USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1108 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 89 THR OG1 : rot -81:sc= 0.218 USER MOD Set 1.2: A 97 CYS SG : rot 107:sc= -1.49 USER MOD Set 2.1: A 79 SER OG : rot 134:sc= -6.32! USER MOD Set 2.2: A 85 HIS : no HD1:sc= -11! C(o=-17!,f=-25!) USER MOD Set 3.1: A 63 CYS SG : rot 70:sc= -0.757 USER MOD Set 3.2: A 65 GLN : amide:sc= -3.24! C(o=-4!,f=-6.4!) USER MOD Set 4.1: A 48 ASN : amide:sc= -7.97! C(o=-9.9!,f=-11!) USER MOD Set 4.2: A 95 GLN : amide:sc= -1.93! C(o=-9.9!,f=-8.7!) USER MOD Set 5.1: A 32 GLN : amide:sc= -1.15 K(o=-0.97,f=-4.8!) USER MOD Set 5.2: A 35 LYS NZ :NH3+ -157:sc= 0.178 (180deg=0) USER MOD Set 6.1: A 24 ASN : amide:sc= -3.92! C(o=-10!,f=-9.6!) USER MOD Set 6.2: A 27 SER OG : rot -149:sc= -6.09! USER MOD Set 7.1: A 18 THR OG1 : rot -174:sc= -5.13! USER MOD Set 7.2: A 29 LYS NZ :NH3+ -161:sc= -5.34! (180deg=-7.87!) USER MOD Single : A 1 MET CE :methyl -130:sc= 0 (180deg=-0.0406) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0436) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -134:sc= -0.0517 (180deg=-3.1!) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0202 USER MOD Single : A 8 GLN : amide:sc= -0.0324 K(o=-0.032,f=-1) USER MOD Single : A 10 GLN : amide:sc= 0.104 K(o=0.1,f=-1.6) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 58:sc= -1.23 USER MOD Single : A 19 ASN : amide:sc= -7.64! C(o=-7.6!,f=-13!) USER MOD Single : A 23 SER OG : rot 180:sc= -0.482 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -4.28! C(o=-4.3!,f=-4.5!) USER MOD Single : A 30 CYS SG : rot 12:sc= -18.2! USER MOD Single : A 39 SER OG : rot 70:sc= 0.762 USER MOD Single : A 40 HIS : no HD1:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 52 THR OG1 : rot -171:sc= -6.27! USER MOD Single : A 55 GLN : amide:sc= -0.352 K(o=-0.35,f=-2.9!) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -165:sc= -7.83! (180deg=-8.66!) USER MOD Single : A 61 THR OG1 : rot 81:sc= 1.41 USER MOD Single : A 62 SER OG : rot 170:sc= 0 USER MOD Single : A 69 SER OG : rot -140:sc= -2.6 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -8.06! C(o=-8.1!,f=-14!) USER MOD Single : A 76 LYS NZ :NH3+ 166:sc= -1.43! (180deg=-3.15!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 168:sc= -5.5! USER MOD Single : A 92 MET CE :methyl -136:sc= -15.5! (180deg=-21.1!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -1.89! C(o=-1.9!,f=-9.7!) USER MOD Single : A 104 ASN : amide:sc= -0.608! C(o=-0.61!,f=-4.7!) USER MOD Single : A 106 LYS NZ :NH3+ -130:sc= -0.0746 (180deg=-1.28) USER MOD Single : A 115 ASN : amide:sc= -10.4! C(o=-10!,f=-7!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -11.9! C(o=-12!,f=-18!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 TYR OH : rot 68:sc= -0.63! USER MOD Single : A 131 GLN : amide:sc= -5.96! C(o=-6!,f=-8.5!) USER MOD Single : A 133 LYS NZ :NH3+ 170:sc= 0.721 (180deg=0.62) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.362 -14.695 12.029 1.00 0.00 N ATOM 2 CA MET A 1 23.553 -14.836 11.208 1.00 0.00 C ATOM 3 C MET A 1 23.807 -13.568 10.390 1.00 0.00 C ATOM 4 O MET A 1 24.931 -13.071 10.343 1.00 0.00 O ATOM 5 CB MET A 1 23.384 -16.028 10.263 1.00 0.00 C ATOM 6 CG MET A 1 23.469 -17.350 11.028 1.00 0.00 C ATOM 7 SD MET A 1 24.405 -18.542 10.085 1.00 0.00 S ATOM 8 CE MET A 1 26.060 -17.949 10.393 1.00 0.00 C ATOM 0 H1 MET A 1 22.267 -15.525 12.649 1.00 0.00 H new ATOM 0 H2 MET A 1 22.441 -13.836 12.610 1.00 0.00 H new ATOM 0 H3 MET A 1 21.525 -14.623 11.416 1.00 0.00 H new ATOM 0 HA MET A 1 24.407 -15.000 11.865 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.423 -15.960 9.754 1.00 0.00 H new ATOM 0 HB3 MET A 1 24.155 -15.999 9.493 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.941 -17.189 11.997 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.467 -17.733 11.221 1.00 0.00 H new ATOM 0 HE1 MET A 1 26.593 -17.851 9.447 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.013 -16.978 10.886 1.00 0.00 H new ATOM 0 HE3 MET A 1 26.586 -18.656 11.034 1.00 0.00 H new ATOM 18 N SER A 2 22.745 -13.082 9.765 1.00 0.00 N ATOM 19 CA SER A 2 22.839 -11.882 8.952 1.00 0.00 C ATOM 20 C SER A 2 21.821 -10.844 9.429 1.00 0.00 C ATOM 21 O SER A 2 20.657 -11.170 9.654 1.00 0.00 O ATOM 22 CB SER A 2 22.618 -12.201 7.472 1.00 0.00 C ATOM 23 OG SER A 2 23.260 -11.256 6.620 1.00 0.00 O ATOM 0 H SER A 2 21.815 -13.498 9.805 1.00 0.00 H new ATOM 0 HA SER A 2 23.843 -11.473 9.062 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.997 -13.200 7.256 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.549 -12.213 7.260 1.00 0.00 H new ATOM 0 HG SER A 2 23.096 -11.495 5.684 1.00 0.00 H new ATOM 29 N PHE A 3 22.297 -9.616 9.569 1.00 0.00 N ATOM 30 CA PHE A 3 21.443 -8.529 10.016 1.00 0.00 C ATOM 31 C PHE A 3 21.698 -7.260 9.200 1.00 0.00 C ATOM 32 O PHE A 3 22.016 -6.212 9.759 1.00 0.00 O ATOM 33 CB PHE A 3 21.793 -8.258 11.481 1.00 0.00 C ATOM 34 CG PHE A 3 23.294 -8.135 11.749 1.00 0.00 C ATOM 35 CD1 PHE A 3 24.076 -9.247 11.757 1.00 0.00 C ATOM 36 CD2 PHE A 3 23.846 -6.914 11.981 1.00 0.00 C ATOM 37 CE1 PHE A 3 25.470 -9.134 12.006 1.00 0.00 C ATOM 38 CE2 PHE A 3 25.239 -6.800 12.230 1.00 0.00 C ATOM 39 CZ PHE A 3 26.022 -7.913 12.238 1.00 0.00 C ATOM 0 H PHE A 3 23.263 -9.349 9.381 1.00 0.00 H new ATOM 0 HA PHE A 3 20.396 -8.804 9.892 1.00 0.00 H new ATOM 0 HB2 PHE A 3 21.301 -7.338 11.797 1.00 0.00 H new ATOM 0 HB3 PHE A 3 21.389 -9.063 12.095 1.00 0.00 H new ATOM 0 HD1 PHE A 3 23.637 -10.217 11.574 1.00 0.00 H new ATOM 0 HD2 PHE A 3 23.224 -6.031 11.976 1.00 0.00 H new ATOM 0 HE1 PHE A 3 26.091 -10.017 12.011 1.00 0.00 H new ATOM 0 HE2 PHE A 3 25.677 -5.830 12.413 1.00 0.00 H new ATOM 0 HZ PHE A 3 27.082 -7.827 12.429 1.00 0.00 H new ATOM 49 N TRP A 4 21.548 -7.397 7.890 1.00 0.00 N ATOM 50 CA TRP A 4 21.759 -6.275 6.992 1.00 0.00 C ATOM 51 C TRP A 4 20.471 -5.449 6.957 1.00 0.00 C ATOM 52 O TRP A 4 20.508 -4.229 7.105 1.00 0.00 O ATOM 53 CB TRP A 4 22.198 -6.756 5.607 1.00 0.00 C ATOM 54 CG TRP A 4 23.638 -7.269 5.554 1.00 0.00 C ATOM 55 CD1 TRP A 4 24.327 -7.894 6.519 1.00 0.00 C ATOM 56 CD2 TRP A 4 24.544 -7.174 4.435 1.00 0.00 C ATOM 57 NE1 TRP A 4 25.606 -8.208 6.105 1.00 0.00 N ATOM 58 CE2 TRP A 4 25.742 -7.756 4.797 1.00 0.00 C ATOM 59 CE3 TRP A 4 24.358 -6.615 3.159 1.00 0.00 C ATOM 60 CZ2 TRP A 4 26.846 -7.835 3.940 1.00 0.00 C ATOM 61 CZ3 TRP A 4 25.471 -6.702 2.314 1.00 0.00 C ATOM 62 CH2 TRP A 4 26.683 -7.284 2.663 1.00 0.00 C ATOM 0 H TRP A 4 21.283 -8.268 7.430 1.00 0.00 H new ATOM 0 HA TRP A 4 22.570 -5.641 7.351 1.00 0.00 H new ATOM 0 HB2 TRP A 4 21.528 -7.551 5.281 1.00 0.00 H new ATOM 0 HB3 TRP A 4 22.089 -5.936 4.897 1.00 0.00 H new ATOM 0 HD1 TRP A 4 23.931 -8.123 7.497 1.00 0.00 H new ATOM 0 HE1 TRP A 4 26.320 -8.684 6.657 1.00 0.00 H new ATOM 0 HE3 TRP A 4 23.430 -6.155 2.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 27.773 -8.296 4.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 25.381 -6.287 1.321 1.00 0.00 H new ATOM 0 HH2 TRP A 4 27.496 -7.311 1.953 1.00 0.00 H new ATOM 73 N LYS A 5 19.363 -6.149 6.761 1.00 0.00 N ATOM 74 CA LYS A 5 18.066 -5.495 6.705 1.00 0.00 C ATOM 75 C LYS A 5 17.521 -5.330 8.125 1.00 0.00 C ATOM 76 O LYS A 5 16.962 -4.288 8.462 1.00 0.00 O ATOM 77 CB LYS A 5 17.123 -6.255 5.769 1.00 0.00 C ATOM 78 CG LYS A 5 17.021 -5.559 4.411 1.00 0.00 C ATOM 79 CD LYS A 5 18.300 -5.758 3.595 1.00 0.00 C ATOM 80 CE LYS A 5 19.191 -4.516 3.659 1.00 0.00 C ATOM 81 NZ LYS A 5 20.505 -4.788 3.037 1.00 0.00 N ATOM 0 H LYS A 5 19.336 -7.161 6.639 1.00 0.00 H new ATOM 0 HA LYS A 5 18.161 -4.495 6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 5 17.484 -7.275 5.633 1.00 0.00 H new ATOM 0 HB3 LYS A 5 16.134 -6.324 6.221 1.00 0.00 H new ATOM 0 HG2 LYS A 5 16.168 -5.954 3.859 1.00 0.00 H new ATOM 0 HG3 LYS A 5 16.841 -4.494 4.557 1.00 0.00 H new ATOM 0 HD2 LYS A 5 18.846 -6.622 3.974 1.00 0.00 H new ATOM 0 HD3 LYS A 5 18.044 -5.973 2.558 1.00 0.00 H new ATOM 0 HE2 LYS A 5 18.705 -3.686 3.147 1.00 0.00 H new ATOM 0 HE3 LYS A 5 19.329 -4.213 4.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 21.262 -4.427 3.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 20.623 -5.813 2.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 20.556 -4.315 2.112 1.00 0.00 H new ATOM 95 N THR A 6 17.703 -6.375 8.920 1.00 0.00 N ATOM 96 CA THR A 6 17.237 -6.358 10.296 1.00 0.00 C ATOM 97 C THR A 6 15.729 -6.106 10.345 1.00 0.00 C ATOM 98 O THR A 6 15.280 -4.973 10.178 1.00 0.00 O ATOM 99 CB THR A 6 18.053 -5.313 11.059 1.00 0.00 C ATOM 100 OG1 THR A 6 19.147 -6.052 11.596 1.00 0.00 O ATOM 101 CG2 THR A 6 17.319 -4.784 12.293 1.00 0.00 C ATOM 0 H THR A 6 18.167 -7.238 8.637 1.00 0.00 H new ATOM 0 HA THR A 6 17.389 -7.324 10.777 1.00 0.00 H new ATOM 0 HB THR A 6 18.291 -4.482 10.395 1.00 0.00 H new ATOM 0 HG1 THR A 6 19.729 -5.451 12.106 1.00 0.00 H new ATOM 0 HG21 THR A 6 17.942 -4.046 12.798 1.00 0.00 H new ATOM 0 HG22 THR A 6 16.381 -4.320 11.987 1.00 0.00 H new ATOM 0 HG23 THR A 6 17.110 -5.609 12.974 1.00 0.00 H new ATOM 109 N LEU A 7 14.989 -7.181 10.575 1.00 0.00 N ATOM 110 CA LEU A 7 13.540 -7.090 10.648 1.00 0.00 C ATOM 111 C LEU A 7 12.984 -8.374 11.268 1.00 0.00 C ATOM 112 O LEU A 7 13.188 -9.463 10.735 1.00 0.00 O ATOM 113 CB LEU A 7 12.954 -6.767 9.273 1.00 0.00 C ATOM 114 CG LEU A 7 11.861 -5.697 9.245 1.00 0.00 C ATOM 115 CD1 LEU A 7 10.562 -6.222 9.860 1.00 0.00 C ATOM 116 CD2 LEU A 7 12.336 -4.410 9.922 1.00 0.00 C ATOM 0 H LEU A 7 15.365 -8.119 10.713 1.00 0.00 H new ATOM 0 HA LEU A 7 13.242 -6.267 11.297 1.00 0.00 H new ATOM 0 HB2 LEU A 7 13.766 -6.446 8.620 1.00 0.00 H new ATOM 0 HB3 LEU A 7 12.547 -7.685 8.848 1.00 0.00 H new ATOM 0 HG LEU A 7 11.649 -5.454 8.204 1.00 0.00 H new ATOM 0 HD11 LEU A 7 9.802 -5.441 9.827 1.00 0.00 H new ATOM 0 HD12 LEU A 7 10.217 -7.088 9.296 1.00 0.00 H new ATOM 0 HD13 LEU A 7 10.741 -6.511 10.896 1.00 0.00 H new ATOM 0 HD21 LEU A 7 11.540 -3.666 9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 7 12.594 -4.619 10.960 1.00 0.00 H new ATOM 0 HD23 LEU A 7 13.213 -4.027 9.400 1.00 0.00 H new ATOM 128 N GLN A 8 12.293 -8.202 12.386 1.00 0.00 N ATOM 129 CA GLN A 8 11.706 -9.333 13.084 1.00 0.00 C ATOM 130 C GLN A 8 11.042 -10.285 12.087 1.00 0.00 C ATOM 131 O GLN A 8 9.877 -10.107 11.736 1.00 0.00 O ATOM 132 CB GLN A 8 10.708 -8.865 14.144 1.00 0.00 C ATOM 133 CG GLN A 8 10.162 -10.049 14.944 1.00 0.00 C ATOM 134 CD GLN A 8 11.162 -10.496 16.013 1.00 0.00 C ATOM 135 OE1 GLN A 8 11.869 -9.701 16.610 1.00 0.00 O ATOM 136 NE2 GLN A 8 11.181 -11.810 16.220 1.00 0.00 N ATOM 0 H GLN A 8 12.127 -7.297 12.825 1.00 0.00 H new ATOM 0 HA GLN A 8 12.503 -9.873 13.596 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.193 -8.159 14.818 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.885 -8.335 13.665 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.220 -9.770 15.416 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.948 -10.879 14.271 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.562 -12.420 15.685 1.00 0.00 H new ATOM 0 HE22 GLN A 8 11.814 -12.208 16.914 1.00 0.00 H new ATOM 145 N ARG A 9 11.812 -11.275 11.660 1.00 0.00 N ATOM 146 CA ARG A 9 11.312 -12.255 10.711 1.00 0.00 C ATOM 147 C ARG A 9 10.919 -11.572 9.399 1.00 0.00 C ATOM 148 O ARG A 9 10.188 -10.583 9.405 1.00 0.00 O ATOM 149 CB ARG A 9 10.100 -12.999 11.274 1.00 0.00 C ATOM 150 CG ARG A 9 10.363 -14.505 11.343 1.00 0.00 C ATOM 151 CD ARG A 9 10.988 -14.891 12.685 1.00 0.00 C ATOM 152 NE ARG A 9 9.991 -15.592 13.524 1.00 0.00 N ATOM 153 CZ ARG A 9 9.408 -16.751 13.189 1.00 0.00 C ATOM 154 NH1 ARG A 9 9.719 -17.347 12.030 1.00 0.00 N ATOM 155 NH2 ARG A 9 8.514 -17.314 14.014 1.00 0.00 N ATOM 0 H ARG A 9 12.778 -11.419 11.954 1.00 0.00 H new ATOM 0 HA ARG A 9 12.110 -12.973 10.525 1.00 0.00 H new ATOM 0 HB2 ARG A 9 9.867 -12.621 12.270 1.00 0.00 H new ATOM 0 HB3 ARG A 9 9.228 -12.807 10.648 1.00 0.00 H new ATOM 0 HG2 ARG A 9 9.428 -15.048 11.204 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.027 -14.800 10.530 1.00 0.00 H new ATOM 0 HD2 ARG A 9 11.854 -15.533 12.521 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.345 -13.999 13.199 1.00 0.00 H new ATOM 0 HE ARG A 9 9.731 -15.166 14.414 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.400 -16.918 11.403 1.00 0.00 H new ATOM 0 HH12 ARG A 9 9.275 -18.229 11.775 1.00 0.00 H new ATOM 0 HH21 ARG A 9 8.278 -16.860 14.896 1.00 0.00 H new ATOM 0 HH22 ARG A 9 8.070 -18.196 13.759 1.00 0.00 H new ATOM 169 N GLN A 10 11.422 -12.127 8.306 1.00 0.00 N ATOM 170 CA GLN A 10 11.133 -11.584 6.990 1.00 0.00 C ATOM 171 C GLN A 10 9.878 -12.240 6.409 1.00 0.00 C ATOM 172 O GLN A 10 9.656 -13.435 6.595 1.00 0.00 O ATOM 173 CB GLN A 10 12.327 -11.758 6.051 1.00 0.00 C ATOM 174 CG GLN A 10 12.597 -13.238 5.774 1.00 0.00 C ATOM 175 CD GLN A 10 14.014 -13.627 6.199 1.00 0.00 C ATOM 176 OE1 GLN A 10 14.978 -12.917 5.963 1.00 0.00 O ATOM 177 NE2 GLN A 10 14.087 -14.791 6.839 1.00 0.00 N ATOM 0 H GLN A 10 12.028 -12.947 8.305 1.00 0.00 H new ATOM 0 HA GLN A 10 10.946 -10.515 7.092 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.135 -11.238 5.112 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.212 -11.300 6.493 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.872 -13.850 6.311 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.463 -13.443 4.712 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.241 -15.336 7.004 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.989 -15.138 7.165 1.00 0.00 H new ATOM 186 N PRO A 11 9.071 -11.407 5.699 1.00 0.00 N ATOM 187 CA PRO A 11 7.845 -11.894 5.090 1.00 0.00 C ATOM 188 C PRO A 11 8.145 -12.724 3.841 1.00 0.00 C ATOM 189 O PRO A 11 9.289 -13.111 3.608 1.00 0.00 O ATOM 190 CB PRO A 11 7.031 -10.645 4.792 1.00 0.00 C ATOM 191 CG PRO A 11 8.018 -9.489 4.816 1.00 0.00 C ATOM 192 CD PRO A 11 9.303 -9.986 5.459 1.00 0.00 C ATOM 0 HA PRO A 11 7.291 -12.569 5.742 1.00 0.00 H new ATOM 0 HB2 PRO A 11 6.541 -10.720 3.821 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.246 -10.504 5.535 1.00 0.00 H new ATOM 0 HG2 PRO A 11 8.211 -9.131 3.805 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.609 -8.650 5.379 1.00 0.00 H new ATOM 0 HD2 PRO A 11 10.160 -9.830 4.804 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.512 -9.456 6.388 1.00 0.00 H new ATOM 200 N ARG A 12 7.097 -12.973 3.069 1.00 0.00 N ATOM 201 CA ARG A 12 7.235 -13.750 1.849 1.00 0.00 C ATOM 202 C ARG A 12 6.473 -13.080 0.704 1.00 0.00 C ATOM 203 O ARG A 12 6.994 -12.953 -0.403 1.00 0.00 O ATOM 204 CB ARG A 12 6.706 -15.173 2.040 1.00 0.00 C ATOM 205 CG ARG A 12 7.850 -16.190 2.022 1.00 0.00 C ATOM 206 CD ARG A 12 7.310 -17.622 2.008 1.00 0.00 C ATOM 207 NE ARG A 12 8.414 -18.581 2.234 1.00 0.00 N ATOM 208 CZ ARG A 12 9.332 -18.901 1.311 1.00 0.00 C ATOM 209 NH1 ARG A 12 9.282 -18.341 0.095 1.00 0.00 N ATOM 210 NH2 ARG A 12 10.298 -19.782 1.605 1.00 0.00 N ATOM 0 H ARG A 12 6.149 -12.651 3.265 1.00 0.00 H new ATOM 0 HA ARG A 12 8.296 -13.798 1.605 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.169 -15.241 2.986 1.00 0.00 H new ATOM 0 HB3 ARG A 12 5.992 -15.409 1.250 1.00 0.00 H new ATOM 0 HG2 ARG A 12 8.475 -16.024 1.144 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.484 -16.045 2.897 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.550 -17.741 2.781 1.00 0.00 H new ATOM 0 HD3 ARG A 12 6.828 -17.828 1.052 1.00 0.00 H new ATOM 0 HE ARG A 12 8.481 -19.026 3.149 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.546 -17.671 -0.128 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.980 -18.584 -0.608 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.335 -20.209 2.531 1.00 0.00 H new ATOM 0 HH22 ARG A 12 10.997 -20.026 0.903 1.00 0.00 H new ATOM 224 N THR A 13 5.251 -12.668 1.010 1.00 0.00 N ATOM 225 CA THR A 13 4.412 -12.014 0.020 1.00 0.00 C ATOM 226 C THR A 13 4.257 -10.528 0.350 1.00 0.00 C ATOM 227 O THR A 13 3.720 -10.175 1.399 1.00 0.00 O ATOM 228 CB THR A 13 3.081 -12.765 -0.042 1.00 0.00 C ATOM 229 OG1 THR A 13 3.394 -13.970 -0.736 1.00 0.00 O ATOM 230 CG2 THR A 13 2.058 -12.071 -0.944 1.00 0.00 C ATOM 0 H THR A 13 4.822 -12.774 1.929 1.00 0.00 H new ATOM 0 HA THR A 13 4.867 -12.049 -0.970 1.00 0.00 H new ATOM 0 HB THR A 13 2.672 -12.861 0.964 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.586 -14.519 -0.819 1.00 0.00 H new ATOM 0 HG21 THR A 13 1.132 -12.645 -0.952 1.00 0.00 H new ATOM 0 HG22 THR A 13 1.860 -11.068 -0.565 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.453 -12.004 -1.958 1.00 0.00 H new ATOM 238 N ILE A 14 4.736 -9.698 -0.564 1.00 0.00 N ATOM 239 CA ILE A 14 4.658 -8.259 -0.383 1.00 0.00 C ATOM 240 C ILE A 14 3.379 -7.736 -1.040 1.00 0.00 C ATOM 241 O ILE A 14 3.262 -7.735 -2.265 1.00 0.00 O