USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1194 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 146 TYR OH : rot -98:sc= 0.298 USER MOD Set 1.2: A 151 CYS SG : rot 180:sc= 0 USER MOD Set 2.1: A 131 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 135 CYS SG : rot 96:sc= 0.00754 USER MOD Set 3.1: A 114 SER OG : rot -33:sc= 1.74 USER MOD Set 3.2: A 120 LYS NZ :NH3+ 174:sc= 0.633 (180deg=0) USER MOD Set 4.1: A 104 SER OG : rot 51:sc= 1.36 USER MOD Set 4.2: A 106 GLN : amide:sc= 0.256 K(o=1.6,f=1.1) USER MOD Set 5.1: A 49 TYR OH : rot 2:sc= 1.26 USER MOD Set 5.2: A 81 HIS : no HD1:sc= 1.39 K(o=2.1,f=-9.2!) USER MOD Set 5.3: A 83 HIS : no HD1:sc= -0.031 K(o=2.1,f=1.4) USER MOD Set 5.4: A 119 CYS SG : rot 160:sc= -0.483 USER MOD Set 6.1: A 28 LYS NZ :NH3+ 179:sc= 0.8 (180deg=0) USER MOD Set 6.2: A 36 GLN : amide:sc= 0.662 K(o=1.5,f=-4.5!) USER MOD Set 7.1: A 23 MET CE :methyl 180:sc= -0.0667 (180deg=-0.0667) USER MOD Set 7.2: A 109 CYS SG : rot 51:sc= -1.2 USER MOD Set 8.1: A 1 MET N :NH3+ 180:sc= 1.08 (180deg=-0.0895) USER MOD Set 8.2: A 5 GLN : amide:sc= 1.73 K(o=2.8,f=-9.2!) USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0116 (180deg=-0.216) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 163:sc= 0 (180deg=-0.119) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0.399 K(o=0.4,f=-0.41) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 17 ASN : amide:sc= -0.0771 K(o=-0.077,f=-1.6!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0.912 K(o=0.91,f=-8.2!) USER MOD Single : A 32 ASN : amide:sc=-0.00502 K(o=-0.005,f=-0.86) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 MET CE :methyl -149:sc= -0.296 (180deg=-2.57!) USER MOD Single : A 47 THR OG1 : rot -56:sc= 1.51 USER MOD Single : A 53 LYS NZ :NH3+ -174:sc= 0.56 (180deg=0.54) USER MOD Single : A 55 GLN : amide:sc= 0.723 K(o=0.72,f=-0.57) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -150:sc= 0.296 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -155:sc= 1.22 USER MOD Single : A 70 GLN : amide:sc= -0.054 X(o=-0.054,f=-0.057) USER MOD Single : A 72 MET CE :methyl -119:sc= -0.0247 (180deg=-0.386) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.584 K(o=-0.58,f=-3.7!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.00124 K(o=0.0012,f=-8.6!) USER MOD Single : A 89 HIS : no HE2:sc= -0.158 K(o=-0.16,f=-0.94) USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 163:sc= 1.27 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.13! USER MOD Single : A 100 SER OG : rot 180:sc= 0.014 USER MOD Single : A 107 SER OG : rot -29:sc= 1.31 USER MOD Single : A 111 SER OG : rot 79:sc= 1.23 USER MOD Single : A 115 MET CE :methyl 168:sc= -0.826 (180deg=-1.27) USER MOD Single : A 117 SER OG : rot -23:sc= 0.869 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -0.254 K(o=-0.25,f=-2.3!) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -70:sc= 1.17 USER MOD Single : A 136 ASN : amide:sc= -0.0397 K(o=-0.04,f=-1.4!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc=-0.00789 K(o=-0.0079,f=-0.58) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 93:sc= -0.385 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc= 0.622 K(o=0.62,f=-7!) USER MOD Single : A 150 THR OG1 : rot -69:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.908 -1.480 -24.269 1.00 0.00 N ATOM 2 CA MET A 1 4.962 -2.552 -25.259 1.00 0.00 C ATOM 3 C MET A 1 4.652 -3.945 -24.704 1.00 0.00 C ATOM 4 O MET A 1 4.029 -4.754 -25.393 1.00 0.00 O ATOM 5 CB MET A 1 6.344 -2.570 -25.907 1.00 0.00 C ATOM 6 CG MET A 1 6.653 -1.345 -26.757 1.00 0.00 C ATOM 7 SD MET A 1 5.476 -1.115 -28.104 1.00 0.00 S ATOM 8 CE MET A 1 5.871 -2.516 -29.147 1.00 0.00 C ATOM 0 H1 MET A 1 5.130 -0.573 -24.727 1.00 0.00 H new ATOM 0 H2 MET A 1 3.954 -1.436 -23.857 1.00 0.00 H new ATOM 0 H3 MET A 1 5.602 -1.667 -23.517 1.00 0.00 H new ATOM 0 HA MET A 1 4.178 -2.331 -25.984 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.098 -2.655 -25.125 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.429 -3.461 -26.530 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.651 -0.458 -26.123 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.657 -1.439 -27.170 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.398 -2.390 -30.121 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.952 -2.582 -29.274 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.504 -3.431 -28.682 1.00 0.00 H new ATOM 20 N ALA A 2 5.086 -4.232 -23.478 1.00 0.00 N ATOM 21 CA ALA A 2 4.845 -5.533 -22.863 1.00 0.00 C ATOM 22 C ALA A 2 3.408 -5.636 -22.397 1.00 0.00 C ATOM 23 O ALA A 2 2.790 -4.617 -22.092 1.00 0.00 O ATOM 24 CB ALA A 2 5.785 -5.765 -21.689 1.00 0.00 C ATOM 0 H ALA A 2 5.607 -3.580 -22.892 1.00 0.00 H new ATOM 0 HA ALA A 2 5.035 -6.300 -23.614 1.00 0.00 H new ATOM 0 HB1 ALA A 2 5.584 -6.742 -21.249 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.817 -5.729 -22.037 1.00 0.00 H new ATOM 0 HB3 ALA A 2 5.628 -4.990 -20.939 1.00 0.00 H new ATOM 30 N SER A 3 2.887 -6.859 -22.328 1.00 0.00 N ATOM 31 CA SER A 3 1.519 -7.067 -21.871 1.00 0.00 C ATOM 32 C SER A 3 1.340 -6.671 -20.410 1.00 0.00 C ATOM 33 O SER A 3 0.242 -6.290 -20.011 1.00 0.00 O ATOM 34 CB SER A 3 1.134 -8.519 -22.050 1.00 0.00 C ATOM 35 OG SER A 3 1.892 -9.339 -21.204 1.00 0.00 O ATOM 0 H SER A 3 3.387 -7.712 -22.580 1.00 0.00 H new ATOM 0 HA SER A 3 0.871 -6.430 -22.473 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.073 -8.648 -21.836 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.288 -8.816 -23.087 1.00 0.00 H new ATOM 0 HG SER A 3 1.628 -10.274 -21.332 1.00 0.00 H new ATOM 41 N MET A 4 2.416 -6.738 -19.626 1.00 0.00 N ATOM 42 CA MET A 4 2.380 -6.305 -18.239 1.00 0.00 C ATOM 43 C MET A 4 2.296 -4.791 -18.173 1.00 0.00 C ATOM 44 O MET A 4 1.694 -4.264 -17.242 1.00 0.00 O ATOM 45 CB MET A 4 3.598 -6.820 -17.482 1.00 0.00 C ATOM 46 CG MET A 4 3.593 -8.327 -17.293 1.00 0.00 C ATOM 47 SD MET A 4 2.189 -8.852 -16.290 1.00 0.00 S ATOM 48 CE MET A 4 2.200 -10.630 -16.502 1.00 0.00 C ATOM 0 H MET A 4 3.323 -7.090 -19.934 1.00 0.00 H new ATOM 0 HA MET A 4 1.493 -6.722 -17.762 1.00 0.00 H new ATOM 0 HB2 MET A 4 4.501 -6.531 -18.020 1.00 0.00 H new ATOM 0 HB3 MET A 4 3.641 -6.338 -16.505 1.00 0.00 H new ATOM 0 HG2 MET A 4 3.553 -8.818 -18.265 1.00 0.00 H new ATOM 0 HG3 MET A 4 4.522 -8.640 -16.816 1.00 0.00 H new ATOM 0 HE1 MET A 4 1.598 -11.093 -15.721 1.00 0.00 H new ATOM 0 HE2 MET A 4 1.785 -10.883 -17.478 1.00 0.00 H new ATOM 0 HE3 MET A 4 3.224 -10.998 -16.437 1.00 0.00 H new ATOM 58 N GLN A 5 2.893 -4.113 -19.154 1.00 0.00 N ATOM 59 CA GLN A 5 2.856 -2.661 -19.264 1.00 0.00 C ATOM 60 C GLN A 5 1.468 -2.231 -19.722 1.00 0.00 C ATOM 61 O GLN A 5 0.990 -1.153 -19.366 1.00 0.00 O ATOM 62 CB GLN A 5 3.931 -2.155 -20.230 1.00 0.00 C ATOM 63 CG GLN A 5 5.347 -2.337 -19.716 1.00 0.00 C ATOM 64 CD GLN A 5 6.410 -1.902 -20.712 1.00 0.00 C ATOM 65 OE1 GLN A 5 6.313 -2.110 -21.928 1.00 0.00 O ATOM 66 NE2 GLN A 5 7.457 -1.278 -20.186 1.00 0.00 N ATOM 0 H GLN A 5 3.421 -4.565 -19.901 1.00 0.00 H new ATOM 0 HA GLN A 5 3.065 -2.223 -18.288 1.00 0.00 H new ATOM 0 HB2 GLN A 5 3.829 -2.679 -21.180 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.759 -1.097 -20.429 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.468 -1.767 -18.795 1.00 0.00 H new ATOM 0 HG3 GLN A 5 5.503 -3.386 -19.464 1.00 0.00 H new ATOM 0 HE21 GLN A 5 7.505 -1.123 -19.179 1.00 0.00 H new ATOM 0 HE22 GLN A 5 8.213 -0.954 -20.789 1.00 0.00 H new ATOM 75 N LYS A 6 0.837 -3.058 -20.552 1.00 0.00 N ATOM 76 CA LYS A 6 -0.528 -2.788 -20.966 1.00 0.00 C ATOM 77 C LYS A 6 -1.445 -2.888 -19.752 1.00 0.00 C ATOM 78 O LYS A 6 -2.294 -2.018 -19.551 1.00 0.00 O ATOM 79 CB LYS A 6 -0.948 -3.770 -22.058 1.00 0.00 C ATOM 80 CG LYS A 6 -0.240 -3.550 -23.388 1.00 0.00 C ATOM 81 CD LYS A 6 -0.662 -4.574 -24.432 1.00 0.00 C ATOM 82 CE LYS A 6 0.079 -4.355 -25.744 1.00 0.00 C ATOM 83 NZ LYS A 6 -0.304 -5.357 -26.777 1.00 0.00 N ATOM 0 H LYS A 6 1.245 -3.907 -20.943 1.00 0.00 H new ATOM 0 HA LYS A 6 -0.600 -1.782 -21.378 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.751 -4.786 -21.716 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.024 -3.689 -22.212 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.459 -2.547 -23.754 1.00 0.00 H new ATOM 0 HG3 LYS A 6 0.838 -3.607 -23.239 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.463 -5.579 -24.061 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.736 -4.504 -24.601 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.132 -3.352 -26.116 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.153 -4.410 -25.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.224 -5.171 -27.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.079 -6.313 -26.