.00 H new ATOM 0 HA SER A 43 -2.592 4.255 -8.770 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.626 5.007 -9.862 1.00 0.00 H new ATOM 0 HB3 SER A 43 -3.336 6.121 -10.271 1.00 0.00 H new ATOM 0 HG SER A 43 -4.910 4.734 -11.944 1.00 0.00 H new ATOM 666 N GLN A 44 -3.904 2.094 -9.102 1.00 0.00 N ATOM 667 CA GLN A 44 -4.469 0.714 -9.185 1.00 0.00 C ATOM 668 C GLN A 44 -5.855 0.716 -9.906 1.00 0.00 C ATOM 669 O GLN A 44 -6.797 1.382 -9.465 1.00 0.00 O ATOM 670 CB GLN A 44 -4.576 0.115 -7.753 1.00 0.00 C ATOM 671 CG GLN A 44 -3.220 -0.235 -7.090 1.00 0.00 C ATOM 672 CD GLN A 44 -3.311 -0.839 -5.680 1.00 0.00 C ATOM 673 OE1 GLN A 44 -4.012 -0.365 -4.788 1.00 0.00 O ATOM 674 NE2 GLN A 44 -2.552 -1.876 -5.413 1.00 0.00 N ATOM 0 H GLN A 44 -4.189 2.604 -8.266 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.802 0.090 -9.779 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -5.103 0.826 -7.116 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -5.186 -0.787 -7.797 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.691 -0.937 -7.734 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.615 0.670 -7.040 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.965 -2.280 -6.143 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.549 -2.278 -4.476 1.00 0.00 H new ATOM 683 N GLU A 45 -5.975 -0.034 -11.016 1.00 0.00 N ATOM 684 CA GLU A 45 -7.206 -0.049 -11.857 1.00 0.00 C ATOM 685 C GLU A 45 -7.921 -1.433 -11.730 1.00 0.00 C ATOM 686 O GLU A 45 -7.681 -2.357 -12.519 1.00 0.00 O ATOM 687 CB GLU A 45 -6.849 0.322 -13.330 1.00 0.00 C ATOM 688 CG GLU A 45 -6.088 1.653 -13.592 1.00 0.00 C ATOM 689 CD GLU A 45 -6.669 2.936 -13.001 1.00 0.00 C ATOM 690 OE1 GLU A 45 -6.081 3.613 -12.160 1.00 0.00 O ATOM 691 OE2 GLU A 45 -7.883 3.250 -13.537 1.00 0.00 O ATOM 0 H GLU A 45 -5.234 -0.645 -11.361 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.911 0.704 -11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.249 -0.490 -13.741 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.778 0.353 -13.900 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.073 1.539 -13.211 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -6.010 1.787 -14.671 1.00 0.00 H new ATOM 699 N GLY A 46 -8.776 -1.591 -10.698 1.00 0.00 N ATOM 700 CA GLY A 46 -9.478 -2.879 -10.421 1.00 0.00 C ATOM 701 C GLY A 46 -8.637 -3.998 -9.760 1.00 0.00 C ATOM 702 O GLY A 46 -8.894 -4.419 -8.632 1.00 0.00 O ATOM 0 H GLY A 46 -9.002 -0.847 -10.038 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.333 -2.670 -9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.874 -3.261 -11.362 1.00 0.00 H new ATOM 706 N ASP A 47 -7.665 -4.524 -10.506 1.00 0.00 N ATOM 707 CA ASP A 47 -6.647 -5.494 -9.996 1.00 0.00 C ATOM 708 C ASP A 47 -5.183 -5.105 -10.393 1.00 0.00 C ATOM 709 O ASP A 47 -4.284 -5.211 -9.554 1.00 0.00 O ATOM 710 CB ASP A 47 -7.021 -6.931 -10.466 1.00 0.00 C ATOM 711 CG ASP A 47 -7.979 -7.768 -9.607 1.00 0.00 C ATOM 712 OD1 ASP A 47 -7.937 -8.995 -9.601 1.00 0.00 O ATOM 713 OD2 ASP A 47 -8.870 -7.031 -8.873 1.00 0.00 O ATOM 0 H ASP A 47 -7.546 -4.298 -11.493 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.664 -5.463 -8.907 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.458 -6.849 -11.461 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.094 -7.495 -10.570 1.00 0.00 H new ATOM 719 N LYS A 48 -4.919 -4.692 -11.648 1.00 0.00 N ATOM 720 CA LYS A 48 -3.572 -4.278 -12.112 1.00 0.00 C ATOM 721 C LYS A 48 -3.119 -2.859 -11.633 1.00 0.00 C ATOM 722 O LYS A 48 -3.916 -1.938 -11.426 1.00 0.00 O ATOM 723 CB LYS A 48 -3.579 -4.420 -13.659 1.00 0.00 C ATOM 724 CG LYS A 48 -4.443 -3.391 -14.434 1.00 0.00 C ATOM 725 CD LYS A 48 -4.822 -3.825 -15.864 1.00 0.00 C ATOM 726 CE LYS A 48 -5.914 -4.913 -15.939 1.00 0.00 C ATOM 727 NZ LYS A 48 -7.255 -4.355 -15.657 1.00 0.00 N ATOM 0 H LYS A 48 -5.633 -4.634 -12.374 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.821 -4.925 -11.658 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.552 -4.343 -14.015 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.930 -5.421 -13.910 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.357 -3.204 -13.870 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.902 -2.446 -14.486 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.162 -2.949 -16.417 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.927 -4.192 -16.367 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.909 -5.368 -16.930 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.690 -5.705 -15.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.965 -5.112 -15.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.266 -3.943 -14.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.478 -3.617 -16.355 1.00 0.00 H new ATOM 740 N VAL A 49 -1.799 -2.693 -11.531 1.00 0.00 N ATOM 741 CA VAL A 49 -1.146 -1.374 -11.306 1.00 0.00 C ATOM 742 C VAL A 49 -0.817 -0.768 -12.713 1.00 0.00 C ATOM 743 O VAL A 49 -0.135 -1.400 -13.531 1.00 0.00 O ATOM 744 CB VAL A 49 0.135 -1.554 -10.422 1.00 0.00 C ATOM 745 CG1 VAL A 49 0.844 -0.213 -10.129 1.00 0.00 C ATOM 746 CG2 VAL A 49 -0.081 -2.247 -9.055 1.00 0.00 C ATOM 0 H VAL A 49 -1.137 -3.466 -11.601 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.802 -0.691 -10.766 1.00 0.00 H new ATOM 0 HB VAL A 49 0.745 -2.209 -11.044 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.725 -0.394 -9.513 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.147 0.251 -11.068 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.161 0.451 -9.599 1.00 0.00 H new ATOM 0 HG21 VAL A 49 0.871 -2.318 -8.529 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.783 -1.664 -8.458 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.484 -3.247 -9.214 1.00 0.00 H new ATOM 756 N VAL A 50 -1.291 0.460 -12.980 1.00 0.00 N ATOM 757 CA VAL A 50 -1.026 1.168 -14.268 1.00 0.00 C ATOM 758 C VAL A 50 -0.097 2.384 -13.953 1.00 0.00 C ATOM 759 O VAL A 50 -0.508 3.350 -13.298 1.00 0.00 O ATOM 760 CB VAL A 50 -2.343 1.544 -15.028 1.00 0.00 C ATOM 761 CG1 VAL A 50 -2.060 2.165 -16.418 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.284 0.338 -15.266 1.00 0.00 C ATOM 0 H VAL A 50 -1.863 0.994 -12.326 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.513 0.509 -14.969 1.00 0.00 H new ATOM 0 HB VAL A 50 -2.827 2.264 -14.368 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.003 2.409 -16.906 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.468 3.073 -16.297 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.509 1.451 -17.030 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.176 0.671 -15.797 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.767 -0.415 -15.862 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.572 -0.093 -14.307 1.00 0.00 H new ATOM 772 N ILE A 51 1.160 2.315 -14.425 1.00 0.00 N ATOM 773 CA ILE A 51 2.200 3.351 -14.152 1.00 0.00 C ATOM 774 C ILE A 51 2.396 4.177 -15.462 1.00 0.00 C ATOM 775 O ILE A 51 3.007 3.712 -16.429 1.00 0.00 O ATOM 776 CB ILE A 51 3.513 2.713 -13.560 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.218 1.955 -12.228 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.631 3.776 -13.388 1.00 0.00 C ATOM 779 CD1 ILE A 51 4.390 1.364 -11.428 1.00 0.00 C ATOM 0 H ILE A 51 1.494 1.546 -15.006 1.00 0.00 H new ATOM 0 HA ILE A 51 1.882 4.041 -13.370 1.00 0.00 H new ATOM 0 HB ILE A 51 3.881 1.978 -14.276 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.685 2.642 -11.571 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.534 1.139 -12.459 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.523 3.303 -12.978 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.867 4.216 -14.357 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.289 4.557 -12.709 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.009 0.873 -10.533 1.00 0.00 H new ATOM 0 HD12 ILE A 51 4.920 0.637 -12.043 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.074 2.163 -11.140 1.00 0.00 H new ATOM 791 N ARG A 52 1.883 5.414 -15.478 1.00 0.00 N ATOM 792 CA ARG A 52 1.951 6.303 -16.671 1.00 0.00 C ATOM 793 C ARG A 52 3.226 7.193 -16.599 1.00 0.00 C ATOM 794 O ARG A 52 3.228 8.230 -15.932 1.00 0.00 O ATOM 795 CB ARG A 52 0.637 7.128 -16.747 1.00 0.00 C ATOM 796 CG ARG A 52 -0.643 6.311 -17.062 1.00 0.00 C ATOM 797 CD ARG A 52 -1.975 7.051 -16.797 1.00 0.00 C ATOM 798 NE ARG A 52 -2.214 7.398 -15.362 1.00 0.00 N ATOM 799 CZ ARG A 52 -2.583 6.549 -14.401 1.00 0.00 C ATOM 800 NH1 ARG A 52 -2.750 5.267 -14.580 1.00 0.00 N ATOM 801 NH2 ARG A 52 -2.794 7.013 -13.210 1.00 0.00 N ATOM 0 H ARG A 52 1.411 5.835 -14.678 1.00 0.00 H new ATOM 0 HA ARG A 52 2.034 5.721 -17.589 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.495 7.642 -15.796 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.754 7.897 -17.511 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.615 6.010 -18.109 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.628 5.398 -16.467 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.991 7.967 -17.387 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.798 6.430 -17.150 1.00 0.00 H new ATOM 0 HE ARG A 52 -2.083 8.373 -15.093 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.597 4.856 -15.501 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.034 4.676 -13.799 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -2.677 8.009 -13.023 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.077 6.383 -12.460 1.00 0.00 H new ATOM 815 N THR A 53 4.309 6.787 -17.285 1.00 0.00 N ATOM 816 CA THR A 53 5.557 7.603 -17.398 1.00 0.00 C ATOM 817 C THR A 53 5.419 8.608 -18.587 1.00 0.00 C ATOM 818 O THR A 53 5.601 8.258 -19.761 1.00 0.00 O ATOM 819 CB THR A 53 6.781 6.640 -17.399 1.00 0.00 C ATOM 820 OG1 THR A 53 6.853 5.976 -16.142 1.00 0.00 O ATOM 821 CG2 THR A 53 8.145 7.312 -17.624 1.00 0.00 C ATOM 0 H THR A 53 4.356 5.895 -17.777 1.00 0.00 H new ATOM 0 HA THR A 53 5.728 8.254 -16.541 1.00 0.00 H new ATOM 0 HB THR A 53 6.608 5.968 -18.240 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.621 5.367 -16.137 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.930 6.556 -17.607 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.147 7.816 -18.591 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.326 8.041 -16.834 1.00 0.00 H new ATOM 829 N LEU A 54 5.035 9.853 -18.247 1.00 0.00 N ATOM 830 CA LEU A 54 4.551 10.859 -19.226 1.00 0.00 C ATOM 831 C LEU A 54 5.562 12.035 -19.370 1.00 0.00 C ATOM 832 O LEU A 54 5.935 12.691 -18.392 1.00 0.00 O ATOM 833 CB LEU A 54 3.172 11.421 -18.762 1.00 0.00 C ATOM 834 CG LEU A 54 1.984 10.436 -18.605 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.751 11.174 -18.061 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.612 