ATOM 242 CB ILE A 14 5.932 -7.584 -0.893 1.00 0.00 C ATOM 243 CG1 ILE A 14 7.166 -8.431 -0.575 1.00 0.00 C ATOM 244 CG2 ILE A 14 6.057 -6.161 -0.345 1.00 0.00 C ATOM 245 CD1 ILE A 14 7.135 -8.922 0.874 1.00 0.00 C ATOM 0 H ILE A 14 5.180 -9.995 -1.433 1.00 0.00 H new ATOM 0 HA ILE A 14 4.597 -8.011 0.677 1.00 0.00 H new ATOM 0 HB ILE A 14 5.866 -7.506 -1.978 1.00 0.00 H new ATOM 0 HG12 ILE A 14 7.210 -9.285 -1.251 1.00 0.00 H new ATOM 0 HG13 ILE A 14 8.068 -7.844 -0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.972 -5.704 -0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 14 5.198 -5.571 -0.665 1.00 0.00 H new ATOM 0 HG23 ILE A 14 6.091 -6.192 0.744 1.00 0.00 H new ATOM 0 HD11 ILE A 14 8.023 -9.521 1.074 1.00 0.00 H new ATOM 0 HD12 ILE A 14 7.116 -8.066 1.548 1.00 0.00 H new ATOM 0 HD13 ILE A 14 6.244 -9.529 1.033 1.00 0.00 H new ATOM 257 N SER A 15 2.453 -7.302 -0.198 1.00 0.00 N ATOM 258 CA SER A 15 1.187 -6.777 -0.682 1.00 0.00 C ATOM 259 C SER A 15 1.155 -5.257 -0.518 1.00 0.00 C ATOM 260 O SER A 15 0.940 -4.751 0.582 1.00 0.00 O ATOM 261 CB SER A 15 0.008 -7.416 0.055 1.00 0.00 C ATOM 262 OG SER A 15 -1.008 -6.465 0.361 1.00 0.00 O ATOM 0 H SER A 15 2.554 -7.303 0.817 1.00 0.00 H new ATOM 0 HA SER A 15 1.096 -7.024 -1.740 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.414 -8.213 -0.558 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.363 -7.877 0.977 1.00 0.00 H new ATOM 0 HG SER A 15 -1.325 -6.047 -0.467 1.00 0.00 H new ATOM 268 N LEU A 16 1.371 -4.569 -1.630 1.00 0.00 N ATOM 269 CA LEU A 16 1.369 -3.116 -1.624 1.00 0.00 C ATOM 270 C LEU A 16 0.444 -2.607 -2.731 1.00 0.00 C ATOM 271 O LEU A 16 0.566 -3.017 -3.884 1.00 0.00 O ATOM 272 CB LEU A 16 2.798 -2.578 -1.721 1.00 0.00 C ATOM 273 CG LEU A 16 2.956 -1.212 -2.391 1.00 0.00 C ATOM 274 CD1 LEU A 16 2.826 -0.081 -1.369 1.00 0.00 C ATOM 275 CD2 LEU A 16 4.271 -1.132 -3.170 1.00 0.00 C ATOM 0 H LEU A 16 1.549 -4.991 -2.541 1.00 0.00 H new ATOM 0 HA LEU A 16 0.975 -2.739 -0.680 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.211 -2.517 -0.714 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.401 -3.302 -2.270 1.00 0.00 H new ATOM 0 HG LEU A 16 2.147 -1.090 -3.111 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.942 0.879 -1.872 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.844 -0.127 -0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.599 -0.188 -0.608 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.358 -0.151 -3.637 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.108 -1.286 -2.488 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.285 -1.903 -3.941 1.00 0.00 H new ATOM 287 N PHE A 17 -0.460 -1.720 -2.342 1.00 0.00 N ATOM 288 CA PHE A 17 -1.406 -1.151 -3.287 1.00 0.00 C ATOM 289 C PHE A 17 -0.924 0.211 -3.791 1.00 0.00 C ATOM 290 O PHE A 17 -0.170 0.900 -3.105 1.00 0.00 O ATOM 291 CB PHE A 17 -2.728 -0.966 -2.540 1.00 0.00 C ATOM 292 CG PHE A 17 -3.228 -2.230 -1.837 1.00 0.00 C ATOM 293 CD1 PHE A 17 -2.631 -3.427 -2.085 1.00 0.00 C ATOM 294 CD2 PHE A 17 -4.268 -2.156 -0.964 1.00 0.00 C ATOM 295 CE1 PHE A 17 -3.095 -4.600 -1.432 1.00 0.00 C ATOM 296 CE2 PHE A 17 -4.731 -3.329 -0.311 1.00 0.00 C ATOM 297 CZ PHE A 17 -4.135 -4.526 -0.559 1.00 0.00 C ATOM 0 H PHE A 17 -0.557 -1.381 -1.385 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.514 -1.810 -4.148 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.608 -0.175 -1.800 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.488 -0.630 -3.245 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.805 -3.485 -2.778 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.742 -1.206 -0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.622 -5.551 -1.629 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.557 -3.270 0.383 1.00 0.00 H new ATOM 0 HZ PHE A 17 -4.488 -5.418 -0.063 1.00 0.00 H new ATOM 307 N THR A 18 -1.379 0.558 -4.986 1.00 0.00 N ATOM 308 CA THR A 18 -1.003 1.825 -5.590 1.00 0.00 C ATOM 309 C THR A 18 -2.138 2.842 -5.446 1.00 0.00 C ATOM 310 O THR A 18 -3.308 2.468 -5.392 1.00 0.00 O ATOM 311 CB THR A 18 -0.609 1.557 -7.044 1.00 0.00 C ATOM 312 OG1 THR A 18 0.385 0.541 -6.953 1.00 0.00 O ATOM 313 CG2 THR A 18 0.125 2.740 -7.679 1.00 0.00 C ATOM 0 H THR A 18 -2.004 -0.016 -5.552 1.00 0.00 H new ATOM 0 HA THR A 18 -0.146 2.267 -5.082 1.00 0.00 H new ATOM 0 HB THR A 18 -1.502 1.329 -7.626 1.00 0.00 H new ATOM 0 HG1 THR A 18 0.763 0.373 -7.841 1.00 0.00 H new ATOM 0 HG21 THR A 18 0.382 2.498 -8.710 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.519 3.619 -7.662 1.00 0.00 H new ATOM 0 HG23 THR A 18 1.036 2.947 -7.117 1.00 0.00 H new ATOM 321 N ASN A 19 -1.751 4.108 -5.387 1.00 0.00 N ATOM 322 CA ASN A 19 -2.721 5.181 -5.250 1.00 0.00 C ATOM 323 C ASN A 19 -2.216 6.417 -5.997 1.00 0.00 C ATOM 324 O ASN A 19 -2.116 7.498 -5.419 1.00 0.00 O ATOM 325 CB ASN A 19 -2.916 5.563 -3.781 1.00 0.00 C ATOM 326 CG ASN A 19 -3.323 4.346 -2.947 1.00 0.00 C ATOM 327 OD1 ASN A 19 -2.557 3.419 -2.740 1.00 0.00 O ATOM 328 ND2 ASN A 19 -4.567 4.401 -2.482 1.00 0.00 N ATOM 0 H ASN A 19 -0.779 4.415 -5.432 1.00 0.00 H new ATOM 0 HA ASN A 19 -3.669 4.834 -5.661 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -1.993 5.987 -3.386 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.681 6.335 -3.701 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.933 3.637 -1.914 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -5.155 5.207 -2.693 1.00 0.00 H new ATOM 335 N ASP A 20 -1.912 6.216 -7.271 1.00 0.00 N ATOM 336 CA ASP A 20 -1.420 7.301 -8.103 1.00 0.00 C ATOM 337 C ASP A 20 -0.361 8.090 -7.331 1.00 0.00 C ATOM 338 O ASP A 20 -0.370 8.109 -6.101 1.00 0.00 O ATOM 339 CB ASP A 20 -2.549 8.264 -8.476 1.00 0.00 C ATOM 340 CG ASP A 20 -2.096 9.673 -8.862 1.00 0.00 C ATOM 341 OD1 ASP A 20 -1.362 10.276 -8.049 1.00 0.00 O ATOM 342 OD2 ASP A 20 -2.492 10.116 -9.961 1.00 0.00 O ATOM 0 H ASP A 20 -1.997 5.318 -7.747 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.001 6.867 -9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.109 7.838 -9.308 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.237 8.338 -7.633 1.00 0.00 H new ATOM 347 N ILE A 21 0.526 8.723 -8.085 1.00 0.00 N ATOM 348 CA ILE A 21 1.589 9.512 -7.487 1.00 0.00 C ATOM 349 C ILE A 21 2.025 10.601 -8.469 1.00 0.00 C ATOM 350 O ILE A 21 1.795 11.785 -8.231 1.00 0.00 O ATOM 351 CB ILE A 21 2.733 8.607 -7.025 1.00 0.00 C ATOM 352 CG1 ILE A 21 2.317 7.135 -7.063 1.00 0.00 C ATOM 353 CG2 ILE A 21 3.238 9.024 -5.642 1.00 0.00 C ATOM 354 CD1 ILE A 21 2.613 6.517 -8.431 1.00 0.00 C ATOM 0 H ILE A 21 0.530 8.705 -9.105 1.00 0.00 H new ATOM 0 HA ILE A 21 1.230 10.017 -6.590 1.00 0.00 H new ATOM 0 HB ILE A 21 3.564 8.725 -7.720 1.00 0.00 H new ATOM 0 HG12 ILE A 21 2.849 6.583 -6.288 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.253 7.048 -6.843 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.051 8.365 -5.337 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.600 10.052 -5.681 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.424 8.953 -4.921 1.00 0.00 H new ATOM 0 HD11 ILE A 21 2.308 5.471 -8.431 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.061 7.056 -9.201 1.00 0.00 H new ATOM 0 HD13 ILE A 21 3.681 6.584 -8.637 1.00 0.00 H new ATOM 366 N ALA A 22 2.647 10.161 -9.553 1.00 0.00 N ATOM 367 CA ALA A 22 3.117 11.083 -10.573 1.00 0.00 C ATOM 368 C ALA A 22 3.204 10.352 -11.914 1.00 0.00 C ATOM 369 O ALA A 22 2.255 9.688 -12.326 1.00 0.00 O ATOM 370 CB ALA A 22 4.460 11.677 -10.144 1.00 0.00 C ATOM 0 H ALA A 22 2.836 9.178 -9.747 1.00 0.00 H new ATOM 0 HA ALA A 22 2.418 11.911 -10.694 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.813 12.369 -10.909 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.337 12.210 -9.201 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.188 10.876 -10.016 1.00 0.00 H new ATOM 376 N SER A 23 4.353 10.499 -12.558 1.00 0.00 N ATOM 377 CA SER A 23 4.577 9.861 -13.844 1.00 0.00 C ATOM 378 C SER A 23 3.780 8.558 -13.928 1.00 0.00 C ATOM 379 O SER A 23 2.615 8.563 -14.324 1.00 0.00 O ATOM 380 CB SER A 23 6.065 9.589 -14.073 1.00 0.00 C ATOM 381 OG SER A 23 6.278 8.578 -15.054 1.00 0.00 O ATOM 0 H SER A 23 5.139 11.051 -12.213 1.00 0.00 H new ATOM 0 HA SER A 23 4.235 10.539 -14.626 1.00 0.00 H new ATOM 0 HB2 SER A 23 6.557 10.509 -14.388 1.00 0.00 H new ATOM 0 HB3 SER A 23 6.527 9.286 -13.133 1.00 0.00 H new ATOM 0 HG SER A 23 7.240 8.435 -15.173 1.00 0.00 H new ATOM 387 N ASN A 24 4.439 7.473 -13.549 1.00 0.00 N ATOM 388 CA ASN A 24 3.807 6.165 -13.576 1.00 0.00 C ATOM 389 C ASN A 24 2.971 5.981 -12.307 1.00 0.00 C ATOM 390 O ASN A 24 3.503 5.634 -11.254 1.00 0.00 O ATOM 391 CB ASN A 24 4.852 5.049 -13.620 1.00 0.00 C ATOM 392 CG ASN A 24 4.945 4.439 -15.020 1.00 0.00 C ATOM 393 OD1 ASN A 24 5.926 4.595 -15.729 1.00 0.00 O ATOM 394 ND2 ASN A 24 3.872 3.739 -15.378 1.00 0.00 N ATOM 0 H ASN A 24 5.405 7.473 -13.221 1.00 0.00 H new ATOM 0 HA ASN A 24 3.184 6.110 -14.468 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.824 5.445 -13.327 1.00 0.00 H new ATOM 0 HB3 ASN A 24 4.592 4.274 -12.899 1.00 0.00 H new ATOM 0 HD21 ASN A 24 3.836 3.293 -16.295 1.00 0.00 H new ATOM 0 HD22 ASN A 24 3.085 3.648 -14.736 1.00 0.00 H new ATOM 401 N ILE A 25 1.676 6.223 -12.450 1.00 0.00 N ATOM 402 CA ILE A 25 0.762 6.088 -11.329 1.00 0.00 C ATOM 403 C ILE A 25 1.097 4.812 -10.553 1.00 0.00 C ATOM 404 O ILE A 25 1.079 4.807 -9.323 1.00 0.00 O ATOM 405 CB ILE A 25 -0.689 6.152 -11.810 1.00 0.00 C ATOM 406 CG1 ILE A 25 -1.070 7.576 -12.218 1.00 0.00 C ATOM 407 CG2 ILE A 25 -1.642 5.584 -10.756 1.00 0.00 C ATOM 408 CD1 ILE A 25 -0.541 8.596 -11.207 1.00 0.00 C ATOM 0 H ILE A 25 1.238 6.512 -13.325 1.00 0.00 H new ATOM 0 HA ILE A 25 0.882 6.922 -10.638 1.00 0.00 H new ATOM 0 HB ILE A 25 -0.781 5.527 -12.698 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -0.666 7.795 -13.206 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -2.154 7.659 -12.291 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -2.667 5.641 -11.123 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -1.386 4.543 -10.557 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.553 6.162 -9.836 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -0.826 9.600 -11.521 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -0.966 8.389 -10.225 1.00 0.00 H new ATOM 0 HD13 ILE A 25 0.546 8.527 -11.155 1.00 0.00 H new ATOM 420 N LYS A 26 1.395 3.763 -11.304 1.00 0.00 N ATOM 421 CA LYS A 26 1.734 2.484 -10.703 1.00 0.00 C ATOM 422 C LYS A 26 3.220 2.475 -10.337 1.00 0.00 C ATOM 423 O LYS A 26 3.574 2.327 -9.168 1.00 0.00 O ATOM 424 CB LYS A 26 1.321 1.333 -11.622 1.00 0.00 C ATOM 425 CG LYS A 26 -0.085 1.558 -12.183 1.00 0.00 C ATOM 426 CD LYS A 26 -0.090 1.445 -13.709 1.00 0.00 C ATOM 427 CE LYS A 26 -0.313 2.813 -14.359 1.00 0.00 C ATOM 428 NZ LYS A 26 -0.600 2.660 -15.803 1.00 0.00 N ATOM 0 H LYS A 26 1.409 3.772 -12.324 1.00 0.00 H new ATOM 0 HA LYS A 26 1.176 2.339 -9.778 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.034 1.244 -12.442 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.350 0.393 -11.070 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.772 0.826 -11.758 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.446 2.543 -11.886 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.857 1.027 -14.049 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.874 0.756 -14.024 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.142 3.324 -13.870 1.00 0.00 H new ATOM 0 HE3 LYS A 26 0.571 3.436 -14.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.749 3.597 -16.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.203 2.192 -16.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.457 2.083 -15.928 1.00 0.00 H new ATOM 442 N SER A 27 4.049 2.636 -11.358 1.00 0.00 N ATOM 443 CA SER A 27 5.488 2.648 -11.158 1.00 0.00 C ATOM 444 C SER A 27 5.865 3.721 -10.134 1.00 0.00 C ATOM 445 O SER A 27 6.327 3.404 -9.039 1.00 0.00 O ATOM 446 CB SER A 27 6.225 2.891 -12.477 1.00 0.00 C ATOM 447 OG SER A 27 5.440 2.515 -13.604 1.00 0.00 O ATOM 0 H SER A 27 3.752 2.759 -12.326 1.00 0.00 H new ATOM 0 HA SER A 27 5.789 1.671 -10.779 1.00 0.00 H new ATOM 0 HB2 SER A 27 6.490 3.945 -12.555 1.00 0.00 H new ATOM 0 HB3 SER A 27 7.158 2.327 -12.480 1.00 0.00 H new ATOM 0 HG SER A 27 6.029 2.211 -14.326 1.00 0.00 H new ATOM 453 N GLN A 28 5.654 4.969 -10.527 1.00 0.00 N ATOM 454 CA GLN A 28 5.966 6.090 -9.656 1.00 0.00 C ATOM 455 C GLN A 28 5.606 5.754 -8.208 1.00 0.00 C ATOM 456 O GLN A 28 6.284 6.190 -7.279 1.00 0.00 O ATOM 457 CB GLN A 28 5.249 7.359 -10.119 1.00 0.00 C ATOM 458 CG GLN A 28 5.380 8.473 -9.079 1.00 0.00 C ATOM 459 CD GLN A 28 6.794 9.056 -9.075 1.00 0.00 C ATOM 460 OE1 GLN A 28 7.287 9.566 -10.068 1.00 0.00 O ATOM 461 NE2 GLN A 28 7.419 8.953 -7.905 1.00 0.00 N ATOM 0 H GLN A 28 5.271 5.228 -11.436 1.00 0.00 H new ATOM 0 HA GLN A 28 7.038 6.278 -9.708 1.00 0.00 H new ATOM 0 HB2 GLN A 28 5.668 7.692 -11.069 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.195 7.142 -10.294 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.658 9.261 -9.293 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.141 8.082 -8.090 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.949 8.515 -7.113 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.368 9.312 -7.800 1.00 0.00 H new ATOM 470 N LYS A 29 4.540 4.981 -8.061 1.00 0.00 N ATOM 471 CA LYS A 29 4.082 4.581 -6.741 1.00 0.00 C ATOM 472 C LYS A 29 5.250 3.972 -5.963 1.00 0.00 C ATOM 473 O LYS A 29 5.942 4.673 -5.227 1.00 0.00 O ATOM 474 CB LYS A 29 2.868 3.656 -6.853 1.00 0.00 C ATOM 475 CG LYS A 29 2.711 2.803 -5.592 1.00 0.00 C ATOM 476 CD LYS A 29 2.744 1.312 -5.932 1.00 0.00 C ATOM 477 CE LYS A 29 2.036 0.488 -4.854 1.00 0.00 C ATOM 478 NZ LYS A 29 1.688 -0.854 -5.372 1.00 0.00 N ATOM 0 H LYS A 29 3.980 4.621 -8.834 1.00 0.00 H new ATOM 0 HA LYS A 29 3.741 5.449 -6.177 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.967 4.249 -7.010 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.978 3.009 -7.723 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.510 3.037 -4.888 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.770 3.047 -5.099 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.264 1.145 -6.896 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.778 0.980 -6.028 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.680 0.391 -3.980 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.133 1.004 -4.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.948 -1.275 -4.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.339 -0.770 -6.