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -1.324 -5.288 -26.966 1.00 0.00 H new ATOM 97 N ARG A 7 -1.245 -3.930 -18.938 1.00 0.00 N ATOM 98 CA ARG A 7 -2.022 -4.132 -17.722 1.00 0.00 C ATOM 99 C ARG A 7 -1.762 -3.028 -16.708 1.00 0.00 C ATOM 100 O ARG A 7 -2.700 -2.580 -16.048 1.00 0.00 O ATOM 101 CB ARG A 7 -1.693 -5.481 -17.109 1.00 0.00 C ATOM 102 CG ARG A 7 -2.212 -6.679 -17.883 1.00 0.00 C ATOM 103 CD ARG A 7 -1.795 -7.972 -17.281 1.00 0.00 C ATOM 104 NE ARG A 7 -2.301 -9.089 -18.063 1.00 0.00 N ATOM 105 CZ ARG A 7 -2.072 -10.397 -17.825 1.00 0.00 C ATOM 106 NH1 ARG A 7 -1.350 -10.797 -16.802 1.00 0.00 N ATOM 107 NH2 ARG A 7 -2.586 -11.298 -18.645 1.00 0.00 N ATOM 0 H ARG A 7 -0.543 -4.650 -19.107 1.00 0.00 H new ATOM 0 HA ARG A 7 -3.078 -4.104 -17.992 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -0.610 -5.568 -17.017 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -2.102 -5.514 -16.099 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -3.300 -6.636 -17.925 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.851 -6.627 -18.910 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.707 -8.021 -17.229 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -2.166 -8.039 -16.258 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.885 -8.862 -18.868 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -0.946 -10.112 -16.164 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -1.193 -11.793 -16.647 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -3.146 -11.000 -19.444 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -2.422 -12.291 -18.479 1.00 0.00 H new ATOM 121 N LEU A 8 -0.500 -2.613 -16.603 1.00 0.00 N ATOM 122 CA LEU A 8 -0.042 -1.510 -15.774 1.00 0.00 C ATOM 123 C LEU A 8 -0.810 -0.243 -16.029 1.00 0.00 C ATOM 124 O LEU A 8 -1.365 0.344 -15.100 1.00 0.00 O ATOM 125 CB LEU A 8 1.433 -1.245 -16.072 1.00 0.00 C ATOM 126 CG LEU A 8 2.100 -0.033 -15.441 1.00 0.00 C ATOM 127 CD1 LEU A 8 2.088 -0.154 -13.941 1.00 0.00 C ATOM 128 CD2 LEU A 8 3.509 0.051 -15.998 1.00 0.00 C ATOM 0 H LEU A 8 0.260 -3.059 -17.117 1.00 0.00 H new ATOM 0 HA LEU A 8 -0.197 -1.797 -14.734 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.995 -2.128 -15.767 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.541 -1.156 -17.153 1.00 0.00 H new ATOM 0 HG LEU A 8 1.562 0.884 -15.681 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.569 0.720 -13.502 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.058 -0.217 -13.589 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.629 -1.053 -13.644 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.020 0.912 -15.566 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.054 -0.859 -15.747 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.466 0.160 -17.082 1.00 0.00 H new ATOM 140 N GLN A 9 -0.839 0.163 -17.292 1.00 0.00 N ATOM 141 CA GLN A 9 -1.530 1.384 -17.632 1.00 0.00 C ATOM 142 C GLN A 9 -3.031 1.249 -17.478 1.00 0.00 C ATOM 143 O GLN A 9 -3.660 2.221 -17.071 1.00 0.00 O ATOM 144 CB GLN A 9 -1.161 1.805 -19.049 1.00 0.00 C ATOM 145 CG GLN A 9 0.294 2.230 -19.172 1.00 0.00 C ATOM 146 CD GLN A 9 0.611 3.429 -18.294 1.00 0.00 C ATOM 147 OE1 GLN A 9 -0.167 4.387 -18.252 1.00 0.00 O ATOM 148 NE2 GLN A 9 1.742 3.387 -17.598 1.00 0.00 N ATOM 0 H GLN A 9 -0.402 -0.325 -18.074 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.212 2.159 -16.934 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.353 0.977 -19.732 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -1.804 2.629 -19.358 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.940 1.397 -18.895 1.00 0.00 H new ATOM 0 HG3 GLN A 9 0.514 2.473 -20.211 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.353 2.573 -17.666 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.000 4.169 -16.996 1.00 0.00 H new ATOM 157 N LYS A 10 -3.614 0.083 -17.763 1.00 0.00 N ATOM 158 CA LYS A 10 -5.051 -0.063 -17.559 1.00 0.00 C ATOM 159 C LYS A 10 -5.422 0.097 -16.089 1.00 0.00 C ATOM 160 O LYS A 10 -6.429 0.738 -15.775 1.00 0.00 O ATOM 161 CB LYS A 10 -5.528 -1.422 -18.067 1.00 0.00 C ATOM 162 CG LYS A 10 -5.533 -1.574 -19.581 1.00 0.00 C ATOM 163 CD LYS A 10 -5.981 -2.970 -19.984 1.00 0.00 C ATOM 164 CE LYS A 10 -5.979 -3.143 -21.496 1.00 0.00 C ATOM 165 NZ LYS A 10 -6.408 -4.512 -21.895 1.00 0.00 N ATOM 0 H LYS A 10 -3.134 -0.742 -18.122 1.00 0.00 H new ATOM 0 HA LYS A 10 -5.546 0.726 -18.126 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -4.891 -2.197 -17.641 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -6.537 -1.599 -17.695 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -6.198 -0.832 -20.023 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -4.535 -1.381 -19.973 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.321 -3.710 -19.531 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -6.983 -3.158 -19.597 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -6.645 -2.407 -21.947 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.979 -2.948 -21.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -6.394 -4.592 -22.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.758 -5.213 -21.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -7.372 -4.689 -21.547 1.00 0.00 H new ATOM 179 N GLU A 11 -4.611 -0.494 -15.207 1.00 0.00 N ATOM 180 CA GLU A 11 -4.812 -0.382 -13.771 1.00 0.00 C ATOM 181 C GLU A 11 -4.737 1.060 -13.319 1.00 0.00 C ATOM 182 O GLU A 11 -5.597 1.517 -12.564 1.00 0.00 O ATOM 183 CB GLU A 11 -3.781 -1.183 -12.978 1.00 0.00 C ATOM 184 CG GLU A 11 -4.053 -1.079 -11.483 1.00 0.00 C ATOM 185 CD GLU A 11 -3.126 -1.850 -10.594 1.00 0.00 C ATOM 186 OE1 GLU A 11 -2.042 -2.198 -10.993 1.00 0.00 O ATOM 187 OE2 GLU A 11 -3.550 -2.113 -9.491 1.00 0.00 O ATOM 0 H GLU A 11 -3.804 -1.058 -15.472 1.00 0.00 H new ATOM 0 HA GLU A 11 -5.805 -0.787 -13.576 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -3.810 -2.228 -13.286 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -2.779 -0.814 -13.197 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -4.009 -0.028 -11.198 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.072 -1.418 -11.294 1.00 0.00 H new ATOM 194 N LEU A 12 -3.693 1.751 -13.766 1.00 0.00 N ATOM 195 CA LEU A 12 -3.487 3.134 -13.396 1.00 0.00 C ATOM 196 C LEU A 12 -4.582 4.037 -13.945 1.00 0.00 C ATOM 197 O LEU A 12 -4.923 5.017 -13.289 1.00 0.00 O ATOM 198 CB LEU A 12 -2.106 3.573 -13.878 1.00 0.00 C ATOM 199 CG LEU A 12 -0.952 2.877 -13.137 1.00 0.00 C ATOM 200 CD1 LEU A 12 0.368 3.270 -13.787 1.00 0.00 C ATOM 201 CD2 LEU A 12 -1.005 3.254 -11.667 1.00 0.00 C ATOM 0 H LEU A 12 -2.979 1.369 -14.386 1.00 0.00 H new ATOM 0 HA LEU A 12 -3.536 3.222 -12.311 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.019 3.368 -14.945 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -2.011 4.652 -13.752 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.044 1.793 -13.204 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.190 2.780 -13.266 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.365 2.961 -14.832 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.495 4.351 -13.729 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.189 2.764 -11.136 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.907 4.335 -11.565 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -1.957 2.935 -11.244 1.00 0.00 H new ATOM 213 N LEU A 13 -5.126 3.742 -15.125 1.00 0.00 N ATOM 214 CA LEU A 13 -6.243 4.529 -15.625 1.00 0.00 C ATOM 215 C LEU A 13 -7.475 4.349 -14.747 1.00 0.00 C ATOM 216 O LEU A 13 -8.187 5.325 -14.511 1.00 0.00 O ATOM 217 CB LEU A 13 -6.566 4.134 -17.069 1.00 0.00 C ATOM 218 CG LEU A 13 -5.531 4.554 -18.120 1.00 0.00 C ATOM 219 CD1 LEU A 13 -5.880 3.905 -19.452 1.00 0.00 C ATOM 220 CD2 LEU A 13 -5.534 6.070 -18.233 1.00 0.00 C ATOM 0 H LEU A 13 -4.819 2.985 -15.735 1.00 0.00 H new ATOM 0 HA LEU A 13 -5.954 5.580 -15.599 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -6.682 3.051 -17.113 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -7.528 4.569 -17.339 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.533 4.227 -17.829 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -5.148 4.200 -20.203 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -5.870 2.821 -19.342 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.872 4.229 -19.766 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.801 6.381 -18.978 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -6.525 6.410 -18.534 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -5.278 6.507 -17.268 1.00 0.00 H new ATOM 232 N ALA A 14 -7.727 3.124 -14.274 1.00 0.00 N ATOM 233 CA ALA A 14 -8.846 2.866 -13.370 1.00 0.00 C ATOM 234 C ALA A 14 -8.662 3.645 -12.071 1.00 0.00 C ATOM 235 O ALA A 14 -9.621 4.211 -11.540 1.00 0.00 O ATOM 236 CB ALA A 14 -8.970 1.378 -13.090 1.00 0.00 C ATOM 0 H ALA A 14 -7.171 2.300 -14.503 1.00 0.00 H new ATOM 0 HA ALA A 14 -9.767 3.201 -13.847 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -9.808 1.203 -12.415 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.140 0.845 -14.025 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -8.051 1.017 -12.628 1.00 0.00 H new ATOM 242 N LEU A 15 -7.426 3.651 -11.575 1.00 0.00 N ATOM 243 CA LEU A 15 -7.034 4.404 -10.396 1.00 0.00 C ATOM 244 C LEU A 15 -7.301 5.885 -10.564 1.00 0.00 C ATOM 245 O LEU A 15 -7.845 6.522 -9.667 1.00 0.00 O ATOM 246 CB LEU A 15 -5.558 4.180 -10.107 1.00 0.00 C ATOM 247 CG LEU A 15 -4.996 4.997 -8.952 1.00 0.00 C ATOM 248 CD1 LEU A 15 -5.705 4.646 -7.661 1.00 0.00 C ATOM 249 CD2 LEU A 15 -3.526 4.691 -8.856 1.00 0.00 C ATOM 0 H LEU A 15 -6.660 3.122 -11.992 1.00 0.00 H new ATOM 0 HA LEU A 15 -7.634 4.047 -9.559 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.402 3.123 -9.894 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -4.988 4.411 -11.007 1.00 0.00 H new ATOM 0 HG LEU A 15 -5.149 6.062 -9.125 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -5.291 5.239 -6.846 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -6.769 4.859 -7.761 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -5.566 3.587 -7.446 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.089 5.261 -8.036 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.387 3.626 -8.672 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.036 4.965 -9.790 1.00 0.00 H new ATOM 261 N GLN A 16 -6.881 6.441 -11.697 1.00 0.00 N ATOM 262 CA GLN A 16 -7.113 7.842 -12.005 1.00 0.00 C ATOM 263 C GLN A 16 -8.601 8.148 -12.107 1.00 0.00 C ATOM 264 O GLN A 16 -9.031 9.234 -11.716 1.00 0.00 O ATOM 265 CB GLN A 16 -6.398 8.213 -13.304 1.00 0.00 C ATOM 266 CG GLN A 16 -4.885 8.240 -13.173 1.00 0.00 C ATOM 267 CD GLN A 16 -4.183 8.487 -14.493 1.00 0.00 C ATOM 268 OE1 GLN A 16 -4.788 8.409 -15.566 1.00 0.00 O ATOM 269 NE2 GLN A 16 -2.892 8.791 -14.420 1.00 0.00 N ATOM 0 H GLN A 16 -6.373 5.933 -12.421 1.00 0.00 H new ATOM 0 HA GLN A 16 -6.709 8.443 -11.191 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.675 7.499 -14.080 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -6.744 9.192 -13.634 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.601 