9.716 -19.910 1.00 0.00 C ATOM 0 H LEU A 54 5.050 10.195 -17.286 1.00 0.00 H new ATOM 0 HA LEU A 54 4.449 10.369 -20.194 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.322 11.915 -17.802 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.872 12.191 -19.473 1.00 0.00 H new ATOM 0 HG LEU A 54 2.313 9.672 -17.900 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.076 10.472 -17.955 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.986 11.607 -17.089 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.467 11.967 -18.753 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.774 9.043 -19.728 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.330 10.451 -20.664 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.468 9.142 -20.266 1.00 0.00 H new ATOM 848 N SER A 55 5.956 12.339 -20.610 1.00 0.00 N ATOM 849 CA SER A 55 6.623 13.625 -20.966 1.00 0.00 C ATOM 850 C SER A 55 5.845 14.373 -22.092 1.00 0.00 C ATOM 851 O SER A 55 5.052 13.776 -22.831 1.00 0.00 O ATOM 852 CB SER A 55 8.079 13.290 -21.371 1.00 0.00 C ATOM 853 OG SER A 55 8.864 13.037 -20.210 1.00 0.00 O ATOM 0 H SER A 55 5.828 11.712 -21.404 1.00 0.00 H new ATOM 0 HA SER A 55 6.629 14.308 -20.117 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.091 12.418 -22.025 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.507 14.118 -21.936 1.00 0.00 H new ATOM 0 HG SER A 55 9.329 13.858 -19.945 1.00 0.00 H new ATOM 859 N THR A 56 6.126 15.678 -22.298 1.00 0.00 N ATOM 860 CA THR A 56 5.575 16.460 -23.464 1.00 0.00 C ATOM 861 C THR A 56 6.276 16.110 -24.834 1.00 0.00 C ATOM 862 O THR A 56 6.847 16.965 -25.517 1.00 0.00 O ATOM 863 CB THR A 56 5.636 17.993 -23.164 1.00 0.00 C ATOM 864 OG1 THR A 56 6.992 18.429 -23.075 1.00 0.00 O ATOM 865 CG2 THR A 56 4.895 18.477 -21.906 1.00 0.00 C ATOM 0 H THR A 56 6.728 16.225 -21.683 1.00 0.00 H new ATOM 0 HA THR A 56 4.533 16.165 -23.583 1.00 0.00 H new ATOM 0 HB THR A 56 5.109 18.436 -24.009 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.449 18.253 -23.924 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.012 19.556 -21.808 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.836 18.233 -21.991 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.311 17.985 -21.027 1.00 0.00 H new ATOM 873 N PHE A 57 6.266 14.816 -25.177 1.00 0.00 N ATOM 874 CA PHE A 57 7.315 14.134 -25.992 1.00 0.00 C ATOM 875 C PHE A 57 6.929 12.615 -26.134 1.00 0.00 C ATOM 876 O PHE A 57 6.869 12.109 -27.256 1.00 0.00 O ATOM 877 CB PHE A 57 8.776 14.206 -25.420 1.00 0.00 C ATOM 878 CG PHE A 57 9.505 15.558 -25.360 1.00 0.00 C ATOM 879 CD1 PHE A 57 10.027 16.138 -26.520 1.00 0.00 C ATOM 880 CD2 PHE A 57 9.713 16.188 -24.127 1.00 0.00 C ATOM 881 CE1 PHE A 57 10.747 17.330 -26.447 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.430 17.378 -24.055 1.00 0.00 C ATOM 883 CZ PHE A 57 10.951 17.945 -25.214 1.00 0.00 C ATOM 0 H PHE A 57 5.515 14.186 -24.895 1.00 0.00 H new ATOM 0 HA PHE A 57 7.335 14.670 -26.941 1.00 0.00 H new ATOM 0 HB2 PHE A 57 8.749 13.805 -24.407 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.392 13.530 -26.014 1.00 0.00 H new ATOM 0 HD1 PHE A 57 9.872 15.661 -27.476 1.00 0.00 H new ATOM 0 HD2 PHE A 57 9.314 15.747 -23.225 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.146 17.776 -27.346 1.00 0.00 H new ATOM 0 HE2 PHE A 57 10.582 17.861 -23.101 1.00 0.00 H new ATOM 0 HZ PHE A 57 11.515 18.864 -25.157 1.00 0.00 H new ATOM 893 N LYS A 58 6.740 11.883 -25.004 1.00 0.00 N ATOM 894 CA LYS A 58 6.588 10.402 -24.980 1.00 0.00 C ATOM 895 C LYS A 58 5.487 9.995 -23.944 1.00 0.00 C ATOM 896 O LYS A 58 5.554 10.367 -22.765 1.00 0.00 O ATOM 897 CB LYS A 58 7.942 9.714 -24.610 1.00 0.00 C ATOM 898 CG LYS A 58 9.169 9.978 -25.518 1.00 0.00 C ATOM 899 CD LYS A 58 9.030 9.437 -26.958 1.00 0.00 C ATOM 900 CE LYS A 58 10.168 9.860 -27.907 1.00 0.00 C ATOM 901 NZ LYS A 58 10.085 11.299 -28.239 1.00 0.00 N ATOM 0 H LYS A 58 6.688 12.306 -24.077 1.00 0.00 H new ATOM 0 HA LYS A 58 6.289 10.070 -25.974 1.00 0.00 H new ATOM 0 HB2 LYS A 58 8.205 10.020 -23.597 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.772 8.638 -24.584 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.347 11.052 -25.563 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.049 9.528 -25.058 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.988 8.348 -26.922 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.081 9.779 -27.372 1.00 0.00 H new ATOM 0 HE2 LYS A 58 11.130 9.647 -27.442 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.119 9.270 -28.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 10.823 11.539 -28.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.150 11.509 -28.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.224 11.863 -27.376 1.00 0.00 H new ATOM 914 N ASN A 59 4.495 9.194 -24.374 1.00 0.00 N ATOM 915 CA ASN A 59 3.458 8.617 -23.470 1.00 0.00 C ATOM 916 C ASN A 59 3.762 7.100 -23.232 1.00 0.00 C ATOM 917 O ASN A 59 3.461 6.260 -24.086 1.00 0.00 O ATOM 918 CB ASN A 59 2.074 8.896 -24.124 1.00 0.00 C ATOM 919 CG ASN A 59 0.835 8.494 -23.307 1.00 0.00 C ATOM 920 OD1 ASN A 59 0.878 7.783 -22.308 1.00 0.00 O ATOM 921 ND2 ASN A 59 -0.330 8.931 -23.717 1.00 0.00 N ATOM 0 H ASN A 59 4.381 8.924 -25.351 1.00 0.00 H new ATOM 0 HA ASN A 59 3.458 9.073 -22.480 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.008 9.962 -24.341 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.037 8.373 -25.080 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -1.177 8.679 -23.208 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.390 9.523 -24.545 1.00 0.00 H new ATOM 928 N THR A 60 4.371 6.759 -22.082 1.00 0.00 N ATOM 929 CA THR A 60 4.862 5.370 -21.809 1.00 0.00 C ATOM 930 C THR A 60 4.056 4.723 -20.633 1.00 0.00 C ATOM 931 O THR A 60 4.403 4.878 -19.457 1.00 0.00 O ATOM 932 CB THR A 60 6.414 5.339 -21.610 1.00 0.00 C ATOM 933 OG1 THR A 60 6.838 6.078 -20.476 1.00 0.00 O ATOM 934 CG2 THR A 60 7.250 5.885 -22.773 1.00 0.00 C ATOM 0 H THR A 60 4.541 7.415 -21.320 1.00 0.00 H new ATOM 0 HA THR A 60 4.674 4.749 -22.685 1.00 0.00 H new ATOM 0 HB THR A 60 6.590 4.268 -21.507 1.00 0.00 H new ATOM 0 HG1 THR A 60 6.205 6.806 -20.305 1.00 0.00 H new ATOM 0 HG21 THR A 60 8.309 5.814 -22.525 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.048 5.302 -23.671 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.988 6.928 -22.951 1.00 0.00 H new ATOM 942 N GLU A 61 2.958 4.003 -20.946 1.00 0.00 N ATOM 943 CA GLU A 61 2.063 3.395 -19.916 1.00 0.00 C ATOM 944 C GLU A 61 2.406 1.901 -19.585 1.00 0.00 C ATOM 945 O GLU A 61 2.491 1.045 -20.470 1.00 0.00 O ATOM 946 CB GLU A 61 0.573 3.646 -20.281 1.00 0.00 C ATOM 947 CG GLU A 61 -0.027 2.872 -21.483 1.00 0.00 C ATOM 948 CD GLU A 61 -1.521 3.133 -21.680 1.00 0.00 C ATOM 949 OE1 GLU A 61 -2.380 2.848 -20.850 1.00 0.00 O ATOM 950 OE2 GLU A 61 -1.796 3.716 -22.879 1.00 0.00 O ATOM 0 H GLU A 61 2.662 3.823 -21.905 1.00 0.00 H new ATOM 0 HA GLU A 61 2.250 3.904 -18.971 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -0.029 3.415 -19.402 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.453 4.711 -20.478 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.507 3.152 -22.391 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.133 1.804 -21.336 1.00 0.00 H new ATOM 958 N ILE A 62 2.595 1.601 -18.289 1.00 0.00 N ATOM 959 CA ILE A 62 3.072 0.270 -17.802 1.00 0.00 C ATOM 960 C ILE A 62 1.914 -0.397 -16.985 1.00 0.00 C ATOM 961 O ILE A 62 1.722 -0.114 -15.799 1.00 0.00 O ATOM 962 CB ILE A 62 4.426 0.502 -17.035 1.00 0.00 C ATOM 963 CG1 ILE A 62 5.621 0.755 -18.000 1.00 0.00 C ATOM 964 CG2 ILE A 62 4.802 -0.593 -16.009 1.00 0.00 C ATOM 965 CD1 ILE A 62 6.698 1.684 -17.415 1.00 0.00 C ATOM 0 H ILE A 62 2.424 2.269 -17.537 1.00 0.00 H new ATOM 0 HA ILE A 62 3.302 -0.441 -18.596 1.00 0.00 H new ATOM 0 HB ILE A 62 4.230 1.405 -16.456 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.078 -0.201 -18.257 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.244 1.188 -18.927 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.751 -0.338 -15.536 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.024 -0.661 -15.248 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.896 -1.552 -16.518 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.499 1.815 -18.142 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.256 2.653 -17.184 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.103 1.243 -16.504 1.00 0.00 H new ATOM 977 N SER A 63 1.159 -1.292 -17.639 1.00 0.00 N ATOM 978 CA SER A 63 -0.005 -2.002 -17.034 1.00 0.00 C ATOM 979 C SER A 63 0.345 -3.471 -16.641 1.00 0.00 C ATOM 980 O SER A 63 0.636 -4.289 -17.522 1.00 0.00 O ATOM 981 CB SER A 63 -1.178 -1.967 -18.045 1.00 0.00 C ATOM 982 OG SER A 63 -0.892 -2.738 -19.216 1.00 0.00 O ATOM 0 H SER A 63 1.330 -1.554 -18.610 1.00 0.00 H new ATOM 0 HA SER A 63 -0.288 -1.495 -16.111 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.080 -2.350 -17.569 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.382 -0.935 -18.330 1.00 0.00 H new ATOM 0 HG SER A 63 -0.295 -3.479 -18.982 1.00 0.00 H new ATOM 988 N PHE A 64 0.296 -3.807 -15.341 1.00 0.00 N ATOM 989 CA PHE A 64 0.767 -5.130 -14.827 1.00 0.00 C ATOM 990 C PHE A 64 0.009 -5.572 -13.533 1.00 0.00 C ATOM 991 O PHE A 64 -0.317 -4.750 -12.673 1.00 0.00 O ATOM 992 CB PHE A 64 2.316 -5.103 -14.592 1.00 0.00 C ATOM 993 CG PHE A 64 2.835 -4.167 -13.477 1.00 0.00 C ATOM 994 CD1 PHE A 64 3.021 -2.810 -13.745 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.014 -4.635 -12.170 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.365 -1.932 -12.724 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.350 -3.755 -11.146 1.00 0.00 C ATOM 998 CZ PHE A 64 3.531 -2.403 -11.424 1.00 0.00 C ATOM 0 H PHE A 64 -0.064 -3.187 -14.615 1.00 0.00 H new ATOM 0 HA PHE A 64 0.540 -5.875 -15.590 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.643 -6.117 -14.363 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.797 -4.816 -15.527 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.897 -2.440 -14.752 1.00 0.00 H new ATOM 0 HD2 PHE A 64 2.890 -5.686 -11.955 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.504 -0.883 -12.939 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.470 -4.120 -10.137 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.800 -1.720 -10.632 1.00 0.00 H new ATOM 1008 N GLN A 65 -0.158 -6.888 -13.322 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.281 -7.450 -11.941 1.00 0.00 C ATOM 1010 C GLN A 65 1.140 -7.766 -11.349 1.00 0.00 C ATOM 1011 O GLN A 65 2.093 -8.039 -12.087 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.232 -8.679 -11.944 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.718 -8.344 -12.256 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.696 -9.502 -12.050 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -4.038 -10.237 -12.969 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -4.194 -9.692 -10.851 1.00 0.00 N ATOM 0 H GLN A 65 -0.212 -7.583 -14.067 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.732 -6.708 -11.281 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.873 -9.399 -12.680 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.179 -9.166 -10.970 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.027 -7.510 -11.626 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.790 -8.006 -13.290 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -3.915 -9.085 -10.081 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.861 -10.447 -10.689 1.00 0.00 H new ATOM 1025 N LEU A 66 1.312 -7.697 -10.015 1.00 0.00 N ATOM 1026 CA LEU A 66 2.646 -7.871 -9.351 1.00 0.00 C ATOM 1027 C LEU A 66 3.283 -9.286 -9.581 1.00 0.00 C ATOM 1028 O LEU A 66 2.664 -10.311 -9.280 1.00 0.00 O ATOM 1029 CB LEU A 66 2.486 -7.570 -7.833 1.00 0.00 C ATOM 1030 CG LEU A 66 2.361 -6.072 -7.438 1.00 0.00 C ATOM 1031 CD1 LEU A 66 1.716 -5.940 -6.048 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.731 -5.365 -7.427 1.00 0.00 C ATOM 0 H LEU A 66 0.548 -7.522 -9.362 1.00 0.00 H new ATOM 0 HA LEU A 66 3.341 -7.168 -9.810 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.601 -8.094 -7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.343 -7.992 -7.308 1.00 0.00 H new ATOM 0 HG LEU A 66 1.733 -5.593 -8.189 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.634 -4.886 -5.783 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.723 -6.388 -6.064 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.333 -6.452 -5.310 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.599 -4.320 -7.146 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.387 -5.854 -6.707 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.177 -5.420 -8.420 1.00 0.00 H new ATOM 1044 N GLY A 67 4.493 -9.333 -10.173 1.00 0.00 N ATOM 1045 CA GLY A 67 5.053 -10.597 -10.739 1.00 0.00 C ATOM 1046 C GLY A 67 4.719 -10.982 -12.211 1.00 0.00 C ATOM 1047 O GLY A 67 5.331 -11.918 -12.728 1.00 0.00 O ATOM 0 H GLY A 67 5.104 -8.523 -10.276 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.138 -10.543 -10.652 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.722 -11.417 -10.102 1.00 0.00 H new ATOM 1051 N GLU A 68 3.784 -10.295 -12.891 1.00 0.00 N ATOM 1052 CA GLU A 68 3.383 -10.592 -14.292 1.00 0.00 C ATOM 1053 C GLU A 68 4.385 -9.952 -15.310 1.00 0.00 C ATOM 1054 O GLU A 68 4.629 -8.739 -15.300 1.00 0.00 O ATOM 1055 CB GLU A 68 1.924 -10.066 -14.466 1.00 0.00 C ATOM 1056 CG GLU A 68 1.089 -10.584 -15.667 1.00 0.00 C ATOM 1057 CD GLU A 68 1.608 -10.197 -17.050 1.00 0.00 C ATOM 1058 OE1 GLU A 68 1.552 -9.060 -17.511 1.00 0.00 O ATOM 1059 OE2 GLU A 68 2.198 -11.249 -17.683 1.00 0.00 O ATOM 0 H GLU A 68 3.276 -9.509 -12.486 1.00 0.00 H new ATOM 0 HA GLU A 68 3.411 -11.662 -14.496 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.375 -10.302 -13.554 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.970 -8.979 -14.538 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.039 -11.671 -15.609 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.070 -10.212 -15.564 1.00 0.00 H new ATOM 1067 N GLU A 69 4.940 -10.782 -16.208 1.00 0.00 N ATOM 1068 CA GLU A 69 5.846 -10.312 -17.291 1.00 0.00 C ATOM 1069 C GLU A 69 5.066 -9.807 -18.557 1.00 0.00 C ATOM 1070 O GLU A 69 4.189 -10.497 -19.091 1.00 0.00 O ATOM 1071 CB GLU A 69 6.853 -11.451 -17.596 1.00 0.00 C ATOM 1072 CG GLU A 69 8.058 -11.004 -18.462 1.00 0.00 C ATOM 1073 CD GLU A 69 9.110 -12.084 -18.680 1.00 0.00 C ATOM 1074 OE1 GLU A 69 9.300 -12.642 -19.756 1.00 0.00 O ATOM 1075 OE2 GLU A 69 9.831 -12.328 -17.545 1.00 0.00 O ATOM 0 H GLU A 69 4.781 -11.790 -16.212 1.00 0.00 H new ATOM 0 HA GLU A 69 6.397 -9.432 -16.959 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.224 -11.857 -16.655 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.330 -12.259 -18.107 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.689 -10.672 -19.432 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.531 -10.143 -17.989 1.00 0.00 H new ATOM 1083 N PHE A 70 5.399 -8.597 -19.031 1.00 0.00 N ATOM 1084 CA PHE A 70 4.697 -7.916 -20.158 1.00 0.00 C ATOM 1085 C PHE A 70 5.705 -7.404 -21.244 1.00 0.00 C ATOM 1086 O PHE A 70 6.863 -7.091 -20.952 1.00 0.00 O ATOM 1087 CB PHE A 70 3.766 -6.800 -19.576 1.00 0.00 C ATOM 1088 CG PHE A 70 4.430 -5.569 -18.917 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.849 -5.617 -17.583 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.661 -4.407 -19.663 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.544 -4.547 -17.024 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.339 -3.331 -19.096 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.807 -3.413 -17.789 1.00 0.00 C ATOM 0 H PHE A 70 6.169 -8.049 -18.647 1.00 0.00 H new ATOM 0 HA PHE A 70 4.064 -8.628 -20.688 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.129 -6.442 -20.385 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.113 -7.263 -18.836 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.632 -6.489 -16.983 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.312 -4.345 -20.683 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.879 -4.597 -15.998 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.502 -2.432 -19.672 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.375 -2.597 -17.367 1.00 0.00 H new ATOM 1103 N ASP A 71 5.257 -7.256 -22.506 1.00 0.00 N ATOM 1104 CA ASP A 71 6.049 -6.506 -23.531 1.00 0.00 C ATOM 1105 C ASP A 71 5.840 -4.964 -23.399 1.00 0.00 C ATOM 1106 O ASP A 71 4.711 -4.475 -23.288 1.00 0.00 O ATOM 1107 CB ASP A 71 5.705 -6.948 -24.976 1.00 0.00 C ATOM 1108 CG ASP A 71 6.380 -8.231 -25.446 1.00 0.00 C ATOM 1109 OD1 ASP A 71 7.354 -8.240 -26.195 1.00 0.00 O ATOM 1110 OD2 ASP A 71 5.782 -9.346 -24.937 1.00 0.00 O ATOM 0 H ASP A 71 4.372 -7.632 -22.846 1.00 0.00 H new ATOM 0 HA ASP A 71 7.095 -6.744 -23.338 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.625 -7.077 -25.051 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.978 -6.143 -25.659 1.00 0.00 H new ATOM 1116 N GLU A 72 6.947 -4.214 -23.465 1.00 0.00 N ATOM 1117 CA GLU A 72 6.929 -2.730 -23.367 1.00 0.00 C ATOM 1118 C GLU A 72 7.698 -2.127 -24.580 1.00 0.00 C ATOM 1119 O GLU A 72 8.931 -2.183 -24.615 1.00 0.00 O ATOM 1120 CB GLU A 72 7.561 -2.334 -22.006 1.00 0.00 C ATOM 1121 CG GLU A 72 7.346 -0.854 -21.601 1.00 0.00 C ATOM 1122 CD GLU A 72 8.161 -0.422 -20.384 1.00 0.00 C ATOM 1123 OE1 GLU A 72 8.314 -1.107 -19.378 1.00 0.00 O ATOM 1124 OE2 GLU A 72 8.688 0.825 -20.527 1.00 0.00 O ATOM 0 H GLU A 72 7.881 -4.606 -23.587 1.00 0.00 H new ATOM 0 HA GLU A 72 5.914 -2.335 -23.403 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.146 -2.974 -21.228 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.632 -2.534 -22.046 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.605 -0.215 -22.445 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.288 -0.694 -21.393 1.00 0.00 H new ATOM 1132 N THR A 73 6.989 -1.535 -25.564 1.00 0.00 N ATOM 1133 CA THR A 73 7.649 -0.829 -26.709 1.00 0.00 C ATOM 1134 C THR A 73 8.099 0.600 -26.265 1.00 0.00 C ATOM 1135 O THR A 73 7.295 1.530 -26.160 1.00 0.00 O ATOM 1136 CB THR A 73 6.743 -0.833 -27.975 1.00 0.00 C ATOM 1137 OG1 THR A 73 6.406 -2.172 -28.326 1.00 0.00 O ATOM 1138 CG2 THR A 73 7.413 -0.229 -29.223 1.00 0.00 C ATOM 0 H THR A 73 5.970 -1.525 -25.599 1.00 0.00 H new ATOM 0 HA THR A 73 8.550 -1.370 -26.998 1.00 0.00 H new ATOM 0 HB THR A 73 5.877 -0.228 -27.705 1.00 0.00 H new ATOM 0 HG1 THR A 73 5.835 -2.168 -29.122 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.719 -0.268 -30.063 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.685 0.808 -29.024 1.00 0.00 H new ATOM 0 HG23 THR A 73 8.310 -0.799 -29.466 1.00 0.00 H new ATOM 1146 N THR A 74 9.398 0.737 -25.969 1.00 0.00 N ATOM 1147 CA THR A 74 9.952 1.962 -25.315 1.00 0.00 C ATOM 1148 C THR A 74 10.309 3.118 -26.309 1.00 0.00 C ATOM 1149 O THR A 74 10.465 2.919 -27.518 1.00 0.00 O ATOM 1150 CB THR A 74 11.191 1.577 -24.438 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.243 1.049 -25.237 1.00 0.00 O ATOM 1152 CG2 THR A 74 10.906 0.588 -23.299 1.00 0.00 C ATOM 0 H THR A 74 10.098 0.022 -26.167 1.00 0.00 H new ATOM 0 HA THR A 74 9.157 2.363 -24.687 1.00 0.00 H new ATOM 0 HB THR A 74 11.482 2.519 -23.973 1.00 0.00 H new ATOM 0 HG1 THR A 74 13.090 1.116 -24.749 1.00 0.00 H new ATOM 0 HG21 THR A 74 11.828 0.387 -22.753 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.168 1.017 -22.621 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.519 -0.343 -23.714 1.00 0.00 H new ATOM 1160 N ALA A 75 10.552 4.326 -25.761 1.00 0.00 N ATOM 1161 CA ALA A 75 11.163 5.464 -26.520 1.00 0.00 C ATOM 1162 C ALA A 75 12.593 5.275 -27.156 1.00 0.00 C ATOM 1163 O ALA A 75 13.011 6.070 -28.004 1.00 0.00 O ATOM 1164 CB ALA A 75 11.146 6.652 -25.540 1.00 0.00 C ATOM 0 H ALA A 75 10.337 4.551 -24.790 1.00 0.00 H new ATOM 0 HA ALA A 75 10.567 5.596 -27.423 1.00 0.00 H new ATOM 0 HB1 ALA A 75 11.579 7.528 -26.023 1.00 0.00 H new ATOM 0 HB2 ALA A 75 10.118 6.869 -25.249 1.00 0.00 H new ATOM 0 HB3 ALA A 75 11.729 6.401 -24.654 1.00 0.00 H new ATOM 1170 N ASP A 76 13.332 4.224 -26.764 1.00 0.00 N ATOM 1171 CA ASP A 76 14.490 3.681 -27.535 1.00 0.00 C ATOM 1172 C ASP A 76 14.143 2.874 -28.841 1.00 0.00 C ATOM 1173 O ASP A 76 15.078 2.588 -29.591 1.00 0.00 O ATOM 1174 CB ASP A 76 15.232 2.808 -26.479 1.00 0.00 C ATOM 1175 CG ASP A 76 16.592 2.137 -26.740 1.00 0.00 C ATOM 1176 OD1 ASP A 76 17.261 1.687 -25.812 1.00 0.00 O ATOM 1177 OD2 ASP A 76 16.959 2.059 -28.054 1.00 0.00 O ATOM 0 H ASP A 76 13.151 3.715 -25.899 1.00 0.00 H new ATOM 0 HA ASP A 76 15.085 4.493 -27.952 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.363 3.436 -25.598 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.544 2.010 -26.201 1.00 0.00 H new ATOM 1183 N ASP A 77 12.882 2.457 -29.094 1.00 0.00 N ATOM 1184 CA ASP A 77 12.506 1.456 -30.138 1.00 0.00 C ATOM 1185 C ASP A 77 12.999 0.006 -29.800 1.00 0.00 C ATOM 1186 O ASP A 77 13.900 -0.543 -30.438 1.00 0.00 O ATOM 1187 CB ASP A 77 12.798 1.962 -31.581 1.00 0.00 C ATOM 1188 CG ASP A 77 12.082 1.185 -32.686 1.00 0.00 C ATOM 1189 OD1 ASP A 77 10.883 0.923 -32.672 1.00 0.00 O ATOM 1190 OD2 ASP A 77 12.921 0.819 -33.693 1.00 0.00 O ATOM 0 H ASP A 77 12.078 2.808 -28.574 1.00 0.00 H new ATOM 0 HA