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.532 -1.461 -5.358 1.00 0.00 H new ATOM 492 N CYS A 30 5.433 2.674 -6.153 1.00 0.00 N ATOM 493 CA CYS A 30 6.505 1.963 -5.478 1.00 0.00 C ATOM 494 C CYS A 30 7.730 1.957 -6.395 1.00 0.00 C ATOM 495 O CYS A 30 8.824 2.332 -5.977 1.00 0.00 O ATOM 496 CB CYS A 30 6.083 0.546 -5.081 1.00 0.00 C ATOM 497 SG CYS A 30 7.094 -0.037 -3.672 1.00 0.00 S ATOM 0 H CYS A 30 4.857 2.096 -6.765 1.00 0.00 H new ATOM 0 HA CYS A 30 6.752 2.473 -4.547 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.027 0.535 -4.811 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.202 -0.129 -5.929 1.00 0.00 H new ATOM 0 HG CYS A 30 7.758 0.962 -3.171 1.00 0.00 H new ATOM 503 N LEU A 31 7.504 1.529 -7.628 1.00 0.00 N ATOM 504 CA LEU A 31 8.575 1.470 -8.608 1.00 0.00 C ATOM 505 C LEU A 31 9.556 2.617 -8.355 1.00 0.00 C ATOM 506 O LEU A 31 10.765 2.450 -8.506 1.00 0.00 O ATOM 507 CB LEU A 31 8.004 1.451 -10.027 1.00 0.00 C ATOM 508 CG LEU A 31 7.444 0.111 -10.507 1.00 0.00 C ATOM 509 CD1 LEU A 31 8.569 -0.895 -10.757 1.00 0.00 C ATOM 510 CD2 LEU A 31 6.399 -0.429 -9.528 1.00 0.00 C ATOM 0 H LEU A 31 6.595 1.220 -7.971 1.00 0.00 H new ATOM 0 HA LEU A 31 9.136 0.541 -8.503 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.211 2.196 -10.088 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.788 1.763 -10.717 1.00 0.00 H new ATOM 0 HG LEU A 31 6.939 0.273 -11.459 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.144 -1.839 -11.097 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.243 -0.505 -11.519 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.123 -1.059 -9.833 1.00 0.00 H new ATOM 0 HD21 LEU A 31 6.017 -1.382 -9.893 1.00 0.00 H new ATOM 0 HD22 LEU A 31 6.857 -0.572 -8.549 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.578 0.283 -9.443 1.00 0.00 H new ATOM 522 N GLN A 32 8.997 3.757 -7.973 1.00 0.00 N ATOM 523 CA GLN A 32 9.807 4.931 -7.698 1.00 0.00 C ATOM 524 C GLN A 32 10.394 4.852 -6.287 1.00 0.00 C ATOM 525 O GLN A 32 11.556 5.195 -6.074 1.00 0.00 O ATOM 526 CB GLN A 32 8.994 6.214 -7.882 1.00 0.00 C ATOM 527 CG GLN A 32 9.180 6.784 -9.289 1.00 0.00 C ATOM 528 CD GLN A 32 10.609 7.292 -9.490 1.00 0.00 C ATOM 529 OE1 GLN A 32 11.301 6.921 -10.424 1.00 0.00 O ATOM 530 NE2 GLN A 32 11.011 8.158 -8.564 1.00 0.00 N ATOM 0 H GLN A 32 7.994 3.892 -7.848 1.00 0.00 H new ATOM 0 HA GLN A 32 10.630 4.956 -8.412 1.00 0.00 H new ATOM 0 HB2 GLN A 32 7.938 6.008 -7.706 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.302 6.953 -7.143 1.00 0.00 H new ATOM 0 HG2 GLN A 32 8.956 6.016 -10.029 1.00 0.00 H new ATOM 0 HG3 GLN A 32 8.474 7.599 -9.451 1.00 0.00 H new ATOM 0 HE21 GLN A 32 10.380 8.426 -7.808 1.00 0.00 H new ATOM 0 HE22 GLN A 32 11.950 8.554 -8.610 1.00 0.00 H new ATOM 539 N LEU A 33 9.564 4.397 -5.360 1.00 0.00 N ATOM 540 CA LEU A 33 9.987 4.269 -3.975 1.00 0.00 C ATOM 541 C LEU A 33 11.159 3.289 -3.893 1.00 0.00 C ATOM 542 O LEU A 33 12.162 3.569 -3.239 1.00 0.00 O ATOM 543 CB LEU A 33 8.802 3.885 -3.087 1.00 0.00 C ATOM 544 CG LEU A 33 9.143 3.121 -1.806 1.00 0.00 C ATOM 545 CD1 LEU A 33 10.494 3.569 -1.244 1.00 0.00 C ATOM 546 CD2 LEU A 33 8.021 3.252 -0.774 1.00 0.00 C ATOM 0 H LEU A 33 8.601 4.112 -5.540 1.00 0.00 H new ATOM 0 HA LEU A 33 10.344 5.226 -3.595 1.00 0.00 H new ATOM 0 HB2 LEU A 33 8.269 4.795 -2.812 1.00 0.00 H new ATOM 0 HB3 LEU A 33 8.114 3.278 -3.676 1.00 0.00 H new ATOM 0 HG LEU A 33 9.231 2.063 -2.053 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.713 3.011 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 33 11.275 3.382 -1.981 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.458 4.634 -1.016 1.00 0.00 H new ATOM 0 HD21 LEU A 33 8.289 2.700 0.127 1.00 0.00 H new ATOM 0 HD22 LEU A 33 7.876 4.303 -0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 33 7.097 2.846 -1.187 1.00 0.00 H new ATOM 558 N LEU A 34 10.994 2.160 -4.567 1.00 0.00 N ATOM 559 CA LEU A 34 12.026 1.137 -4.578 1.00 0.00 C ATOM 560 C LEU A 34 13.106 1.521 -5.591 1.00 0.00 C ATOM 561 O LEU A 34 14.178 0.917 -5.620 1.00 0.00 O ATOM 562 CB LEU A 34 11.411 -0.241 -4.827 1.00 0.00 C ATOM 563 CG LEU A 34 9.888 -0.328 -4.709 1.00 0.00 C ATOM 564 CD1 LEU A 34 9.230 -0.325 -6.091 1.00 0.00 C ATOM 565 CD2 LEU A 34 9.470 -1.543 -3.878 1.00 0.00 C ATOM 0 H LEU A 34 10.161 1.931 -5.109 1.00 0.00 H new ATOM 0 HA LEU A 34 12.510 1.073 -3.604 1.00 0.00 H new ATOM 0 HB2 LEU A 34 11.697 -0.569 -5.826 1.00 0.00 H new ATOM 0 HB3 LEU A 34 11.851 -0.946 -4.122 1.00 0.00 H new ATOM 0 HG LEU A 34 9.535 0.559 -4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 34 8.148 -0.388 -5.979 1.00 0.00 H new ATOM 0 HD12 LEU A 34 9.488 0.595 -6.615 1.00 0.00 H new ATOM 0 HD13 LEU A 34 9.585 -1.181 -6.665 1.00 0.00 H new ATOM 0 HD21 LEU A 34 8.383 -1.581 -3.810 1.00 0.00 H new ATOM 0 HD22 LEU A 34 9.836 -2.453 -4.354 1.00 0.00 H new ATOM 0 HD23 LEU A 34 9.893 -1.462 -2.877 1.00 0.00 H new ATOM 577 N LYS A 35 12.787 2.522 -6.398 1.00 0.00 N ATOM 578 CA LYS A 35 13.717 2.993 -7.411 1.00 0.00 C ATOM 579 C LYS A 35 15.097 3.189 -6.778 1.00 0.00 C ATOM 580 O LYS A 35 16.104 3.241 -7.481 1.00 0.00 O ATOM 581 CB LYS A 35 13.172 4.246 -8.098 1.00 0.00 C ATOM 582 CG LYS A 35 14.024 4.620 -9.313 1.00 0.00 C ATOM 583 CD LYS A 35 13.253 4.389 -10.614 1.00 0.00 C ATOM 584 CE LYS A 35 13.531 5.507 -11.621 1.00 0.00 C ATOM 585 NZ LYS A 35 12.507 5.508 -12.690 1.00 0.00 N ATOM 0 H LYS A 35 11.897 3.020 -6.371 1.00 0.00 H new ATOM 0 HA LYS A 35 13.830 2.249 -8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 35 12.142 4.075 -8.411 1.00 0.00 H new ATOM 0 HB3 LYS A 35 13.157 5.075 -7.391 1.00 0.00 H new ATOM 0 HG2 LYS A 35 14.323 5.666 -9.244 1.00 0.00 H new ATOM 0 HG3 LYS A 35 14.938 4.027 -9.317 1.00 0.00 H new ATOM 0 HD2 LYS A 35 13.537 3.428 -11.044 1.00 0.00 H new ATOM 0 HD3 LYS A 35 12.184 4.341 -10.404 1.00 0.00 H new ATOM 0 HE2 LYS A 35 13.534 6.471 -11.112 1.00 0.00 H new ATOM 0 HE3 LYS A 35 14.521 5.374 -12.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 12.891 5.972 -13.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.245 4.528 -12.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 11.665 6.024 -12.364 1.00 0.00 H new ATOM 599 N GLY A 36 15.097 3.292 -5.457 1.00 0.00 N ATOM 600 CA GLY A 36 16.336 3.482 -4.722 1.00 0.00 C ATOM 601 C GLY A 36 17.320 2.345 -5.004 1.00 0.00 C ATOM 602 O GLY A 36 18.050 2.382 -5.994 1.00 0.00 O ATOM 0 H GLY A 36 14.259 3.247 -4.877 1.00 0.00 H new ATOM 0 HA2 GLY A 36 16.786 4.435 -5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 36 16.126 3.529 -3.654 1.00 0.00 H new ATOM 606 N ASP A 37 17.309 1.361 -4.116 1.00 0.00 N ATOM 607 CA ASP A 37 18.192 0.216 -4.258 1.00 0.00 C ATOM 608 C ASP A 37 17.402 -0.964 -4.827 1.00 0.00 C ATOM 609 O ASP A 37 16.247 -0.811 -5.220 1.00 0.00 O ATOM 610 CB ASP A 37 18.765 -0.208 -2.904 1.00 0.00 C ATOM 611 CG ASP A 37 19.723 0.799 -2.263 1.00 0.00 C ATOM 612 OD1 ASP A 37 19.213 1.815 -1.744 1.00 0.00 O ATOM 613 OD2 ASP A 37 20.942 0.529 -2.307 1.00 0.00 O ATOM 0 H ASP A 37 16.703 1.333 -3.296 1.00 0.00 H new ATOM 0 HA ASP A 37 19.008 0.499 -4.923 1.00 0.00 H new ATOM 0 HB2 ASP A 37 17.938 -0.388 -2.217 1.00 0.00 H new ATOM 0 HB3 ASP A 37 19.288 -1.156 -3.029 1.00 0.00 H new ATOM 618 N VAL A 38 18.057 -2.116 -4.855 1.00 0.00 N ATOM 619 CA VAL A 38 17.431 -3.321 -5.370 1.00 0.00 C ATOM 620 C VAL A 38 18.266 -4.538 -4.965 1.00 0.00 C ATOM 621 O VAL A 38 19.419 -4.397 -4.562 1.00 0.00 O ATOM 622 CB VAL A 38 17.237 -3.205 -6.883 1.00 0.00 C ATOM 623 CG1 VAL A 38 18.426 -3.806 -7.635 1.00 0.00 C ATOM 624 CG2 VAL A 38 15.925 -3.859 -7.319 1.00 0.00 C ATOM 0 H VAL A 38 19.016 -2.240 -4.529 1.00 0.00 H new ATOM 0 HA VAL A 38 16.439 -3.450 -4.938 1.00 0.00 H new ATOM 0 HB VAL A 38 17.182 -2.146 -7.134 1.00 0.00 H new ATOM 0 HG11 VAL A 38 18.263 -3.711 -8.709 1.00 0.00 H new ATOM 0 HG12 VAL A 38 19.337 -3.276 -7.358 1.00 0.00 H new ATOM 0 HG13 VAL A 38 18.526 -4.860 -7.375 1.00 0.00 H new ATOM 0 HG21 VAL A 38 15.812 -3.762 -8.399 1.00 0.00 H new ATOM 0 HG22 VAL A 38 15.937 -4.915 -7.048 1.00 0.00 H new ATOM 0 HG23 VAL A 38 15.090 -3.366 -6.821 1.00 0.00 H new ATOM 634 N SER A 39 17.651 -5.705 -5.088 1.00 0.00 N ATOM 635 CA SER A 39 18.323 -6.945 -4.740 1.00 0.00 C ATOM 636 C SER A 39 17.311 -8.091 -4.683 1.00 0.00 C ATOM 637 O SER A 39 16.137 -7.903 -4.997 1.00 0.00 O ATOM 638 CB SER A 39 19.057 -6.818 -3.404 1.00 0.00 C ATOM 639 OG SER A 39 20.390 -6.341 -3.570 1.00 0.00 O ATOM 0 H SER A 39 16.695 -5.818 -5.424 1.00 0.00 H new ATOM 0 HA SER A 39 19.063 -7.160 -5.511 1.00 0.00 H new ATOM 0 HB2 SER A 39 18.508 -6.139 -2.752 1.00 0.00 H new ATOM 0 HB3 SER A 39 19.078 -7.789 -2.908 1.00 0.00 H new ATOM 0 HG SER A 39 20.369 -5.402 -3.850 1.00 0.00 H new ATOM 645 N HIS A 40 17.804 -9.253 -4.280 1.00 0.00 N ATOM 646 CA HIS A 40 16.957 -10.430 -4.178 1.00 0.00 C ATOM 647 C HIS A 40 16.778 -10.807 -2.706 1.00 0.00 C ATOM 648 O HIS A 40 17.755 -10.912 -1.966 1.00 0.00 O ATOM 649 CB HIS A 40 17.517 -11.577 -5.021 1.00 0.00 C ATOM 650 CG HIS A 40 16.485 -12.269 -5.880 1.00 0.00 C ATOM 651 ND1 HIS A 40 16.141 -13.599 -5.713 1.00 0.00 N ATOM 652 CD2 HIS A 40 15.727 -11.801 -6.913 1.00 0.00 C ATOM 653 CE1 HIS A 40 15.217 -13.907 -6.612 1.00 0.00 C ATOM 654 NE2 HIS A 40 14.962 -12.791 -7.354 1.00 0.00 N ATOM 0 H HIS A 40 18.779 -9.405 -4.020 1.00 0.00 H new ATOM 0 HA HIS A 40 15.969 -10.208 -4.583 1.00 0.00 H new ATOM 0 HB2 HIS A 40 18.308 -11.190 -5.663 1.00 0.00 H new ATOM 0 HB3 HIS A 40 17.975 -12.311 -4.358 1.00 0.00 H new ATOM 0 HD2 HIS A 40 15.746 -10.795 -7.305 1.00 0.00 H new ATOM 0 HE1 HIS A 40 14.748 -14.872 -6.735 1.00 0.00 H new ATOM 0 HE2 HIS A 40 14.293 -12.728 -8.122 1.00 0.00 H new ATOM 662 N ARG A 41 15.524 -11.000 -2.326 1.00 0.00 N ATOM 663 CA ARG A 41 15.205 -11.363 -0.956 1.00 0.00 C ATOM 664 C ARG A 41 13.689 -11.477 -0.776 1.00 0.00 C ATOM 665 O ARG A 41 13.217 -12.216 0.086 1.00 0.00 O ATOM 666 CB ARG A 41 15.752 -10.329 0.030 1.00 0.00 C ATOM 667 CG ARG A 41 14.824 -9.116 0.124 1.00 0.00 C ATOM 668 CD ARG A 41 14.018 -9.142 1.424 1.00 0.00 C ATOM 669 NE ARG A 41 13.783 -10.541 1.846 1.00 0.00 N ATOM 670 CZ ARG A 41 14.496 -11.170 2.790 1.00 0.00 C ATOM 671 NH1 ARG A 41 15.493 -10.529 3.416 1.00 0.00 N ATOM 672 NH2 ARG A 41 14.213 -12.441 3.109 1.00 0.00 N ATOM 0 H ARG A 41 14.717 -10.912 -2.943 1.00 0.00 H new ATOM 0 HA ARG A 41 15.672 -12.326 -0.751 1.00 0.00 H new ATOM 0 HB2 ARG A 41 15.863 -10.783 1.015 1.00 0.00 H new ATOM 0 HB3 ARG A 41 16.744 -10.008 -0.287 1.00 0.00 H new ATOM 0 HG2 ARG A 41 15.412 -8.199 0.075 1.00 0.00 H new ATOM 0 HG3 ARG A 41 14.145 -9.106 -0.729 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.554 -8.603 2.205 1.00 0.00 H new ATOM 0 HD3 ARG A 41 13.065 -8.632 1.281 1.00 0.00 H new ATOM 0 HE ARG A 41 13.032 -11.058 1.390 1.00 0.00 H new ATOM 0 HH11 ARG A 41 15.709 -9.562 3.174 1.00 0.00 H new ATOM 0 HH12 ARG A 41 16.036 -11.008 4.135 1.00 0.00 H new ATOM 0 HH21 ARG A 41 13.455 -12.930 2.633 1.00 0.00 H new ATOM 0 HH22 ARG A 41 14.756 -12.919 3.828 1.00 0.00 H new ATOM 686 N PHE A 42 12.970 -10.733 -1.604 1.00 0.00 N ATOM 687 CA PHE A 42 11.518 -10.741 -1.547 1.00 0.00 C ATOM 688 C PHE A 42 10.915 -10.259 -2.868 1.00 0.00 C ATOM 689 O PHE A 42 11.596 -9.619 -3.668 1.00 0.00 O ATOM 690 CB PHE A 42 11.109 -9.778 -0.431 1.00 0.00 C ATOM 691 CG PHE A 42 11.134 -8.304 -0.841 1.00 0.00 C ATOM 692 CD1 PHE A 42 12.008 -7.878 -1.792 1.00 0.00 C ATOM 693 CD2 PHE A 42 10.282 -7.420 -0.255 1.00 0.00 C ATOM 694 CE1 PHE A 42 12.031 -6.510 -2.173 1.00 0.00 C ATOM 695 CE2 PHE A 42 10.306 -6.053 -0.636 1.00 0.00 C ATOM 696 CZ PHE A 42 11.180 -5.626 -1.586 1.00 0.00 C ATOM 0 H PHE A 42 13.366 -10.121 -2.318 1.00 0.00 H new ATOM 0 HA PHE A 42 11.158 -11.753 -1.363 1.00 0.00 H new ATOM 0 HB2 PHE A 42 10.104 -10.034 -0.094 1.00 0.00 H new ATOM 0 HB3 PHE A 42 11.776 -9.919 0.419 1.00 0.00 H new ATOM 0 HD1 PHE A 42 12.684 -8.580 -2.257 1.00 0.00 H new ATOM 0 HD2 PHE A 42 9.588 -7.758 0.500 1.00 0.00 H new ATOM 0 HE1 PHE A 42 12.724 -6.172 -2.929 1.00 0.00 H new ATOM 0 HE2 PHE A 42 9.629 -5.351 -0.171 1.00 0.00 H new ATOM 0 HZ PHE A 42 11.199 -4.585 -1.874 1.00 0.00 H new ATOM 706 N ASP A 43 9.644 -10.585 -3.055 1.00 0.00 N ATOM 707 CA ASP A 43 8.942 -10.192 -4.265 1.00 0.00 C ATOM 708 C ASP A 43 7.993 -9.036 -3.947 1.00 0.00 C ATOM 709 O ASP A 43 7.036 -9.203 -3.191 1.00 0.00 O ATOM 710 CB ASP A 43 8.108 -11.350 -4.818 1.00 0.00 C ATOM 711 CG ASP A 43 8.651 -11.984 -6.100 1.00 0.00 C ATOM 712 OD1 ASP A 43 9.865 -12.282 -6.115 1.00 0.00 O ATOM 713 OD2 ASP A 43 7.840 -12.157 -7.035 1.00 0.00 O ATOM 0 H ASP A 43 9.083 -11.116 -2.389 1.00 0.00 H new ATOM 0 HA ASP A 43 9.686 -9.897 -5.005 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.033 -12.122 -4.052 1.00 0.00 H new ATOM 0 HB3 ASP A 43 7.097 -10.991 -5.008 1.00 0.00 H new ATOM 718 N VAL A 44 8.290 -7.888 -4.539 1.00 0.00 N ATOM 719 CA VAL A 44 7.475 -6.704 -4.327 1.00 0.00 C ATOM 720 C VAL A 44 6.310 -6.708 -5.319 1.00 0.00 C ATOM 721 O VAL A 44 6.522 -6.711 -6.531 1.00 0.00 O ATOM 722 CB VAL A 44 8.341 -5.447 -4.428 1.00 0.00 C ATOM 723 CG1 VAL A 44 7.709 -4.282 -3.664 1.00 0.00 C ATOM 724 CG2 VAL A 44 9.763 -5.720 -3.933 1.00 0.00 C ATOM 0 H VAL A 44 9.084 -7.753 -5.165 1.00 0.00 H new ATOM 0 HA VAL A 44 7.049 -6.709 -3.324 1.00 0.00 H new ATOM 0 HB VAL A 44 8.400 -5.165 -5.479 1.00 0.00 H new ATOM 0 HG11 VAL A 44 8.345 -3.401 -3.752 1.00 0.00 H new ATOM 0 HG12 VAL A 44 6.726 -4.063 -4.082 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.605 -4.550 -2.613 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.358 -4.810 -4.015 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.731 -6.039 -2.891 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.215 -6.505 -4.539 1.00 0.00 H new ATOM 734 N GLU A 45 5.105 -6.709 -4.768 1.00 0.00 N ATOM 735 CA GLU A 45 3.906 -6.713 -5.590 1.00 0.00 C ATOM 736 C GLU A 45 3.326 -5.301 -5.688 1.00 0.00 C ATOM 737 O GLU A 45 2.861 -4.747 -4.693 1.00 0.00 O ATOM 738 CB GLU A 45 2.869 -7.696 -5.042 1.00 0.00 C ATOM 739 CG GLU A 45 1.730 -6.955 -4.339 1.00 0.00 C ATOM 740 CD GLU A 45 0.665 -7.934 -3.840 1.00 0.00 C ATOM 741 OE1 GLU A 45 1.061 -8.903 -3.157 1.00 0.00 O ATOM 742 OE2 GLU A 45 -0.520 -7.691 -4.153 1.00 0.00 O ATOM 0 H GLU A 45 4.933 -6.707 -3.763 1.00 0.00 H new ATOM 0 HA GLU A 45 4.177 -7.044 -6.593 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.468 -8.299 -5.857 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.347 -8.383 -4.343 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.126 -6.384 -3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.278 -6.239 -5.026 1.00 0.00 H new ATOM 749 N ILE A 46 3.371 -4.759 -6.896 1.00 0.00 N ATOM 750 CA ILE A 46 2.855 -3.423 -7.137 1.00 0.00 C ATOM 751 C ILE A 46 1.573 -3.517 -7.966 1.00 0.00 C ATOM 752 O ILE A 46 1.625 -3.770 -9.169 1.00 0.00 O ATOM 753 CB ILE A 46 3.932 -2.538 -7.769 1.00 0.00 C ATOM 754 CG1 ILE A 46 5.326 -2.937 -7.278 1.00 0.00 C ATOM 755 CG2 ILE A 46 3.639 -1.057 -7.522 1.00 0.00 C ATOM 756 CD1 ILE A 46 5.352 -3.075 -5.754 1.00 0.00 C ATOM 0 H ILE A 46 3.757 -5.222 -7.719 1.00 0.00 H new ATOM 0 HA ILE A 46 2.591 -2.942 -6.195 1.00 0.00 H new ATOM 0 HB ILE A 46 3.913 -2.694 -8.848 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.621 -3.881 -7.737 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.054 -2.189 -7.591 1.00 0.00 H new ATOM 0 HG21 ILE A 46 4.419 -0.450 -7.981 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.674 -0.799 -7.959 1.00 0.00 H new ATOM 0 HG23 ILE A 46 3.614 -0.865 -6.449 1.00 0.00 H new ATOM 0 HD11 ILE A 46 6.354 -3.359 -5.431 1.00 0.00 H new ATOM 0 HD12 ILE A 46 5.080 -2.123 -5.298 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.641 -3.841 -5.446 1.00 0.00 H new ATOM 768 N ALA A 47 0.452 -3.309 -7.291 1.00 0.00 N ATOM 769 CA ALA A 47 -0.841 -3.368 -7.950 1.00 0.00 C ATOM 770 C ALA A 47 -1.748 -2.273 -7.384 1.00 0.00 C ATOM 771 O ALA A 47 -1.797 -2.068 -6.172 1.00 0.00 O ATOM 772 CB ALA A 47 -1.438 -4.766 -7.779 1.00 0.00 C ATOM 0 H ALA A 47 0.413 -3.099 -6.294 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.735 -3.188 -9.020 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.408 -4.810 -8.274 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.770 -5.504 -8.224 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.562 -4.982 -6.718 1.00 0.00 H new ATOM 778 N ASN A 48 -2.443 -1.599 -8.288 1.00 0.00 N ATOM 779 CA ASN A 48 -3.345 -0.530 -7.894 1.00 0.00 C ATOM 780 C ASN A 48 -4.743 -1.108 -7.662 1.00 0.00 C ATOM 781 O ASN A 48 -5.322 -1.718 -8.559 1.00 0.00 O ATOM 782 CB ASN A 48 -3.448 0.535 -8.987 1.00 0.00 C ATOM 783 CG ASN A 48 -3.641 -0.108 -10.362 1.00 0.00 C ATOM 784 OD1 ASN A 48 -4.745 -0.247 -10.862 1.00 0.00 O ATOM 785 ND2 ASN A 48 -2.508 -0.491 -10.944 1.00 0.00 N ATOM 0 H ASN A 48 -2.400 -1.772 -9.292 1.00 0.00 H new ATOM 0 HA ASN A 48 -2.952 -0.075 -6.984 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -4.283 1.202 -8.773 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -2.545 1.146 -8.991 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.531 -0.931 -11.864 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -1.617 -0.345 -10.470 1.00 0.00 H new ATOM 792 N ARG A 49 -5.244 -0.895 -6.455 1.00 0.00 N ATOM 793 CA ARG A 49 -6.562 -1.387 -6.094 1.00 0.00 C ATOM 794 C ARG A 49 -7.121 -0.591 -4.912 1.00 0.00 C ATOM 795 O ARG A 49 -6.367 0.036 -4.170 1.00 0.00 O ATOM 796 CB ARG A 49 -6.515 -2.870 -5.724 1.00 0.00 C ATOM 797 CG ARG A 49 -7.767 -3.599 -6.217 1.00 0.00 C ATOM 798 CD ARG A 49 -7.549 -4.177 -7.617 1.00 0.00 C ATOM 799 NE ARG A 49 -8.846 -4.583 -8.204 1.00 0.00 N ATOM 800 CZ ARG A 49 -9.425 -5.773 -7.996 1.00 0.00 C ATOM 801 NH1 ARG A 49 -8.827 -6.681 -7.214 1.00 0.00 N ATOM 802 NH2 ARG A 49 -10.603 -6.054 -8.570 1.00 0.00 N ATOM 0 H ARG A 49 -4.761 -0.388 -5.714 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.211 -1.261 -6.961 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.628 -3.329 -6.160 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.430 -2.976 -4.642 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.022 -4.401 -5.524 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -8.611 -2.910 -6.232 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -7.068 -3.436 -8.255 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -6.879 -5.035 -7.565 1.00 0.00 H new ATOM 0 HE ARG A 49 -9.329 -3.915 -8.804 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -7.931 -6.466 -6.777 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -9.268 -7.587 -7.056 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -11.058 -5.362 -9.165 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -11.044 -6.960 -8.412 1.00 0.00 H new ATOM 816 N PHE A 50 -8.438 -0.644 -4.774 1.00 0.00 N ATOM 817 CA PHE A 50 -9.106 0.064 -3.695 1.00 0.00 C ATOM 818 C PHE A 50 -8.810 -0.591 -2.344 1.00 0.00 C ATOM 819 O PHE A 50 -8.960 -1.803 -2.192 1.00 0.00 O ATOM 820 CB PHE A 50 -10.609 -0.017 -3.970 1.00 0.00 C ATOM 821 CG PHE A 50 -11.197 -1.420 -3.806 1.00 0.00 C ATOM 822 CD1 PHE A 50 -10.406 -2.513 -3.977 1.00 0.00 C ATOM 823 CD2 PHE A 50 -12.510 -1.574 -3.488 1.00 0.00 C ATOM 824 CE1 PHE A 50 -10.952 -3.815 -3.824 1.00 0.00 C ATOM 825 CE2 PHE A 50 -13.056 -2.876 -3.335 1.00 0.00 C ATOM 826 CZ PHE A 50 -12.265 -3.969 -3.506 1.00 0.00 C ATOM 0 H PHE A 50 -9.060 -1.166 -5.391 1.00 0.00 H new ATOM 0 HA PHE A 50 -8.755 1.095 -3.653 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.128 0.664 -3.296 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.801 0.330 -4.985 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.363 -2.391 -4.229 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -13.138 -0.706 -3.352 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -10.324 -4.683 -3.960 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -14.099 -2.998 -3.083 1.00 0.00 H new ATOM 0 HZ PHE A 50 -12.680 -4.959 -3.389 1.00 0.00 H new ATOM 836 N PRO A 51 -8.385 0.261 -1.373 1.00 0.00 N ATOM 837 CA PRO A 51 -8.068 -0.223 -0.040 1.00 0.00 C ATOM 838 C PRO A 51 -9.341 -0.538 0.746 1.00 0.00 C ATOM 839 O PRO A 51 -9.509 -0.078 1.875 1.00 0.00 O ATOM 840 CB PRO A 51 -7.238 0.883 0.592 1.00 0.00 C ATOM 841 CG PRO A 51 -7.511 2.132 -0.231 1.00 0.00 C ATOM 842 CD PRO A 51 -8.196 1.701 -1.518 1.00 0.00 C ATOM 0 HA PRO A 51 -7.514 -1.161 -0.054 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -7.518 1.034 1.635 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.178 0.631 0.579 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.143 2.825 0.325 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.581 2.656 -0.451 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.149 2.214 -1.651 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.584 1.934 -2.389 1.00 0.00 H new ATOM 850 N THR A 52 -10.207 -1.322 0.119 1.00 0.00 N ATOM 851 CA THR A 52 -11.460 -1.704 0.747 1.00 0.00 C ATOM 852 C THR A 52 -11.196 -2.443 2.060 1.00 0.00 C ATOM 853 O THR A 52 -10.207 -3.164 2.183 1.00 0.00 O ATOM 854 CB THR A 52 -12.262 -2.528 -0.263 1.00 0.00 C ATOM 855 OG1 THR A 52 -11.457 -2.515 -1.439 1.00 0.00 O ATOM 856 CG2 THR A 52 -13.557 -1.833 -0.689 1.00 0.00 C ATOM 0 H THR A 52 -10.065 -1.702 -0.817 1.00 0.00 H new ATOM 0 HA THR A 52 -12.050 -0.828 1.017 1.00 0.00 H new ATOM 0 HB THR A 52 -12.498 -3.501 0.168 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.963 -2.897 -2.186 1.00 0.00 H new ATOM 0 HG21 THR A 52 -14.088 -2.460 -1.406 1.00 0.00 H new ATOM 0 HG22 THR A 52 -14.187 -1.669 0.186 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.321 -0.874 -1.151 1.00 0.00 H new ATOM 864 N TRP A 53 -12.097 -2.238 3.009 1.00 0.00 N ATOM 865 CA TRP A 53 -11.974 -2.876 4.309 1.00 0.00 C ATOM 866 C TRP A 53 -12.162 -4.382 4.116 1.00 0.00 C ATOM 867 O TRP A 53 -11.674 -5.180 4.916 1.00 0.00 O ATOM 868 CB TRP A 53 -12.961 -2.274 5.311 1.00 0.00 C ATOM 869 CG TRP A 53 -14.141 -3.187 5.648 1.00 0.00 C ATOM 870 CD1 TRP A 53 -15.232 -3.432 4.909 1.00 0.00 C ATOM 871 CD2 TRP A 53 -14.305 -3.973 6.847 1.00 0.00 C ATOM 872 NE1 TRP A 53 -16.084 -4.314 5.542 1.00 0.00 N ATOM 873 CE2 TRP A 53 -15.502 -4.653 6.758 1.00 0.00 C ATOM 874 CE3 TRP A 53 -13.469 -4.105 7.970 1.00 0.00 C ATOM 875 CZ2 TRP A 53 -15.972 -5.512 7.759 1.00 0.00 C ATOM 876 CZ3 TRP A 53 -13.953 -4.967 8.961 1.00 0.00 C ATOM 877 CH2 TRP A 53 -15.156 -5.659 8.887 1.00 0.00 C ATOM 0 H TRP A 53 -12.916 -1.639 2.904 1.00 0.00 H new ATOM 0 HA TRP A 53 -10.985 -2.700 4.733 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -12.428 -2.033 6.230 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -13.344 -1.336 4.909 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -15.421 -2.994 3.940 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -16.976 -4.654 5.184 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -12.528 -3.583 8.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -16.913 -6.033 7.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -13.349 -5.104 9.846 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -15.460 -6.307 9.696 1.00 0.00 H new ATOM 888 N ASP A 54 -12.870 -4.727 3.050 1.00 0.00 N ATOM 889 CA ASP A 54 -13.128 -6.123 2.743 1.00 0.00 C ATOM 890 C ASP A 54 -11.813 -6.903 2.792 1.00 0.00 C ATOM 891 O ASP A 54 -11.690 -7.872 3.540 1.00 0.00 O ATOM 892 CB ASP A 54 -13.717 -6.278 1.339 1.00 0.00 C ATOM 893 CG ASP A 54 -15.126 -6.873 1.291 1.00 0.00 C ATOM 894 OD1 ASP A 54 -15.714 -7.027 2.383 1.00 0.00 O ATOM 895 OD2 ASP A 54 -15.582 -7.160 0.164 1.00 0.00 O ATOM 0 H ASP A 54 -13.273 -4.063 2.388 1.00 0.00 H new ATOM 0 HA ASP A 54 -13.838 -6.504 3.477 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -13.736 -5.300 0.859 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -13.052 -6.909 0.750 1.00 0.00 H new ATOM 900 N GLN A 55 -10.863 -6.452 1.986 1.00 0.00 N ATOM 901 CA GLN A 55 -9.562 -7.096 1.929 1.00 0.00 C ATOM 902 C GLN A 55 -8.688 -6.631 3.095 1.00 0.00 C ATOM 903 O GLN A 55 -7.952 -7.425 3.679 1.00 0.00 O ATOM 904 CB GLN A 55 -8.876 -6.826 0.588 1.00 0.00 C ATOM 905 CG GLN A 55 -8.606 -8.132 -0.162 1.00 0.00 C ATOM 906 CD GLN A 55 -8.921 -7.983 -1.652 1.00 0.00 C ATOM 907 OE1 GLN A 55 -9.533 -7.023 -2.091 1.00 0.00 O ATOM 908 NE2 GLN A 55 -8.469 -8.984 -2.403 1.00 0.00 N ATOM 0 H GLN A 55 -10.968 -5.648 1.367 1.00 0.00 H new ATOM 0 HA GLN A 55 -9.707 -8.173 2.016 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.504 -6.176 -0.021 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -7.937 -6.298 0.755 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -7.563 -8.420 -0.034 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.212 -8.932 0.263 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -7.964 -9.758 -1.971 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -8.628 -8.978 -3.411 1.00 0.00 H new ATOM 917 N LEU A 56 -8.797 -5.346 3.400 1.00 0.00 N ATOM 918 CA LEU A 56 -8.026 -4.767 4.486 1.00 0.00 C ATOM 919 C LEU A 56 -8.387 -5.471 5.795 1.00 0.00 C ATOM 920 O LEU A 56 -7.588 -5.502 6.730 1.00 0.00 O ATOM 921 CB LEU A 56 -8.220 -3.249 4.531 1.00 0.00 C ATOM 922 CG LEU A 56 -8.315 -2.626 5.925 1.00 0.00 C ATOM 923 CD1 LEU A 56 -9.621 -3.023 6.615 1.00 0.00 C ATOM 924 CD2 LEU A 56 -7.089 -2.981 6.769 1.00 0.00 C ATOM 0 H LEU A 56 -9.408 -4.690 2.914 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.960 -4.925 4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.390 -2.781 4.001 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.129 -3.002 3.982 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.326 -1.542 5.815 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.663 -2.567 7.604 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -10.466 -2.678 6.020 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.665 -4.108 6.713 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.182 -2.526 7.755 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.021 -4.064 6.874 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.190 -2.607 6.280 1.00 0.00 H new ATOM 936 N GLN A 57 -9.593 -6.021 5.821 1.00 0.00 N ATOM 937 CA GLN A 57 -10.070 -6.723 7.000 1.00 0.00 C ATOM 938 C GLN A 57 -8.953 -7.584 7.594 1.00 0.00 C ATOM 939 O GLN A 57 -8.914 -7.810 8.802 1.00 0.00 O ATOM 940 CB GLN A 57 -11.300 -7.572 6.673 1.00 0.00 C ATOM 941 CG GLN A 57 -12.316 -7.528 7.816 1.00 0.00 C ATOM 942 CD GLN A 57 -12.969 -8.896 8.021 1.00 0.00 C ATOM 943 OE1 GLN A 57 -13.848 -9.311 7.283 1.00 0.00 O ATOM 944 NE2 GLN A 57 -12.493 -9.572 9.063 1.00 0.00 N ATOM 0 H GLN A 57 -10.253 -5.994 5.044 1.00 0.00 H new ATOM 0 HA GLN A 57 -10.367 -5.983 7.743 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -11.763 -7.209 5.756 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -10.997 -8.603 6.491 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -11.821 -7.216 8.736 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -13.082 -6.784 7.598 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -11.756 -9.167 9.640 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -12.865 -10.496 9.285 1.00 0.00 H new ATOM 953 N TYR A 58 -8.071 -8.041 6.716 1.00 0.00 N ATOM 954 CA TYR A 58 -6.957 -8.871 7.138 1.00 0.00 C ATOM 955 C TYR A 58 -5.893 -8.038 7.855 1.00 0.00 C ATOM 956 O TYR A 58 -5.496 -8.362 8.973 1.00 0.00 O ATOM 957 CB TYR A 58 -6.355 -9.452 5.856 1.00 0.00 C ATOM 958 CG TYR A 58 -5.910 -10.910 5.983 1.00 0.00 C ATOM 959 CD1 TYR A 58 -6.838 -11.893 6.263 1.00 0.00 C ATOM 960 CD2 TYR A 58 -4.581 -11.244 5.816 1.00 0.00 C ATOM 961 CE1 TYR A 58 -6.420 -13.265 6.382 1.00 0.00 C ATOM 962 CE2 TYR A 58 -4.163 -12.617 5.935 1.00 0.00 C ATOM 963 CZ TYR A 58 -5.103 -13.560 6.212 1.00 0.00 C ATOM 964 OH TYR A 58 -4.708 -14.856 6.324 1.00 0.00 O ATOM 0 H TYR A 58 -8.106 -7.852 5.714 1.00 0.00 H new ATOM 0 HA TYR A 58 -7.294 -9.643 7.829 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -7.090 -9.376 5.055 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -5.498 -8.846 5.562 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -7.878 -11.632 6.393 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -3.855 -10.476 5.596 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -7.136 -14.043 6.601 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -3.126 -12.892 5.807 1.00 0.00 H new ATOM 0 HH TYR A 58 -3.741 -14.917 6.177 1.00 0.00 H new ATOM 974 N MET A 59 -5.461 -6.982 7.182 1.00 0.00 N ATOM 975 CA MET A 59 -4.451 -6.100 7.741 1.00 0.00 C ATOM 976 C MET A 59 -5.015 -5.291 8.911 1.00 0.00 C ATOM 977 O MET A 59 -4.278 -4.908 9.818 1.00 0.00 O ATOM 978 CB MET A 59 -3.949 -5.145 6.656 1.00 0.00 C ATOM 979 CG MET A 59 -3.691 -5.892 5.345 1.00 0.00 C ATOM 980 SD MET A 59 -3.010 -7.506 5.687 1.00 0.00 S ATOM 981 CE MET A 59 -1.564 -7.460 4.641 1.00 0.00 C ATOM 0 H MET A 59 -5.792 -6.717 6.254 1.00 0.00 H new ATOM 0 HA MET A 59 -3.627 -6.711 8.110 1.00 0.00 H new ATOM 0 HB2 MET A 59 -4.684 -4.357 6.491 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.031 -4.660 6.989 1.00 0.00 H new ATOM 0 HG2 MET A 59 -4.620 -5.992 4.784 1.00 0.00 H new ATOM 0 HG3 MET A 59 -3.002 -5.322 4.721 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.168 -8.469 4.523 1.00 0.00 H new ATOM 0 HE2 MET A 59 -1.834 -7.059 3.664 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.805 -6.824 5.097 1.00 0.00 H new ATOM 991 N ARG A 60 -6.318 -5.056 8.852 1.00 0.00 N ATOM 992 CA ARG A 60 -6.990 -4.300 9.895 1.00 0.00 C ATOM 993 C ARG A 60 -6.719 -4.928 11.264 1.00 0.00 C ATOM 994 O ARG A 60 -6.546 -4.218 12.253 1.00 0.00 O ATOM 995 CB ARG A 60 -8.500 -4.252 9.654 1.00 0.00 C ATOM 996 CG ARG A 60 -9.267 -4.766 10.875 1.00 0.00 C ATOM 997 CD ARG A 60 -9.151 -3.789 12.046 1.00 0.00 C ATOM 998 NE ARG A 60 -8.905 -4.532 13.302 1.00 0.00 N ATOM 999 CZ ARG A 60 -8.298 -4.011 14.377 1.00 0.00 C ATOM 1000 NH1 ARG A 60 -7.870 -2.741 14.355 1.00 0.00 N ATOM 1001 NH2 ARG A 60 -8.117 -4.760 15.474 1.00 0.00 N ATOM 0 H ARG A 60 -6.926 -5.376 8.098 1.00 0.00 H new ATOM 0 HA ARG A 60 -6.597 -3.283 9.873 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -8.804 -3.229 9.433 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.752 -4.855 8.782 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.317 -4.907 10.617 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -8.878 -5.740 11.170 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -8.338 -3.086 11.865 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.066 -3.203 12.134 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.217 -5.502 13.353 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.006 -2.171 13.520 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.408 -2.344 15.173 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.441 -5.727 15.491 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.655 -4.363 16.292 1.00 0.00 H new ATOM 1015 N THR A 61 -6.690 -6.253 11.277 1.00 0.00 N ATOM 1016 CA THR A 61 -6.443 -6.984 12.508 1.00 0.00 C ATOM 1017 C THR A 61 -4.958 -6.930 12.871 1.00 0.00 C ATOM 1018 O THR A 61 -4.606 -6.831 14.046 1.00 0.00 O ATOM 1019 CB THR A 61 -6.973 -8.408 12.326 1.00 0.00 C ATOM 1020 OG1 THR A 61 -7.307 -8.481 10.943 1.00 0.00 O ATOM 1021 CG2 THR A 61 -8.305 -8.633 13.044 1.00 0.00 C ATOM 0 H THR A 61 -6.834 -6.839 10.454 1.00 0.00 H new ATOM 0 HA THR A 61 -6.968 -6.531 13.349 1.00 0.00 H new ATOM 0 HB THR A 61 -6.236 -9.120 12.698 1.00 0.00 H new ATOM 0 HG1 THR A 61 -6.497 -8.656 10.420 1.00 0.00 H new ATOM 0 HG21 THR A 61 -8.637 -9.659 12.883 1.00 0.00 H new ATOM 0 HG22 THR A 61 -8.177 -8.457 14.112 1.00 0.00 H new ATOM 0 HG23 THR A 61 -9.052 -7.944 12.649 1.00 0.00 H new ATOM 1029 N SER A 62 -4.127 -6.997 11.842 1.00 0.00 N ATOM 1030 CA SER A 62 -2.688 -6.957 12.038 1.00 0.00 C ATOM 1031 C SER A 62 -2.173 -5.528 11.849 1.00 0.00 C ATOM 1032 O SER A 62 -1.097 -5.321 11.292 1.00 0.00 O ATOM 1033 CB SER A 62 -1.974 -7.909 11.077 1.00 0.00 C ATOM 1034 OG SER A 62 -2.119 -9.272 11.469 1.00 0.00 O ATOM 0 H SER A 62 -4.423 -7.079 10.869 1.00 0.00 H new ATOM 0 HA SER A 62 -2.473 -7.283 13.056 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.374 -7.776 10.072 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.915 -7.655 11.035 1.00 0.00 H new ATOM 0 HG SER A 62 -1.792 -9.855 10.752 1.00 0.00 H new ATOM 1040 N CYS A 63 -2.967 -4.580 12.324 1.00 0.00 N ATOM 1041 CA CYS A 63 -2.606 -3.177 12.214 1.00 0.00 C ATOM 1042 C CYS A 63 -3.704 -2.345 12.880 1.00 0.00 C ATOM 1043 O CYS A 63 -4.889 -2.573 12.645 1.00 0.00 O ATOM 1044 CB CYS A 63 -2.380 -2.763 10.759 1.00 0.00 C ATOM 1045 SG CYS A 63 -0.808 -1.837 10.609 1.00 0.00 S ATOM 0 H CYS A 63 -3.859 -4.756 12.786 1.00 0.00 H new ATOM 0 HA CYS A 63 -1.659 -3.002 12.724 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.354 -3.646 10.121 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -3.210 -2.146 10.415 1.00 0.00 H new ATOM 0 HG CYS A 63 0.192 -2.647 10.793 1.00 0.00 H new ATOM 1051 N PRO A 64 -3.258 -1.371 13.719 1.00 0.00 N ATOM 1052 CA PRO A 64 -4.189 -0.504 14.420 1.00 0.00 C ATOM 1053 C PRO A 64 -4.787 0.538 13.473 1.00 0.00 C ATOM 1054 O PRO A 64 -5.916 0.985 13.669 1.00 0.00 O ATOM 1055 CB PRO A 64 -3.378 0.114 15.547 1.00 0.00 C ATOM 1056 CG PRO A 64 -1.920 -0.066 15.159 1.00 0.00 C ATOM 1057 CD PRO A 64 -1.862 -1.072 14.021 1.00 0.00 C ATOM 0 HA PRO A 64 -5.050 -1.043 14.816 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -3.622 1.169 15.670 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -3.593 -0.376 16.497 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -1.487 0.885 14.850 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -1.339 -0.419 16.011 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -1.349 -0.658 13.153 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -1.319 -1.971 14.314 1.00 0.00 H new ATOM 1065 N GLN A 65 -4.003 0.895 12.466 1.00 0.00 N ATOM 1066 CA GLN A 65 -4.441 1.876 11.488 1.00 0.00 C ATOM 1067 C GLN A 65 -5.194 1.189 10.347 1.00 0.00 C ATOM 1068 O GLN A 65 -5.894 1.845 9.576 1.00 0.00 O ATOM 1069 CB GLN A 65 -3.257 2.685 10.954 1.00 0.00 C ATOM 1070 CG GLN A 65 -2.006 1.813 10.838 1.00 0.00 C ATOM 1071 CD GLN A 65 -1.213 1.814 12.147 1.00 0.00 C ATOM 1072 OE1 GLN A 65 -1.566 2.465 13.116 1.00 0.00 O ATOM 1073 NE2 GLN A 65 -0.125 1.049 12.121 1.00 0.00 N ATOM 0 H GLN A 65 -3.067 0.522 12.307 1.00 0.00 H new ATOM 0 HA GLN A 65 -5.121 2.571 11.980 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -3.507 3.101 9.978 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -3.058 3.527 11.618 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -2.292 0.793 10.583 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.377 2.180 10.027 1.00 0.00 H new ATOM 0 HE21 GLN A 65 0.113 0.530 11.276 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.471 0.982 12.946 1.00 0.00 H new ATOM 1082 N GLY A 66 -5.025 -0.123 10.275 1.00 0.00 N ATOM 1083 CA GLY A 66 -5.681 -0.906 9.242 1.00 0.00 C ATOM 1084 C GLY A 66 -6.106 -0.020 8.069 1.00 0.00 C ATOM 1085 O GLY A 66 -5.270 0.417 7.281 1.00 0.00 O ATOM 0 H GLY A 66 -4.443 -0.663 10.915 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.006 -1.685 8.888 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.555 -1.406 9.660 1.00 0.00 H new ATOM 1089 N PRO A 67 -7.442 0.225 7.990 1.00 0.00 N ATOM 1090 CA PRO A 67 -7.989 1.051 6.927 1.00 0.00 C ATOM 1091 C PRO A 67 -7.697 2.532 7.178 1.00 0.00 C ATOM 1092 O PRO A 67 -7.450 3.287 6.239 1.00 0.00 O ATOM 1093 CB PRO A 67 -9.475 0.734 6.908 1.00 0.00 C ATOM 1094 CG PRO A 67 -9.783 0.098 8.254 1.00 0.00 C ATOM 1095 CD PRO A 67 -8.462 -0.276 8.906 1.00 0.00 C ATOM 0 HA PRO A 67 -7.538 0.841 5.957 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -10.065 1.638 6.759 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -9.719 