9.018 -12.465 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.544 7.291 -12.758 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.431 8.845 -13.512 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.361 8.971 -15.272 1.00 0.00 H new ATOM 278 N ASN A 17 -9.386 7.214 -12.644 1.00 0.00 N ATOM 279 CA ASN A 17 -10.828 7.403 -12.711 1.00 0.00 C ATOM 280 C ASN A 17 -11.454 7.470 -11.317 1.00 0.00 C ATOM 281 O ASN A 17 -12.414 8.216 -11.120 1.00 0.00 O ATOM 282 CB ASN A 17 -11.466 6.304 -13.536 1.00 0.00 C ATOM 283 CG ASN A 17 -11.190 6.468 -15.004 1.00 0.00 C ATOM 284 OD1 ASN A 17 -10.862 7.563 -15.474 1.00 0.00 O ATOM 285 ND2 ASN A 17 -11.318 5.395 -15.742 1.00 0.00 N ATOM 0 H ASN A 17 -9.051 6.333 -13.033 1.00 0.00 H new ATOM 0 HA ASN A 17 -11.017 8.360 -13.198 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -11.091 5.336 -13.203 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -12.543 6.303 -13.368 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -11.145 5.443 -16.746 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -11.591 4.511 -15.313 1.00 0.00 H new ATOM 292 N ASP A 18 -10.940 6.702 -10.352 1.00 0.00 N ATOM 293 CA ASP A 18 -11.473 6.825 -8.997 1.00 0.00 C ATOM 294 C ASP A 18 -10.469 6.472 -7.891 1.00 0.00 C ATOM 295 O ASP A 18 -10.467 5.337 -7.411 1.00 0.00 O ATOM 296 CB ASP A 18 -12.707 5.926 -8.865 1.00 0.00 C ATOM 297 CG ASP A 18 -13.449 6.083 -7.545 1.00 0.00 C ATOM 298 OD1 ASP A 18 -12.999 6.835 -6.714 1.00 0.00 O ATOM 299 OD2 ASP A 18 -14.463 5.446 -7.380 1.00 0.00 O ATOM 0 H ASP A 18 -10.191 6.020 -10.474 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.722 7.877 -8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -13.393 6.145 -9.684 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -12.400 4.886 -8.976 1.00 0.00 H new ATOM 304 N PRO A 19 -9.604 7.416 -7.487 1.00 0.00 N ATOM 305 CA PRO A 19 -8.633 7.270 -6.418 1.00 0.00 C ATOM 306 C PRO A 19 -9.270 7.005 -5.046 1.00 0.00 C ATOM 307 O PRO A 19 -10.317 7.586 -4.756 1.00 0.00 O ATOM 308 CB PRO A 19 -7.942 8.639 -6.441 1.00 0.00 C ATOM 309 CG PRO A 19 -8.186 9.178 -7.824 1.00 0.00 C ATOM 310 CD PRO A 19 -9.567 8.695 -8.207 1.00 0.00 C ATOM 0 HA PRO A 19 -7.973 6.415 -6.566 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -8.355 9.302 -5.681 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -6.875 8.546 -6.237 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -8.133 10.267 -7.836 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.435 8.815 -8.525 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -10.352 9.378 -7.882 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -9.680 8.569 -9.284 1.00 0.00 H new ATOM 318 N PRO A 20 -8.686 6.155 -4.194 1.00 0.00 N ATOM 319 CA PRO A 20 -9.125 5.905 -2.838 1.00 0.00 C ATOM 320 C PRO A 20 -9.119 7.172 -1.987 1.00 0.00 C ATOM 321 O PRO A 20 -8.278 8.046 -2.220 1.00 0.00 O ATOM 322 CB PRO A 20 -8.069 4.923 -2.335 1.00 0.00 C ATOM 323 CG PRO A 20 -7.527 4.292 -3.575 1.00 0.00 C ATOM 324 CD PRO A 20 -7.556 5.353 -4.652 1.00 0.00 C ATOM 0 HA PRO A 20 -10.149 5.536 -2.787 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.286 5.434 -1.775 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.504 4.179 -1.668 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -6.511 3.932 -3.414 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -8.128 3.430 -3.865 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -6.630 5.926 -4.696 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.719 4.934 -5.645 1.00 0.00 H new ATOM 332 N PRO A 21 -10.032 7.299 -1.021 1.00 0.00 N ATOM 333 CA PRO A 21 -10.090 8.419 -0.113 1.00 0.00 C ATOM 334 C PRO A 21 -8.755 8.648 0.575 1.00 0.00 C ATOM 335 O PRO A 21 -8.268 7.783 1.302 1.00 0.00 O ATOM 336 CB PRO A 21 -11.166 7.939 0.869 1.00 0.00 C ATOM 337 CG PRO A 21 -12.025 7.013 0.051 1.00 0.00 C ATOM 338 CD PRO A 21 -11.073 6.276 -0.865 1.00 0.00 C ATOM 0 HA PRO A 21 -10.312 9.376 -0.586 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.725 7.424 1.722 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.745 8.773 1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -12.571 6.318 0.690 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -12.767 7.570 -0.521 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -10.692 5.357 -0.419 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -11.535 6.002 -1.814 1.00 0.00 H new ATOM 346 N GLY A 22 -8.176 9.824 0.356 1.00 0.00 N ATOM 347 CA GLY A 22 -6.900 10.167 0.967 1.00 0.00 C ATOM 348 C GLY A 22 -5.695 9.517 0.287 1.00 0.00 C ATOM 349 O GLY A 22 -4.655 9.374 0.921 1.00 0.00 O ATOM 0 H GLY A 22 -8.570 10.553 -0.239 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.777 11.250 0.945 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -6.918 9.869 2.015 1.00 0.00 H new ATOM 353 N MET A 23 -5.816 9.105 -0.980 1.00 0.00 N ATOM 354 CA MET A 23 -4.688 8.488 -1.686 1.00 0.00 C ATOM 355 C MET A 23 -4.365 9.054 -3.077 1.00 0.00 C ATOM 356 O MET A 23 -5.251 9.178 -3.926 1.00 0.00 O ATOM 357 CB MET A 23 -4.998 7.006 -1.831 1.00 0.00 C ATOM 358 CG MET A 23 -3.944 6.136 -2.489 1.00 0.00 C ATOM 359 SD MET A 23 -4.040 6.130 -4.292 1.00 0.00 S ATOM 360 CE MET A 23 -3.103 4.669 -4.728 1.00 0.00 C ATOM 0 H MET A 23 -6.671 9.186 -1.531 1.00 0.00 H new ATOM 0 HA MET A 23 -3.805 8.703 -1.084 1.00 0.00 H new ATOM 0 HB2 MET A 23 -5.195 6.604 -0.837 1.00 0.00 H new ATOM 0 HB3 MET A 23 -5.921 6.909 -2.403 1.00 0.00 H new ATOM 0 HG2 MET A 23 -2.956 6.484 -2.187 1.00 0.00 H new ATOM 0 HG3 MET A 23 -4.048 5.114 -2.124 1.00 0.00 H new ATOM 0 HE1 MET A 23 -3.089 4.556 -5.812 1.00 0.00 H new ATOM 0 HE2 MET A 23 -2.082 4.768 -4.360 1.00 0.00 H new ATOM 0 HE3 MET A 23 -3.567 3.791 -4.278 1.00 0.00 H new ATOM 370 N THR A 24 -3.085 9.383 -3.304 1.00 0.00 N ATOM 371 CA THR A 24 -2.586 9.883 -4.592 1.00 0.00 C ATOM 372 C THR A 24 -1.371 9.088 -5.079 1.00 0.00 C ATOM 373 O THR A 24 -0.417 8.890 -4.336 1.00 0.00 O ATOM 374 CB THR A 24 -2.196 11.375 -4.503 1.00 0.00 C ATOM 375 OG1 THR A 24 -3.342 12.155 -4.137 1.00 0.00 O ATOM 376 CG2 THR A 24 -1.654 11.871 -5.837 1.00 0.00 C ATOM 0 H THR A 24 -2.360 9.308 -2.590 1.00 0.00 H new ATOM 0 HA THR A 24 -3.402 9.760 -5.304 1.00 0.00 H new ATOM 0 HB THR A 24 -1.419 11.482 -3.746 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.090 13.100 -4.080 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.386 12.924 -5.752 1.00 0.00 H new ATOM 0 HG22 THR A 24 -0.771 11.292 -6.109 1.00 0.00 H new ATOM 0 HG23 THR A 24 -2.417 11.752 -6.606 1.00 0.00 H new ATOM 384 N LEU A 25 -1.359 8.678 -6.349 1.00 0.00 N ATOM 385 CA LEU A 25 -0.248 7.867 -6.859 1.00 0.00 C ATOM 386 C LEU A 25 0.434 8.378 -8.125 1.00 0.00 C ATOM 387 O LEU A 25 -0.223 8.644 -9.133 1.00 0.00 O ATOM 388 CB LEU A 25 -0.764 6.458 -7.162 1.00 0.00 C ATOM 389 CG LEU A 25 0.246 5.395 -7.629 1.00 0.00 C ATOM 390 CD1 LEU A 25 -0.253 4.002 -7.255 1.00 0.00 C ATOM 391 CD2 LEU A 25 0.396 5.477 -9.137 1.00 0.00 C ATOM 0 H LEU A 25 -2.088 8.887 -7.031 1.00 0.00 H new ATOM 0 HA LEU A 25 0.503 7.905 -6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.250 6.082 -6.262 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.534 6.544 -7.928 1.00 0.00 H new ATOM 0 HG LEU A 25 1.206 5.577 -7.146 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.468 3.256 -7.589 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.369 3.935 -6.173 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.214 3.819 -7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.111 4.726 -9.473 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.570 5.296 -9.609 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.755 6.468 -9.414 1.00 0.00 H new ATOM 403 N ASN A 26 1.761 8.502 -8.060 1.00 0.00 N ATOM 404 CA ASN A 26 2.570 8.912 -9.198 1.00 0.00 C ATOM 405 C ASN A 26 3.338 7.720 -9.774 1.00 0.00 C ATOM 406 O ASN A 26 3.819 6.849 -9.048 1.00 0.00 O ATOM 407 CB ASN A 26 3.518 10.025 -8.795 1.00 0.00 C ATOM 408 CG ASN A 26 2.793 11.290 -8.422 1.00 0.00 C ATOM 409 OD1 ASN A 26 1.815 11.676 -9.072 1.00 0.00 O ATOM 410 ND2 ASN A 26 3.256 11.948 -7.388 1.00 0.00 N ATOM 0 H ASN A 26 2.301 8.320 -7.214 1.00 0.00 H new ATOM 0 HA ASN A 26 1.908 9.291 -9.977 1.00 0.00 H new ATOM 0 HB2 ASN A 26 4.124 9.695 -7.951 1.00 0.00 H new ATOM 0 HB3 ASN A 26 4.203 10.231 -9.618 1.00 0.00 H new ATOM 0 HD21 ASN A 26 2.806 12.814 -7.092 1.00 0.00 H new ATOM 0 HD22 ASN A 26 4.066 11.594 -6.879 1.00 0.00 H new ATOM 417 N GLU A 27 3.465 7.664 -11.097 1.00 0.00 N ATOM 418 CA GLU A 27 4.221 6.569 -11.695 1.00 0.00 C ATOM 419 C GLU A 27 5.681 6.972 -11.849 1.00 0.00 C ATOM 420 O GLU A 27 5.994 8.007 -12.440 1.00 0.00 O ATOM 421 CB GLU A 27 3.648 6.148 -13.050 1.00 0.00 C ATOM 422 CG GLU A 27 4.383 4.962 -13.668 1.00 0.00 C ATOM 423 CD GLU A 27 3.834 4.520 -14.998 1.00 0.00 C ATOM 424 OE1 GLU A 27 2.878 5.092 -15.467 1.00 0.00 O ATOM 425 OE2 GLU A 27 4.376 3.597 -15.556 1.00 0.00 O ATOM 0 H GLU A 27 3.071 8.337 -11.754 1.00 0.00 H new ATOM 0 HA GLU A 27 4.144 5.711 -11.027 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.595 5.893 -12.929 1.00 0.00 H new ATOM 0 HB3 GLU A 27 3.694 6.994 -13.736 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.434 5.224 -13.791 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.343 4.122 -12.974 1.00 0.00 H new ATOM 432 N LYS A 28 6.567 6.144 -11.313 1.00 0.00 N ATOM 433 CA LYS A 28 8.003 6.365 -11.357 1.00 0.00 C ATOM 434 C LYS A 28 8.677 5.521 -12.433 1.00 0.00 C ATOM 435 O LYS A 28 8.680 4.288 -12.390 1.00 0.00 O ATOM 436 CB LYS A 28 8.618 6.052 -9.997 1.00 0.00 C ATOM 437 CG LYS A 28 10.116 6.286 -9.889 1.00 0.00 C ATOM 438 CD LYS A 28 10.599 5.917 -8.496 1.00 0.00 C ATOM 439 CE LYS A 28 12.105 6.057 -8.355 1.00 0.00 C ATOM 440 NZ LYS A 28 12.562 5.526 -7.045 1.00 0.00 N ATOM 0 H LYS A 28 6.302 5.287 -10.828 1.00 0.00 H new ATOM 0 HA LYS A 28 8.167 7.413 -11.606 1.00 0.00 H new ATOM 0 HB2 LYS A 28 8.117 6.659 -9.243 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.412 5.009 -9.755 1.00 0.00 H new ATOM 0 HG2 LYS A 28 10.641 5.689 -10.635 1.00 0.00 H new ATOM 0 HG3 LYS A 28 10.345 7.331 -10.098 1.00 0.00 H new ATOM 0 HD2 LYS A 28 10.106 6.554 -7.762 1.00 0.00 H new ATOM 0 HD3 LYS A 28 10.309 4.890 -8.273 1.00 0.00 H new ATOM 0 HE2 LYS A 28 12.602 5.521 -9.164 1.00 0.00 H new ATOM 0 HE3 LYS A 28 12.388 7.106 -8.