ASP A 77 11.421 1.355 -30.120 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.511 3.011 -31.649 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.872 1.913 -31.758 1.00 0.00 H new ATOM 1196 N ARG A 78 12.382 -0.600 -28.773 1.00 0.00 N ATOM 1197 CA ARG A 78 12.708 -1.977 -28.305 1.00 0.00 C ATOM 1198 C ARG A 78 11.510 -2.513 -27.461 1.00 0.00 C ATOM 1199 O ARG A 78 11.080 -1.854 -26.504 1.00 0.00 O ATOM 1200 CB ARG A 78 14.063 -2.057 -27.525 1.00 0.00 C ATOM 1201 CG ARG A 78 14.199 -1.132 -26.295 1.00 0.00 C ATOM 1202 CD ARG A 78 15.472 -1.337 -25.459 1.00 0.00 C ATOM 1203 NE ARG A 78 15.607 -0.303 -24.401 1.00 0.00 N ATOM 1204 CZ ARG A 78 14.893 -0.248 -23.271 1.00 0.00 C ATOM 1205 NH1 ARG A 78 14.097 -1.200 -22.869 1.00 0.00 N ATOM 1206 NH2 ARG A 78 14.975 0.806 -22.521 1.00 0.00 N ATOM 0 H ARG A 78 11.638 -0.155 -28.235 1.00 0.00 H new ATOM 0 HA ARG A 78 12.854 -2.614 -29.178 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.209 -3.086 -27.197 1.00 0.00 H new ATOM 0 HB3 ARG A 78 14.871 -1.826 -28.219 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.169 -0.097 -26.634 1.00 0.00 H new ATOM 0 HG3 ARG A 78 13.333 -1.281 -25.651 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.451 -2.326 -25.001 1.00 0.00 H new ATOM 0 HD3 ARG A 78 16.345 -1.306 -26.111 1.00 0.00 H new ATOM 0 HE ARG A 78 16.304 0.427 -24.549 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.992 -2.047 -23.427 1.00 0.00 H new ATOM 0 HH12 ARG A 78 13.579 -1.097 -21.996 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.579 1.581 -22.795 1.00 0.00 H new ATOM 0 HH22 ARG A 78 14.436 0.860 -21.657 1.00 0.00 H new ATOM 1220 N ASN A 79 10.995 -3.712 -27.793 1.00 0.00 N ATOM 1221 CA ASN A 79 9.957 -4.405 -26.980 1.00 0.00 C ATOM 1222 C ASN A 79 10.600 -5.255 -25.834 1.00 0.00 C ATOM 1223 O ASN A 79 10.931 -6.430 -26.016 1.00 0.00 O ATOM 1224 CB ASN A 79 8.969 -5.169 -27.907 1.00 0.00 C ATOM 1225 CG ASN A 79 9.536 -6.285 -28.801 1.00 0.00 C ATOM 1226 OD1 ASN A 79 10.274 -6.037 -29.749 1.00 0.00 O ATOM 1227 ND2 ASN A 79 9.217 -7.529 -28.542 1.00 0.00 N ATOM 0 H ASN A 79 11.279 -4.231 -28.624 1.00 0.00 H new ATOM 0 HA ASN A 79 9.348 -3.671 -26.452 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.192 -5.606 -27.280 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.483 -4.438 -28.553 1.00 0.00 H new ATOM 0 HD21 ASN A 79 9.582 -8.281 -29.126 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.604 -7.745 -27.756 1.00 0.00 H new ATOM 1234 N CYS A 80 10.796 -4.649 -24.648 1.00 0.00 N ATOM 1235 CA CYS A 80 11.430 -5.338 -23.494 1.00 0.00 C ATOM 1236 C CYS A 80 10.443 -6.233 -22.690 1.00 0.00 C ATOM 1237 O CYS A 80 9.387 -5.777 -22.229 1.00 0.00 O ATOM 1238 CB CYS A 80 12.136 -4.311 -22.581 1.00 0.00 C ATOM 1239 SG CYS A 80 11.225 -2.736 -22.429 1.00 0.00 S ATOM 0 H CYS A 80 10.527 -3.684 -24.458 1.00 0.00 H new ATOM 0 HA CYS A 80 12.175 -6.021 -23.903 1.00 0.00 H new ATOM 0 HB2 CYS A 80 12.266 -4.745 -21.590 1.00 0.00 H new ATOM 0 HB3 CYS A 80 13.133 -4.110 -22.974 1.00 0.00 H new ATOM 0 HG CYS A 80 11.918 -1.901 -21.714 1.00 0.00 H new ATOM 1245 N LYS A 81 10.854 -7.495 -22.467 1.00 0.00 N ATOM 1246 CA LYS A 81 10.129 -8.459 -21.598 1.00 0.00 C ATOM 1247 C LYS A 81 10.307 -8.070 -20.099 1.00 0.00 C ATOM 1248 O LYS A 81 11.333 -8.316 -19.455 1.00 0.00 O ATOM 1249 CB LYS A 81 10.618 -9.902 -21.894 1.00 0.00 C ATOM 1250 CG LYS A 81 10.286 -10.486 -23.291 1.00 0.00 C ATOM 1251 CD LYS A 81 8.794 -10.499 -23.707 1.00 0.00 C ATOM 1252 CE LYS A 81 7.792 -11.206 -22.772 1.00 0.00 C ATOM 1253 NZ LYS A 81 8.061 -12.653 -22.645 1.00 0.00 N ATOM 0 H LYS A 81 11.701 -7.883 -22.883 1.00 0.00 H new ATOM 0 HA LYS A 81 9.061 -8.422 -21.815 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.700 -9.926 -21.766 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.193 -10.565 -21.140 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.842 -9.918 -24.037 1.00 0.00 H new ATOM 0 HG3 LYS A 81 10.658 -11.510 -23.328 1.00 0.00 H new ATOM 0 HD2 LYS A 81 8.470 -9.465 -23.824 1.00 0.00 H new ATOM 0 HD3 LYS A 81 8.724 -10.968 -24.688 1.00 0.00 H new ATOM 0 HE2 LYS A 81 7.833 -10.744 -21.785 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.781 -11.060 -23.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 7.168 -13.180 -22.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 8.710 -12.953 -23.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 8.495 -12.846 -21.720 1.00 0.00 H new ATOM 1266 N SER A 82 9.291 -7.365 -19.605 1.00 0.00 N ATOM 1267 CA SER A 82 9.387 -6.515 -18.405 1.00 0.00 C ATOM 1268 C SER A 82 8.594 -7.129 -17.227 1.00 0.00 C ATOM 1269 O SER A 82 7.392 -7.376 -17.349 1.00 0.00 O ATOM 1270 CB SER A 82 8.787 -5.145 -18.794 1.00 0.00 C ATOM 1271 OG SER A 82 9.533 -4.495 -19.824 1.00 0.00 O ATOM 0 H SER A 82 8.363 -7.364 -20.028 1.00 0.00 H new ATOM 0 HA SER A 82 10.423 -6.422 -18.078 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.758 -5.284 -19.127 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.753 -4.503 -17.914 1.00 0.00 H new ATOM 0 HG SER A 82 9.445 -4.999 -20.660 1.00 0.00 H new ATOM 1277 N VAL A 83 9.256 -7.359 -16.087 1.00 0.00 N ATOM 1278 CA VAL A 83 8.597 -7.902 -14.861 1.00 0.00 C ATOM 1279 C VAL A 83 8.784 -6.911 -13.665 1.00 0.00 C ATOM 1280 O VAL A 83 9.877 -6.380 -13.439 1.00 0.00 O ATOM 1281 CB VAL A 83 9.053 -9.379 -14.601 1.00 0.00 C ATOM 1282 CG1 VAL A 83 10.539 -9.569 -14.219 1.00 0.00 C ATOM 1283 CG2 VAL A 83 8.171 -10.094 -13.555 1.00 0.00 C ATOM 0 H VAL A 83 10.254 -7.181 -15.973 1.00 0.00 H new ATOM 0 HA VAL A 83 7.518 -7.971 -15.000 1.00 0.00 H new ATOM 0 HB VAL A 83 8.925 -9.839 -15.581 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.742 -10.628 -14.063 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.172 -9.193 -15.023 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.752 -9.020 -13.302 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.530 -11.113 -13.412 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.221 -9.556 -12.608 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.139 -10.118 -13.905 1.00 0.00 H new ATOM 1293 N VAL A 84 7.697 -6.652 -12.913 1.00 0.00 N ATOM 1294 CA VAL A 84 7.700 -5.657 -11.800 1.00 0.00 C ATOM 1295 C VAL A 84 7.252 -6.362 -10.475 1.00 0.00 C ATOM 1296 O VAL A 84 6.144 -6.907 -10.388 1.00 0.00 O ATOM 1297 CB VAL A 84 6.831 -4.400 -12.145 1.00 0.00 C ATOM 1298 CG1 VAL A 84 6.869 -3.350 -11.012 1.00 0.00 C ATOM 1299 CG2 VAL A 84 7.212 -3.658 -13.447 1.00 0.00 C ATOM 0 H VAL A 84 6.798 -7.115 -13.049 1.00 0.00 H new ATOM 0 HA VAL A 84 8.712 -5.280 -11.656 1.00 0.00 H new ATOM 0 HB VAL A 84 5.838 -4.829 -12.279 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.254 -2.493 -11.289 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.483 -3.792 -10.093 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.897 -3.023 -10.853 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.547 -2.806 -13.588 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.242 -3.307 -13.378 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.116 -4.337 -14.294 1.00 0.00 H new ATOM 1309 N SER A 85 8.102 -6.290 -9.434 1.00 0.00 N ATOM 1310 CA SER A 85 7.833 -6.914 -8.106 1.00 0.00 C ATOM 1311 C SER A 85 8.093 -5.916 -6.931 1.00 0.00 C ATOM 1312 O SER A 85 9.008 -5.084 -6.969 1.00 0.00 O ATOM 1313 CB SER A 85 8.713 -8.182 -7.962 1.00 0.00 C ATOM 1314 OG SER A 85 8.271 -9.216 -8.844 1.00 0.00 O ATOM 0 H SER A 85 8.996 -5.801 -9.480 1.00 0.00 H new ATOM 0 HA SER A 85 6.780 -7.189 -8.053 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.752 -7.934 -8.179 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.678 -8.538 -6.932 1.00 0.00 H new ATOM 0 HG SER A 85 8.843 -10.005 -8.736 1.00 0.00 H new ATOM 1320 N LEU A 86 7.300 -6.035 -5.849 1.00 0.00 N ATOM 1321 CA LEU A 86 7.529 -5.275 -4.586 1.00 0.00 C ATOM 1322 C LEU A 86 8.556 -5.999 -3.657 1.00 0.00 C ATOM 1323 O LEU A 86 8.276 -7.065 -3.102 1.00 0.00 O ATOM 1324 CB LEU A 86 6.172 -5.027 -3.858 1.00 0.00 C ATOM 1325 CG LEU A 86 5.532 -3.634 -4.078 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.083 -3.647 -3.561 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.293 -2.506 -3.357 1.00 0.00 C ATOM 0 H LEU A 86 6.488 -6.652 -5.816 1.00 0.00 H new ATOM 0 HA LEU A 86 7.964 -4.309 -4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.462 -5.787 -4.184 1.00 0.00 H new ATOM 0 HB3 LEU A 86 6.324 -5.171 -2.788 1.00 0.00 H new ATOM 0 HG LEU A 86 5.571 -3.435 -5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.633 -2.667 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.510 -4.399 -4.103 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.078 -3.884 -2.497 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.798 -1.554 -3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.303 -2.701 -2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.317 -2.463 -3.728 1.00 0.00 H new ATOM 1339 N ASP A 87 9.735 -5.386 -3.473 1.00 0.00 N ATOM 1340 CA ASP A 87 10.826 -5.943 -2.622 1.00 0.00 C ATOM 1341 C ASP A 87 10.944 -5.156 -1.272 1.00 0.00 C ATOM 1342 O ASP A 87 11.843 -4.329 -1.098 1.00 0.00 O ATOM 1343 CB ASP A 87 12.099 -5.927 -3.515 1.00 0.00 C ATOM 1344 CG ASP A 87 13.321 -6.619 -2.913 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.307 -7.759 -2.459 1.00 0.00 O ATOM 1346 OD2 ASP A 87 14.432 -5.832 -2.945 1.00 0.00 O ATOM 0 H ASP A 87 9.970 -4.492 -3.904 1.00 0.00 H new ATOM 0 HA ASP A 87 10.638 -6.966 -2.295 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.863 -6.404 -4.466 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.358 -4.891 -3.733 1.00 0.00 H new ATOM 1352 N GLY A 88 10.026 -5.404 -0.315 1.00 0.00 N ATOM 1353 CA GLY A 88 10.023 -4.700 1.006 1.00 0.00 C ATOM 1354 C GLY A 88 9.763 -3.173 0.980 1.00 0.00 C ATOM 1355 O GLY A 88 10.641 -2.389 1.340 1.00 0.00 O ATOM 0 H GLY A 88 9.273 -6.084 -0.422 1.00 0.00 H new ATOM 0 HA2 GLY A 88 9.265 -5.164 1.637 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.986 -4.873 1.486 1.00 0.00 H new ATOM 1359 N ASP A 89 8.576 -2.755 0.499 1.00 0.00 N ATOM 1360 CA ASP A 89 8.316 -1.348 0.047 1.00 0.00 C ATOM 1361 C ASP A 89 9.338 -0.759 -1.004 1.00 0.00 C ATOM 1362 O ASP A 89 9.732 0.410 -0.912 1.00 0.00 O ATOM 1363 CB ASP A 89 8.020 -0.439 1.280 1.00 0.00 C ATOM 1364 CG ASP A 89 7.252 0.860 1.004 1.00 0.00 C ATOM 1365 OD1 ASP A 89 6.108 1.065 1.398 1.00 0.00 O ATOM 1366 OD2 ASP A 89 7.985 1.755 0.278 1.00 0.00 O ATOM 0 H ASP A 89 7.766 -3.368 0.408 1.00 0.00 H new ATOM 0 HA ASP A 89 7.413 -1.373 -0.563 1.00 0.00 H new ATOM 0 HB2 ASP A 89 7.454 -1.022 2.006 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.969 -0.181 1.749 1.00 0.00 H new ATOM 1372 N LYS A 90 9.715 -1.553 -2.023 1.00 0.00 N ATOM 1373 CA LYS A 90 10.594 -1.098 -3.135 1.00 0.00 C ATOM 1374 C LYS A 90 10.009 -1.650 -4.468 1.00 0.00 C ATOM 1375 O LYS A 90 9.996 -2.862 -4.701 1.00 0.00 O ATOM 1376 CB LYS A 90 12.082 -1.508 -2.949 1.00 0.00 C ATOM 1377 CG LYS A 90 12.767 -0.986 -1.663 1.00 0.00 C ATOM 1378 CD LYS A 90 14.303 -0.967 -1.758 1.00 0.00 C ATOM 1379 CE LYS A 90 14.955 -0.468 -0.460 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.401 -0.263 -0.674 1.00 0.00 N ATOM 0 H LYS A 90 9.424 -2.527 -2.106 1.00 0.00 H new ATOM 0 HA LYS A 90 10.605 -0.008 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.143 -2.596 -2.955 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.648 -1.152 -3.810 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.410 0.022 -1.453 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.469 -1.611 -0.821 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.665 -1.971 -1.982 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.607 -0.326 -2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 90 14.489 0.465 -0.143 1.00 0.00 H new ATOM 0 HE3 LYS A 90 14.795 -1.191 0.