0.056 6.091 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -10.338 0.792 8.886 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -10.408 -0.785 8.125 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -8.365 0.177 9.893 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -8.378 -1.354 9.041 1.00 0.00 H new ATOM 1103 N VAL A 68 -7.735 2.902 8.450 1.00 0.00 N ATOM 1104 CA VAL A 68 -7.477 4.279 8.836 1.00 0.00 C ATOM 1105 C VAL A 68 -6.221 4.779 8.120 1.00 0.00 C ATOM 1106 O VAL A 68 -6.154 5.937 7.711 1.00 0.00 O ATOM 1107 CB VAL A 68 -7.380 4.386 10.359 1.00 0.00 C ATOM 1108 CG1 VAL A 68 -8.050 3.189 11.036 1.00 0.00 C ATOM 1109 CG2 VAL A 68 -5.923 4.524 10.807 1.00 0.00 C ATOM 0 H VAL A 68 -7.940 2.273 9.226 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.302 4.922 8.530 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.912 5.286 10.666 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -7.967 3.290 12.118 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.102 3.154 10.755 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -7.559 2.269 10.718 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.882 4.598 11.894 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.358 3.651 10.481 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.490 5.422 10.365 1.00 0.00 H new ATOM 1119 N SER A 69 -5.256 3.880 7.990 1.00 0.00 N ATOM 1120 CA SER A 69 -4.005 4.215 7.331 1.00 0.00 C ATOM 1121 C SER A 69 -4.221 4.314 5.819 1.00 0.00 C ATOM 1122 O SER A 69 -3.587 5.130 5.150 1.00 0.00 O ATOM 1123 CB SER A 69 -2.922 3.181 7.645 1.00 0.00 C ATOM 1124 OG SER A 69 -1.961 3.680 8.572 1.00 0.00 O ATOM 0 H SER A 69 -5.315 2.920 8.330 1.00 0.00 H new ATOM 0 HA SER A 69 -3.668 5.180 7.708 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.386 2.282 8.052 1.00 0.00 H new ATOM 0 HB3 SER A 69 -2.419 2.891 6.722 1.00 0.00 H new ATOM 0 HG SER A 69 -1.066 3.384 8.306 1.00 0.00 H new ATOM 1130 N LEU A 70 -5.117 3.473 5.325 1.00 0.00 N ATOM 1131 CA LEU A 70 -5.424 3.456 3.905 1.00 0.00 C ATOM 1132 C LEU A 70 -6.249 4.695 3.551 1.00 0.00 C ATOM 1133 O LEU A 70 -5.885 5.452 2.652 1.00 0.00 O ATOM 1134 CB LEU A 70 -6.098 2.138 3.518 1.00 0.00 C ATOM 1135 CG LEU A 70 -5.492 0.871 4.127 1.00 0.00 C ATOM 1136 CD1 LEU A 70 -6.542 -0.235 4.249 1.00 0.00 C ATOM 1137 CD2 LEU A 70 -4.267 0.413 3.333 1.00 0.00 C ATOM 0 H LEU A 70 -5.640 2.798 5.883 1.00 0.00 H new ATOM 0 HA LEU A 70 -4.507 3.504 3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.147 2.191 3.808 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.071 2.044 2.432 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.153 1.106 5.136 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -6.085 -1.124 4.684 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.356 0.105 4.889 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.934 -0.475 3.261 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.856 -0.489 3.787 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.559 0.201 2.304 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.513 1.200 3.342 1.00 0.00 H new ATOM 1149 N GLN A 71 -7.345 4.864 4.276 1.00 0.00 N ATOM 1150 CA GLN A 71 -8.225 5.998 4.049 1.00 0.00 C ATOM 1151 C GLN A 71 -7.479 7.308 4.307 1.00 0.00 C ATOM 1152 O GLN A 71 -7.749 8.318 3.660 1.00 0.00 O ATOM 1153 CB GLN A 71 -9.480 5.901 4.920 1.00 0.00 C ATOM 1154 CG GLN A 71 -9.887 4.442 5.134 1.00 0.00 C ATOM 1155 CD GLN A 71 -11.410 4.293 5.146 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -12.039 4.000 4.143 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -11.965 4.512 6.335 1.00 0.00 N ATOM 0 H GLN A 71 -7.644 4.235 5.021 1.00 0.00 H new ATOM 0 HA GLN A 71 -8.544 5.983 3.007 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -9.296 6.376 5.884 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -10.298 6.445 4.448 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.464 3.823 4.343 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -9.475 4.080 6.076 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -11.379 4.754 7.134 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -12.976 4.438 6.447 1.00 0.00 H new ATOM 1166 N ARG A 72 -6.554 7.249 5.255 1.00 0.00 N ATOM 1167 CA ARG A 72 -5.767 8.418 5.606 1.00 0.00 C ATOM 1168 C ARG A 72 -4.642 8.626 4.590 1.00 0.00 C ATOM 1169 O ARG A 72 -4.084 9.718 4.492 1.00 0.00 O ATOM 1170 CB ARG A 72 -5.162 8.275 7.004 1.00 0.00 C ATOM 1171 CG ARG A 72 -6.232 8.444 8.085 1.00 0.00 C ATOM 1172 CD ARG A 72 -6.633 9.913 8.234 1.00 0.00 C ATOM 1173 NE ARG A 72 -6.539 10.322 9.653 1.00 0.00 N ATOM 1174 CZ ARG A 72 -6.820 11.554 10.100 1.00 0.00 C ATOM 1175 NH1 ARG A 72 -7.214 12.504 9.242 1.00 0.00 N ATOM 1176 NH2 ARG A 72 -6.707 11.835 11.405 1.00 0.00 N ATOM 0 H ARG A 72 -6.333 6.409 5.790 1.00 0.00 H new ATOM 0 HA ARG A 72 -6.433 9.281 5.597 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -4.692 7.296 7.102 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -4.379 9.020 7.143 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -7.108 7.848 7.831 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -5.856 8.068 9.036 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -5.984 10.540 7.623 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -7.650 10.059 7.871 1.00 0.00 H new ATOM 0 HE ARG A 72 -6.242 9.623 10.333 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -7.300 12.290 8.248 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -7.428 13.442 9.582 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -6.407 11.111 12.058 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -6.921 12.773 11.745 1.00 0.00 H new ATOM 1190 N GLN A 73 -4.344 7.562 3.860 1.00 0.00 N ATOM 1191 CA GLN A 73 -3.296 7.614 2.855 1.00 0.00 C ATOM 1192 C GLN A 73 -3.704 8.544 1.710 1.00 0.00 C ATOM 1193 O GLN A 73 -2.866 9.251 1.152 1.00 0.00 O ATOM 1194 CB GLN A 73 -2.967 6.214 2.332 1.00 0.00 C ATOM 1195 CG GLN A 73 -1.736 5.641 3.037 1.00 0.00 C ATOM 1196 CD GLN A 73 -0.695 5.165 2.022 1.00 0.00 C ATOM 1197 OE1 GLN A 73 -1.005 4.809 0.897 1.00 0.00 O ATOM 1198 NE2 GLN A 73 0.554 5.180 2.480 1.00 0.00 N ATOM 0 H GLN A 73 -4.810 6.659 3.944 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.395 8.014 3.319 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -3.820 5.554 2.488 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.789 6.256 1.258 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.297 6.400 3.685 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.033 4.809 3.676 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.744 5.490 3.433 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.322 4.882 1.878 1.00 0.00 H new ATOM 1207 N ILE A 74 -4.990 8.514 1.396 1.00 0.00 N ATOM 1208 CA ILE A 74 -5.520 9.346 0.328 1.00 0.00 C ATOM 1209 C ILE A 74 -5.795 10.750 0.870 1.00 0.00 C ATOM 1210 O ILE A 74 -5.931 10.937 2.078 1.00 0.00 O ATOM 1211 CB ILE A 74 -6.741 8.683 -0.312 1.00 0.00 C ATOM 1212 CG1 ILE A 74 -6.592 8.610 -1.833 1.00 0.00 C ATOM 1213 CG2 ILE A 74 -8.031 9.394 0.104 1.00 0.00 C ATOM 1214 CD1 ILE A 74 -7.858 9.107 -2.533 1.00 0.00 C ATOM 0 H ILE A 74 -5.682 7.927 1.862 1.00 0.00 H new ATOM 0 HA ILE A 74 -4.788 9.451 -0.472 1.00 0.00 H new ATOM 0 HB ILE A 74 -6.805 7.658 0.054 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -5.739 9.211 -2.147 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -6.386 7.582 -2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -8.884 8.903 -0.364 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.137 9.350 1.188 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.991 10.436 -0.215 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.725 9.044 -3.613 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -8.705 8.489 -2.235 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.047 10.142 -2.250 1.00 0.00 H new ATOM 1226 N PRO A 75 -5.871 11.726 -0.074 1.00 0.00 N ATOM 1227 CA PRO A 75 -6.127 13.107 0.296 1.00 0.00 C ATOM 1228 C PRO A 75 -7.596 13.310 0.674 1.00 0.00 C ATOM 1229 O PRO A 75 -7.901 13.973 1.664 1.00 0.00 O ATOM 1230 CB PRO A 75 -5.707 13.924 -0.915 1.00 0.00 C ATOM 1231 CG PRO A 75 -5.669 12.950 -2.081 1.00 0.00 C ATOM 1232 CD PRO A 75 -5.715 11.541 -1.514 1.00 0.00 C ATOM 0 HA PRO A 75 -5.569 13.416 1.180 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -6.413 14.733 -1.104 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.731 14.383 -0.757 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.514 13.121 -2.748 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.763 13.095 -2.670 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -6.546 10.973 -1.933 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.803 10.991 -1.746 1.00 0.00 H new ATOM 1240 N LYS A 76 -8.468 12.726 -0.135 1.00 0.00 N ATOM 1241 CA LYS A 76 -9.897 12.835 0.101 1.00 0.00 C ATOM 1242 C LYS A 76 -10.299 11.874 1.222 1.00 0.00 C ATOM 1243 O LYS A 76 -11.161 11.017 1.032 1.00 0.00 O ATOM 1244 CB LYS A 76 -10.674 12.620 -1.200 1.00 0.00 C ATOM 1245 CG LYS A 76 -10.467 11.201 -1.734 1.00 0.00 C ATOM 1246 CD LYS A 76 -11.766 10.394 -1.663 1.00 0.00 C ATOM 1247 CE LYS A 76 -11.787 9.295 -2.728 1.00 0.00 C ATOM 1248 NZ LYS A 76 -12.550 8.122 -2.246 1.00 0.00 N ATOM 0 H LYS A 76 -8.212 12.176 -0.955 1.00 0.00 H new ATOM 0 HA LYS A 76 -10.152 13.841 0.435 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -11.736 12.796 -1.027 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -10.348 13.344 -1.946 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -10.117 11.244 -2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.691 10.700 -1.155 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.868 9.949 -0.673 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.619 11.058 -1.803 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.236 9.677 -3.645 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -10.767 8.998 -2.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.759 7.491 -3.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.987 7.609 -1.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -13.441 8.441 -1.815 1.00 0.00 H new ATOM 1262 N LEU A 77 -9.654 12.049 2.367 1.00 0.00 N ATOM 1263 CA LEU A 77 -9.933 11.208 3.519 1.00 0.00 C ATOM 1264 C LEU A 77 -11.363 11.466 3.999 1.00 0.00 C ATOM 1265 O LEU A 77 -12.213 10.580 3.932 1.00 0.00 O ATOM 1266 CB LEU A 77 -8.874 11.415 4.603 1.00 0.00 C ATOM 1267 CG LEU A 77 -7.581 12.101 4.155 1.00 0.00 C ATOM 1268 CD1 LEU A 77 -7.653 13.612 4.385 1.00 0.00 C ATOM 1269 CD2 LEU A 77 -6.363 11.474 4.837 1.00 0.00 C ATOM 0 H LEU A 77 -8.940 12.760 2.521 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.873 10.155 3.245 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.315 12.005 5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.619 10.443 5.024 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.465 11.945 3.083 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.722 14.075 4.058 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.484 14.028 3.815 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.805 13.812 5.446 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.458 11.980 4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.457 11.578 5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.305 10.417 4.578 1.00 0.00 H new ATOM 1281 N ASP A 78 -11.583 12.684 4.472 1.00 0.00 N ATOM 1282 CA ASP A 78 -12.895 13.069 4.963 1.00 0.00 C ATOM 1283 C ASP A 78 -13.971 12.491 4.042 1.00 0.00 C ATOM 1284 O ASP A 78 -15.107 12.281 4.463 1.00 0.00 O ATOM 1285 CB ASP A 78 -13.053 14.591 4.977 1.00 0.00 C ATOM 1286 CG ASP A 78 -12.583 15.301 3.705 1.00 0.00 C ATOM 1287 OD1 ASP A 78 -11.349 15.364 3.514 1.00 0.00 O ATOM 1288 OD2 ASP A 78 -13.468 15.764 2.954 1.00 0.00 O ATOM 0 H ASP A 78 -10.875 13.417 4.526 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.000 12.685 5.978 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -14.103 14.831 5.142 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.497 14.991 5.825 1.00 0.00 H new ATOM 1293 N SER A 79 -13.574 12.249 2.801 1.00 0.00 N ATOM 1294 CA SER A 79 -14.489 11.698 1.816 1.00 0.00 C ATOM 1295 C SER A 79 -14.550 10.175 1.951 1.00 0.00 C ATOM 1296 O SER A 79 -15.610 9.615 2.227 1.00 0.00 O ATOM 1297 CB SER A 79 -14.071 12.089 0.397 1.00 0.00 C ATOM 1298 OG SER A 79 -15.096 11.816 -0.555 1.00 0.00 O ATOM 0 H SER A 79 -12.631 12.425 2.455 1.00 0.00 H new ATOM 0 HA SER A 79 -15.480 12.112 2.001 1.00 0.00 H new ATOM 0 HB2 SER A 79 -13.825 13.151 0.371 1.00 0.00 H new ATOM 0 HB3 SER A 79 -13.167 11.546 0.122 1.00 0.00 H new ATOM 0 HG SER A 79 -15.203 12.587 -1.151 1.00 0.00 H new ATOM 1304 N VAL A 80 -13.400 9.549 1.752 1.00 0.00 N ATOM 1305 CA VAL A 80 -13.309 8.102 1.848 1.00 0.00 C ATOM 1306 C VAL A 80 -13.211 7.699 3.321 1.00 0.00 C ATOM 1307 O VAL A 80 -13.862 6.749 3.752 1.00 0.00 O ATOM 1308 CB VAL A 80 -12.134 7.595 1.009 1.00 0.00 C ATOM 1309 CG1 VAL A 80 -10.800 8.057 1.599 1.00 0.00 C ATOM 1310 CG2 VAL A 80 -12.175 6.071 0.874 1.00 0.00 C ATOM 0 H VAL A 80 -12.523 10.017 1.525 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.206 7.634 1.442 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.225 8.023 0.011 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.981 7.683 0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -10.770 9.146 1.621 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.698 7.671 2.613 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.329 5.736 0.273 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.120 5.616 1.863 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -13.105 5.774 0.389 1.00 0.00 H new ATOM 1320 N LEU A 81 -12.391 8.441 4.051 1.00 0.00 N ATOM 1321 CA LEU A 81 -12.200 8.172 5.466 1.00 0.00 C ATOM 1322 C LEU A 81 -13.561 8.139 6.164 1.00 0.00 C ATOM 1323 O LEU A 81 -13.649 7.811 7.346 1.00 0.00 O ATOM 1324 CB LEU A 81 -11.221 9.179 6.075 1.00 0.00 C ATOM 1325 CG LEU A 81 -11.683 9.871 7.359 1.00 0.00 C ATOM 1326 CD1 LEU A 81 -11.300 9.052 8.592 1.00 0.00 C ATOM 1327 CD2 LEU A 81 -11.148 11.303 7.433 1.00 0.00 C ATOM 0 H LEU A 81 -11.852 9.228 3.689 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.745 7.192 5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -10.282 8.664 6.281 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -11.008 9.945 5.329 1.00 0.00 H new ATOM 0 HG LEU A 81 -12.771 9.934 7.340 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.640 9.567 9.491 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.769 8.070 8.537 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -10.217 8.935 8.629 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.491 11.772 8.355 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.058 11.285 7.418 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -11.513 11.872 6.578 1.00 0.00 H new ATOM 1339 N LYS A 82 -14.589 8.484 5.402 1.00 0.00 N ATOM 1340 CA LYS A 82 -15.942 8.498 5.932 1.00 0.00 C ATOM 1341 C LYS A 82 -16.827 7.585 5.082 1.00 0.00 C ATOM 1342 O LYS A 82 -16.747 6.362 5.188 1.00 0.00 O ATOM 1343 CB LYS A 82 -16.461 9.933 6.039 1.00 0.00 C ATOM 1344 CG LYS A 82 -16.133 10.535 7.407 1.00 0.00 C ATOM 1345 CD LYS A 82 -14.981 11.536 7.304 1.00 0.00 C ATOM 1346 CE LYS A 82 -15.498 12.975 7.357 1.00 0.00 C ATOM 1347 NZ LYS A 82 -15.281 13.554 8.702 1.00 0.00 N ATOM 0 H LYS A 82 -14.512 8.756 4.422 1.00 0.00 H new ATOM 0 HA LYS A 82 -15.958 8.102 6.947 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -16.016 10.544 5.253 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -17.539 9.946 5.881 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -17.015 11.031 7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -15.867 9.740 8.104 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -14.276 11.369 8.118 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -14.437 11.375 6.373 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -14.987 13.579 6.608 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -16.560 12.995 7.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -15.637 14.531 8.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -15.789 12.986 9.