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 13.596 5.616 -6.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.115 6.066 -6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 12.295 4.524 -6.964 1.00 0.00 H new ATOM 454 N SER A 29 9.260 6.211 -13.407 1.00 0.00 N ATOM 455 CA SER A 29 9.972 5.570 -14.504 1.00 0.00 C ATOM 456 C SER A 29 11.461 5.850 -14.388 1.00 0.00 C ATOM 457 O SER A 29 11.869 6.998 -14.206 1.00 0.00 O ATOM 458 CB SER A 29 9.461 6.062 -15.841 1.00 0.00 C ATOM 459 OG SER A 29 10.218 5.518 -16.888 1.00 0.00 O ATOM 0 H SER A 29 9.252 7.230 -13.457 1.00 0.00 H new ATOM 0 HA SER A 29 9.798 4.496 -14.443 1.00 0.00 H new ATOM 0 HB2 SER A 29 8.413 5.785 -15.960 1.00 0.00 H new ATOM 0 HB3 SER A 29 9.509 7.150 -15.877 1.00 0.00 H new ATOM 0 HG SER A 29 9.873 5.845 -17.745 1.00 0.00 H new ATOM 465 N VAL A 30 12.267 4.798 -14.497 1.00 0.00 N ATOM 466 CA VAL A 30 13.716 4.926 -14.376 1.00 0.00 C ATOM 467 C VAL A 30 14.446 4.300 -15.554 1.00 0.00 C ATOM 468 O VAL A 30 13.877 3.513 -16.313 1.00 0.00 O ATOM 469 CB VAL A 30 14.237 4.267 -13.080 1.00 0.00 C ATOM 470 CG1 VAL A 30 13.608 4.927 -11.862 1.00 0.00 C ATOM 471 CG2 VAL A 30 13.930 2.781 -13.104 1.00 0.00 C ATOM 0 H VAL A 30 11.941 3.847 -14.669 1.00 0.00 H new ATOM 0 HA VAL A 30 13.919 5.997 -14.355 1.00 0.00 H new ATOM 0 HB VAL A 30 15.317 4.402 -13.018 1.00 0.00 H new ATOM 0 HG11 VAL A 30 13.984 4.452 -10.956 1.00 0.00 H new ATOM 0 HG12 VAL A 30 13.864 5.987 -11.850 1.00 0.00 H new ATOM 0 HG13 VAL A 30 12.525 4.816 -11.907 1.00 0.00 H new ATOM 0 HG21 VAL A 30 14.299 2.318 -12.188 1.00 0.00 H new ATOM 0 HG22 VAL A 30 12.853 2.633 -13.177 1.00 0.00 H new ATOM 0 HG23 VAL A 30 14.418 2.322 -13.964 1.00 0.00 H new ATOM 481 N GLN A 31 15.730 4.639 -15.671 1.00 0.00 N ATOM 482 CA GLN A 31 16.617 4.183 -16.741 1.00 0.00 C ATOM 483 C GLN A 31 16.895 2.680 -16.733 1.00 0.00 C ATOM 484 O GLN A 31 17.412 2.139 -17.710 1.00 0.00 O ATOM 485 CB GLN A 31 17.954 4.926 -16.655 1.00 0.00 C ATOM 486 CG GLN A 31 18.812 4.557 -15.453 1.00 0.00 C ATOM 487 CD GLN A 31 18.469 5.360 -14.214 1.00 0.00 C ATOM 488 OE1 GLN A 31 17.321 5.763 -14.012 1.00 0.00 O ATOM 489 NE2 GLN A 31 19.469 5.600 -13.373 1.00 0.00 N ATOM 0 H GLN A 31 16.195 5.256 -15.005 1.00 0.00 H new ATOM 0 HA GLN A 31 16.092 4.402 -17.671 1.00 0.00 H new ATOM 0 HB2 GLN A 31 18.522 4.729 -17.564 1.00 0.00 H new ATOM 0 HB3 GLN A 31 17.757 5.998 -16.628 1.00 0.00 H new ATOM 0 HG2 GLN A 31 18.689 3.496 -15.237 1.00 0.00 H new ATOM 0 HG3 GLN A 31 19.862 4.712 -15.701 1.00 0.00 H new ATOM 0 HE21 GLN A 31 20.404 5.248 -13.579 1.00 0.00 H new ATOM 0 HE22 GLN A 31 19.302 6.136 -12.522 1.00 0.00 H new ATOM 498 N ASN A 32 16.553 2.011 -15.636 1.00 0.00 N ATOM 499 CA ASN A 32 16.714 0.579 -15.504 1.00 0.00 C ATOM 500 C ASN A 32 15.453 -0.189 -15.903 1.00 0.00 C ATOM 501 O ASN A 32 15.409 -1.406 -15.726 1.00 0.00 O ATOM 502 CB ASN A 32 17.106 0.253 -14.079 1.00 0.00 C ATOM 503 CG ASN A 32 18.485 0.751 -13.750 1.00 0.00 C ATOM 504 OD1 ASN A 32 19.383 0.735 -14.599 1.00 0.00 O ATOM 505 ND2 ASN A 32 18.674 1.195 -12.533 1.00 0.00 N ATOM 0 H ASN A 32 16.154 2.457 -14.810 1.00 0.00 H new ATOM 0 HA ASN A 32 17.501 0.263 -16.189 1.00 0.00 H new ATOM 0 HB2 ASN A 32 16.386 0.699 -13.393 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.064 -0.826 -13.928 1.00 0.00 H new ATOM 0 HD21 ASN A 32 19.590 1.546 -12.255 1.00 0.00 H new ATOM 0 HD22 ASN A 32 17.905 1.190 -11.863 1.00 0.00 H new ATOM 512 N SER A 33 14.438 0.510 -16.435 1.00 0.00 N ATOM 513 CA SER A 33 13.179 -0.083 -16.889 1.00 0.00 C ATOM 514 C SER A 33 12.403 -0.756 -15.765 1.00 0.00 C ATOM 515 O SER A 33 11.846 -1.840 -15.946 1.00 0.00 O ATOM 516 CB SER A 33 13.418 -1.086 -18.008 1.00 0.00 C ATOM 517 OG SER A 33 13.996 -0.477 -19.130 1.00 0.00 O ATOM 0 H SER A 33 14.474 1.521 -16.562 1.00 0.00 H new ATOM 0 HA SER A 33 12.575 0.745 -17.261 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.069 -1.884 -17.650 1.00 0.00 H new ATOM 0 HB3 SER A 33 12.473 -1.549 -18.291 1.00 0.00 H new ATOM 0 HG SER A 33 14.138 -1.148 -19.830 1.00 0.00 H new ATOM 523 N ILE A 34 12.368 -0.103 -14.609 1.00 0.00 N ATOM 524 CA ILE A 34 11.660 -0.604 -13.440 1.00 0.00 C ATOM 525 C ILE A 34 10.520 0.333 -13.076 1.00 0.00 C ATOM 526 O ILE A 34 10.750 1.486 -12.711 1.00 0.00 O ATOM 527 CB ILE A 34 12.602 -0.739 -12.230 1.00 0.00 C ATOM 528 CG1 ILE A 34 13.743 -1.701 -12.565 1.00 0.00 C ATOM 529 CG2 ILE A 34 11.812 -1.229 -11.024 1.00 0.00 C ATOM 530 CD1 ILE A 34 14.840 -1.718 -11.528 1.00 0.00 C ATOM 0 H ILE A 34 12.832 0.792 -14.457 1.00 0.00 H new ATOM 0 HA ILE A 34 11.267 -1.589 -13.691 1.00 0.00 H new ATOM 0 HB ILE A 34 13.035 0.232 -11.990 1.00 0.00 H new ATOM 0 HG12 ILE A 34 13.339 -2.708 -12.672 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.170 -1.425 -13.529 1.00 0.00 H new ATOM 0 HG21 ILE A 34 12.479 -1.325 -10.167 1.00 0.00 H new ATOM 0 HG22 ILE A 34 11.022 -0.514 -10.792 1.00 0.00 H new ATOM 0 HG23 ILE A 34 11.369 -2.199 -11.249 1.00 0.00 H new ATOM 0 HD11 ILE A 34 15.616 -2.422 -11.830 1.00 0.00 H new ATOM 0 HD12 ILE A 34 15.270 -0.721 -11.437 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.427 -2.024 -10.567 1.00 0.00 H new ATOM 542 N THR A 35 9.290 -0.160 -13.162 1.00 0.00 N ATOM 543 CA THR A 35 8.160 0.687 -12.813 1.00 0.00 C ATOM 544 C THR A 35 7.892 0.641 -11.327 1.00 0.00 C ATOM 545 O THR A 35 7.680 -0.435 -10.762 1.00 0.00 O ATOM 546 CB THR A 35 6.866 0.279 -13.537 1.00 0.00 C ATOM 547 OG1 THR A 35 7.039 0.400 -14.955 1.00 0.00 O ATOM 548 CG2 THR A 35 5.723 1.167 -13.059 1.00 0.00 C ATOM 0 H THR A 35 9.055 -1.107 -13.459 1.00 0.00 H new ATOM 0 HA THR A 35 8.437 1.694 -13.126 1.00 0.00 H new ATOM 0 HB THR A 35 6.629 -0.760 -13.309 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.211 0.137 -15.409 1.00 0.00 H new ATOM 0 HG21 THR A 35 4.803 0.882 -13.569 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.594 1.046 -11.983 1.00 0.00 H new ATOM 0 HG23 THR A 35 5.954 2.209 -13.282 1.00 0.00 H new ATOM 556 N GLN A 36 7.919 1.816 -10.713 1.00 0.00 N ATOM 557 CA GLN A 36 7.644 1.911 -9.297 1.00 0.00 C ATOM 558 C GLN A 36 6.521 2.905 -9.073 1.00 0.00 C ATOM 559 O GLN A 36 6.240 3.729 -9.940 1.00 0.00 O ATOM 560 CB GLN A 36 8.899 2.306 -8.509 1.00 0.00 C ATOM 561 CG GLN A 36 10.031 1.293 -8.567 1.00 0.00 C ATOM 562 CD GLN A 36 11.256 1.681 -7.748 1.00 0.00 C ATOM 563 OE1 GLN A 36 11.517 2.853 -7.454 1.00 0.00 O ATOM 564 NE2 GLN A 36 12.030 0.669 -7.369 1.00 0.00 N ATOM 0 H GLN A 36 8.126 2.703 -11.171 1.00 0.00 H new ATOM 0 HA GLN A 36 7.335 0.932 -8.930 1.00 0.00 H new ATOM 0 HB2 GLN A 36 9.264 3.260 -8.888 1.00 0.00 H new ATOM 0 HB3 GLN A 36 8.622 2.462 -7.466 1.00 0.00 H new ATOM 0 HG2 GLN A 36 9.661 0.330 -8.214 1.00 0.00 H new ATOM 0 HG3 GLN A 36 10.330 1.158 -9.606 1.00 0.00 H new ATOM 0 HE21 GLN A 36 11.784 -0.286 -7.629 1.00 0.00 H new ATOM 0 HE22 GLN A 36 12.869 0.848 -6.818 1.00 0.00 H new ATOM 573 N TRP A 37 5.830 2.799 -7.951 1.00 0.00 N ATOM 574 CA TRP A 37 4.778 3.771 -7.682 1.00 0.00 C ATOM 575 C TRP A 37 5.107 4.574 -6.439 1.00 0.00 C ATOM 576 O TRP A 37 5.662 4.053 -5.470 1.00 0.00 O ATOM 577 CB TRP A 37 3.428 3.097 -7.510 1.00 0.00 C ATOM 578 CG TRP A 37 2.913 2.413 -8.741 1.00 0.00 C ATOM 579 CD1 TRP A 37 3.058 2.788 -10.044 1.00 0.00 C ATOM 580 CD2 TRP A 37 2.171 1.175 -8.765 1.00 0.00 C ATOM 581 NE1 TRP A 37 2.439 1.881 -10.866 1.00 0.00 N ATOM 582 CE2 TRP A 37 1.889 0.887 -10.096 1.00 0.00 C ATOM 583 CE3 TRP A 37 1.729 0.302 -7.776 1.00 0.00 C ATOM 584 CZ2 TRP A 37 1.167 -0.239 -10.457 1.00 0.00 C ATOM 585 CZ3 TRP A 37 1.026 -0.833 -8.132 1.00 0.00 C ATOM 586 CH2 TRP A 37 0.744 -1.093 -9.442 1.00 0.00 C ATOM 0 H TRP A 37 5.966 2.083 -7.237 1.00 0.00 H new ATOM 0 HA TRP A 37 4.721 4.438 -8.542 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.502 2.364 -6.706 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.701 3.845 -7.194 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.583 3.670 -10.380 1.00 0.00 H new ATOM 0 HE1 TRP A 37 2.395 1.936 -11.884 1.00 0.00 H new ATOM 0 HE3 TRP A 37 1.934 0.510 -6.736 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 0.940 -0.448 -11.