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.871 -0.124 0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.804 -1.097 -1.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.548 0.577 -1.269 1.00 0.00 H new ATOM 1393 N LEU A 91 9.503 -0.765 -5.341 1.00 0.00 N ATOM 1394 CA LEU A 91 8.860 -1.156 -6.626 1.00 0.00 C ATOM 1395 C LEU A 91 9.931 -1.408 -7.742 1.00 0.00 C ATOM 1396 O LEU A 91 10.278 -0.513 -8.524 1.00 0.00 O ATOM 1397 CB LEU A 91 7.795 -0.068 -6.998 1.00 0.00 C ATOM 1398 CG LEU A 91 6.304 -0.493 -6.977 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.436 0.704 -7.403 1.00 0.00 C ATOM 1400 CD2 LEU A 91 5.972 -1.685 -7.895 1.00 0.00 C ATOM 0 H LEU A 91 9.523 0.243 -5.185 1.00 0.00 H new ATOM 0 HA LEU A 91 8.339 -2.108 -6.522 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.916 0.770 -6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.026 0.302 -7.997 1.00 0.00 H new ATOM 0 HG LEU A 91 6.094 -0.814 -5.956 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.385 0.414 -7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.592 1.531 -6.711 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.715 1.016 -8.410 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.910 -1.917 -7.820 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.216 -1.429 -8.926 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.555 -2.553 -7.589 1.00 0.00 H new ATOM 1412 N VAL A 92 10.453 -2.643 -7.815 1.00 0.00 N ATOM 1413 CA VAL A 92 11.616 -2.993 -8.682 1.00 0.00 C ATOM 1414 C VAL A 92 11.087 -3.378 -10.099 1.00 0.00 C ATOM 1415 O VAL A 92 10.507 -4.451 -10.290 1.00 0.00 O ATOM 1416 CB VAL A 92 12.501 -4.108 -8.018 1.00 0.00 C ATOM 1417 CG1 VAL A 92 13.748 -4.458 -8.867 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.016 -3.753 -6.600 1.00 0.00 C ATOM 0 H VAL A 92 10.090 -3.433 -7.281 1.00 0.00 H new ATOM 0 HA VAL A 92 12.277 -2.134 -8.796 1.00 0.00 H new ATOM 0 HB VAL A 92 11.819 -4.955 -7.951 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.325 -5.233 -8.363 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.432 -4.819 -9.846 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.366 -3.568 -8.990 1.00 0.00 H new ATOM 0 HG21 VAL A 92 13.618 -4.576 -6.215 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.625 -2.850 -6.649 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.168 -3.583 -5.937 1.00 0.00 H new ATOM 1428 N HIS A 93 11.314 -2.495 -11.086 1.00 0.00 N ATOM 1429 CA HIS A 93 11.106 -2.822 -12.525 1.00 0.00 C ATOM 1430 C HIS A 93 12.369 -3.528 -13.111 1.00 0.00 C ATOM 1431 O HIS A 93 13.493 -3.098 -12.847 1.00 0.00 O ATOM 1432 CB HIS A 93 10.801 -1.486 -13.264 1.00 0.00 C ATOM 1433 CG HIS A 93 10.095 -1.541 -14.620 1.00 0.00 C ATOM 1434 ND1 HIS A 93 10.258 -2.532 -15.578 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.247 -0.527 -15.102 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.461 -2.021 -16.563 1.00 0.00 C ATOM 1437 NE2 HIS A 93 8.819 -0.834 -16.377 1.00 0.00 N ATOM 0 H HIS A 93 11.643 -1.543 -10.922 1.00 0.00 H new ATOM 0 HA HIS A 93 10.273 -3.514 -12.653 1.00 0.00 H new ATOM 0 HB2 HIS A 93 10.193 -0.872 -12.600 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.747 -0.963 -13.405 1.00 0.00 H new ATOM 0 HD1 HIS A 93 10.810 -3.389 -15.554 1.00 0.00 H new ATOM 0 HD2 HIS A 93 8.971 0.362 -14.554 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.340 -2.559 -17.491 1.00 0.00 H new ATOM 1445 N ILE A 94 12.190 -4.590 -13.906 1.00 0.00 N ATOM 1446 CA ILE A 94 13.312 -5.303 -14.588 1.00 0.00 C ATOM 1447 C ILE A 94 12.951 -5.360 -16.111 1.00 0.00 C ATOM 1448 O ILE A 94 12.015 -6.077 -16.473 1.00 0.00 O ATOM 1449 CB ILE A 94 13.527 -6.720 -13.938 1.00 0.00 C ATOM 1450 CG1 ILE A 94 13.915 -6.688 -12.427 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.601 -7.522 -14.709 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.673 -8.000 -11.659 1.00 0.00 C ATOM 0 H ILE A 94 11.272 -4.989 -14.103 1.00 0.00 H new ATOM 0 HA ILE A 94 14.264 -4.785 -14.472 1.00 0.00 H new ATOM 0 HB ILE A 94 12.554 -7.206 -14.006 1.00 0.00 H new ATOM 0 HG12 ILE A 94 14.970 -6.427 -12.345 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.351 -5.892 -11.941 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.732 -8.498 -14.241 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.283 -7.655 -15.743 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.546 -6.979 -14.687 1.00 0.00 H new ATOM 0 HD11 ILE A 94 13.974 -7.874 -10.619 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.614 -8.256 -11.701 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.259 -8.800 -12.112 1.00 0.00 H new ATOM 1464 N GLN A 95 13.693 -4.662 -16.999 1.00 0.00 N ATOM 1465 CA GLN A 95 13.459 -4.720 -18.474 1.00 0.00 C ATOM 1466 C GLN A 95 14.513 -5.650 -19.150 1.00 0.00 C ATOM 1467 O GLN A 95 15.717 -5.384 -19.061 1.00 0.00 O ATOM 1468 CB GLN A 95 13.525 -3.289 -19.083 1.00 0.00 C ATOM 1469 CG GLN A 95 12.348 -2.352 -18.706 1.00 0.00 C ATOM 1470 CD GLN A 95 12.369 -0.950 -19.339 1.00 0.00 C ATOM 1471 OE1 GLN A 95 13.012 -0.660 -20.347 1.00 0.00 O ATOM 1472 NE2 GLN A 95 11.650 -0.018 -18.762 1.00 0.00 N ATOM 0 H GLN A 95 14.462 -4.049 -16.727 1.00 0.00 H new ATOM 0 HA GLN A 95 12.466 -5.131 -18.658 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.457 -2.820 -18.766 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.565 -3.376 -20.169 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.416 -2.842 -18.988 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.333 -2.239 -17.622 1.00 0.00 H new ATOM 0 HE21 GLN A 95 11.109 -0.236 -17.925 1.00 0.00 H new ATOM 0 HE22 GLN A 95 11.632 0.925 -19.150 1.00 0.00 H new ATOM 1481 N LYS A 96 14.063 -6.715 -19.842 1.00 0.00 N ATOM 1482 CA LYS A 96 14.972 -7.699 -20.508 1.00 0.00 C ATOM 1483 C LYS A 96 14.778 -7.698 -22.059 1.00 0.00 C ATOM 1484 O LYS A 96 13.663 -7.862 -22.567 1.00 0.00 O ATOM 1485 CB LYS A 96 14.718 -9.116 -19.931 1.00 0.00 C ATOM 1486 CG LYS A 96 15.154 -9.318 -18.460 1.00 0.00 C ATOM 1487 CD LYS A 96 14.836 -10.714 -17.878 1.00 0.00 C ATOM 1488 CE LYS A 96 13.404 -10.938 -17.353 1.00 0.00 C ATOM 1489 NZ LYS A 96 12.420 -11.072 -18.445 1.00 0.00 N ATOM 0 H LYS A 96 13.072 -6.926 -19.961 1.00 0.00 H new ATOM 0 HA LYS A 96 16.002 -7.405 -20.307 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.654 -9.338 -20.011 1.00 0.00 H new ATOM 0 HB3 LYS A 96 15.243 -9.843 -20.551 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.228 -9.145 -18.386 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.666 -8.563 -17.844 1.00 0.00 H new ATOM 0 HD2 LYS A 96 15.035 -11.457 -18.650 1.00 0.00 H new ATOM 0 HD3 LYS A 96 15.532 -10.908 -17.062 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.382 -11.836 -16.736 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.120 -10.103 -16.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.602 -11.620 -18.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.105 -10.128 -18.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.859 -11.563 -19.250 1.00 0.00 H new ATOM 1502 N TRP A 97 15.870 -7.525 -22.821 1.00 0.00 N ATOM 1503 CA TRP A 97 15.829 -7.444 -24.312 1.00 0.00 C ATOM 1504 C TRP A 97 17.189 -7.921 -24.909 1.00 0.00 C ATOM 1505 O TRP A 97 18.244 -7.460 -24.467 1.00 0.00 O ATOM 1506 CB TRP A 97 15.420 -6.012 -24.797 1.00 0.00 C ATOM 1507 CG TRP A 97 16.477 -4.890 -24.720 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.236 -4.420 -25.816 1.00 0.00 C ATOM 1509 CD2 TRP A 97 17.014 -4.262 -23.606 1.00 0.00 C ATOM 1510 NE1 TRP A 97 18.231 -3.507 -25.414 1.00 0.00 N ATOM 1511 CE2 TRP A 97 18.101 -3.458 -24.038 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.730 -4.396 -22.225 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 18.957 -2.853 -23.089 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.585 -3.792 -21.307 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.698 -3.057 -21.731 1.00 0.00 C ATOM 0 H TRP A 97 16.809 -7.436 -22.434 1.00 0.00 H new ATOM 0 HA TRP A 97 15.055 -8.116 -24.683 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.093 -6.092 -25.834 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.555 -5.696 -24.213 1.00 0.00 H new ATOM 0 HD1 TRP A 97 17.073 -4.724 -26.839 1.00 0.00 H new ATOM 0 HE1 TRP A 97 18.893 -3.000 -26.001 1.00 0.00 H new ATOM 0 HE3 TRP A 97 15.868 -4.955 -21.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.792 -2.247 -23.