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -14.264 13.552 8.921 1.00 0.00 H new ATOM 1361 N TYR A 83 -17.652 8.214 4.258 1.00 0.00 N ATOM 1362 CA TYR A 83 -18.552 7.474 3.390 1.00 0.00 C ATOM 1363 C TYR A 83 -18.758 8.206 2.062 1.00 0.00 C ATOM 1364 O TYR A 83 -19.390 7.676 1.149 1.00 0.00 O ATOM 1365 CB TYR A 83 -19.888 7.401 4.131 1.00 0.00 C ATOM 1366 CG TYR A 83 -20.648 6.090 3.916 1.00 0.00 C ATOM 1367 CD1 TYR A 83 -20.066 4.889 4.270 1.00 0.00 C ATOM 1368 CD2 TYR A 83 -21.914 6.109 3.369 1.00 0.00 C ATOM 1369 CE1 TYR A 83 -20.781 3.656 4.067 1.00 0.00 C ATOM 1370 CE2 TYR A 83 -22.630 4.876 3.167 1.00 0.00 C ATOM 1371 CZ TYR A 83 -22.028 3.710 3.526 1.00 0.00 C ATOM 1372 OH TYR A 83 -22.703 2.545 3.335 1.00 0.00 O ATOM 0 H TYR A 83 -17.716 9.228 4.173 1.00 0.00 H new ATOM 0 HA TYR A 83 -18.144 6.488 3.165 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -19.708 7.534 5.198 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -20.517 8.231 3.808 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -19.075 4.875 4.699 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -22.368 7.049 3.092 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -20.337 2.709 4.338 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -23.622 4.877 2.740 1.00 0.00 H new ATOM 0 HH TYR A 83 -23.580 2.736 2.942 1.00 0.00 H new ATOM 1382 N LYS A 84 -18.215 9.413 1.997 1.00 0.00 N ATOM 1383 CA LYS A 84 -18.332 10.223 0.796 1.00 0.00 C ATOM 1384 C LYS A 84 -17.761 9.448 -0.394 1.00 0.00 C ATOM 1385 O LYS A 84 -18.057 8.267 -0.569 1.00 0.00 O ATOM 1386 CB LYS A 84 -17.681 11.591 1.008 1.00 0.00 C ATOM 1387 CG LYS A 84 -18.324 12.649 0.108 1.00 0.00 C ATOM 1388 CD LYS A 84 -17.969 14.060 0.581 1.00 0.00 C ATOM 1389 CE LYS A 84 -17.305 14.862 -0.540 1.00 0.00 C ATOM 1390 NZ LYS A 84 -17.320 16.308 -0.222 1.00 0.00 N ATOM 0 H LYS A 84 -17.693 9.850 2.757 1.00 0.00 H new ATOM 0 HA LYS A 84 -19.380 10.425 0.573 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -17.781 11.887 2.052 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -16.614 11.527 0.795 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.988 12.511 -0.920 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -19.407 12.523 0.109 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -18.871 14.573 0.915 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -17.298 14.002 1.438 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.278 14.524 -0.677 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.827 14.685 -1.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -16.866 16.838 -0.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -18.303 16.629 -0.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -16.802 16.474 0.664 1.00 0.00 H new ATOM 1404 N HIS A 85 -16.955 10.145 -1.180 1.00 0.00 N ATOM 1405 CA HIS A 85 -16.341 9.538 -2.349 1.00 0.00 C ATOM 1406 C HIS A 85 -16.145 8.040 -2.105 1.00 0.00 C ATOM 1407 O HIS A 85 -16.108 7.254 -3.050 1.00 0.00 O ATOM 1408 CB HIS A 85 -15.039 10.255 -2.713 1.00 0.00 C ATOM 1409 CG HIS A 85 -15.232 11.676 -3.184 1.00 0.00 C ATOM 1410 ND1 HIS A 85 -14.432 12.723 -2.758 1.00 0.00 N ATOM 1411 CD2 HIS A 85 -16.139 12.213 -4.049 1.00 0.00 C ATOM 1412 CE1 HIS A 85 -14.850 13.834 -3.345 1.00 0.00 C ATOM 1413 NE2 HIS A 85 -15.908 13.517 -4.145 1.00 0.00 N ATOM 0 H HIS A 85 -16.712 11.124 -1.031 1.00 0.00 H new ATOM 0 HA HIS A 85 -17.001 9.648 -3.210 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -14.382 10.257 -1.843 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -14.531 9.690 -3.494 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -16.914 11.669 -4.568 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -14.427 14.819 -3.213 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -16.435 14.173 -4.722 1.00 0.00 H new ATOM 1421 N THR A 86 -16.024 7.691 -0.833 1.00 0.00 N ATOM 1422 CA THR A 86 -15.832 6.301 -0.453 1.00 0.00 C ATOM 1423 C THR A 86 -16.856 5.410 -1.159 1.00 0.00 C ATOM 1424 O THR A 86 -16.603 4.228 -1.386 1.00 0.00 O ATOM 1425 CB THR A 86 -15.901 6.214 1.072 1.00 0.00 C ATOM 1426 OG1 THR A 86 -14.650 5.642 1.444 1.00 0.00 O ATOM 1427 CG2 THR A 86 -16.935 5.195 1.555 1.00 0.00 C ATOM 0 H THR A 86 -16.055 8.346 -0.052 1.00 0.00 H new ATOM 0 HA THR A 86 -14.855 5.935 -0.770 1.00 0.00 H new ATOM 0 HB THR A 86 -16.141 7.196 1.481 1.00 0.00 H new ATOM 0 HG1 THR A 86 -14.528 5.724 2.413 1.00 0.00 H new ATOM 0 HG21 THR A 86 -16.943 5.173 2.645 1.00 0.00 H new ATOM 0 HG22 THR A 86 -17.922 5.478 1.190 1.00 0.00 H new ATOM 0 HG23 THR A 86 -16.677 4.207 1.174 1.00 0.00 H new ATOM 1435 N ASP A 87 -17.991 6.011 -1.487 1.00 0.00 N ATOM 1436 CA ASP A 87 -19.054 5.286 -2.162 1.00 0.00 C ATOM 1437 C ASP A 87 -18.442 4.340 -3.197 1.00 0.00 C ATOM 1438 O ASP A 87 -17.280 3.952 -3.080 1.00 0.00 O ATOM 1439 CB ASP A 87 -19.994 6.245 -2.895 1.00 0.00 C ATOM 1440 CG ASP A 87 -20.007 7.676 -2.357 1.00 0.00 C ATOM 1441 OD1 ASP A 87 -20.383 7.835 -1.175 1.00 0.00 O ATOM 1442 OD2 ASP A 87 -19.640 8.580 -3.138 1.00 0.00 O ATOM 0 H ASP A 87 -18.197 6.992 -1.298 1.00 0.00 H new ATOM 0 HA ASP A 87 -19.617 4.734 -1.410 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -19.713 6.271 -3.948 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -21.007 5.845 -2.846 1.00 0.00 H new ATOM 1447 N PRO A 88 -19.273 3.986 -4.214 1.00 0.00 N ATOM 1448 CA PRO A 88 -18.826 3.092 -5.269 1.00 0.00 C ATOM 1449 C PRO A 88 -17.890 3.815 -6.240 1.00 0.00 C ATOM 1450 O PRO A 88 -17.695 3.368 -7.369 1.00 0.00 O ATOM 1451 CB PRO A 88 -20.101 2.597 -5.932 1.00 0.00 C ATOM 1452 CG PRO A 88 -21.188 3.582 -5.532 1.00 0.00 C ATOM 1453 CD PRO A 88 -20.654 4.425 -4.386 1.00 0.00 C ATOM 0 HA PRO A 88 -18.239 2.255 -4.890 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -19.988 2.558 -7.015 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -20.347 1.588 -5.601 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -21.460 4.215 -6.377 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -22.090 3.052 -5.228 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -20.705 5.488 -4.620 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -21.235 4.270 -3.477 1.00 0.00 H new ATOM 1461 N THR A 89 -17.334 4.920 -5.764 1.00 0.00 N ATOM 1462 CA THR A 89 -16.423 5.709 -6.576 1.00 0.00 C ATOM 1463 C THR A 89 -15.004 5.146 -6.483 1.00 0.00 C ATOM 1464 O THR A 89 -14.298 5.064 -7.488 1.00 0.00 O ATOM 1465 CB THR A 89 -16.530 7.167 -6.124 1.00 0.00 C ATOM 1466 OG1 THR A 89 -16.532 7.908 -7.342 1.00 0.00 O ATOM 1467 CG2 THR A 89 -15.272 7.648 -5.398 1.00 0.00 C ATOM 0 H THR A 89 -17.497 5.287 -4.826 1.00 0.00 H new ATOM 0 HA THR A 89 -16.690 5.661 -7.632 1.00 0.00 H new ATOM 0 HB THR A 89 -17.394 7.282 -5.469 1.00 0.00 H new ATOM 0 HG1 THR A 89 -15.612 8.017 -7.660 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.400 8.688 -5.099 1.00 0.00 H new ATOM 0 HG22 THR A 89 -15.105 7.034 -4.513 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.413 7.565 -6.064 1.00 0.00 H new ATOM 1475 N PHE A 90 -14.627 4.773 -5.269 1.00 0.00 N ATOM 1476 CA PHE A 90 -13.304 4.220 -5.033 1.00 0.00 C ATOM 1477 C PHE A 90 -13.378 2.715 -4.771 1.00 0.00 C ATOM 1478 O PHE A 90 -12.385 2.005 -4.924 1.00 0.00 O ATOM 1479 CB PHE A 90 -12.745 4.915 -3.790 1.00 0.00 C ATOM 1480 CG PHE A 90 -11.687 5.978 -4.095 1.00 0.00 C ATOM 1481 CD1 PHE A 90 -11.978 7.006 -4.936 1.00 0.00 C ATOM 1482 CD2 PHE A 90 -10.455 5.894 -3.525 1.00 0.00 C ATOM 1483 CE1 PHE A 90 -10.996 7.993 -5.218 1.00 0.00 C ATOM 1484 CE2 PHE A 90 -9.473 6.880 -3.807 1.00 0.00 C ATOM 1485 CZ PHE A 90 -9.765 7.909 -4.648 1.00 0.00 C ATOM 0 H PHE A 90 -15.215 4.843 -4.438 1.00 0.00 H new ATOM 0 HA PHE A 90 -12.673 4.379 -5.907 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -13.567 5.380 -3.246 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -12.311 4.164 -3.130 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -12.956 7.072 -5.390 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -10.224 5.077 -2.858 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -11.228 8.810 -5.885 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -8.495 6.813 -3.354 1.00 0.00 H new ATOM 0 HZ PHE A 90 -9.018 8.659 -4.863 1.00 0.00 H new ATOM 1495 N GLY A 91 -14.564 2.272 -4.380 1.00 0.00 N ATOM 1496 CA GLY A 91 -14.780 0.863 -4.095 1.00 0.00 C ATOM 1497 C GLY A 91 -14.233 -0.014 -5.222 1.00 0.00 C ATOM 1498 O GLY A 91 -13.552 0.477 -6.122 1.00 0.00 O ATOM 0 H GLY A 91 -15.385 2.864 -4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.294 0.600 -3.156 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.846 0.673 -3.966 1.00 0.00 H new ATOM 1502 N MET A 92 -14.551 -1.298 -5.137 1.00 0.00 N ATOM 1503 CA MET A 92 -14.100 -2.248 -6.139 1.00 0.00 C ATOM 1504 C MET A 92 -12.792 -1.786 -6.784 1.00 0.00 C ATOM 1505 O MET A 92 -11.714 -2.001 -6.233 1.00 0.00 O ATOM 1506 CB MET A 92 -15.175 -2.402 -7.218 1.00 0.00 C ATOM 1507 CG MET A 92 -15.824 -1.055 -7.540 1.00 0.00 C ATOM 1508 SD MET A 92 -17.041 -0.651 -6.298 1.00 0.00 S ATOM 1509 CE MET A 92 -16.981 1.132 -6.374 1.00 0.00 C ATOM 0 H MET A 92 -15.115 -1.702 -4.390 1.00 0.00 H new ATOM 0 HA MET A 92 -13.923 -3.206 -5.650 1.00 0.00 H new ATOM 0 HB2 MET A 92 -14.732 -2.821 -8.121 1.00 0.00 H new ATOM 0 HB3 MET A 92 -15.936 -3.105 -6.880 1.00 0.00 H new ATOM 0 HG2 MET A 92 -15.063 -0.276 -7.582 1.00 0.00 H new ATOM 0 HG3 MET A 92 -16.294 -1.094 -8.523 1.00 0.00 H new ATOM 0 HE1 MET A 92 -16.974 1.539 -5.363 1.00 0.00 H new ATOM 0 HE2 MET A 92 -16.077 1.444 -6.897 1.00 0.00 H new ATOM 0 HE3 MET A 92 -17.855 1.503 -6.909 1.00 0.00 H new ATOM 1519 N ASP A 93 -12.930 -1.160 -7.944 1.00 0.00 N ATOM 1520 CA ASP A 93 -11.773 -0.665 -8.670 1.00 0.00 C ATOM 1521 C ASP A 93 -11.567 0.816 -8.346 1.00 0.00 C ATOM 1522 O ASP A 93 -12.283 1.673 -8.861 1.00 0.00 O ATOM 1523 CB ASP A 93 -11.973 -0.795 -10.181 1.00 0.00 C ATOM 1524 CG ASP A 93 -12.011 -2.231 -10.707 1.00 0.00 C ATOM 1525 OD1 ASP A 93 -13.113 -2.821 -10.667 1.00 0.00 O ATOM 1526 OD2 ASP A 93 -10.938 -2.707 -11.137 1.00 0.00 O ATOM 0 H ASP A 93 -13.826 -0.984 -8.399 1.00 0.00 H new ATOM 0 HA ASP A 93 -10.909 -1.257 -8.369 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -12.905 -0.300 -10.453 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -11.169 -0.260 -10.686 1.00 0.00 H new ATOM 1531 N LEU A 94 -10.586 1.072 -7.493 1.00 0.00 N ATOM 1532 CA LEU A 94 -10.277 2.435 -7.094 1.00 0.00 C ATOM 1533 C LEU A 94 -9.488 3.122 -8.211 1.00 0.00 C ATOM 1534 O LEU A 94 -9.580 4.336 -8.383 1.00 0.00 O ATOM 1535 CB LEU A 94 -9.566 2.448 -5.740 1.00 0.00 C ATOM 1536 CG LEU A 94 -8.267 3.254 -5.673 1.00 0.00 C ATOM 1537 CD1 LEU A 94 -8.400 4.428 -4.700 1.00 0.00 C ATOM 1538 CD2 LEU A 94 -7.080 2.354 -5.326 1.00 0.00 C ATOM 0 H LEU A 94 -9.995 0.359 -7.067 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.193 3.008 -6.952 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -10.255 2.844 -4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -9.347 1.418 -5.457 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.074 3.674 -6.660 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.463 4.984 -4.671 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.203 5.086 -5.032 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -8.629 4.050 -3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.170 2.952 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.250 1.885 -4.357 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.973 1.583 -6.089 1.00 0.00 H new ATOM 1550 N GLN A 95 -8.731 2.315 -8.939 1.00 0.00 N ATOM 1551 CA GLN A 95 -7.926 2.830 -10.034 1.00 0.00 C ATOM 1552 C GLN A 95 -8.784 3.690 -10.964 1.00 0.00 C ATOM 1553 O GLN A 95 -8.275 4.598 -11.621 1.00 0.00 O ATOM 1554 CB GLN A 95 -7.255 1.691 -10.804 1.00 0.00 C ATOM 1555 CG GLN A 95 -5.929 2.149 -11.415 1.00 0.00 C ATOM 1556 CD GLN A 95 -5.704 1.506 -12.785 1.00 0.00 C ATOM 1557 OE1 GLN A 95 -5.765 0.299 -12.950 1.00 0.00 O ATOM 1558 NE2 GLN A 95 -5.443 2.378 -13.755 1.00 0.00 N ATOM 0 H GLN A 95 -8.658 1.308 -8.792 1.00 0.00 H new ATOM 0 HA GLN A 95 -7.137 3.456 -9.617 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -7.079 0.849 -10.135 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.920 1.339 -11.592 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.926 3.234 -11.514 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -5.108 1.888 -10.748 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -5.407 3.376 -13.547 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.279 2.049 -14.706 1.00 0.00 H new ATOM 1567 N LYS A 96 -10.070 3.375 -10.991 1.00 0.00 N ATOM 1568 CA LYS A 96 -11.004 4.107 -11.830 1.00 0.00 C ATOM 1569 C LYS A 96 -11.051 5.568 -11.377 1.00 0.00 C ATOM 1570 O LYS A 96 -11.315 6.462 -12.180 1.00 0.00 O ATOM 1571 CB LYS A 96 -12.371 3.421 -11.836 1.00 0.00 C ATOM 1572 CG LYS A 96 -12.230 1.919 -12.093 1.00 0.00 C ATOM 1573 CD LYS A 96 -11.185 1.645 -13.177 1.00 0.00 C ATOM 1574 CE LYS A 96 -11.301 0.211 -13.699 1.00 0.00 C ATOM 1575 NZ LYS A 96 -10.244 -0.063 -14.698 1.00 0.00 N ATOM 0 H LYS A 96 -10.488 2.622 -10.445 1.00 0.00 H new ATOM 0 HA LYS A 96 -10.668 4.104 -12.867 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -12.868 3.585 -10.880 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.002 3.867 -12.604 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -11.944 1.414 -11.171 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.192 1.506 -12.397 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -11.317 2.347 -14.000 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -10.186 1.810 -12.774 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -11.218 -0.492 -12.870 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.283 0.059 -14.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -10.337 -1.040 -15.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -10.342 0.596 -15.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.310 0.062 -14.258 1.00 0.00 H new ATOM 1589 N CYS A 97 -10.790 5.765 -10.093 1.00 0.00 N ATOM 1590 CA CYS A 97 -10.799 7.103 -9.525 1.00 0.00 C ATOM 1591 C CYS A 97 -9.355 7.604 -9.453 1.00 0.00 C ATOM 1592 O CYS A 97 -9.056 8.711 -9.897 1.00 0.00 O ATOM 1593 CB CYS A 97 -11.482 7.130 -8.156 1.00 0.00 C ATOM 1594 SG CYS A 97 -13.140 7.890 -8.299 1.00 0.00 S ATOM 0 H CYS A 97 -10.571 5.021 -9.430 1.00 0.00 H new ATOM 0 HA CYS A 97 -11.381 7.768 -10.162 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -11.570 6.117 -7.764 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -10.874 7.694 -7.448 1.00 0.00 H new ATOM 0 HG CYS A 97 -14.051 6.968 -8.193 1.00 0.00 H new ATOM 1600 N VAL A 98 -8.498 6.765 -8.890 1.00 0.00 N ATOM 1601 CA VAL A 98 -7.093 7.109 -8.755 1.00 0.00 C ATOM 1602 C VAL A 98 -6.504 7.383 -10.140 1.00 0.00 C ATOM 1603 O VAL A 98 -5.613 8.219 -10.285 1.00 0.00 O ATOM 1604 CB VAL A 98 -6.354 6.004 -7.998 1.00 0.00 C ATOM 1605 CG1 VAL A 98 -4.866 6.333 -7.862 1.00 0.00 C ATOM 1606 CG2 VAL A 98 -6.989 5.758 -6.628 1.00 0.00 C ATOM 0 H VAL A 98 -8.750 5.848 -8.522 1.00 0.00 H new ATOM 0 HA VAL A 98 -6.977 8.020 -8.167 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.442 5.085 -8.577 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -4.364 5.531 -7.320 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -4.424 6.433 -8.853 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -4.749 7.269 -7.316 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.444 4.968 -6.111 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -6.947 6.673 -6.038 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -8.029 5.457 -6.758 1.00 0.00 H new ATOM 1616 N GLN A 99 -7.025 6.663 -11.122 1.00 0.00 N ATOM 1617 CA GLN A 99 -6.561 6.818 -12.491 1.00 0.00 C ATOM 1618 C GLN A 99 -6.290 8.293 -12.795 1.00 0.00 C ATOM 1619 O GLN A 99 -5.491 8.612 -13.675 1.00 0.00 O ATOM 1620 CB GLN A 99 -7.568 6.229 -13.481 1.00 0.00 C ATOM 1621 CG GLN A 99 -9.004 6.526 -13.044 1.00 0.00 C ATOM 1622 CD GLN A 99 -9.599 7.676 -13.860 1.00 0.00 C ATOM 1623 OE1 GLN A 99 -9.114 8.796 -13.847 1.00 0.00 O ATOM 1624 NE2 GLN A 99 -10.672 7.338 -14.568 1.00 0.00 N ATOM 0 H GLN A 99 -7.764 5.971 -10.998 1.00 0.00 H new ATOM 0 HA GLN A 99 -5.627 6.267 -12.603 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -7.393 6.644 -14.474 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -7.422 5.151 -13.556 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -9.617 5.633 -13.166 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -9.020 6.781 -11.984 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -11.026 6.382 -14.533 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -11.142 8.035 -15.146 1.00 0.00 H new ATOM 1633 N ARG A 100 -6.970 9.152 -12.052 1.00 0.00 N ATOM 1634 CA ARG A 100 -6.813 10.586 -12.231 1.00 0.00 C ATOM 1635 C ARG A 100 -8.077 11.319 -11.779 1.00 0.00 C ATOM 1636 O ARG A 100 -8.041 12.520 -11.516 1.00 0.00 O ATOM 1637 CB ARG A 100 -6.529 10.929 -13.695 1.00 0.00 C ATOM 1638 CG ARG A 100 -6.830 12.402 -13.981 1.00 0.00 C ATOM 1639 CD ARG A 100 -6.373 12.792 -15.388 1.00 0.00 C ATOM 1640 NE ARG A 100 -7.465 13.493 -16.099 1.00 0.00 N ATOM 1641 CZ ARG A 100 -7.370 13.955 -17.353 1.00 0.00 C ATOM 1642 NH1 ARG A 100 -6.233 13.793 -18.043 1.00 0.00 N ATOM 1643 NH2 ARG A 100 -8.413 14.579 -17.918 1.00 0.00 N ATOM 0 H ARG A 100 -7.632 8.883 -11.324 1.00 0.00 H new ATOM 0 HA ARG A 100 -5.967 10.906 -11.623 