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 0.697 -1.521 -7.367 1.00 0.00 H new ATOM 0 HH2 TRP A 37 0.181 -1.979 -9.696 1.00 0.00 H new ATOM 597 N ILE A 38 4.750 5.851 -6.479 1.00 0.00 N ATOM 598 CA ILE A 38 4.964 6.762 -5.368 1.00 0.00 C ATOM 599 C ILE A 38 3.602 7.150 -4.826 1.00 0.00 C ATOM 600 O ILE A 38 2.837 7.840 -5.497 1.00 0.00 O ATOM 601 CB ILE A 38 5.737 8.008 -5.822 1.00 0.00 C ATOM 602 CG1 ILE A 38 7.092 7.595 -6.409 1.00 0.00 C ATOM 603 CG2 ILE A 38 5.908 8.957 -4.645 1.00 0.00 C ATOM 604 CD1 ILE A 38 7.821 8.732 -7.086 1.00 0.00 C ATOM 0 H ILE A 38 4.302 6.283 -7.287 1.00 0.00 H new ATOM 0 HA ILE A 38 5.560 6.278 -4.595 1.00 0.00 H new ATOM 0 HB ILE A 38 5.178 8.527 -6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 38 7.718 7.194 -5.612 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.939 6.791 -7.129 1.00 0.00 H new ATOM 0 HG21 ILE A 38 6.457 9.842 -4.968 1.00 0.00 H new ATOM 0 HG22 ILE A 38 4.928 9.254 -4.272 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.462 8.456 -3.851 1.00 0.00 H new ATOM 0 HD11 ILE A 38 8.772 8.372 -7.479 1.00 0.00 H new ATOM 0 HD12 ILE A 38 7.213 9.118 -7.904 1.00 0.00 H new ATOM 0 HD13 ILE A 38 8.005 9.527 -6.364 1.00 0.00 H new ATOM 616 N VAL A 39 3.280 6.729 -3.607 1.00 0.00 N ATOM 617 CA VAL A 39 1.939 7.031 -3.126 1.00 0.00 C ATOM 618 C VAL A 39 1.877 7.889 -1.890 1.00 0.00 C ATOM 619 O VAL A 39 2.454 7.551 -0.866 1.00 0.00 O ATOM 620 CB VAL A 39 1.162 5.749 -2.812 1.00 0.00 C ATOM 621 CG1 VAL A 39 -0.215 6.106 -2.287 1.00 0.00 C ATOM 622 CG2 VAL A 39 1.081 4.908 -4.061 1.00 0.00 C ATOM 0 H VAL A 39 3.885 6.211 -2.970 1.00 0.00 H new ATOM 0 HA VAL A 39 1.498 7.593 -3.949 1.00 0.00 H new ATOM 0 HB VAL A 39 1.672 5.171 -2.041 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.767 5.193 -2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.115 6.701 -1.379 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.754 6.681 -3.040 1.00 0.00 H new ATOM 0 HG21 VAL A 39 0.529 3.992 -3.848 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.568 5.467 -4.843 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.087 4.656 -4.396 1.00 0.00 H new ATOM 632 N ASP A 40 1.144 8.988 -1.971 1.00 0.00 N ATOM 633 CA ASP A 40 1.006 9.859 -0.823 1.00 0.00 C ATOM 634 C ASP A 40 -0.344 9.602 -0.161 1.00 0.00 C ATOM 635 O ASP A 40 -1.368 9.478 -0.838 1.00 0.00 O ATOM 636 CB ASP A 40 1.182 11.320 -1.228 1.00 0.00 C ATOM 637 CG ASP A 40 2.626 11.645 -1.627 1.00 0.00 C ATOM 638 OD1 ASP A 40 3.488 10.834 -1.383 1.00 0.00 O ATOM 639 OD2 ASP A 40 2.865 12.727 -2.117 1.00 0.00 O ATOM 0 H ASP A 40 0.644 9.292 -2.807 1.00 0.00 H new ATOM 0 HA ASP A 40 1.790 9.642 -0.097 1.00 0.00 H new ATOM 0 HB2 ASP A 40 0.518 11.546 -2.062 1.00 0.00 H new ATOM 0 HB3 ASP A 40 0.883 11.963 -0.400 1.00 0.00 H new ATOM 644 N MET A 41 -0.361 9.500 1.170 1.00 0.00 N ATOM 645 CA MET A 41 -1.641 9.240 1.820 1.00 0.00 C ATOM 646 C MET A 41 -1.897 10.115 3.039 1.00 0.00 C ATOM 647 O MET A 41 -0.973 10.572 3.709 1.00 0.00 O ATOM 648 CB MET A 41 -1.738 7.784 2.278 1.00 0.00 C ATOM 649 CG MET A 41 -1.548 6.726 1.207 1.00 0.00 C ATOM 650 SD MET A 41 -1.617 5.068 1.903 1.00 0.00 S ATOM 651 CE MET A 41 -0.159 5.162 2.934 1.00 0.00 C ATOM 0 H MET A 41 0.447 9.588 1.786 1.00 0.00 H new ATOM 0 HA MET A 41 -2.389 9.470 1.061 1.00 0.00 H new ATOM 0 HB2 MET A 41 -0.993 7.620 3.056 1.00 0.00 H new ATOM 0 HB3 MET A 41 -2.716 7.634 2.736 1.00 0.00 H new ATOM 0 HG2 MET A 41 -2.320 6.835 0.445 1.00 0.00 H new ATOM 0 HG3 MET A 41 -0.588 6.875 0.712 1.00 0.00 H new ATOM 0 HE1 MET A 41 0.295 4.174 3.014 1.00 0.00 H new ATOM 0 HE2 MET A 41 0.556 5.855 2.491 1.00 0.00 H new ATOM 0 HE3 MET A 41 -0.438 5.514 3.927 1.00 0.00 H new ATOM 661 N GLU A 42 -3.174 10.355 3.326 1.00 0.00 N ATOM 662 CA GLU A 42 -3.562 11.114 4.514 1.00 0.00 C ATOM 663 C GLU A 42 -4.192 10.205 5.566 1.00 0.00 C ATOM 664 O GLU A 42 -5.130 9.467 5.255 1.00 0.00 O ATOM 665 CB GLU A 42 -4.536 12.235 4.162 1.00 0.00 C ATOM 666 CG GLU A 42 -4.944 13.079 5.362 1.00 0.00 C ATOM 667 CD GLU A 42 -5.878 14.202 5.006 1.00 0.00 C ATOM 668 OE1 GLU A 42 -6.220 14.321 3.854 1.00 0.00 O ATOM 669 OE2 GLU A 42 -6.247 14.946 5.885 1.00 0.00 O ATOM 0 H GLU A 42 -3.956 10.036 2.755 1.00 0.00 H new ATOM 0 HA GLU A 42 -2.653 11.554 4.924 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -4.080 12.880 3.411 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.429 11.802 3.711 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -5.422 12.438 6.103 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.050 13.493 5.828 1.00 0.00 H new ATOM 676 N GLY A 43 -3.683 10.238 6.798 1.00 0.00 N ATOM 677 CA GLY A 43 -4.267 9.404 7.850 1.00 0.00 C ATOM 678 C GLY A 43 -5.693 9.813 8.221 1.00 0.00 C ATOM 679 O GLY A 43 -6.040 10.997 8.258 1.00 0.00 O ATOM 0 H GLY A 43 -2.892 10.814 7.087 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.268 8.364 7.522 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.638 9.458 8.738 1.00 0.00 H new ATOM 683 N ALA A 44 -6.491 8.804 8.570 1.00 0.00 N ATOM 684 CA ALA A 44 -7.915 8.938 8.870 1.00 0.00 C ATOM 685 C ALA A 44 -8.244 9.790 10.107 1.00 0.00 C ATOM 686 O ALA A 44 -7.569 9.680 11.137 1.00 0.00 O ATOM 687 CB ALA A 44 -8.511 7.554 9.074 1.00 0.00 C ATOM 0 H ALA A 44 -6.155 7.845 8.654 1.00 0.00 H new ATOM 0 HA ALA A 44 -8.345 9.460 8.015 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -9.574 7.645 9.298 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.381 6.964 8.166 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -8.006 7.059 9.904 1.00 0.00 H new ATOM 693 N PRO A 45 -9.313 10.597 10.037 1.00 0.00 N ATOM 694 CA PRO A 45 -9.722 11.476 11.100 1.00 0.00 C ATOM 695 C PRO A 45 -10.271 10.731 12.289 1.00 0.00 C ATOM 696 O PRO A 45 -10.990 9.741 12.154 1.00 0.00 O ATOM 697 CB PRO A 45 -10.793 12.320 10.400 1.00 0.00 C ATOM 698 CG PRO A 45 -11.307 11.453 9.284 1.00 0.00 C ATOM 699 CD PRO A 45 -10.125 10.636 8.815 1.00 0.00 C ATOM 0 HA PRO A 45 -8.905 12.058 11.526 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -11.593 12.592 11.089 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -10.373 13.250 10.016 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -12.114 10.808 9.631 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -11.709 12.059 8.472 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -10.417 9.640 8.482 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -9.600 11.109 7.985 1.00 0.00 H new ATOM 707 N GLY A 46 -9.922 11.238 13.465 1.00 0.00 N ATOM 708 CA GLY A 46 -10.322 10.627 14.717 1.00 0.00 C ATOM 709 C GLY A 46 -9.285 9.614 15.195 1.00 0.00 C ATOM 710 O GLY A 46 -9.405 9.101 16.309 1.00 0.00 O ATOM 0 H GLY A 46 -9.357 12.080 13.573 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.456 11.399 15.475 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -11.286 10.133 14.592 1.00 0.00 H new ATOM 714 N THR A 47 -8.274 9.311 14.373 1.00 0.00 N ATOM 715 CA THR A 47 -7.266 8.349 14.781 1.00 0.00 C ATOM 716 C THR A 47 -5.985 9.066 15.131 1.00 0.00 C ATOM 717 O THR A 47 -5.836 10.268 14.909 1.00 0.00 O ATOM 718 CB THR A 47 -6.910 7.352 13.670 1.00 0.00 C ATOM 719 OG1 THR A 47 -6.174 8.035 12.648 1.00 0.00 O ATOM 720 CG2 THR A 47 -8.194 6.802 13.071 1.00 0.00 C ATOM 0 H THR A 47 -8.140 9.711 13.444 1.00 0.00 H new ATOM 0 HA THR A 47 -7.690 7.813 15.630 1.00 0.00 H new ATOM 0 HB THR A 47 -6.311 6.538 14.078 1.00 0.00 H new ATOM 0 HG1 THR A 47 -6.694 8.801 12.327 1.00 0.00 H new ATOM 0 HG21 THR A 47 -7.952 6.092 12.280 1.00 0.00 H new ATOM 0 HG22 THR A 47 -8.771 6.298 13.847 1.00 0.00 H new ATOM 0 HG23 THR A 47 -8.782 7.621 12.656 1.00 0.00 H new ATOM 728 N LEU A 48 -5.024 8.291 15.612 1.00 0.00 N ATOM 729 CA LEU A 48 -3.707 8.790 15.977 1.00 0.00 C ATOM 730 C LEU A 48 -2.890 9.251 14.772 1.00 0.00 C ATOM 731 O LEU A 48 -1.850 9.888 14.944 1.00 0.00 O ATOM 732 CB LEU A 48 -2.923 7.690 16.697 1.00 0.00 C ATOM 733 CG LEU A 48 -3.473 7.260 18.060 1.00 0.00 C ATOM 734 CD1 LEU A 48 -2.660 6.079 18.571 1.00 0.00 C ATOM 735 CD2 LEU A 48 -3.403 8.436 19.022 1.00 0.00 C ATOM 0 H LEU A 48 -5.138 7.288 15.761 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.868 9.653 16.624 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.885 6.814 16.049 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.897 8.031 16.832 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.515 6.952 17.973 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -3.044 5.765 19.542 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -2.737 5.252 17.866 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -1.615 6.373 18.672 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.794 8.135 19.994 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.367 8.756 19.131 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.999 9.261 18.632 1.00 0.00 H new ATOM 747 N TYR A 49 -3.347 8.931 13.560 1.00 0.00 N ATOM 748 CA TYR A 49 -2.641 9.287 12.354 1.00 0.00 C ATOM 749 C TYR A 49 -3.366 10.400 11.589 1.00 0.00 C ATOM 750 O TYR A 49 -2.955 10.731 10.479 1.00 0.00 O ATOM 751 CB TYR A 49 -2.510 8.004 11.538 1.00 0.00 C ATOM 752 CG TYR A 49 -1.750 6.946 12.324 1.00 0.00 C ATOM 753 CD1 TYR A 49 -0.362 6.879 12.378 1.00 0.00 C ATOM 754 CD2 TYR A 49 -2.492 6.013 13.028 1.00 0.00 C ATOM 755 CE1 TYR A 49 0.268 5.895 13.122 1.00 0.00 C ATOM 756 CE2 TYR A 49 -1.868 5.034 13.774 1.00 0.00 C ATOM 757 CZ TYR A 49 -0.482 4.971 13.822 1.00 0.00 C ATOM 758 OH TYR A 49 0.116 3.982 14.575 1.00 0.00 O ATOM 0 H TYR A 49 -4.215 8.420 13.400 1.00 0.00 H new ATOM 0 HA TYR A 49 -1.654 9.694 12.576 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -3.500 7.630 11.277 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -1.991 8.213 10.602 1.00 0.00 H new ATOM 0 HD1 TYR A 49 0.230 7.601 11.835 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -3.571 6.052 12.993 1.00 0.00 H new ATOM 0 HE1 TYR A 49 1.347 5.851 13.155 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.459 4.315 14.322 1.00 0.00 H new ATOM 0 HH TYR A 49 1.090 4.088 14.541 1.00 0.00 H new ATOM 768 N GLU A 50 -4.420 10.982 12.182 1.00 0.00 N ATOM 769 CA GLU A 50 -5.218 12.032 11.546 1.00 0.00 C ATOM 770 C GLU A 50 -4.493 13.209 10.925 1.00 0.00 C ATOM 771 O GLU A 50 -3.962 14.070 11.627 1.00 0.00 O ATOM 772 CB GLU A 50 -6.202 12.622 12.552 1.00 0.00 C ATOM 773 CG GLU A 50 -6.992 13.786 11.963 1.00 0.00 C ATOM 774 CD GLU A 50 -8.077 14.318 12.856 1.00 0.00 C ATOM 775 OE1 GLU A 50 -8.424 13.661 13.809 1.00 0.00 O ATOM 776 OE2 GLU A 50 -8.568 15.387 12.579 1.00 0.00 O ATOM 0 H GLU A 50 -4.740 10.734 13.118 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.676 11.492 10.718 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -6.892 11.846 12.882 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -5.659 12.962 13.434 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.301 14.596 11.730 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.438 13.466 11.021 1.00 0.00 H new ATOM 783 N GLY A 51 -4.494 13.246 9.592 1.00 0.00 N ATOM 784 CA GLY A 51 -3.874 14.337 8.851 1.00 0.00 C ATOM 785 C GLY A 51 -2.388 14.129 8.587 1.00 0.00 C ATOM 786 O GLY A 51 -1.742 14.982 7.977 1.00 0.00 O ATOM 0 H GLY A 51 -4.920 12.529 9.005 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.390 14.457 7.899 