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.386 -3.892 -20.250 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.369 -2.640 -20.995 1.00 0.00 H new ATOM 1526 N ASP A 98 17.197 -8.788 -25.944 1.00 0.00 N ATOM 1527 CA ASP A 98 18.436 -9.074 -26.759 1.00 0.00 C ATOM 1528 C ASP A 98 19.710 -9.649 -26.017 1.00 0.00 C ATOM 1529 O ASP A 98 20.836 -9.494 -26.501 1.00 0.00 O ATOM 1530 CB ASP A 98 18.768 -7.810 -27.620 1.00 0.00 C ATOM 1531 CG ASP A 98 17.758 -7.477 -28.717 1.00 0.00 C ATOM 1532 OD1 ASP A 98 16.829 -6.687 -28.574 1.00 0.00 O ATOM 1533 OD2 ASP A 98 17.994 -8.168 -29.865 1.00 0.00 O ATOM 0 H ASP A 98 16.374 -9.308 -26.247 1.00 0.00 H new ATOM 0 HA ASP A 98 18.170 -9.930 -27.378 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.852 -6.951 -26.955 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.745 -7.953 -28.081 1.00 0.00 H new ATOM 1539 N GLY A 99 19.551 -10.302 -24.850 1.00 0.00 N ATOM 1540 CA GLY A 99 20.685 -10.543 -23.904 1.00 0.00 C ATOM 1541 C GLY A 99 21.100 -9.418 -22.910 1.00 0.00 C ATOM 1542 O GLY A 99 22.142 -9.556 -22.268 1.00 0.00 O ATOM 0 H GLY A 99 18.657 -10.675 -24.530 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.438 -11.426 -23.315 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.562 -10.793 -24.501 1.00 0.00 H new ATOM 1546 N LYS A 100 20.314 -8.339 -22.761 1.00 0.00 N ATOM 1547 CA LYS A 100 20.644 -7.168 -21.904 1.00 0.00 C ATOM 1548 C LYS A 100 19.540 -6.959 -20.816 1.00 0.00 C ATOM 1549 O LYS A 100 18.340 -7.100 -21.086 1.00 0.00 O ATOM 1550 CB LYS A 100 20.744 -5.884 -22.776 1.00 0.00 C ATOM 1551 CG LYS A 100 21.843 -5.796 -23.851 1.00 0.00 C ATOM 1552 CD LYS A 100 21.368 -6.187 -25.255 1.00 0.00 C ATOM 1553 CE LYS A 100 22.531 -6.091 -26.248 1.00 0.00 C ATOM 1554 NZ LYS A 100 22.223 -6.841 -27.479 1.00 0.00 N ATOM 0 H LYS A 100 19.416 -8.246 -23.236 1.00 0.00 H new ATOM 0 HA LYS A 100 21.600 -7.359 -21.416 1.00 0.00 H new ATOM 0 HB2 LYS A 100 19.784 -5.749 -23.275 1.00 0.00 H new ATOM 0 HB3 LYS A 100 20.875 -5.038 -22.102 1.00 0.00 H new ATOM 0 HG2 LYS A 100 22.230 -4.777 -23.879 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.671 -6.444 -23.564 1.00 0.00 H new ATOM 0 HD2 LYS A 100 20.971 -7.202 -25.244 1.00 0.00 H new ATOM 0 HD3 LYS A 100 20.556 -5.531 -25.569 1.00 0.00 H new ATOM 0 HE2 LYS A 100 22.724 -5.046 -26.491 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.439 -6.486 -25.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 23.103 -7.027 -28.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 21.770 -7.744 -27.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 21.578 -6.282 -28.074 1.00 0.00 H new ATOM 1567 N GLU A 101 19.951 -6.578 -19.592 1.00 0.00 N ATOM 1568 CA GLU A 101 19.016 -6.338 -18.456 1.00 0.00 C ATOM 1569 C GLU A 101 19.310 -4.964 -17.772 1.00 0.00 C ATOM 1570 O GLU A 101 20.413 -4.738 -17.262 1.00 0.00 O ATOM 1571 CB GLU A 101 19.135 -7.533 -17.471 1.00 0.00 C ATOM 1572 CG GLU A 101 18.095 -7.529 -16.323 1.00 0.00 C ATOM 1573 CD GLU A 101 18.283 -8.669 -15.325 1.00 0.00 C ATOM 1574 OE1 GLU A 101 19.181 -8.703 -14.489 1.00 0.00 O ATOM 1575 OE2 GLU A 101 17.343 -9.644 -15.463 1.00 0.00 O ATOM 0 H GLU A 101 20.931 -6.426 -19.355 1.00 0.00 H new ATOM 0 HA GLU A 101 17.988 -6.279 -18.813 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.033 -8.461 -18.033 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.135 -7.531 -17.038 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.155 -6.579 -15.792 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.094 -7.592 -16.750 1.00 0.00 H new ATOM 1583 N THR A 102 18.299 -4.079 -17.709 1.00 0.00 N ATOM 1584 CA THR A 102 18.333 -2.859 -16.844 1.00 0.00 C ATOM 1585 C THR A 102 17.214 -2.920 -15.757 1.00 0.00 C ATOM 1586 O THR A 102 16.078 -3.329 -16.028 1.00 0.00 O ATOM 1587 CB THR A 102 18.307 -1.538 -17.670 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.477 -0.435 -16.786 1.00 0.00 O ATOM 1589 CG2 THR A 102 17.048 -1.238 -18.498 1.00 0.00 C ATOM 0 H THR A 102 17.438 -4.177 -18.246 1.00 0.00 H new ATOM 0 HA THR A 102 19.290 -2.850 -16.322 1.00 0.00 H new ATOM 0 HB THR A 102 19.112 -1.682 -18.391 1.00 0.00 H new ATOM 0 HG1 THR A 102 18.556 0.392 -17.306 1.00 0.00 H new ATOM 0 HG21 THR A 102 17.173 -0.288 -19.019 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.894 -2.034 -19.227 1.00 0.00 H new ATOM 0 HG23 THR A 102 16.183 -1.179 -17.837 1.00 0.00 H new ATOM 1597 N ASN A 103 17.538 -2.475 -14.527 1.00 0.00 N ATOM 1598 CA ASN A 103 16.648 -2.663 -13.341 1.00 0.00 C ATOM 1599 C ASN A 103 16.463 -1.316 -12.558 1.00 0.00 C ATOM 1600 O ASN A 103 17.405 -0.529 -12.418 1.00 0.00 O ATOM 1601 CB ASN A 103 17.082 -3.839 -12.402 1.00 0.00 C ATOM 1602 CG ASN A 103 17.929 -4.999 -12.946 1.00 0.00 C ATOM 1603 OD1 ASN A 103 17.424 -6.053 -13.309 1.00 0.00 O ATOM 1604 ND2 ASN A 103 19.231 -4.846 -13.019 1.00 0.00 N ATOM 0 H ASN A 103 18.406 -1.982 -14.319 1.00 0.00 H new ATOM 0 HA ASN A 103 15.677 -2.963 -13.734 1.00 0.00 H new ATOM 0 HB2 ASN A 103 17.634 -3.400 -11.571 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.172 -4.272 -11.987 1.00 0.00 H new ATOM 0 HD21 ASN A 103 19.814 -5.603 -13.376 1.00 0.00 H new ATOM 0 HD22 ASN A 103 19.659 -3.970 -12.718 1.00 0.00 H new ATOM 1611 N PHE A 104 15.243 -1.035 -12.061 1.00 0.00 N ATOM 1612 CA PHE A 104 14.843 0.335 -11.614 1.00 0.00 C ATOM 1613 C PHE A 104 14.198 0.222 -10.196 1.00 0.00 C ATOM 1614 O PHE A 104 13.032 -0.172 -10.063 1.00 0.00 O ATOM 1615 CB PHE A 104 13.863 1.035 -12.614 1.00 0.00 C ATOM 1616 CG PHE A 104 14.182 1.042 -14.126 1.00 0.00 C ATOM 1617 CD1 PHE A 104 13.998 -0.119 -14.888 1.00 0.00 C ATOM 1618 CD2 PHE A 104 14.583 2.216 -14.771 1.00 0.00 C ATOM 1619 CE1 PHE A 104 14.225 -0.111 -16.256 1.00 0.00 C ATOM 1620 CE2 PHE A 104 14.797 2.227 -16.149 1.00 0.00 C ATOM 1621 CZ PHE A 104 14.619 1.063 -16.890 1.00 0.00 C ATOM 0 H PHE A 104 14.508 -1.734 -11.954 1.00 0.00 H new ATOM 0 HA PHE A 104 15.735 0.961 -11.580 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.885 0.569 -12.490 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.764 2.073 -12.298 1.00 0.00 H new ATOM 0 HD1 PHE A 104 13.676 -1.030 -14.405 1.00 0.00 H new ATOM 0 HD2 PHE A 104 14.728 3.120 -14.198 1.00 0.00 H new ATOM 0 HE1 PHE A 104 14.096 -1.017 -16.830 1.00 0.00 H new ATOM 0 HE2 PHE A 104 15.101 3.139 -16.641 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.787 1.071 -17.957 1.00 0.00 H new ATOM 1631 N VAL A 105 14.956 0.551 -9.138 1.00 0.00 N ATOM 1632 CA VAL A 105 14.542 0.291 -7.724 1.00 0.00 C ATOM 1633 C VAL A 105 13.829 1.563 -7.155 1.00 0.00 C ATOM 1634 O VAL A 105 14.485 2.504 -6.701 1.00 0.00 O ATOM 1635 CB VAL A 105 15.781 -0.187 -6.884 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.472 -0.412 -5.385 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.444 -1.487 -7.407 1.00 0.00 C ATOM 0 H VAL A 105 15.867 1.001 -9.222 1.00 0.00 H new ATOM 0 HA VAL A 105 13.817 -0.521 -7.668 1.00 0.00 H new ATOM 0 HB VAL A 105 16.470 0.649 -7.003 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.376 -0.741 -4.872 1.00 0.00 H new ATOM 0 HG12 VAL A 105 15.122 0.520 -4.942 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.700 -1.174 -5.283 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.290 -1.746 -6.770 1.00 0.00 H new ATOM 0 HG22 VAL A 105 15.716 -2.298 -7.391 1.00 0.00 H new ATOM 0 HG23 VAL A 105 16.792 -1.332 -8.428 1.00 0.00 H new ATOM 1647 N ARG A 106 12.485 1.582 -7.181 1.00 0.00 N ATOM 1648 CA ARG A 106 11.666 2.742 -6.714 1.00 0.00 C ATOM 1649 C ARG A 106 11.323 2.603 -5.205 1.00 0.00 C ATOM 1650 O ARG A 106 10.509 1.754 -4.841 1.00 0.00 O ATOM 1651 CB ARG A 106 10.377 2.790 -7.583 1.00 0.00 C ATOM 1652 CG ARG A 106 10.600 3.257 -9.044 1.00 0.00 C ATOM 1653 CD ARG A 106 9.423 3.018 -10.004 1.00 0.00 C ATOM 1654 NE ARG A 106 9.273 1.556 -10.233 1.00 0.00 N ATOM 1655 CZ ARG A 106 8.425 0.990 -11.078 1.00 0.00 C ATOM 1656 NH1 ARG A 106 7.760 1.649 -11.991 1.00 0.00 N ATOM 1657 NH2 ARG A 106 8.261 -0.292 -10.990 1.00 0.00 N ATOM 0 H ARG A 106 11.926 0.801 -7.524 1.00 0.00 H new ATOM 0 HA ARG A 106 12.225 3.671 -6.825 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.927 1.797 -7.598 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.659 3.458 -7.108 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.828 4.323 -9.035 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.478 2.747 -9.440 1.00 0.00 H new ATOM 0 HD2 ARG A 106 8.505 3.429 -9.584 1.00 0.00 H new ATOM 0 HD3 ARG A 106 9.598 3.531 -10.950 1.00 0.00 H new ATOM 0 HE ARG A 106 9.876 0.936 -9.692 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.881 2.658 -12.081 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.121 1.154 -12.613 1.00 0.00 H new ATOM 0 HH21 ARG A 106 8.776 -0.825 -10.289 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.617 -0.768 -11.622 1.00 0.00 H new ATOM 1671 N GLU A 107 11.924 3.419 -4.327 1.00 0.00 N ATOM 1672 CA GLU A 107 11.797 3.255 -2.846 1.00 0.00 C ATOM 1673 C GLU A 107 11.257 4.542 -2.145 1.00 0.00 C ATOM 1674 O GLU A 107 11.749 5.643 -2.411 1.00 0.00 O ATOM 1675 CB GLU A 107 13.165 2.758 -2.296 1.00 0.00 C ATOM 1676 CG GLU A 107 14.400 3.698 -2.417 1.00 0.00 C ATOM 1677 CD GLU A 107 15.655 3.039 -2.998 1.00 0.00 C ATOM 1678 OE1 GLU A 107 16.352 2.251 -2.363 1.00 0.00 O ATOM 1679 OE2 GLU A 107 15.908 3.416 -4.290 1.00 0.00 O ATOM 0 H GLU A 107 12.509 4.207 -4.605 1.00 0.00 H new ATOM 0 HA GLU A 107 11.041 2.504 -2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.031 2.520 -1.241 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.408 1.825 -2.805 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.131 4.549 -3.043 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.638 4.091 -1.429 1.00 0.00 H new ATOM 1687 N ILE A 108 10.276 4.416 -1.222 1.00 0.00 N ATOM 1688 CA ILE A 108 9.762 5.581 -0.429 1.00 0.00 C ATOM 1689 C ILE A 108 10.804 5.970 0.680 1.00 0.00 C ATOM 1690 O ILE A 108 10.912 5.306 1.716 1.00 0.00 O ATOM 1691 CB ILE A 108 8.312 5.344 0.145 1.00 0.00 C ATOM 1692 CG1 ILE A 108 7.202 5.006 -0.897 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.798 6.524 1.019 1.00 0.00 C ATOM 1694 CD1 ILE A 108 7.029 5.997 -2.065 1.00 0.00 C ATOM 0 H ILE A 108 9.821 3.530 -1.001 1.00 0.00 H new ATOM 0 HA ILE A 108 9.654 6.429 -1.105 1.00 0.00 H new ATOM 0 HB ILE A 108 8.470 4.452 0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.414 4.021 -1.314 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.251 4.931 -0.370 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.796 6.298 1.383 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.468 6.668 1.867 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.770 7.435 0.421 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.228 5.652 -2.719 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.778 6.982 -1.672 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.959 6.058 -2.631 1.00 0.00 H new ATOM 1706 N LYS A 109 11.536 7.074 0.461 1.00 0.00 N ATOM 1707 CA LYS A 109 12.478 7.646 1.458 1.00 0.00 C ATOM 1708 C LYS A 109 11.818 8.902 2.108 1.00 0.00 C ATOM 1709 O LYS A 109 11.967 10.028 1.622 1.00 0.00 O ATOM 1710 CB LYS A 109 13.813 7.922 0.712 1.00 0.00 C ATOM 1711 CG LYS A 109 15.020 8.376 1.573 1.00 0.00 C ATOM 1712 CD LYS A 109 15.904 7.262 2.177 1.00 0.00 C ATOM 1713 CE LYS A 109 15.294 6.500 3.366 1.00 0.00 C ATOM 1714 NZ LYS A 109 16.305 5.608 3.966 1.00 0.00 N ATOM 0 H LYS A 109 11.497 7.602 -0.411 1.00 0.00 H new ATOM 0 HA LYS A 109 12.701 6.973 2.286 1.00 0.00 H new ATOM 0 HB2 LYS A 109 14.098 7.014 0.181 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.628 8.687 -0.042 1.00 0.00 H new ATOM 0 HG2 LYS A 109 15.653 9.017 0.959 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.642 8.990 2.390 1.00 0.00 H new ATOM 0 HD2 LYS A 109 16.140 6.544 1.391 1.00 0.00 H new ATOM 0 HD3 LYS A 109 16.847 7.705 2.498 1.00 0.00 H new ATOM 0 HE2 LYS A 109 14.931 7.206 4.113 1.00 0.00 H new ATOM 0 HE3 LYS A 109 14.435 5.918 3.