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -5.485 10.716 -13.926 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -7.135 10.297 -14.344 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -7.900 12.585 -13.879 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -6.327 13.029 -13.245 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -5.495 13.435 -15.329 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -6.079 11.902 -15.944 1.00 0.00 H new ATOM 0 HE ARG A 100 -8.345 13.633 -15.603 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -5.439 13.318 -17.614 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -6.161 14.145 -18.998 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -9.279 14.702 -17.393 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.341 14.931 -18.873 1.00 0.00 H new ATOM 1657 N GLY A 101 -9.164 10.566 -11.702 1.00 0.00 N ATOM 1658 CA GLY A 101 -10.437 11.130 -11.285 1.00 0.00 C ATOM 1659 C GLY A 101 -10.378 11.602 -9.831 1.00 0.00 C ATOM 1660 O GLY A 101 -9.296 11.811 -9.286 1.00 0.00 O ATOM 0 H GLY A 101 -9.190 9.570 -11.921 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -10.697 11.967 -11.933 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -11.224 10.384 -11.397 1.00 0.00 H new ATOM 1664 N LEU A 102 -11.556 11.754 -9.244 1.00 0.00 N ATOM 1665 CA LEU A 102 -11.652 12.197 -7.863 1.00 0.00 C ATOM 1666 C LEU A 102 -10.530 13.196 -7.573 1.00 0.00 C ATOM 1667 O LEU A 102 -10.690 14.396 -7.791 1.00 0.00 O ATOM 1668 CB LEU A 102 -11.668 10.997 -6.915 1.00 0.00 C ATOM 1669 CG LEU A 102 -12.733 11.023 -5.817 1.00 0.00 C ATOM 1670 CD1 LEU A 102 -12.249 11.819 -4.603 1.00 0.00 C ATOM 1671 CD2 LEU A 102 -14.063 11.552 -6.356 1.00 0.00 C ATOM 0 H LEU A 102 -12.452 11.578 -9.699 1.00 0.00 H new ATOM 0 HA LEU A 102 -12.594 12.718 -7.695 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -11.808 10.093 -7.508 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.689 10.920 -6.442 1.00 0.00 H new ATOM 0 HG LEU A 102 -12.905 10.000 -5.483 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -13.025 11.822 -3.837 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.346 11.359 -4.203 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -12.032 12.844 -4.903 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.803 11.560 -5.555 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.925 12.565 -6.733 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -14.410 10.908 -7.164 1.00 0.00 H new ATOM 1683 N TRP A 103 -9.419 12.663 -7.086 1.00 0.00 N ATOM 1684 CA TRP A 103 -8.270 13.493 -6.764 1.00 0.00 C ATOM 1685 C TRP A 103 -7.006 12.708 -7.119 1.00 0.00 C ATOM 1686 O TRP A 103 -7.035 11.481 -7.199 1.00 0.00 O ATOM 1687 CB TRP A 103 -8.307 13.936 -5.300 1.00 0.00 C ATOM 1688 CG TRP A 103 -7.915 15.399 -5.083 1.00 0.00 C ATOM 1689 CD1 TRP A 103 -7.457 16.273 -5.988 1.00 0.00 C ATOM 1690 CD2 TRP A 103 -7.967 16.127 -3.838 1.00 0.00 C ATOM 1691 NE1 TRP A 103 -7.210 17.507 -5.421 1.00 0.00 N ATOM 1692 CE2 TRP A 103 -7.530 17.415 -4.071 1.00 0.00 C ATOM 1693 CE3 TRP A 103 -8.370 15.711 -2.557 1.00 0.00 C ATOM 1694 CZ2 TRP A 103 -7.454 18.392 -3.071 1.00 0.00 C ATOM 1695 CZ3 TRP A 103 -8.288 16.699 -1.568 1.00 0.00 C ATOM 1696 CH2 TRP A 103 -7.851 18.000 -1.787 1.00 0.00 C ATOM 0 H TRP A 103 -9.290 11.667 -6.907 1.00 0.00 H new ATOM 0 HA TRP A 103 -8.283 14.414 -7.347 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -9.312 13.778 -4.908 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -7.636 13.301 -4.722 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -7.300 16.041 -7.031 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -6.858 18.334 -5.903 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -8.716 14.709 -2.352 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -7.108 19.394 -3.279 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -8.585 16.431 -0.565 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -7.818 18.706 -0.970 1.00 0.00 H new ATOM 1707 N ASN A 104 -5.926 13.448 -7.322 1.00 0.00 N ATOM 1708 CA ASN A 104 -4.653 12.836 -7.667 1.00 0.00 C ATOM 1709 C ASN A 104 -3.837 12.614 -6.392 1.00 0.00 C ATOM 1710 O ASN A 104 -3.215 13.543 -5.879 1.00 0.00 O ATOM 1711 CB ASN A 104 -3.841 13.741 -8.596 1.00 0.00 C ATOM 1712 CG ASN A 104 -3.607 15.112 -7.959 1.00 0.00 C ATOM 1713 OD1 ASN A 104 -4.530 15.826 -7.604 1.00 0.00 O ATOM 1714 ND2 ASN A 104 -2.324 15.439 -7.835 1.00 0.00 N ATOM 0 H ASN A 104 -5.906 14.466 -7.254 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.858 11.892 -8.172 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -2.883 13.272 -8.820 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -4.367 13.861 -9.543 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -2.064 16.334 -7.422 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -1.600 14.794 -8.153 1.00 0.00 H new ATOM 1721 N PRO A 105 -3.867 11.345 -5.904 1.00 0.00 N ATOM 1722 CA PRO A 105 -3.138 10.988 -4.699 1.00 0.00 C ATOM 1723 C PRO A 105 -1.637 10.883 -4.977 1.00 0.00 C ATOM 1724 O PRO A 105 -1.162 11.332 -6.019 1.00 0.00 O ATOM 1725 CB PRO A 105 -3.751 9.674 -4.243 1.00 0.00 C ATOM 1726 CG PRO A 105 -4.476 9.110 -5.453 1.00 0.00 C ATOM 1727 CD PRO A 105 -4.593 10.219 -6.486 1.00 0.00 C ATOM 0 HA PRO A 105 -3.221 11.743 -3.918 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.982 8.985 -3.892 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.440 9.832 -3.413 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -3.929 8.262 -5.864 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.464 8.746 -5.171 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.160 9.919 -7.440 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.635 10.475 -6.676 1.00 0.00 H new ATOM 1735 N LYS A 106 -0.932 10.287 -4.027 1.00 0.00 N ATOM 1736 CA LYS A 106 0.505 10.118 -4.157 1.00 0.00 C ATOM 1737 C LYS A 106 1.040 9.380 -2.927 1.00 0.00 C ATOM 1738 O LYS A 106 2.051 9.780 -2.351 1.00 0.00 O ATOM 1739 CB LYS A 106 1.184 11.466 -4.409 1.00 0.00 C ATOM 1740 CG LYS A 106 1.205 12.315 -3.136 1.00 0.00 C ATOM 1741 CD LYS A 106 -0.215 12.594 -2.639 1.00 0.00 C ATOM 1742 CE LYS A 106 -0.626 11.591 -1.560 1.00 0.00 C ATOM 1743 NZ LYS A 106 -2.099 11.544 -1.430 1.00 0.00 N ATOM 0 H LYS A 106 -1.329 9.915 -3.164 1.00 0.00 H new ATOM 0 HA LYS A 106 0.739 9.503 -5.026 1.00 0.00 H new ATOM 0 HB2 LYS A 106 2.203 11.304 -4.759 1.00 0.00 H new ATOM 0 HB3 LYS A 106 0.657 12.001 -5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 106 1.771 11.799 -2.360 1.00 0.00 H new ATOM 0 HG3 LYS A 106 1.717 13.257 -3.331 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -0.272 13.607 -2.240 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -0.913 12.541 -3.474 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -0.246 10.601 -1.812 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.180 11.871 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.363 11.644 -0.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.521 12.321 -1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -2.451 10.634 -1.792 1.00 0.00 H new ATOM 1757 N GLU A 107 0.339 8.317 -2.563 1.00 0.00 N ATOM 1758 CA GLU A 107 0.731 7.521 -1.413 1.00 0.00 C ATOM 1759 C GLU A 107 0.635 6.030 -1.742 1.00 0.00 C ATOM 1760 O GLU A 107 -0.277 5.604 -2.450 1.00 0.00 O ATOM 1761 CB GLU A 107 -0.121 7.867 -0.190 1.00 0.00 C ATOM 1762 CG GLU A 107 0.424 9.106 0.524 1.00 0.00 C ATOM 1763 CD GLU A 107 -0.204 9.260 1.911 1.00 0.00 C ATOM 1764 OE1 GLU A 107 0.042 8.364 2.748 1.00 0.00 O ATOM 1765 OE2 GLU A 107 -0.915 10.270 2.103 1.00 0.00 O ATOM 0 H GLU A 107 -0.498 7.988 -3.044 1.00 0.00 H new ATOM 0 HA GLU A 107 1.768 7.755 -1.171 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.151 8.044 -0.498 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.135 7.022 0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.507 9.029 0.618 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.218 9.994 -0.073 1.00 0.00 H new ATOM 1772 N ALA A 108 1.589 5.277 -1.214 1.00 0.00 N ATOM 1773 CA ALA A 108 1.624 3.843 -1.443 1.00 0.00 C ATOM 1774 C ALA A 108 1.419 3.113 -0.114 1.00 0.00 C ATOM 1775 O ALA A 108 2.093 3.409 0.871 1.00 0.00 O ATOM 1776 CB ALA A 108 2.944 3.465 -2.118 1.00 0.00 C ATOM 0 H ALA A 108 2.344 5.634 -0.628 1.00 0.00 H new ATOM 0 HA ALA A 108 0.818 3.542 -2.112 1.00 0.00 H new ATOM 0 HB1 ALA A 108 2.970 2.389 -2.290 1.00 0.00 H new ATOM 0 HB2 ALA A 108 3.028 3.987 -3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 108 3.776 3.750 -1.474 1.00 0.00 H new ATOM 1782 N LEU A 109 0.486 2.173 -0.130 1.00 0.00 N ATOM 1783 CA LEU A 109 0.184 1.398 1.062 1.00 0.00 C ATOM 1784 C LEU A 109 0.873 0.035 0.968 1.00 0.00 C ATOM 1785 O LEU A 109 0.563 -0.761 0.083 1.00 0.00 O ATOM 1786 CB LEU A 109 -1.329 1.309 1.274 1.00 0.00 C ATOM 1787 CG LEU A 109 -2.193 1.481 0.023 1.00 0.00 C ATOM 1788 CD1 LEU A 109 -3.435 0.589 0.088 1.00 0.00 C ATOM 1789 CD2 LEU A 109 -2.554 2.951 -0.197 1.00 0.00 C ATOM 0 H LEU A 109 -0.071 1.930 -0.949 1.00 0.00 H new ATOM 0 HA LEU A 109 0.579 1.894 1.949 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.557 0.340 1.719 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.620 2.069 1.999 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.611 1.160 -0.841 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.032 0.730 -0.813 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -3.130 -0.455 0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.029 0.855 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.168 3.045 -1.093 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -3.109 3.322 0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.642 3.535 -0.320 1.00 0.00 H new ATOM 1801 N TRP A 110 1.794 -0.191 1.893 1.00 0.00 N ATOM 1802 CA TRP A 110 2.529 -1.444 1.925 1.00 0.00 C ATOM 1803 C TRP A 110 1.969 -2.292 3.069 1.00 0.00 C ATOM 1804 O TRP A 110 1.858 -1.819 4.199 1.00 0.00 O ATOM 1805 CB TRP A 110 4.034 -1.194 2.047 1.00 0.00 C ATOM 1806 CG TRP A 110 4.895 -2.424 1.754 1.00 0.00 C ATOM 1807 CD1 TRP A 110 5.718 -2.627 0.716 1.00 0.00 C ATOM 1808 CD2 TRP A 110 4.985 -3.621 2.556 1.00 0.00 C ATOM 1809 NE1 TRP A 110 6.330 -3.861 0.790 1.00 0.00 N ATOM 1810 CE2 TRP A 110 5.870 -4.485 1.944 1.00 0.00 C ATOM 1811 CE3 TRP A 110 4.341 -3.962 3.758 1.00 0.00 C ATOM 1812 CZ2 TRP A 110 6.191 -5.746 2.460 1.00 0.00 C ATOM 1813 CZ3 TRP A 110 4.672 -5.226 4.261 1.00 0.00 C ATOM 1814 CH2 TRP A 110 5.561 -6.107 3.657 1.00 0.00 C ATOM 0 H TRP A 110 2.048 0.472 2.626 1.00 0.00 H new ATOM 0 HA TRP A 110 2.400 -1.991 0.991 1.00 0.00 H new ATOM 0 HB2 TRP A 110 4.316 -0.394 1.362 1.00 0.00 H new ATOM 0 HB3 TRP A 110 4.253 -0.842 3.055 1.00 0.00 H new ATOM 0 HD1 TRP A 110 5.882 -1.914 -0.079 1.00 0.00 H new ATOM 0 HE1 TRP A 110 6.997 -4.245 0.121 1.00 0.00 H new ATOM 0 HE3 TRP A 110 3.646 -3.301 4.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 6.887 -6.405 1.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 4.204 -5.538 5.183 1.00 0.00 H new ATOM 0 HH2 TRP A 110 5.765 -7.066 4.109 1.00 0.00 H new ATOM 1825 N VAL A 111 1.632 -3.529 2.736 1.00 0.00 N ATOM 1826 CA VAL A 111 1.086 -4.447 3.722 1.00 0.00 C ATOM 1827 C VAL A 111 1.460 -5.880 3.339 1.00 0.00 C ATOM 1828 O VAL A 111 1.470 -6.229 2.160 1.00 0.00 O ATOM 1829 CB VAL A 111 -0.424 -4.237 3.852 1.00 0.00 C ATOM 1830 CG1 VAL A 111 -0.761 -2.751 3.990 1.00 0.00 C ATOM 1831 CG2 VAL A 111 -1.168 -4.861 2.670 1.00 0.00 C ATOM 0 H VAL A 111 1.726 -3.917 1.798 1.00 0.00 H new ATOM 0 HA VAL A 111 1.513 -4.251 4.705 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.756 -4.741 4.760 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.840 -2.630 4.081 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.275 -2.349 4.879 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.408 -2.215 3.109 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -2.239 -4.698 2.787 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.830 -4.399 1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.966 -5.932 2.637 1.00 0.00 H new ATOM 1841 N ASP A 112 1.758 -6.672 4.359 1.00 0.00 N ATOM 1842 CA ASP A 112 2.132 -8.060 4.144 1.00 0.00 C ATOM 1843 C ASP A 112 1.197 -8.965 4.949 1.00 0.00 C ATOM 1844 O ASP A 112 0.769 -8.604 6.044 1.00 0.00 O ATOM 1845 CB ASP A 112 3.564 -8.323 4.613 1.00 0.00 C ATOM 1846 CG ASP A 112 4.408 -9.177 3.664 1.00 0.00 C ATOM 1847 OD1 ASP A 112 5.019 -8.577 2.753 1.00 0.00 O ATOM 1848 OD2 ASP A 112 4.424 -10.409 3.872 1.00 0.00 O ATOM 0 H ASP A 112 1.748 -6.379 5.336 1.00 0.00 H new ATOM 0 HA ASP A 112 2.058 -8.268 3.077 1.00 0.00 H new ATOM 0 HB2 ASP A 112 4.064 -7.366 4.759 1.00 0.00 H new ATOM 0 HB3 ASP A 112 3.528 -8.815 5.585 1.00 0.00 H new ATOM 1853 N TRP A 113 0.908 -10.124 4.375 1.00 0.00 N ATOM 1854 CA TRP A 113 0.032 -11.083 5.025 1.00 0.00 C ATOM 1855 C TRP A 113 0.806 -12.393 5.190 1.00 0.00 C ATOM 1856 O TRP A 113 0.219 -13.430 5.495 1.00 0.00 O ATOM 1857 CB TRP A 113 -1.271 -11.254 4.242 1.00 0.00 C ATOM 1858 CG TRP A 113 -1.086 -11.281 2.723 1.00 0.00 C ATOM 1859 CD1 TRP A 113 -1.092 -10.246 1.873 1.00 0.00 C ATOM 1860 CD2 TRP A 113 -0.866 -12.449 1.905 1.00 0.00 C ATOM 1861 NE1 TRP A 113 -0.893 -10.659 0.571 1.00 0.00 N ATOM 1862 CE2 TRP A 113 -0.751 -12.042 0.592 1.00 0.00 C ATOM 1863 CE3 TRP A 113 -0.768 -13.806 2.263 1.00 0.00 C ATOM 1864 CZ2 TRP A 113 -0.532 -12.929 -0.470 1.00 0.00 C ATOM 1865 CZ3 TRP A 113 -0.549 -14.679 1.191 1.00 0.00 C ATOM 1866 CH2 TRP A 113 -0.431 -14.285 -0.137 1.00 0.00 C ATOM 0 H TRP A 113 1.265 -10.420 3.467 1.00 0.00 H new ATOM 0 HA TRP A 113 -0.266 -10.727 6.011 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -1.752 -12.180 4.556 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -1.948 -10.440 4.501 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -1.235 -9.217 2.169 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -0.857 -10.060 -0.254 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -0.855 -14.147 3.284 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -0.446 -12.585 -1.490 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -0.466 -15.733 1.411 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -0.262 -15.022 -0.908 1.00 0.00 H new ATOM 1877 N GLU A 114 2.111 -12.302 4.982 1.00 0.00 N ATOM 1878 CA GLU A 114 2.971 -13.467 5.105 1.00 0.00 C ATOM 1879 C GLU A 114 3.586 -13.529 6.505 1.00 0.00 C ATOM 1880 O GLU A 114 3.713 -14.606 7.084 1.00 0.00 O ATOM 1881 CB GLU A 114 4.058 -13.462 4.028 1.00 0.00 C ATOM 1882 CG GLU A 114 3.856 -14.611 3.039 1.00 0.00 C ATOM 1883 CD GLU A 114 2.402 -14.679 2.568 1.00 0.00 C ATOM 1884 OE1 GLU A 114 1.678 -13.691 2.817 1.00 0.00 O ATOM 1885 OE2 GLU A 114 2.047 -15.718 1.971 1.00 0.00 O ATOM 0 H GLU A 114 2.594 -11.440 4.729 1.00 0.00 H new ATOM 0 HA GLU A 114 2.363 -14.360 4.957 1.00 0.00 H new ATOM 0 HB2 GLU A 114 4.042 -12.512 3.495 1.00 0.00 H new ATOM 0 HB3 GLU A 114 5.039 -13.548 4.496 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.514 -14.477 2.181 1.00 0.00 H new ATOM 0 HG3 GLU A 114 4.134 -15.554 3.510 1.00 0.00 H new ATOM 1892 N ASN A 115 3.950 -12.359 7.008 1.00 0.00 N ATOM 1893 CA ASN A 115 4.548 -12.266 8.329 1.00 0.00 C ATOM 1894 C ASN A 115 3.584 -11.542 9.271 1.00 0.00 C ATOM 1895 O ASN A 115 3.889 -11.345 10.446 1.00 0.00 O ATOM 1896 CB ASN A 115 5.855 -11.471 8.287 1.00 0.00 C ATOM 1897 CG ASN A 115 7.058 -12.401 8.120 1.00 0.00 C ATOM 1898 OD1 ASN A 115 6.957 -13.502 7.603 1.00 0.00 O ATOM 1899 ND2 ASN A 115 8.199 -11.899 8.583 1.00 0.00 N ATOM 0 H ASN A 115 3.842 -11.467 6.525 1.00 0.00 H new ATOM 0 HA ASN A 115 4.752 -13.278 8.679 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.825 -10.758 7.463 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.963 -10.893 9.205 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.059 -12.443 8.517 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.214 -10.970 9.004 1.00 0.00 H new ATOM 1906 N LYS A 116 2.439 -11.166 8.720 1.00 0.00 N ATOM 1907 CA LYS A 116 1.429 -10.468 9.496 1.00 0.00 C ATOM 1908 C LYS A 116 1.898 -9.038 9.768 1.00 0.00 C ATOM 1909 O LYS A 116 1.720 -8.521 10.871 1.00 0.00 O ATOM 1910 CB LYS A 116 1.088 -11.255 10.763 1.00 0.00 C ATOM 1911 CG LYS A 116 1.901 -10.752 11.957 1.00 0.00 C ATOM 1912 CD LYS A 116 1.026 -9.939 12.913 1.00 0.00 C ATOM 1913 CE LYS A 116 1.884 -9.088 13.851 1.00 0.00 C ATOM 1914 NZ LYS A 116 1.035 -8.401 14.850 1.00 0.00 N ATOM 0 H LYS A 116 2.189 -11.332 7.745 1.00 0.00 H new ATOM 0 HA LYS A 116 0.499 -10.396 8.933 1.00 0.00 H new ATOM 0 HB2 LYS A 116 0.024 -11.161 10.978 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.289 -12.314 10.602 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.336 -11.599 12.488 1.00 0.00 H new ATOM 0 HG3 LYS A 116 2.729 -10.137 11.604 1.00 0.00 H new ATOM 0 HD2 LYS A 116 0.357 -9.295 12.341 1.00 0.00 H new ATOM 0 HD3 LYS A 116 0.398 -10.611 13.498 1.00 0.00 H new ATOM 0 HE2 LYS A 116 2.614 -9.719 14.358 1.00 0.00 H new ATOM 0 HE3 LYS A 116 2.444 -8.352 13.