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.009 15.265 9.406 1.00 0.00 H new ATOM 790 N GLU A 52 -1.838 13.011 9.051 1.00 0.00 N ATOM 791 CA GLU A 52 -0.430 12.721 8.864 1.00 0.00 C ATOM 792 C GLU A 52 -0.169 12.296 7.436 1.00 0.00 C ATOM 793 O GLU A 52 -0.950 11.552 6.843 1.00 0.00 O ATOM 794 CB GLU A 52 0.032 11.650 9.850 1.00 0.00 C ATOM 795 CG GLU A 52 1.517 11.334 9.800 1.00 0.00 C ATOM 796 CD GLU A 52 1.921 10.360 10.868 1.00 0.00 C ATOM 797 OE1 GLU A 52 1.068 9.958 11.621 1.00 0.00 O ATOM 798 OE2 GLU A 52 3.079 10.022 10.943 1.00 0.00 O ATOM 0 H GLU A 52 -2.352 12.292 9.560 1.00 0.00 H new ATOM 0 HA GLU A 52 0.144 13.626 9.060 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.222 11.972 10.860 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.526 10.734 9.657 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.768 10.924 8.822 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.088 12.255 9.915 1.00 0.00 H new ATOM 805 N LYS A 53 0.901 12.830 6.858 1.00 0.00 N ATOM 806 CA LYS A 53 1.252 12.468 5.495 1.00 0.00 C ATOM 807 C LYS A 53 2.137 11.232 5.460 1.00 0.00 C ATOM 808 O LYS A 53 3.173 11.174 6.124 1.00 0.00 O ATOM 809 CB LYS A 53 1.956 13.602 4.761 1.00 0.00 C ATOM 810 CG LYS A 53 2.191 13.215 3.310 1.00 0.00 C ATOM 811 CD LYS A 53 2.822 14.299 2.455 1.00 0.00 C ATOM 812 CE LYS A 53 2.904 13.740 1.048 1.00 0.00 C ATOM 813 NZ LYS A 53 3.481 14.653 0.026 1.00 0.00 N ATOM 0 H LYS A 53 1.527 13.501 7.303 1.00 0.00 H new ATOM 0 HA LYS A 53 0.311 12.256 4.987 1.00 0.00 H new ATOM 0 HB2 LYS A 53 1.353 14.508 4.811 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.907 13.825 5.245 1.00 0.00 H new ATOM 0 HG2 LYS A 53 2.831 12.333 3.283 1.00 0.00 H new ATOM 0 HG3 LYS A 53 1.237 12.931 2.866 1.00 0.00 H new ATOM 0 HD2 LYS A 53 2.223 15.209 2.477 1.00 0.00 H new ATOM 0 HD3 LYS A 53 3.812 14.560 2.828 1.00 0.00 H new ATOM 0 HE2 LYS A 53 3.501 12.828 1.073 1.00 0.00 H new ATOM 0 HE3 LYS A 53 1.901 13.456 0.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 3.399 14.217 -0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 2.964 15.556 0.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 4.484 14.826 0.241 1.00 0.00 H new ATOM 827 N PHE A 54 1.716 10.252 4.675 1.00 0.00 N ATOM 828 CA PHE A 54 2.440 9.004 4.518 1.00 0.00 C ATOM 829 C PHE A 54 2.944 8.831 3.107 1.00 0.00 C ATOM 830 O PHE A 54 2.368 9.380 2.171 1.00 0.00 O ATOM 831 CB PHE A 54 1.499 7.856 4.797 1.00 0.00 C ATOM 832 CG PHE A 54 1.018 7.871 6.202 1.00 0.00 C ATOM 833 CD1 PHE A 54 1.794 7.311 7.195 1.00 0.00 C ATOM 834 CD2 PHE A 54 -0.187 8.467 6.528 1.00 0.00 C ATOM 835 CE1 PHE A 54 1.379 7.340 8.507 1.00 0.00 C ATOM 836 CE2 PHE A 54 -0.605 8.498 7.839 1.00 0.00 C ATOM 837 CZ PHE A 54 0.181 7.936 8.816 1.00 0.00 C ATOM 0 H PHE A 54 0.857 10.302 4.127 1.00 0.00 H new ATOM 0 HA PHE A 54 3.285 9.020 5.207 1.00 0.00 H new ATOM 0 HB2 PHE A 54 0.647 7.911 4.120 1.00 0.00 H new ATOM 0 HB3 PHE A 54 2.006 6.912 4.596 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.735 6.846 6.941 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -0.799 8.907 5.755 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.987 6.900 9.283 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -1.545 8.961 8.098 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.149 7.963 9.844 1.00 0.00 H new ATOM 847 N GLN A 55 4.009 8.054 2.935 1.00 0.00 N ATOM 848 CA GLN A 55 4.462 7.837 1.573 1.00 0.00 C ATOM 849 C GLN A 55 4.910 6.398 1.351 1.00 0.00 C ATOM 850 O GLN A 55 5.686 5.856 2.138 1.00 0.00 O ATOM 851 CB GLN A 55 5.577 8.803 1.192 1.00 0.00 C ATOM 852 CG GLN A 55 5.965 8.677 -0.272 1.00 0.00 C ATOM 853 CD GLN A 55 6.956 9.734 -0.706 1.00 0.00 C ATOM 854 OE1 GLN A 55 8.168 9.628 -0.492 1.00 0.00 O ATOM 855 NE2 GLN A 55 6.428 10.787 -1.321 1.00 0.00 N ATOM 0 H GLN A 55 4.543 7.592 3.671 1.00 0.00 H new ATOM 0 HA GLN A 55 3.608 8.030 0.924 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.256 9.825 1.395 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.450 8.613 1.816 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.393 7.690 -0.447 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.069 8.750 -0.889 1.00 0.00 H new ATOM 0 HE21 GLN A 55 5.421 10.834 -1.478 1.00 0.00 H new ATOM 0 HE22 GLN A 55 7.030 11.548 -1.636 1.00 0.00 H new ATOM 864 N LEU A 56 4.375 5.793 0.290 1.00 0.00 N ATOM 865 CA LEU A 56 4.677 4.419 -0.085 1.00 0.00 C ATOM 866 C LEU A 56 5.487 4.291 -1.355 1.00 0.00 C ATOM 867 O LEU A 56 5.423 5.122 -2.262 1.00 0.00 O ATOM 868 CB LEU A 56 3.403 3.619 -0.343 1.00 0.00 C ATOM 869 CG LEU A 56 2.392 3.548 0.786 1.00 0.00 C ATOM 870 CD1 LEU A 56 1.137 2.856 0.288 1.00 0.00 C ATOM 871 CD2 LEU A 56 3.005 2.768 1.927 1.00 0.00 C ATOM 0 H LEU A 56 3.714 6.251 -0.337 1.00 0.00 H new ATOM 0 HA LEU A 56 5.248 4.041 0.763 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.907 4.045 -1.215 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.690 2.601 -0.605 1.00 0.00 H new ATOM 0 HG LEU A 56 2.128 4.548 1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.407 2.802 1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.717 3.420 -0.545 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.385 1.848 -0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.292 2.706 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.256 1.763 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.909 3.272 2.268 1.00 0.00 H new ATOM 883 N LEU A 57 6.230 3.198 -1.402 1.00 0.00 N ATOM 884 CA LEU A 57 7.022 2.798 -2.541 1.00 0.00 C ATOM 885 C LEU A 57 6.565 1.432 -3.012 1.00 0.00 C ATOM 886 O LEU A 57 6.559 0.473 -2.239 1.00 0.00 O ATOM 887 CB LEU A 57 8.506 2.739 -2.192 1.00 0.00 C ATOM 888 CG LEU A 57 9.402 2.233 -3.325 1.00 0.00 C ATOM 889 CD1 LEU A 57 9.331 3.215 -4.488 1.00 0.00 C ATOM 890 CD2 LEU A 57 10.820 2.082 -2.797 1.00 0.00 C ATOM 0 H LEU A 57 6.297 2.547 -0.620 1.00 0.00 H new ATOM 0 HA LEU A 57 6.885 3.538 -3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.838 3.735 -1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.637 2.092 -1.325 1.00 0.00 H new ATOM 0 HG LEU A 57 9.068 1.260 -3.685 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.966 2.863 -5.301 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.302 3.290 -4.839 1.00 0.00 H new ATOM 0 HD13 LEU A 57 9.674 4.195 -4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.469 1.722 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.181 3.048 -2.443 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.827 1.368 -1.973 1.00 0.00 H new ATOM 902 N PHE A 58 6.135 1.345 -4.264 1.00 0.00 N ATOM 903 CA PHE A 58 5.750 0.048 -4.794 1.00 0.00 C ATOM 904 C PHE A 58 6.589 -0.427 -5.952 1.00 0.00 C ATOM 905 O PHE A 58 6.944 0.365 -6.813 1.00 0.00 O ATOM 906 CB PHE A 58 4.354 0.032 -5.370 1.00 0.00 C ATOM 907 CG PHE A 58 3.199 0.170 -4.437 1.00 0.00 C ATOM 908 CD1 PHE A 58 2.818 1.384 -3.893 1.00 0.00 C ATOM 909 CD2 PHE A 58 2.454 -0.962 -4.159 1.00 0.00 C ATOM 910 CE1 PHE A 58 1.717 1.438 -3.064 1.00 0.00 C ATOM 911 CE2 PHE A 58 1.350 -0.906 -3.342 1.00 0.00 C ATOM 912 CZ PHE A 58 0.985 0.300 -2.789 1.00 0.00 C ATOM 0 H PHE A 58 6.046 2.129 -4.911 1.00 0.00 H new ATOM 0 HA PHE A 58 5.865 -0.586 -3.915 1.00 0.00 H new ATOM 0 HB2 PHE A 58 4.288 0.837 -6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 58 4.231 -0.904 -5.915 1.00 0.00 H new ATOM 0 HD1 PHE A 58 3.377 2.281 -4.115 1.00 0.00 H new ATOM 0 HD2 PHE A 58 2.745 -1.908 -4.592 1.00 0.00 H new ATOM 0 HE1 PHE A 58 1.424 2.380 -2.625 1.00 0.00 H new ATOM 0 HE2 PHE A 58 0.776 -1.798 -3.137 1.00 0.00 H new ATOM 0 HZ PHE A 58 0.125 0.357 -2.139 1.00 0.00 H new ATOM 922 N LYS A 59 6.883 -1.720 -5.994 1.00 0.00 N ATOM 923 CA LYS A 59 7.558 -2.268 -7.159 1.00 0.00 C ATOM 924 C LYS A 59 6.499 -3.003 -7.964 1.00 0.00 C ATOM 925 O LYS A 59 5.932 -3.996 -7.494 1.00 0.00 O ATOM 926 CB LYS A 59 8.699 -3.212 -6.799 1.00 0.00 C ATOM 927 CG LYS A 59 9.464 -3.737 -8.006 1.00 0.00 C ATOM 928 CD LYS A 59 10.593 -4.661 -7.577 1.00 0.00 C ATOM 929 CE LYS A 59 11.359 -5.205 -8.774 1.00 0.00 C ATOM 930 NZ LYS A 59 12.449 -6.129 -8.354 1.00 0.00 N ATOM 0 H LYS A 59 6.671 -2.392 -5.256 1.00 0.00 H new ATOM 0 HA LYS A 59 8.018 -1.458 -7.725 1.00 0.00 H new ATOM 0 HB2 LYS A 59 9.393 -2.693 -6.138 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.297 -4.057 -6.239 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.783 -4.272 -8.668 1.00 0.00 H new ATOM 0 HG3 LYS A 59 9.870 -2.901 -8.575 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.277 -4.121 -6.922 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.185 -5.490 -6.998 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.672 -5.730 -9.438 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.782 -4.377 -9.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.950 -6.480 -9.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 13.117 -5.621 -7.