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 15.885 5.097 4.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 16.632 4.925 3.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 17.112 6.173 4.300 1.00 0.00 H new ATOM 1727 N ASP A 110 11.045 8.689 3.196 1.00 0.00 N ATOM 1728 CA ASP A 110 10.295 9.765 3.921 1.00 0.00 C ATOM 1729 C ASP A 110 9.392 10.690 3.023 1.00 0.00 C ATOM 1730 O ASP A 110 9.593 11.910 2.982 1.00 0.00 O ATOM 1731 CB ASP A 110 11.301 10.510 4.849 1.00 0.00 C ATOM 1732 CG ASP A 110 10.700 11.387 5.948 1.00 0.00 C ATOM 1733 OD1 ASP A 110 10.806 11.132 7.143 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.054 12.482 5.445 1.00 0.00 O ATOM 0 H ASP A 110 10.916 7.764 3.606 1.00 0.00 H new ATOM 0 HA ASP A 110 9.527 9.298 4.537 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.944 9.767 5.320 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.940 11.135 4.226 1.00 0.00 H new ATOM 1740 N GLY A 111 8.414 10.107 2.309 1.00 0.00 N ATOM 1741 CA GLY A 111 7.621 10.853 1.288 1.00 0.00 C ATOM 1742 C GLY A 111 8.066 10.741 -0.191 1.00 0.00 C ATOM 1743 O GLY A 111 7.201 10.685 -1.065 1.00 0.00 O ATOM 0 H GLY A 111 8.147 9.128 2.411 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.587 10.515 1.354 1.00 0.00 H new ATOM 0 HA3 GLY A 111 7.629 11.908 1.562 1.00 0.00 H new ATOM 1747 N LYS A 112 9.377 10.759 -0.486 1.00 0.00 N ATOM 1748 CA LYS A 112 9.892 10.804 -1.885 1.00 0.00 C ATOM 1749 C LYS A 112 10.194 9.391 -2.469 1.00 0.00 C ATOM 1750 O LYS A 112 10.832 8.557 -1.820 1.00 0.00 O ATOM 1751 CB LYS A 112 11.166 11.691 -1.946 1.00 0.00 C ATOM 1752 CG LYS A 112 10.893 13.206 -1.800 1.00 0.00 C ATOM 1753 CD LYS A 112 12.121 14.117 -1.994 1.00 0.00 C ATOM 1754 CE LYS A 112 12.680 14.121 -3.428 1.00 0.00 C ATOM 1755 NZ LYS A 112 13.591 15.267 -3.613 1.00 0.00 N ATOM 0 H LYS A 112 10.111 10.743 0.222 1.00 0.00 H new ATOM 0 HA LYS A 112 9.104 11.235 -2.503 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.850 11.379 -1.157 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.672 11.515 -2.895 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.130 13.493 -2.524 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.477 13.390 -0.809 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.851 15.136 -1.718 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.908 13.799 -1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.211 13.189 -3.622 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.862 14.177 -4.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.696 15.467 -4.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.199 16.103 -3.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 14.521 15.040 -3.207 1.00 0.00 H new ATOM 1768 N MET A 113 9.803 9.150 -3.733 1.00 0.00 N ATOM 1769 CA MET A 113 10.182 7.915 -4.471 1.00 0.00 C ATOM 1770 C MET A 113 11.609 8.082 -5.082 1.00 0.00 C ATOM 1771 O MET A 113 11.815 8.785 -6.077 1.00 0.00 O ATOM 1772 CB MET A 113 9.077 7.589 -5.507 1.00 0.00 C ATOM 1773 CG MET A 113 9.281 6.284 -6.303 1.00 0.00 C ATOM 1774 SD MET A 113 7.854 5.974 -7.365 1.00 0.00 S ATOM 1775 CE MET A 113 8.254 6.993 -8.799 1.00 0.00 C ATOM 0 H MET A 113 9.223 9.792 -4.273 1.00 0.00 H new ATOM 0 HA MET A 113 10.246 7.055 -3.804 1.00 0.00 H new ATOM 0 HB2 MET A 113 8.121 7.532 -4.987 1.00 0.00 H new ATOM 0 HB3 MET A 113 9.008 8.418 -6.212 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.185 6.355 -6.908 1.00 0.00 H new ATOM 0 HG3 MET A 113 9.422 5.449 -5.617 1.00 0.00 H new ATOM 0 HE1 MET A 113 7.461 6.903 -9.542 1.00 0.00 H new ATOM 0 HE2 MET A 113 8.346 8.034 -8.491 1.00 0.00 H new ATOM 0 HE3 MET A 113 9.197 6.658 -9.232 1.00 0.00 H new ATOM 1785 N VAL A 114 12.602 7.433 -4.461 1.00 0.00 N ATOM 1786 CA VAL A 114 14.023 7.509 -4.904 1.00 0.00 C ATOM 1787 C VAL A 114 14.267 6.292 -5.853 1.00 0.00 C ATOM 1788 O VAL A 114 14.369 5.142 -5.407 1.00 0.00 O ATOM 1789 CB VAL A 114 14.978 7.609 -3.665 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.474 7.629 -4.052 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.721 8.865 -2.797 1.00 0.00 C ATOM 0 H VAL A 114 12.458 6.842 -3.643 1.00 0.00 H new ATOM 0 HA VAL A 114 14.245 8.413 -5.471 1.00 0.00 H new ATOM 0 HB VAL A 114 14.749 6.708 -3.096 1.00 0.00 H new ATOM 0 HG11 VAL A 114 17.082 7.699 -3.150 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.724 6.713 -4.587 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.673 8.489 -4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.415 8.874 -1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 114 14.870 9.761 -3.400 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.697 8.845 -2.423 1.00 0.00 H new ATOM 1801 N MET A 115 14.307 6.559 -7.169 1.00 0.00 N ATOM 1802 CA MET A 115 14.438 5.512 -8.211 1.00 0.00 C ATOM 1803 C MET A 115 15.928 5.296 -8.594 1.00 0.00 C ATOM 1804 O MET A 115 16.540 6.155 -9.233 1.00 0.00 O ATOM 1805 CB MET A 115 13.529 5.916 -9.399 1.00 0.00 C ATOM 1806 CG MET A 115 13.448 4.869 -10.527 1.00 0.00 C ATOM 1807 SD MET A 115 11.978 5.182 -11.527 1.00 0.00 S ATOM 1808 CE MET A 115 12.734 5.691 -13.072 1.00 0.00 C ATOM 0 H MET A 115 14.250 7.505 -7.546 1.00 0.00 H new ATOM 0 HA MET A 115 14.105 4.540 -7.846 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.524 6.105 -9.023 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.894 6.854 -9.817 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.342 4.918 -11.149 1.00 0.00 H new ATOM 0 HG3 MET A 115 13.408 3.865 -10.105 1.00 0.00 H new ATOM 0 HE1 MET A 115 11.956 5.921 -13.799 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.346 6.577 -12.903 1.00 0.00 H new ATOM 0 HE3 MET A 115 13.360 4.885 -13.454 1.00 0.00 H new ATOM 1818 N THR A 116 16.490 4.139 -8.215 1.00 0.00 N ATOM 1819 CA THR A 116 17.913 3.791 -8.500 1.00 0.00 C ATOM 1820 C THR A 116 17.975 2.903 -9.791 1.00 0.00 C ATOM 1821 O THR A 116 17.484 1.769 -9.811 1.00 0.00 O ATOM 1822 CB THR A 116 18.533 3.151 -7.222 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.481 4.076 -6.138 1.00 0.00 O ATOM 1824 CG2 THR A 116 20.009 2.753 -7.354 1.00 0.00 C ATOM 0 H THR A 116 15.985 3.414 -7.705 1.00 0.00 H new ATOM 0 HA THR A 116 18.521 4.668 -8.722 1.00 0.00 H new ATOM 0 HB THR A 116 17.940 2.251 -7.058 1.00 0.00 H new ATOM 0 HG1 THR A 116 17.720 3.860 -5.560 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.353 2.317 -6.416 1.00 0.00 H new ATOM 0 HG22 THR A 116 20.119 2.023 -8.156 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.605 3.636 -7.584 1.00 0.00 H new ATOM 1832 N LEU A 117 18.554 3.447 -10.875 1.00 0.00 N ATOM 1833 CA LEU A 117 18.549 2.824 -12.224 1.00 0.00 C ATOM 1834 C LEU A 117 19.911 2.103 -12.478 1.00 0.00 C ATOM 1835 O LEU A 117 20.909 2.755 -12.800 1.00 0.00 O ATOM 1836 CB LEU A 117 18.312 3.888 -13.342 1.00 0.00 C ATOM 1837 CG LEU A 117 17.069 4.818 -13.307 1.00 0.00 C ATOM 1838 CD1 LEU A 117 17.283 6.081 -12.452 1.00 0.00 C ATOM 1839 CD2 LEU A 117 16.740 5.287 -14.733 1.00 0.00 C ATOM 0 H LEU A 117 19.045 4.340 -10.847 1.00 0.00 H new ATOM 0 HA LEU A 117 17.732 2.103 -12.257 1.00 0.00 H new ATOM 0 HB2 LEU A 117 19.192 4.531 -13.363 1.00 0.00 H new ATOM 0 HB3 LEU A 117 18.285 3.353 -14.292 1.00 0.00 H new ATOM 0 HG LEU A 117 16.262 4.232 -12.867 1.00 0.00 H new ATOM 0 HD11 LEU A 117 16.378 6.689 -12.468 1.00 0.00 H new ATOM 0 HD12 LEU A 117 17.507 5.792 -11.425 1.00 0.00 H new ATOM 0 HD13 LEU A 117 18.115 6.658 -12.857 1.00 0.00 H new ATOM 0 HD21 LEU A 117 15.867 5.940 -14.709 1.00 0.00 H new ATOM 0 HD22 LEU A 117 17.590 5.833 -15.142 1.00 0.00 H new ATOM 0 HD23 LEU A 117 16.528 4.422 -15.361 1.00 0.00 H new ATOM 1851 N THR A 118 19.955 0.768 -12.349 1.00 0.00 N ATOM 1852 CA THR A 118 21.186 -0.040 -12.588 1.00 0.00 C ATOM 1853 C THR A 118 21.118 -0.711 -13.995 1.00 0.00 C ATOM 1854 O THR A 118 20.339 -1.646 -14.221 1.00 0.00 O ATOM 1855 CB THR A 118 21.463 -1.040 -11.411 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.458 -2.002 -11.773 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.272 -1.863 -10.885 1.00 0.00 C ATOM 0 H THR A 118 19.146 0.209 -12.077 1.00 0.00 H new ATOM 0 HA THR A 118 22.054 0.619 -12.599 1.00 0.00 H new ATOM 0 HB THR A 118 21.768 -0.357 -10.618 1.00 0.00 H new ATOM 0 HG1 THR A 118 23.334 -1.566 -11.817 1.00 0.00 H new ATOM 0 HG21 THR A 118 20.607 -2.510 -10.075 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.499 -1.189 -10.515 1.00 0.00 H new ATOM 0 HG23 THR A 118 19.866 -2.473 -11.692 1.00 0.00 H new ATOM 1865 N PHE A 119 22.003 -0.283 -14.917 1.00 0.00 N ATOM 1866 CA PHE A 119 22.469 -1.161 -16.028 1.00 0.00 C ATOM 1867 C PHE A 119 23.829 -1.813 -15.610 1.00 0.00 C ATOM 1868 O PHE A 119 24.913 -1.344 -15.976 1.00 0.00 O ATOM 1869 CB PHE A 119 22.508 -0.333 -17.346 1.00 0.00 C ATOM 1870 CG PHE A 119 22.798 -1.126 -18.637 1.00 0.00 C ATOM 1871 CD1 PHE A 119 22.047 -2.260 -18.971 1.00 0.00 C ATOM 1872 CD2 PHE A 119 23.798 -0.692 -19.514 1.00 0.00 C ATOM 1873 CE1 PHE A 119 22.301 -2.957 -20.148 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.047 -1.386 -20.697 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.297 -2.516 -21.014 1.00 0.00 C ATOM 0 H PHE A 119 22.410 0.652 -14.922 1.00 0.00 H new ATOM 0 HA PHE A 119 21.786 -1.988 -16.223 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.549 0.173 -17.462 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.267 0.442 -17.242 1.00 0.00 H new ATOM 0 HD1 PHE A 119 21.263 -2.597 -18.309 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.380 0.185 -19.273 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.726 -3.839 -20.389 1.00 0.00 H new ATOM 0 HE2 PHE A 119 24.822 -1.047 -21.368 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.489 -3.050 -21.933 1.00 0.00 H new ATOM 1885 N GLY A 120 23.751 -2.861 -14.763 1.00 0.00 N ATOM 1886 CA GLY A 120 24.938 -3.435 -14.073 1.00 0.00 C ATOM 1887 C GLY A 120 25.686 -2.450 -13.140 1.00 0.00 C ATOM 1888 O GLY A 120 25.116 -1.935 -12.172 1.00 0.00 O ATOM 0 H GLY A 120 22.876 -3.333 -14.536 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.619 -4.297 -13.487 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.636 -3.802 -14.825 1.00 0.00 H new ATOM 1892 N ASP A 121 26.946 -2.156 -13.487 1.00 0.00 N ATOM 1893 CA ASP A 121 27.765 -1.124 -12.782 1.00 0.00 C ATOM 1894 C ASP A 121 27.397 0.380 -13.044 1.00 0.00 C ATOM 1895 O ASP A 121 27.786 1.220 -12.229 1.00 0.00 O ATOM 1896 CB ASP A 121 29.268 -1.369 -13.103 1.00 0.00 C ATOM 1897 CG ASP A 121 29.862 -2.674 -12.567 1.00 0.00 C ATOM 1898 OD1 ASP A 121 29.977 -3.688 -13.248 1.00 0.00 O ATOM 1899 OD2 ASP A 121 30.239 -2.574 -11.257 1.00 0.00 O ATOM 0 H ASP A 121 27.436 -2.614 -14.255 1.00 0.00 H new ATOM 0 HA ASP A 121 27.536 -1.261 -11.725 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.396 -1.352 -14.185 1.00 0.00 H new ATOM 0 HB3 ASP A 121 29.846 -0.537 -12.700 1.00 0.00 H new ATOM 1905 N VAL A 122 26.679 0.745 -14.129 1.00 0.00 N ATOM 1906 CA VAL A 122 26.272 2.161 -14.392 1.00 0.00 C ATOM 1907 C VAL A 122 24.946 2.451 -13.610 1.00 0.00 C ATOM 1908 O VAL A 122 23.866 1.977 -13.984 1.00 0.00 O ATOM 1909 CB VAL A 122 26.188 2.480 -15.926 1.00 0.00 C ATOM 1910 CG1 VAL A 122 25.843 3.965 -16.196 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.497 2.183 -16.698 1.00 0.00 C ATOM 0 H VAL A 122 26.365 0.086 -14.842 1.00 0.00 H new ATOM 0 HA VAL A 122 27.039 2.842 -14.022 1.00 0.00 H new ATOM 0 HB VAL A 122 25.397 1.820 -16.282 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.796 4.138 -17.271 1.00 0.00 H new ATOM 0 HG12 VAL A 122 24.878 4.202 -15.748 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.612 4.602 -15.759 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.362 2.428 -17.751 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.307 2.785 -16.286 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.745 1.126 -16.601 1.00 0.00 H new ATOM 1921 N VAL A 123 25.067 3.212 -12.507 1.00 0.00 N ATOM 1922 CA VAL A 123 23.954 3.434 -11.538 1.00 0.00 C ATOM 1923 C VAL A 123 23.571 4.953 -11.552 1.00 0.00 C ATOM 1924 O VAL A 123 24.322 5.797 -11.051 1.00 0.00 O ATOM 1925 CB VAL A 123 24.331 2.897 -10.110 1.00 0.00 C ATOM 1926 CG1 VAL A 123 23.194 3.087 -9.079 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.705 1.393 -10.073 1.00 0.00 C ATOM 0 H VAL A 123 25.931 3.692 -12.254 1.00 0.00 H new ATOM 0 HA VAL A 123 23.073 2.865 -11.836 1.00 0.00 H new ATOM 0 HB VAL A 123 25.203 3.498 -9.851 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.511 2.698 -8.112 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.962 4.148 -8.985 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.306 2.549 -9.413 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.951 1.104 -9.051 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.861 0.799 -10.424 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.566 1.216 -10.718 1.00 0.00 H new ATOM 1937 N ALA A 124 22.378 5.288 -12.077 1.00 0.00 N ATOM 1938 CA ALA A 124 21.772 6.635 -11.911 1.00 0.00 C ATOM 1939 C ALA A 124 20.693 6.677 -10.783 1.00 0.00 C ATOM 1940 O ALA A 124 20.133 5.649 -10.394 1.00 0.00 O ATOM 1941 CB ALA A 124 21.197 7.037 -13.280 1.00 0.00 C ATOM 0 H ALA A 124 21.807 4.644 -12.624 1.00 0.00 H new ATOM 0 HA ALA A 124 22.530 7.348 -11.589 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.740 8.024 -13.207 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.999 7.062 -14.018 1.00 0.00 H new ATOM 0 HB3 ALA A 124 20.445 6.310 -13.586 1.00 0.00 H new ATOM 1947 N VAL A 125 20.391 7.874 -10.253 1.00 0.00 N ATOM 1948 CA VAL A 125 19.388 8.042 -9.150 1.00 0.00 C ATOM 1949 C VAL A 125 18.410 9.209 -9.521 1.00 0.00 C ATOM 1950 O VAL A 125 18.807 10.380 -9.529 1.00 0.00 O ATOM 1951 CB VAL A 125 20.043 8.224 -7.731 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.989 8.141 -6.602 1.00 0.00 C ATOM 1953 CG2 VAL A 125 21.145 7.199 -7.369 1.00 0.00 C ATOM 0 H VAL A 125 20.818 8.748 -10.560 1.00 0.00 H new ATOM 0 HA VAL A 125 18.818 7.117 -9.063 1.00 0.00 H new ATOM 0 HB VAL A 125 20.501 9.211 -7.804 1.00 0.00 H new ATOM 0 HG11 VAL A 125 19.479 8.271 -5.637 1.00 0.00 H new ATOM 0 HG12 VAL A 125 18.245 8.926 -6.740 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.499 7.168 -6.632 1.00 0.00 H new ATOM 0 HG21 VAL A 125 21.529 7.414 -6.372 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.726 6.193 -7.387 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.957 7.267 -8.093 1.00 0.00 H new ATOM 1963 N ARG A 126 17.128 8.896 -9.799 1.00 0.00 N ATOM 1964 CA ARG A 126 16.073 9.923 -10.044 1.00 0.00 C ATOM 1965 C ARG A 126 15.155 10.114 -8.794 1.00 0.00 C ATOM 1966 O ARG A 126 14.497 9.181 -8.322 1.00 0.00 O ATOM 1967 CB ARG A 126 15.257 9.579 -11.320 1.00 0.00 C ATOM 1968 CG ARG A 126 15.997 9.888 -12.646 1.00 0.00 C ATOM 1969 CD ARG A 126 15.104 9.940 -13.899 1.00 0.00 C ATOM 1970 NE ARG A 126 14.691 8.610 -14.414 1.00 0.00 N ATOM 1971 CZ ARG A 126 13.931 8.423 -15.502 1.00 0.00 C ATOM 1972 NH1 ARG A 126 13.396 9.402 -16.186 1.00 0.00 N ATOM 1973 NH2 ARG A 126 13.702 7.212 -15.915 1.00 0.00 N ATOM 0 H ARG A 126 16.788 7.936 -9.862 1.00 0.00 H new ATOM 0 HA ARG A 126 16.566 10.879 -10.217 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.999 8.520 -11.299 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.320 10.136 -11.301 1.00 0.00 H new ATOM 0 HG2 ARG A 126 16.508 10.845 -12.544 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.766 9.131 -12.799 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.210 10.521 -13.670 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.636 10.472 -14.688 1.00 0.00 H new ATOM 0 HE ARG A 126 15.007 7.784 -13.906 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.549 10.368 -15.898 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.826 9.199 -17.007 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.099 6.418 -15.412 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.125 7.056 -16.742 1.00 0.00 H new ATOM 1987 N HIS A 127 15.110 11.351 -8.278 1.00 0.00 N ATOM 1988 CA HIS A 127 14.445 11.674 -6.982 1.00 0.00 C ATOM 1989 C HIS A 127 13.044 12.319 -7.231 1.00 0.00 C ATOM 1990 O HIS A 127 12.954 13.453 -7.712 1.00 0.00 O ATOM 1991 CB HIS A 127 15.361 12.640 -6.176 1.00 0.00 C ATOM 1992 CG HIS A 127 16.724 12.103 -5.732 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.845 12.083 -6.537 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.046 11.609 -4.458 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.755 11.547 -5.669 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.377 11.224 -4.391 1.00 0.00 N ATOM 0 H HIS A 127 15.528 12.161 -8.736 1.00 0.00 H new ATOM 0 HA HIS A 127 14.291 10.759 -6.411 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.530 13.530 -6.782 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.817 12.958 -5.287 1.00 0.00 H new ATOM 0 HD1 HIS A 127 17.961 12.383 -7.505 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.348 11.538 -3.637 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.772 11.378 -5.990 1.00 0.00 H new ATOM 2004 N TYR A 128 11.951 11.617 -6.902 1.00 0.00 N ATOM 2005 CA TYR A 128 10.572 12.031 -7.285 1.00 0.00 C ATOM 2006 C TYR A 128 9.745 12.567 -6.069 1.00 0.00 C ATOM 2007 O TYR A 128 9.619 11.895 -5.040 1.00 0.00 O ATOM 2008 CB TYR A 128 9.873 10.799 -7.925 1.00 0.00 C ATOM 2009 CG TYR A 128 10.307 10.410 -9.350 1.00 0.00 C ATOM 2010 CD1 TYR A 128 9.716 11.027 -10.458 1.00 0.00 C ATOM 2011 CD2 TYR A 128 11.274 9.421 -9.555 1.00 0.00 C ATOM 2012 CE1 TYR A 128 10.107 10.679 -11.749 1.00 0.00 C ATOM 2013 CE2 TYR A 128 11.655 9.066 -10.846 1.00 0.00 C ATOM 2014 CZ TYR A 128 11.078 9.703 -11.943 1.00 0.00 C ATOM 2015 OH TYR A 128 11.470 9.366 -13.210 1.00 0.00 O ATOM 0 H TYR A 128 11.985 10.750 -6.366 1.00 0.00 H new ATOM 0 HA TYR A 128 10.632 12.858 -7.992 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.038 9.940 -7.274 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.799 10.987 -7.938 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.953 11.777 -10.312 1.00 0.00 H new ATOM 0 HD2 TYR A 128 11.728 8.930 -8.707 1.00 0.00 H new ATOM 0 HE1 TYR A 128 9.656 11.168 -12.600 1.00 0.00 H new ATOM 0 HE2 TYR A 128 12.398 8.297 -10.997 1.00 0.00 H new ATOM 0 HH TYR A 128 12.157 8.668 -13.165 1.00 0.00 H new ATOM 2025 N GLU A 129 9.123 13.747 -6.234 1.00 0.00 N ATOM 2026 CA GLU A 129 8.115 14.294 -5.272 1.00 0.00 C ATOM 2027 C GLU A 129 6.638 14.022 -5.706 1.00 0.00 C ATOM 2028 O GLU A 129 6.325 13.940 -6.898 1.00 0.00 O ATOM 2029 CB GLU A 129 8.343 15.831 -5.100 1.00 0.00 C ATOM 2030 CG GLU A 129 9.268 16.240 -3.928 1.00 0.00 C ATOM 2031 CD GLU A 129 8.686 16.065 -2.519 1.00 0.00 C ATOM 2032 OE1 GLU A 129 7.838 15.229 -2.212 1.00 0.00 O ATOM 2033 OE2 GLU A 129 9.233 16.937 -1.629 1.00 0.00 O ATOM 0 H GLU A 129 9.295 14.358 -7.033 1.00 0.00 H new ATOM 0 HA GLU A 129 8.262 13.775 -4.325 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.763 16.224 -6.026 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.374 16.311 -4.960 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.186 15.657 -3.995 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.545 17.286 -4.058 1.00 0.00 H new ATOM 2041 N LYS A 130 5.715 13.944 -4.726 1.00 0.00 N ATOM 2042 CA LYS A 130 4.251 13.853 -5.004 1.00 0.00 C ATOM 2043 C LYS A 130 3.650 15.232 -5.447 1.00 0.00 C ATOM 2044 O LYS A 130 3.831 16.250 -4.770 1.00 0.00 O ATOM 2045 CB LYS A 130 3.490 13.317 -3.757 1.00 0.00 C ATOM 2046 CG LYS A 130 3.803 11.857 -3.357 1.00 0.00 C ATOM 2047 CD LYS A 130 2.835 11.290 -2.300 1.00 0.00 C ATOM 2048 CE LYS A 130 3.132 9.814 -1.987 1.00 0.00 C ATOM 2049 NZ LYS A 130 2.126 9.239 -1.075 1.00 0.00 N ATOM 0 H LYS A 130 5.949 13.942 -3.733 1.00 0.00 H new ATOM 0 HA LYS A 130 4.124 13.154 -5.831 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.718 13.963 -2.909 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.419 13.402 -3.943 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.766 11.229 -4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.821 11.804 -2.972 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.911 11.878 -1.385 1.00 0.00 H new ATOM 0 HD3 LYS A 130 1.810 11.387 -2.657 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.152 9.242 -2.915 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.122 9.729 -1.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.167 8.201 -1.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 2.322 9.549 -0.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.178 9.561 -1.356 1.00 0.00 H new ATOM 2062 N ALA A 131 2.940 15.238 -6.583 1.00 0.00 N ATOM 2063 CA ALA A 131 2.331 16.452 -7.173 1.00 0.00 C ATOM 2064 C ALA A 131 0.796 16.520 -6.957 1.00 0.00 C ATOM 2065 O ALA A 131 0.321 17.551 -6.430 1.00 0.00 O ATOM 2066 CB ALA A 131 2.679 16.413 -8.666 1.00 0.00 C ATOM 2067 OXT ALA A 131 0.058 15.572 -7.327 1.00 0.00 O ATOM 0 H ALA A 131 2.767 14.394 -7.129 1.00 0.00 H new ATOM 0 HA ALA A 131 2.722 17.346 -6.687 1.00 0.00 H new ATOM 0 HB1 ALA A 131 2.256 17.287 -9.161 1.00 0.00 H new ATOM 0 HB2 ALA A 131 3.762 16.416 -8.787 1.00 0.00 H new ATOM 0 HB3 ALA A 131 2.267 15.508 -9.112 1.00 0.00 H new TER 2073 ALA A 131