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 1.633 -7.828 15.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 0.355 -7.784 14.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 0.520 -9.108 15.412 1.00 0.00 H new ATOM 1928 N LEU A 117 2.490 -8.438 8.745 1.00 0.00 N ATOM 1929 CA LEU A 117 2.986 -7.077 8.861 1.00 0.00 C ATOM 1930 C LEU A 117 2.157 -6.158 7.962 1.00 0.00 C ATOM 1931 O LEU A 117 1.753 -6.552 6.869 1.00 0.00 O ATOM 1932 CB LEU A 117 4.488 -7.029 8.572 1.00 0.00 C ATOM 1933 CG LEU A 117 4.885 -6.600 7.158 1.00 0.00 C ATOM 1934 CD1 LEU A 117 5.357 -5.145 7.139 1.00 0.00 C ATOM 1935 CD2 LEU A 117 5.932 -7.549 6.571 1.00 0.00 C ATOM 0 H LEU A 117 2.637 -8.869 7.833 1.00 0.00 H new ATOM 0 HA LEU A 117 2.869 -6.714 9.882 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.953 -6.345 9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.906 -8.018 8.761 1.00 0.00 H new ATOM 0 HG LEU A 117 4.002 -6.661 6.522 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.633 -4.865 6.122 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.553 -4.497 7.488 1.00 0.00 H new ATOM 0 HD13 LEU A 117 6.222 -5.034 7.793 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.197 -7.222 5.566 1.00 0.00 H new ATOM 0 HD22 LEU A 117 6.822 -7.543 7.201 1.00 0.00 H new ATOM 0 HD23 LEU A 117 5.524 -8.559 6.528 1.00 0.00 H new ATOM 1947 N VAL A 118 1.928 -4.950 8.456 1.00 0.00 N ATOM 1948 CA VAL A 118 1.154 -3.972 7.710 1.00 0.00 C ATOM 1949 C VAL A 118 1.674 -2.568 8.028 1.00 0.00 C ATOM 1950 O VAL A 118 2.306 -2.355 9.061 1.00 0.00 O ATOM 1951 CB VAL A 118 -0.336 -4.141 8.015 1.00 0.00 C ATOM 1952 CG1 VAL A 118 -1.159 -3.033 7.355 1.00 0.00 C ATOM 1953 CG2 VAL A 118 -0.830 -5.523 7.583 1.00 0.00 C ATOM 0 H VAL A 118 2.264 -4.626 9.363 1.00 0.00 H new ATOM 0 HA VAL A 118 1.272 -4.128 6.638 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.469 -4.060 9.094 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -2.214 -3.176 7.587 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.833 -2.064 7.732 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.017 -3.069 6.275 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -1.892 -5.617 7.811 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.677 -5.645 6.511 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.274 -6.292 8.119 1.00 0.00 H new ATOM 1963 N GLY A 119 1.387 -1.646 7.121 1.00 0.00 N ATOM 1964 CA GLY A 119 1.817 -0.269 7.291 1.00 0.00 C ATOM 1965 C GLY A 119 1.836 0.470 5.951 1.00 0.00 C ATOM 1966 O GLY A 119 2.635 0.149 5.073 1.00 0.00 O ATOM 0 H GLY A 119 0.862 -1.826 6.266 1.00 0.00 H new ATOM 0 HA2 GLY A 119 1.147 0.242 7.982 1.00 0.00 H new ATOM 0 HA3 GLY A 119 2.812 -0.247 7.736 1.00 0.00 H new ATOM 1970 N ASN A 120 0.945 1.444 5.837 1.00 0.00 N ATOM 1971 CA ASN A 120 0.849 2.231 4.619 1.00 0.00 C ATOM 1972 C ASN A 120 1.733 3.473 4.748 1.00 0.00 C ATOM 1973 O ASN A 120 1.571 4.260 5.680 1.00 0.00 O ATOM 1974 CB ASN A 120 -0.588 2.696 4.375 1.00 0.00 C ATOM 1975 CG ASN A 120 -1.568 1.526 4.483 1.00 0.00 C ATOM 1976 OD1 ASN A 120 -2.679 1.657 4.971 1.00 0.00 O ATOM 1977 ND2 ASN A 120 -1.097 0.379 4.003 1.00 0.00 N ATOM 0 H ASN A 120 0.283 1.706 6.568 1.00 0.00 H new ATOM 0 HA ASN A 120 1.171 1.605 3.787 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -0.853 3.465 5.100 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -0.665 3.149 3.387 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -1.675 -0.461 4.030 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -0.157 0.339 3.608 1.00 0.00 H new ATOM 1984 N GLU A 121 2.648 3.611 3.800 1.00 0.00 N ATOM 1985 CA GLU A 121 3.557 4.744 3.796 1.00 0.00 C ATOM 1986 C GLU A 121 4.769 4.450 2.910 1.00 0.00 C ATOM 1987 O GLU A 121 5.092 3.289 2.660 1.00 0.00 O ATOM 1988 CB GLU A 121 3.992 5.103 5.219 1.00 0.00 C ATOM 1989 CG GLU A 121 3.352 6.417 5.673 1.00 0.00 C ATOM 1990 CD GLU A 121 4.325 7.234 6.525 1.00 0.00 C ATOM 1991 OE1 GLU A 121 5.412 7.554 5.997 1.00 0.00 O ATOM 1992 OE2 GLU A 121 3.959 7.521 7.686 1.00 0.00 O ATOM 0 H GLU A 121 2.779 2.956 3.029 1.00 0.00 H new ATOM 0 HA GLU A 121 3.031 5.605 3.384 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.710 4.302 5.902 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.078 5.190 5.260 1.00 0.00 H new ATOM 0 HG2 GLU A 121 3.049 6.998 4.802 1.00 0.00 H new ATOM 0 HG3 GLU A 121 2.449 6.207 6.246 1.00 0.00 H new ATOM 1999 N PRO A 122 5.424 5.548 2.448 1.00 0.00 N ATOM 2000 CA PRO A 122 6.593 5.419 1.596 1.00 0.00 C ATOM 2001 C PRO A 122 7.817 4.987 2.406 1.00 0.00 C ATOM 2002 O PRO A 122 8.595 4.144 1.961 1.00 0.00 O ATOM 2003 CB PRO A 122 6.761 6.784 0.948 1.00 0.00 C ATOM 2004 CG PRO A 122 5.967 7.754 1.808 1.00 0.00 C ATOM 2005 CD PRO A 122 5.070 6.938 2.724 1.00 0.00 C ATOM 0 HA PRO A 122 6.477 4.645 0.838 1.00 0.00 H new ATOM 0 HB2 PRO A 122 7.812 7.070 0.906 1.00 0.00 H new ATOM 0 HB3 PRO A 122 6.391 6.778 -0.077 1.00 0.00 H new ATOM 0 HG2 PRO A 122 6.638 8.383 2.393 1.00 0.00 H new ATOM 0 HG3 PRO A 122 5.371 8.419 1.183 1.00 0.00 H new ATOM 0 HD2 PRO A 122 5.240 7.189 3.771 1.00 0.00 H new ATOM 0 HD3 PRO A 122 4.017 7.127 2.518 1.00 0.00 H new ATOM 2013 N ALA A 123 7.951 5.585 3.580 1.00 0.00 N ATOM 2014 CA ALA A 123 9.067 5.273 4.456 1.00 0.00 C ATOM 2015 C ALA A 123 8.835 3.907 5.105 1.00 0.00 C ATOM 2016 O ALA A 123 9.784 3.244 5.521 1.00 0.00 O ATOM 2017 CB ALA A 123 9.232 6.389 5.491 1.00 0.00 C ATOM 0 H ALA A 123 7.305 6.284 3.945 1.00 0.00 H new ATOM 0 HA ALA A 123 9.995 5.215 3.888 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.069 6.155 6.148 1.00 0.00 H new ATOM 0 HB2 ALA A 123 9.424 7.333 4.981 1.00 0.00 H new ATOM 0 HB3 ALA A 123 8.320 6.475 6.082 1.00 0.00 H new ATOM 2023 N ASP A 124 7.567 3.527 5.170 1.00 0.00 N ATOM 2024 CA ASP A 124 7.198 2.251 5.761 1.00 0.00 C ATOM 2025 C ASP A 124 7.957 1.127 5.052 1.00 0.00 C ATOM 2026 O ASP A 124 8.565 0.278 5.702 1.00 0.00 O ATOM 2027 CB ASP A 124 5.700 1.984 5.602 1.00 0.00 C ATOM 2028 CG ASP A 124 4.850 2.317 6.830 1.00 0.00 C ATOM 2029 OD1 ASP A 124 5.435 2.849 7.798 1.00 0.00 O ATOM 2030 OD2 ASP A 124 3.634 2.033 6.772 1.00 0.00 O ATOM 0 H ASP A 124 6.783 4.080 4.824 1.00 0.00 H new ATOM 0 HA ASP A 124 7.448 2.285 6.821 1.00 0.00 H new ATOM 0 HB2 ASP A 124 5.331 2.563 4.755 1.00 0.00 H new ATOM 0 HB3 ASP A 124 5.558 0.932 5.355 1.00 0.00 H new ATOM 2035 N ILE A 125 7.896 1.159 3.729 1.00 0.00 N ATOM 2036 CA ILE A 125 8.570 0.153 2.925 1.00 0.00 C ATOM 2037 C ILE A 125 10.018 0.014 3.398 1.00 0.00 C ATOM 2038 O ILE A 125 10.437 -1.063 3.818 1.00 0.00 O ATOM 2039 CB ILE A 125 8.438 0.481 1.436 1.00 0.00 C ATOM 2040 CG1 ILE A 125 7.070 0.057 0.900 1.00 0.00 C ATOM 2041 CG2 ILE A 125 9.585 -0.139 0.635 1.00 0.00 C ATOM 2042 CD1 ILE A 125 7.133 -0.227 -0.602 1.00 0.00 C ATOM 0 H ILE A 125 7.391 1.865 3.194 1.00 0.00 H new ATOM 0 HA ILE A 125 8.097 -0.820 3.057 1.00 0.00 H new ATOM 0 HB ILE A 125 8.509 1.562 1.317 1.00 0.00 H new ATOM 0 HG12 ILE A 125 6.729 -0.833 1.428 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.340 0.843 1.095 1.00 0.00 H new ATOM 0 HG21 ILE A 125 9.468 0.109 -0.420 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.535 0.254 0.997 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.570 -1.222 0.757 1.00 0.00 H new ATOM 0 HD11 ILE A 125 6.147 -0.526 -0.957 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.451 0.672 -1.129 1.00 0.00 H new ATOM 0 HD13 ILE A 125 7.846 -1.030 -0.791 1.00 0.00 H new ATOM 2054 N ASP A 126 10.743 1.120 3.315 1.00 0.00 N ATOM 2055 CA ASP A 126 12.136 1.135 3.729 1.00 0.00 C ATOM 2056 C ASP A 126 12.243 0.601 5.159 1.00 0.00 C ATOM 2057 O ASP A 126 13.119 -0.209 5.458 1.00 0.00 O ATOM 2058 CB ASP A 126 12.700 2.557 3.712 1.00 0.00 C ATOM 2059 CG ASP A 126 14.052 2.725 4.408 1.00 0.00 C ATOM 2060 OD1 ASP A 126 14.087 2.509 5.639 1.00 0.00 O ATOM 2061 OD2 ASP A 126 15.020 3.064 3.694 1.00 0.00 O ATOM 0 H ASP A 126 10.392 2.012 2.967 1.00 0.00 H new ATOM 0 HA ASP A 126 12.702 0.514 3.034 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.799 2.880 2.676 1.00 0.00 H new ATOM 0 HB3 ASP A 126 11.979 3.223 4.186 1.00 0.00 H new ATOM 2066 N LYS A 127 11.340 1.076 6.004 1.00 0.00 N ATOM 2067 CA LYS A 127 11.323 0.656 7.395 1.00 0.00 C ATOM 2068 C LYS A 127 11.097 -0.856 7.464 1.00 0.00 C ATOM 2069 O LYS A 127 11.932 -1.588 7.992 1.00 0.00 O ATOM 2070 CB LYS A 127 10.296 1.468 8.187 1.00 0.00 C ATOM 2071 CG LYS A 127 10.944 2.700 8.823 1.00 0.00 C ATOM 2072 CD LYS A 127 11.817 3.444 7.811 1.00 0.00 C ATOM 2073 CE LYS A 127 11.519 4.944 7.828 1.00 0.00 C ATOM 2074 NZ LYS A 127 12.736 5.719 7.498 1.00 0.00 N ATOM 0 H LYS A 127 10.615 1.748 5.752 1.00 0.00 H new ATOM 0 HA LYS A 127 12.286 0.857 7.866 1.00 0.00 H new ATOM 0 HB2 LYS A 127 9.486 1.778 7.527 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.854 0.844 8.963 1.00 0.00 H new ATOM 0 HG2 LYS A 127 10.170 3.368 9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.549 2.397 9.677 1.00 0.00 H new ATOM 0 HD2 LYS A 127 12.869 3.276 8.040 1.00 0.00 H new ATOM 0 HD3 LYS A 127 11.641 3.046 6.812 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.730 5.172 7.111 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.150 5.236 8.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.515 6.735 7.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 13.478 5.515 8.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 13.071 5.452 6.550 1.00 0.00 H new ATOM 2088 N TYR A 128 9.963 -1.278 6.923 1.00 0.00 N ATOM 2089 CA TYR A 128 9.617 -2.689 6.916 1.00 0.00 C ATOM 2090 C TYR A 128 10.521 -3.471 5.962 1.00 0.00 C ATOM 2091 O TYR A 128 11.369 -4.247 6.400 1.00 0.00 O ATOM 2092 CB TYR A 128 8.175 -2.767 6.412 1.00 0.00 C ATOM 2093 CG TYR A 128 7.222 -1.786 7.098 1.00 0.00 C ATOM 2094 CD1 TYR A 128 7.485 -1.351 8.382 1.00 0.00 C ATOM 2095 CD2 TYR A 128 6.099 -1.336 6.434 1.00 0.00 C ATOM 2096 CE1 TYR A 128 6.589 -0.427 9.027 1.00 0.00 C ATOM 2097 CE2 TYR A 128 5.202 -0.412 7.080 1.00 0.00 C ATOM 2098 CZ TYR A 128 5.491 -0.004 8.345 1.00 0.00 C ATOM 2099 OH TYR A 128 4.644 0.868 8.954 1.00 0.00 O ATOM 0 H TYR A 128 9.272 -0.667 6.487 1.00 0.00 H new ATOM 0 HA TYR A 128 9.736 -3.118 7.911 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.165 -2.577 5.339 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.804 -3.781 6.559 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.363 -1.704 8.902 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.893 -1.676 5.430 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.784 -0.078 10.030 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.320 -0.051 6.571 1.00 0.00 H new ATOM 0 HH TYR A 128 5.092 1.732 9.070 1.00 0.00 H new ATOM 2109 N ILE A 129 10.309 -3.240 4.674 1.00 0.00 N ATOM 2110 CA ILE A 129 11.095 -3.913 3.654 1.00 0.00 C ATOM 2111 C ILE A 129 11.337 -2.954 2.487 1.00 0.00 C ATOM 2112 O ILE A 129 10.511 -2.852 1.581 1.00 0.00 O ATOM 2113 CB ILE A 129 10.425 -5.226 3.242 1.00 0.00 C ATOM 2114 CG1 ILE A 129 8.967 -4.995 2.840 1.00 0.00 C ATOM 2115 CG2 ILE A 129 10.556 -6.278 4.345 1.00 0.00 C ATOM 2116 CD1 ILE A 129 8.078 -4.828 4.074 1.00 0.00 C ATOM 0 H ILE A 129 9.604 -2.596 4.314 1.00 0.00 H new ATOM 0 HA ILE A 129 12.073 -4.190 4.047 1.00 0.00 H new ATOM 0 HB ILE A 129 10.943 -5.613 2.365 1.00 0.00 H new ATOM 0 HG12 ILE A 129 8.895 -4.106 2.213 1.00 0.00 H new ATOM 0 HG13 ILE A 129 8.613 -5.836 2.243 1.00 0.00 H new ATOM 0 HG21 ILE A 129 10.072 -7.201 4.027 1.00 0.00 H new ATOM 0 HG22 ILE A 129 11.611 -6.471 4.541 1.00 0.00 H new ATOM 0 HG23 ILE A 129 10.079 -5.913 5.255 1.00 0.00 H new ATOM 0 HD11 ILE A 129 7.047 -4.665 3.760 1.00 0.00 H new ATOM 0 HD12 ILE A 129 8.133 -5.728 4.687 1.00 0.00 H new ATOM 0 HD13 ILE A 129 8.420 -3.972 4.656 1.00 0.00 H new ATOM 2128 N ILE A 130 12.473 -2.275 2.547 1.00 0.00 N ATOM 2129 CA ILE A 130 12.834 -1.327 1.507 1.00 0.00 C ATOM 2130 C ILE A 130 12.695 -2.000 0.140 1.00 0.00 C ATOM 2131 O ILE A 130 12.160 -3.102 0.038 1.00 0.00 O ATOM 2132 CB ILE A 130 14.226 -0.749 1.769 1.00 0.00 C ATOM 2133 CG1 ILE A 130 15.277 -1.428 0.887 1.00 0.00 C ATOM 2134 CG2 ILE A 130 14.584 -0.832 3.254 1.00 0.00 C ATOM 2135 CD1 ILE A 130 15.534 -2.864 1.349 1.00 0.00 C ATOM 0 H ILE A 130 13.156 -2.363 3.300 1.00 0.00 H new ATOM 0 HA ILE A 130 12.154 -0.475 1.515 1.00 0.00 H new ATOM 0 HB ILE A 130 14.213 0.307 1.500 1.00 0.00 H new ATOM 0 HG12 ILE A 130 14.941 -1.430 -0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 130 16.207 -0.860 0.919 1.00 0.00 H new ATOM 0 HG21 ILE A 130 15.578 -0.414 3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 130 13.856 -0.267 3.836 1.00 0.00 H new ATOM 0 HG23 ILE A 130 14.573 -1.874 3.573 1.00 0.00 H new ATOM 0 HD11 ILE A 130 16.284 -3.324 0.706 1.00 0.00 H new ATOM 0 HD12 ILE A 130 15.893 -2.856 2.378 1.00 0.00 H new ATOM 0 HD13 ILE A 130 14.608 -3.436 1.292 1.00 0.00 H new ATOM 2147 N GLN A 131 13.185 -1.307 -0.878 1.00 0.00 N ATOM 2148 CA GLN A 131 13.122 -1.823 -2.234 1.00 0.00 C ATOM 2149 C GLN A 131 13.470 -3.313 -2.252 1.00 0.00 C ATOM 2150 O GLN A 131 13.082 -4.034 -3.170 1.00 0.00 O ATOM 2151 CB GLN A 131 14.045 -1.034 -3.165 1.00 0.00 C ATOM 2152 CG GLN A 131 15.218 -0.430 -2.391 1.00 0.00 C ATOM 2153 CD GLN A 131 14.905 1.000 -1.948 1.00 0.00 C ATOM 2154 OE1 GLN A 131 13.782 1.471 -2.028 1.00 0.00 O ATOM 2155 NE2 GLN A 131 15.957 1.664 -1.477 1.00 0.00 N ATOM 0 H GLN A 131 13.627 -0.392 -0.790 1.00 0.00 H new ATOM 0 HA GLN A 131 12.102 -1.703 -2.600 1.00 0.00 H new ATOM 0 HB2 GLN A 131 14.422 -1.689 -3.950 1.00 0.00 H new ATOM 0 HB3 GLN A 131 13.481 -0.240 -3.655 1.00 0.00 H new ATOM 0 HG2 GLN A 131 15.437 -1.045 -1.518 1.00 0.00 H new ATOM 0 HG3 GLN A 131 16.111 -0.434 -3.016 1.00 0.00 H new ATOM 0 HE21 GLN A 131 16.870 1.211 -1.437 1.00 0.00 H new ATOM 0 HE22 GLN A 131 15.851 2.626 -1.156 1.00 0.00 H new ATOM 2164 N ARG A 132 14.199 -3.730 -1.227 1.00 0.00 N ATOM 2165 CA ARG A 132 14.603 -5.121 -1.113 1.00 0.00 C ATOM 2166 C ARG A 132 14.937 -5.459 0.342 1.00 0.00 C ATOM 2167 O ARG A 132 16.103 -5.449 0.733 1.00 0.00 O ATOM 2168 CB ARG A 132 15.823 -5.413 -1.990 1.00 0.00 C ATOM 2169 CG ARG A 132 16.886 -4.325 -1.831 1.00 0.00 C ATOM 2170 CD ARG A 132 17.971 -4.758 -0.844 1.00 0.00 C ATOM 2171 NE ARG A 132 19.310 -4.479 -1.410 1.00 0.00 N ATOM 2172 CZ ARG A 132 20.450 -4.995 -0.931 1.00 0.00 C ATOM 2173 NH1 ARG A 132 20.421 -5.820 0.125 1.00 0.00 N ATOM 2174 NH2 ARG A 132 21.620 -4.687 -1.508 1.00 0.00 N ATOM 0 H ARG A 132 14.520 -3.129 -0.468 1.00 0.00 H new ATOM 0 HA ARG A 132 13.770 -5.738 -1.451 1.00 0.00 H new ATOM 0 HB2 ARG A 132 16.245 -6.381 -1.721 1.00 0.00 H new ATOM 0 HB3 ARG A 132 15.517 -5.478 -3.034 1.00 0.00 H new ATOM 0 HG2 ARG A 132 17.336 -4.108 -2.799 1.00 0.00 H new ATOM 0 HG3 ARG A 132 16.419 -3.404 -1.482 1.00 0.00 H new ATOM 0 HD2 ARG A 132 17.848 -4.227 0.100 1.00 0.00 H new ATOM 0 HD3 ARG A 132 17.873 -5.822 -0.627 1.00 0.00 H new ATOM 0 HE ARG A 132 19.368 -3.855 -2.215 1.00 0.00 H new ATOM 0 HH11 ARG A 132 19.531 -6.055 0.564 1.00 0.00 H new ATOM 0 HH12 ARG A 132 21.289 -6.213 0.489 1.00 0.00 H new ATOM 0 HH21 ARG A 132 21.643 -4.060 -2.312 1.00 0.00 H new ATOM 0 HH22 ARG A 132 22.488 -5.080 -1.143 1.00 0.00 H new ATOM 2188 N LYS A 133 13.893 -5.751 1.103 1.00 0.00 N ATOM 2189 CA LYS A 133 14.060 -6.092 2.505 1.00 0.00 C ATOM 2190 C LYS A 133 12.868 -6.932 2.967 1.00 0.00 C ATOM 2191 O LYS A 133 13.000 -7.762 3.865 1.00 0.00 O ATOM 2192 CB LYS A 133 14.283 -4.829 3.340 1.00 0.00 C ATOM 2193 CG LYS A 133 14.173 -5.135 4.836 1.00 0.00 C ATOM 2194 CD LYS A 133 14.821 -4.028 5.670 1.00 0.00 C ATOM 2195 CE LYS A 133 13.835 -3.466 6.696 1.00 0.00 C ATOM 2196 NZ LYS A 133 14.530 -2.569 7.646 1.00 0.00 N ATOM 0 H LYS A 133 12.927 -5.758 0.775 1.00 0.00 H new ATOM 0 HA LYS A 133 14.953 -6.701 2.645 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.267 -4.413 3.121 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.548 -4.072 3.065 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.124 -5.238 5.114 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.655 -6.088 5.053 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.700 -4.420 6.182 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.165 -3.228 5.015 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.042 -2.920 6.185 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.361 -4.284 7.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 13.828 -2.066 8.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.151 -3.131 8.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 15.101 -1.879 7.117 1.00 0.00 H new TER 2210 LYS A 133