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 12.042 -6.932 -7.833 1.00 0.00 H new ATOM 944 N PHE A 60 6.216 -2.509 -9.168 1.00 0.00 N ATOM 945 CA PHE A 60 5.221 -3.151 -10.020 1.00 0.00 C ATOM 946 C PHE A 60 5.579 -4.590 -10.324 1.00 0.00 C ATOM 947 O PHE A 60 6.617 -4.869 -10.929 1.00 0.00 O ATOM 948 CB PHE A 60 4.975 -2.389 -11.318 1.00 0.00 C ATOM 949 CG PHE A 60 3.958 -3.060 -12.202 1.00 0.00 C ATOM 950 CD1 PHE A 60 2.642 -3.204 -11.796 1.00 0.00 C ATOM 951 CD2 PHE A 60 4.312 -3.545 -13.452 1.00 0.00 C ATOM 952 CE1 PHE A 60 1.701 -3.805 -12.609 1.00 0.00 C ATOM 953 CE2 PHE A 60 3.378 -4.152 -14.269 1.00 0.00 C ATOM 954 CZ PHE A 60 2.070 -4.284 -13.847 1.00 0.00 C ATOM 0 H PHE A 60 6.654 -1.680 -9.569 1.00 0.00 H new ATOM 0 HA PHE A 60 4.294 -3.138 -9.447 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.637 -1.380 -11.083 1.00 0.00 H new ATOM 0 HB3 PHE A 60 5.915 -2.292 -11.861 1.00 0.00 H new ATOM 0 HD1 PHE A 60 2.345 -2.839 -10.824 1.00 0.00 H new ATOM 0 HD2 PHE A 60 5.332 -3.447 -13.792 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.678 -3.899 -12.275 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.671 -4.524 -15.240 1.00 0.00 H new ATOM 0 HZ PHE A 60 1.340 -4.760 -14.484 1.00 0.00 H new ATOM 964 N SER A 61 4.712 -5.500 -9.898 1.00 0.00 N ATOM 965 CA SER A 61 4.952 -6.909 -10.133 1.00 0.00 C ATOM 966 C SER A 61 4.878 -7.307 -11.590 1.00 0.00 C ATOM 967 O SER A 61 3.892 -7.061 -12.283 1.00 0.00 O ATOM 968 CB SER A 61 3.963 -7.766 -9.380 1.00 0.00 C ATOM 969 OG SER A 61 4.152 -9.114 -9.718 1.00 0.00 O ATOM 0 H SER A 61 3.850 -5.288 -9.396 1.00 0.00 H new ATOM 0 HA SER A 61 5.969 -7.075 -9.779 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.092 -7.629 -8.306 1.00 0.00 H new ATOM 0 HB3 SER A 61 2.945 -7.460 -9.621 1.00 0.00 H new ATOM 0 HG SER A 61 3.299 -9.591 -9.649 1.00 0.00 H new ATOM 975 N SER A 62 5.908 -8.031 -12.016 1.00 0.00 N ATOM 976 CA SER A 62 6.026 -8.547 -13.374 1.00 0.00 C ATOM 977 C SER A 62 5.083 -9.721 -13.626 1.00 0.00 C ATOM 978 O SER A 62 4.990 -10.198 -14.756 1.00 0.00 O ATOM 979 CB SER A 62 7.452 -8.979 -13.651 1.00 0.00 C ATOM 980 OG SER A 62 7.802 -10.092 -12.875 1.00 0.00 O ATOM 0 H SER A 62 6.696 -8.279 -11.418 1.00 0.00 H new ATOM 0 HA SER A 62 5.746 -7.738 -14.049 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.563 -9.219 -14.708 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.133 -8.155 -13.438 1.00 0.00 H new ATOM 0 HG SER A 62 8.726 -10.352 -13.074 1.00 0.00 H new ATOM 986 N ARG A 63 4.431 -10.217 -12.573 1.00 0.00 N ATOM 987 CA ARG A 63 3.470 -11.299 -12.667 1.00 0.00 C ATOM 988 C ARG A 63 2.030 -10.815 -12.490 1.00 0.00 C ATOM 989 O ARG A 63 1.133 -11.653 -12.409 1.00 0.00 O ATOM 990 CB ARG A 63 3.806 -12.364 -11.632 1.00 0.00 C ATOM 991 CG ARG A 63 5.104 -13.107 -11.924 1.00 0.00 C ATOM 992 CD ARG A 63 5.359 -14.238 -10.992 1.00 0.00 C ATOM 993 NE ARG A 63 5.671 -13.788 -9.644 1.00 0.00 N ATOM 994 CZ ARG A 63 6.905 -13.469 -9.211 1.00 0.00 C ATOM 995 NH1 ARG A 63 7.946 -13.547 -10.012 1.00 0.00 N ATOM 996 NH2 ARG A 63 7.043 -13.078 -7.959 1.00 0.00 N ATOM 0 H ARG A 63 4.562 -9.869 -11.623 1.00 0.00 H new ATOM 0 HA ARG A 63 3.538 -11.722 -13.669 1.00 0.00 H new ATOM 0 HB2 ARG A 63 3.878 -11.896 -10.650 1.00 0.00 H new ATOM 0 HB3 ARG A 63 2.988 -13.083 -11.583 1.00 0.00 H new ATOM 0 HG2 ARG A 63 5.075 -13.487 -12.945 1.00 0.00 H new ATOM 0 HG3 ARG A 63 5.936 -12.405 -11.869 1.00 0.00 H new ATOM 0 HD2 ARG A 63 4.482 -14.885 -10.962 1.00 0.00 H new ATOM 0 HD3 ARG A 63 6.186 -14.839 -11.372 1.00 0.00 H new ATOM 0 HE ARG A 63 4.900 -13.709 -8.980 1.00 0.00 H new ATOM 0 HH11 ARG A 63 7.825 -13.853 -10.977 1.00 0.00 H new ATOM 0 HH12 ARG A 63 8.874 -13.301 -9.667 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.228 -13.024 -7.349 1.00 0.00 H new ATOM 0 HH22 ARG A 63 7.965 -12.829 -7.601 1.00 0.00 H new ATOM 1010 N TYR A 64 1.821 -9.493 -12.443 1.00 0.00 N ATOM 1011 CA TYR A 64 0.509 -8.867 -12.285 1.00 0.00 C ATOM 1012 C TYR A 64 -0.549 -9.358 -13.281 1.00 0.00 C ATOM 1013 O TYR A 64 -0.280 -9.422 -14.483 1.00 0.00 O ATOM 1014 CB TYR A 64 0.651 -7.351 -12.451 1.00 0.00 C ATOM 1015 CG TYR A 64 -0.654 -6.604 -12.313 1.00 0.00 C ATOM 1016 CD1 TYR A 64 -1.138 -6.254 -11.061 1.00 0.00 C ATOM 1017 CD2 TYR A 64 -1.380 -6.295 -13.451 1.00 0.00 C ATOM 1018 CE1 TYR A 64 -2.350 -5.600 -10.952 1.00 0.00 C ATOM 1019 CE2 TYR A 64 -2.591 -5.642 -13.342 1.00 0.00 C ATOM 1020 CZ TYR A 64 -3.075 -5.299 -12.100 1.00 0.00 C ATOM 1021 OH TYR A 64 -4.288 -4.658 -11.996 1.00 0.00 O ATOM 0 H TYR A 64 2.580 -8.816 -12.516 1.00 0.00 H new ATOM 0 HA TYR A 64 0.164 -9.145 -11.289 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.355 -6.977 -11.708 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.079 -7.140 -13.431 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -0.569 -6.492 -10.174 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -0.998 -6.565 -14.425 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -2.732 -5.324 -9.980 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -3.158 -5.401 -14.229 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.664 -4.521 -12.891 1.00 0.00 H new ATOM 1031 N PRO A 65 -1.767 -9.663 -12.817 1.00 0.00 N ATOM 1032 CA PRO A 65 -2.311 -9.614 -11.471 1.00 0.00 C ATOM 1033 C PRO A 65 -2.232 -10.904 -10.682 1.00 0.00 C ATOM 1034 O PRO A 65 -3.012 -11.111 -9.756 1.00 0.00 O ATOM 1035 CB PRO A 65 -3.755 -9.228 -11.784 1.00 0.00 C ATOM 1036 CG PRO A 65 -4.052 -9.922 -13.076 1.00 0.00 C ATOM 1037 CD PRO A 65 -2.770 -9.811 -13.871 1.00 0.00 C ATOM 0 HA PRO A 65 -1.757 -8.938 -10.819 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -4.433 -9.551 -10.994 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.866 -8.148 -11.878 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -4.328 -10.964 -12.912 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -4.884 -9.450 -13.598 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.592 -10.696 -14.482 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.782 -8.955 -14.546 1.00 0.00 H new ATOM 1045 N PHE A 66 -1.287 -11.771 -11.006 1.00 0.00 N ATOM 1046 CA PHE A 66 -1.218 -13.062 -10.348 1.00 0.00 C ATOM 1047 C PHE A 66 -0.163 -13.137 -9.250 1.00 0.00 C ATOM 1048 O PHE A 66 0.314 -14.222 -8.913 1.00 0.00 O ATOM 1049 CB PHE A 66 -0.995 -14.105 -11.430 1.00 0.00 C ATOM 1050 CG PHE A 66 -2.147 -14.062 -12.387 1.00 0.00 C ATOM 1051 CD1 PHE A 66 -3.386 -14.564 -12.030 1.00 0.00 C ATOM 1052 CD2 PHE A 66 -1.994 -13.494 -13.642 1.00 0.00 C ATOM 1053 CE1 PHE A 66 -4.453 -14.503 -12.904 1.00 0.00 C ATOM 1054 CE2 PHE A 66 -3.060 -13.436 -14.520 1.00 0.00 C ATOM 1055 CZ PHE A 66 -4.288 -13.937 -14.151 1.00 0.00 C ATOM 0 H PHE A 66 -0.568 -11.607 -11.710 1.00 0.00 H new ATOM 0 HA PHE A 66 -2.154 -13.245 -9.821 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -0.060 -13.910 -11.956 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -0.910 -15.097 -10.986 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -3.520 -15.009 -11.055 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -1.035 -13.094 -13.936 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -5.415 -14.898 -12.612 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -2.929 -12.997 -15.498 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.121 -13.887 -14.837 1.00 0.00 H new ATOM 1065 N ASP A 67 0.182 -11.978 -8.695 1.00 0.00 N ATOM 1066 CA ASP A 67 1.113 -11.849 -7.588 1.00 0.00 C ATOM 1067 C ASP A 67 1.033 -10.399 -7.123 1.00 0.00 C ATOM 1068 O ASP A 67 0.703 -9.504 -7.903 1.00 0.00 O ATOM 1069 CB ASP A 67 2.533 -12.261 -7.984 1.00 0.00 C ATOM 1070 CG ASP A 67 3.398 -12.630 -6.784 1.00 0.00 C ATOM 1071 OD1 ASP A 67 2.980 -12.417 -5.668 1.00 0.00 O ATOM 1072 OD2 ASP A 67 4.471 -13.146 -7.004 1.00 0.00 O ATOM 0 H ASP A 67 -0.190 -11.083 -9.014 1.00 0.00 H new ATOM 0 HA ASP A 67 0.847 -12.523 -6.774 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.483 -13.111 -8.665 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.005 -11.443 -8.529 1.00 0.00 H new ATOM 1077 N SER A 68 1.350 -10.186 -5.854 1.00 0.00 N ATOM 1078 CA SER A 68 1.241 -8.868 -5.241 1.00 0.00 C ATOM 1079 C SER A 68 2.415 -7.964 -5.607 1.00 0.00 C ATOM 1080 O SER A 68 3.496 -8.466 -5.913 1.00 0.00 O ATOM 1081 CB SER A 68 1.173 -9.039 -3.732 1.00 0.00 C ATOM 1082 OG SER A 68 2.384 -9.544 -3.234 1.00 0.00 O ATOM 0 H SER A 68 1.687 -10.914 -5.224 1.00 0.00 H new ATOM 0 HA SER A 68 0.337 -8.388 -5.617 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.953 -8.080 -3.262 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.358 -9.715 -3.474 1.00 0.00 H new ATOM 0 HG SER A 68 2.220 -10.013 -2.389 1.00 0.00 H new ATOM 1088 N PRO A 69 2.242 -6.638 -5.582 1.00 0.00 N ATOM 1089 CA PRO A 69 3.301 -5.686 -5.808 1.00 0.00 C ATOM 1090 C PRO A 69 4.120 -5.568 -4.532 1.00 0.00 C ATOM 1091 O PRO A 69 3.586 -5.776 -3.441 1.00 0.00 O ATOM 1092 CB PRO A 69 2.508 -4.426 -6.166 1.00 0.00 C ATOM 1093 CG PRO A 69 1.207 -4.587 -5.419 1.00 0.00 C ATOM 1094 CD PRO A 69 0.892 -6.075 -5.459 1.00 0.00 C ATOM 0 HA PRO A 69 4.027 -5.930 -6.583 1.00 0.00 H new ATOM 0 HB2 PRO A 69 3.035 -3.522 -5.859 1.00 0.00 H new ATOM 0 HB3 PRO A 69 2.344 -4.350 -7.241 1.00 0.00 H new ATOM 0 HG2 PRO A 69 1.299 -4.233 -4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 69 0.412 -4.006 -5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 69 0.383 -6.414 -4.557 1.00 0.00 H new ATOM 0 HD3 PRO A 69 0.255 -6.340 -6.303 1.00 0.00 H new ATOM 1102 N GLN A 70 5.397 -5.230 -4.641 1.00 0.00 N ATOM 1103 CA GLN A 70 6.184 -5.118 -3.416 1.00 0.00 C ATOM 1104 C GLN A 70 5.889 -3.767 -2.810 1.00 0.00 C ATOM 1105 O GLN A 70 6.060 -2.770 -3.497 1.00 0.00 O ATOM 1106 CB GLN A 70 7.683 -5.270 -3.661 1.00 0.00 C ATOM 1107 CG GLN A 70 8.520 -5.132 -2.401 1.00 0.00 C ATOM 1108 CD GLN A 70 8.302 -6.273 -1.427 1.00 0.00 C ATOM 1109 OE1 GLN A 70 8.455 -7.447 -1.776 1.00 0.00 O ATOM 1110 NE2 GLN A 70 7.940 -5.934 -0.195 1.00 0.00 N ATOM 0 H GLN A 70 5.891 -5.037 -5.512 1.00 0.00 H new ATOM 0 HA GLN A 70 5.905 -5.928 -2.742 1.00 0.00 H new ATOM 0 HB2 GLN A 70 7.873 -6.246 -4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.003 -4.520 -4.384 1.00 0.00 H new ATOM 0 HG2 GLN A 70 9.575 -5.088 -2.673 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.278 -4.189 -1.910 1.00 0.00 H new ATOM 0 HE21 GLN A 70 7.825 -4.951 0.050 1.00 0.00 H new ATOM 0 HE22 GLN A 70 7.777 -6.657 0.506 1.00 0.00 H new ATOM 1119 N VAL A 71 5.470 -3.683 -1.551 1.00 0.00 N ATOM 1120 CA VAL A 71 5.175 -2.350 -1.031 1.00 0.00 C ATOM 1121 C VAL A 71 5.796 -2.075 0.321 1.00 0.00 C ATOM 1122 O VAL A 71 5.871 -2.953 1.183 1.00 0.00 O ATOM 1123 CB VAL A 71 3.656 -2.128 -0.899 1.00 0.00 C ATOM 1124 CG1 VAL A 71 3.068 -3.103 0.099 1.00 0.00 C ATOM 1125 CG2 VAL A 71 3.364 -0.691 -0.475 1.00 0.00 C ATOM 0 H VAL A 71 5.333 -4.463 -0.908 1.00 0.00 H new ATOM 0 HA VAL A 71 5.611 -1.665 -1.759 1.00 0.00 H new ATOM 0 HB VAL A 71 3.193 -2.303 -1.870 1.00 0.00 H new ATOM 0 HG11 VAL A 71 1.994 -2.935 0.182 1.00 0.00 H new ATOM 0 HG12 VAL A 71 3.251 -4.123 -0.238 1.00 0.00 H new ATOM 0 HG13 VAL A 71 3.535 -2.954 1.072 1.00 0.00 H new ATOM 0 HG21 VAL A 71 2.287 -0.550 -0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 71 3.837 -0.492 0.487 1.00 0.00 H new ATOM 0 HG23 VAL A 71 3.760 -0.004 -1.223 1.00 0.00 H new ATOM 1135 N MET A 72 6.250 -0.839 0.480 1.00 0.00 N ATOM 1136 CA MET A 72 6.830 -0.409 1.734 1.00 0.00 C ATOM 1137 C MET A 72 6.697 1.087 1.960 1.00 0.00 C ATOM 1138 O MET A 72 6.456 1.859 1.038 1.00 0.00 O ATOM 1139 CB MET A 72 8.303 -0.790 1.718 1.00 0.00 C ATOM 1140 CG MET A 72 9.078 -0.044 0.640 1.00 0.00 C ATOM 1141 SD MET A 72 10.732 -0.704 0.376 1.00 0.00 S ATOM 1142 CE MET A 72 10.295 -2.207 -0.495 1.00 0.00 C ATOM 0 H MET A 72 6.226 -0.122 -0.245 1.00 0.00 H new ATOM 0 HA MET A 72 6.294 -0.898 2.548 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.742 -0.577 2.692 1.00 0.00 H new ATOM 0 HB3 MET A 72 8.397 -1.863 1.554 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.522 -0.089 -0.296 1.00 0.00 H new ATOM 0 HG3 MET A 72 9.153 1.008 0.916 1.00 0.00 H new ATOM 0 HE1 MET A 72 10.638 -3.071 0.075 1.00 0.00 H new ATOM 0 HE2 MET A 72 9.213 -2.257 -0.613 1.00 0.00 H new ATOM 0 HE3 MET A 72 10.768 -2.209 -1.477 1.00 0.00 H new ATOM 1152 N PHE A 73 6.849 1.505 3.204 1.00 0.00 N ATOM 1153 CA PHE A 73 6.854 2.927 3.503 1.00 0.00 C ATOM 1154 C PHE A 73 8.234 3.453 3.165 1.00 0.00 C ATOM 1155 O PHE A 73 9.232 2.749 3.329 1.00 0.00 O ATOM 1156 CB PHE A 73 6.467 3.268 4.945 1.00 0.00 C ATOM 1157 CG PHE A 73 5.001 3.154 5.258 1.00 0.00 C ATOM 1158 CD1 PHE A 73 4.152 4.230 5.022 1.00 0.00 C ATOM 1159 CD2 PHE A 73 4.462 2.000 5.792 1.00 0.00 C ATOM 1160 CE1 PHE A 73 2.803 4.146 5.313 1.00 0.00 C ATOM 1161 CE2 PHE A 73 3.111 1.922 6.078 1.00 0.00 C ATOM 1162 CZ PHE A 73 2.283 2.990 5.843 1.00 0.00 C ATOM 0 H PHE A 73 6.969 0.893 4.011 1.00 0.00 H new ATOM 0 HA PHE A 73 6.084 3.408 2.900 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.018 2.610 5.617 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.790 4.287 5.160 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.552 5.143 4.606 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.101 1.151 5.988 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.157 4.990 5.123 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.704 1.011 6.491 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.230 2.923 6.073 1.00 0.00 H new ATOM 1172 N THR A 74 8.286 4.688 2.687 1.00 0.00 N ATOM 1173 CA THR A 74 9.554 5.296 2.312 1.00 0.00 C ATOM 1174 C THR A 74 9.613 6.775 2.658 1.00 0.00 C ATOM 1175 O THR A 74 8.602 7.475 2.673 1.00 0.00 O ATOM 1176 CB THR A 74 9.797 5.123 0.801 1.00 0.00 C ATOM 1177 OG1 THR A 74 11.096 5.625 0.454 1.00 0.00 O ATOM 1178 CG2 THR A 74 8.735 5.884 0.021 1.00 0.00 C ATOM 0 H THR A 74 7.470 5.285 2.550 1.00 0.00 H new ATOM 0 HA THR A 74 10.330 4.786 2.883 1.00 0.00 H new ATOM 0 HB THR A 74 9.743 4.063 0.551 1.00 0.00 H new ATOM 0 HG1 THR A 74 11.245 5.510 -0.508 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.910 5.760 -1.048 1.00 0.00 H new ATOM 0 HG22 THR A 74 7.749 5.496 0.275 1.00 0.00 H new ATOM 0 HG23 THR A 74 8.785 6.943 0.276 1.00 0.00 H new ATOM 1186 N GLY A 75 10.824 7.241 2.936 1.00 0.00 N ATOM 1187 CA GLY A 75 11.047 8.632 3.305 1.00 0.00 C ATOM 1188 C GLY A 75 11.757 8.733 4.648 1.00 0.00 C ATOM 1189 O GLY A 75 12.150 7.724 5.235 1.00 0.00 O ATOM 0 H GLY A 75 11.670 6.672 2.912 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.643 9.125 2.537 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.093 9.157 3.354 1.00 0.00 H new ATOM 1193 N GLU A 76 11.920 9.967 5.120 1.00 0.00 N ATOM 1194 CA GLU A 76 12.587 10.282 6.383 1.00 0.00 C ATOM 1195 C GLU A 76 11.842 9.879 7.661 1.00 0.00 C ATOM 1196 O GLU A 76 12.419 9.941 8.747 1.00 0.00 O ATOM 1197 CB GLU A 76 12.858 11.787 6.443 1.00 0.00 C ATOM 1198 CG GLU A 76 11.608 12.654 6.541 1.00 0.00 C ATOM 1199 CD GLU A 76 10.993 12.955 5.203 1.00 0.00 C ATOM 1200 OE1 GLU A 76 11.297 12.264 4.260 1.00 0.00 O ATOM 1201 OE2 GLU A 76 10.217 13.878 5.123 1.00 0.00 O ATOM 0 H GLU A 76 11.585 10.794 4.625 1.00 0.00 H new ATOM 0 HA GLU A 76 13.496 9.681 6.372 1.00 0.00 H new ATOM 0 HB2 GLU A 76 13.496 11.994 7.302 1.00 0.00 H new ATOM 0 HB3 GLU A 76 13.417 12.078 5.554 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.872 12.150 7.167 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.861 13.591 7.037 1.00 0.00 H new ATOM 1208 N ASN A 77 10.579 9.479 7.551 1.00 0.00 N ATOM 1209 CA ASN A 77 9.810 9.102 8.727 1.00 0.00 C ATOM 1210 C ASN A 77 8.924 7.896 8.454 1.00 0.00 C ATOM 1211 O ASN A 77 7.867 8.014 7.833 1.00 0.00 O ATOM 1212 CB ASN A 77 8.985 10.282 9.206 1.00 0.00 C ATOM 1213 CG ASN A 77 8.251 10.008 10.491 1.00 0.00 C ATOM 1214 OD1 ASN A 77 8.233 8.877 10.989 1.00 0.00 O ATOM 1215 ND2 ASN A 77 7.643 11.028 11.040 1.00 0.00 N ATOM 0 H ASN A 77 10.072 9.409 6.668 1.00 0.00 H new ATOM 0 HA ASN A 77 10.509 8.817 9.513 1.00 0.00 H new ATOM 0 HB2 ASN A 77 9.640 11.142 9.345 1.00 0.00 H new ATOM 0 HB3 ASN A 77 8.265 10.551 8.434 1.00 0.00 H new ATOM 0 HD21 ASN A 77 7.129 10.906 11.913 1.00 0.00 H new ATOM 0 HD22 ASN A 77 7.683 11.945 10.596 1.00 0.00 H new ATOM 1222 N ILE A 78 9.369 6.738 8.928 1.00 0.00 N ATOM 1223 CA ILE A 78 8.625 5.499 8.761 1.00 0.00 C ATOM 1224 C ILE A 78 7.677 5.376 9.962 1.00 0.00 C ATOM 1225 O ILE A 78 8.153 5.462 11.095 1.00 0.00 O ATOM 1226 CB ILE A 78 9.566 4.290 8.658 1.00 0.00 C ATOM 1227 CG1 ILE A 78 10.552 4.522 7.510 1.00 0.00 C ATOM 1228 CG2 ILE A 78 8.765 3.025 8.415 1.00 0.00 C ATOM 1229 CD1 ILE A 78 9.881 4.725 6.174 1.00 0.00 C ATOM 0 H ILE A 78 10.248 6.633 9.434 1.00 0.00 H new ATOM 0 HA ILE A 78 8.057 5.517 7.831 1.00 0.00 H new ATOM 0 HB ILE A 78 10.116 4.174 9.592 1.00 0.00 H new ATOM 0 HG12 ILE A 78 11.163 5.395 7.737 1.00 0.00 H new ATOM 0 HG13 ILE A 78 11.227 3.669 7.443 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.442 2.174 8.344 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.072 2.869 9.242 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.205 3.122 7.485 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.639 4.884 5.407 1.00 0.00 H new ATOM 0 HD12 ILE A 78 9.292 3.843 5.925 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.227 5.596 6.224 1.00 0.00 H new ATOM 1241 N PRO A 79 6.363 5.197 9.761 1.00 0.00 N ATOM 1242 CA PRO A 79 5.363 5.138 10.815 1.00 0.00 C ATOM 1243 C PRO A 79 5.540 4.124 11.934 1.00 0.00 C ATOM 1244 O PRO A 79 6.001 3.002 11.732 1.00 0.00 O ATOM 1245 CB PRO A 79 4.114 4.770 10.001 1.00 0.00 C ATOM 1246 CG PRO A 79 4.386 5.298 8.631 1.00 0.00 C ATOM 1247 CD PRO A 79 5.855 5.102 8.386 1.00 0.00 C ATOM 0 HA PRO A 79 5.373 6.073 11.375 1.00 0.00 H new ATOM 0 HB2 PRO A 79 3.955 3.692 9.986 1.00 0.00 H new ATOM 0 HB3 PRO A 79 3.217 5.219 10.428 1.00 0.00 H new ATOM 0 HG2 PRO A 79 3.794 4.768 7.885 1.00 0.00 H new ATOM 0 HG3 PRO A 79 4.118 6.352 8.560 1.00 0.00 H new ATOM 0 HD2 PRO A 79 6.075 4.138 7.927 1.00 0.00 H new ATOM 0 HD3 PRO A 79 6.274 5.869 7.734 1.00 0.00 H new ATOM 1255 N VAL A 80 5.145 4.552 13.129 1.00 0.00 N ATOM 1256 CA VAL A 80 5.150 3.685 14.295 1.00 0.00 C ATOM 1257 C VAL A 80 3.762 3.077 14.348 1.00 0.00 C ATOM 1258 O VAL A 80 2.773 3.798 14.505 1.00 0.00 O ATOM 1259 CB VAL A 80 5.473 4.446 15.591 1.00 0.00 C ATOM 1260 CG1 VAL A 80 5.415 3.487 16.771 1.00 0.00 C ATOM 1261 CG2 VAL A 80 6.853 5.073 15.474 1.00 0.00 C ATOM 0 H VAL A 80 4.816 5.500 13.312 1.00 0.00 H new ATOM 0 HA VAL A 80 5.928 2.926 14.212 1.00 0.00 H new ATOM 0 HB VAL A 80 4.741 5.237 15.751 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.644 4.027 17.690 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.416 3.057 16.842 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.144 2.689 16.628 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.086 5.614 16.391 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.596 4.291 15.315 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.868 5.764 14.631 1.00 0.00 H new ATOM 1271 N HIS A 81 3.714 1.760 14.212 1.00 0.00 N ATOM 1272 CA HIS A 81 2.468 1.016 14.155 1.00 0.00 C ATOM 1273 C HIS A 81 2.758 -0.472 14.318 1.00 0.00 C ATOM 1274 O HIS A 81 3.778 -0.927 13.815 1.00 0.00 O ATOM 1275 CB HIS A 81 1.802 1.261 12.798 1.00 0.00 C ATOM 1276 CG HIS A 81 0.423 0.724 12.629 1.00 0.00 C ATOM 1277 ND1 HIS A 81 0.163 -0.617 12.444 1.00 0.00 N ATOM 1278 CD2 HIS A 81 -0.772 1.350 12.594 1.00 0.00 C ATOM 1279 CE1 HIS A 81 -1.138 -0.790 12.312 1.00 0.00 C ATOM 1280 NE2 HIS A 81 -1.723 0.388 12.394 1.00 0.00 N ATOM 0 H HIS A 81 4.546 1.175 14.138 1.00 0.00 H new ATOM 0 HA HIS A 81 1.805 1.344 14.955 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.774 2.336 12.621 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.435 0.827 12.024 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -0.945 2.410 12.703 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.638 -1.735 12.162 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -2.726 0.556 12.320 1.00 0.00 H new ATOM 1288 N PRO A 82 1.927 -1.275 14.983 1.00 0.00 N ATOM 1289 CA PRO A 82 2.135 -2.710 15.088 1.00 0.00 C ATOM 1290 C PRO A 82 2.378 -3.448 13.761 1.00 0.00 C ATOM 1291 O PRO A 82 3.070 -4.467 13.748 1.00 0.00 O ATOM 1292 CB PRO A 82 0.825 -3.117 15.769 1.00 0.00 C ATOM 1293 CG PRO A 82 0.460 -1.918 16.605 1.00 0.00 C ATOM 1294 CD PRO A 82 0.860 -0.701 15.808 1.00 0.00 C ATOM 0 HA PRO A 82 3.049 -2.972 15.621 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.049 -3.345 15.038 1.00 0.00 H new ATOM 0 HB3 PRO A 82 0.955 -4.008 16.384 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.608 -1.906 16.821 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.978 -1.941 17.564 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.038 -0.306 15.211 1.00 0.00 H new ATOM 0 HD3 PRO A 82 1.215 0.113 16.440 1.00 0.00 H new ATOM 1302 N HIS A 83 1.813 -2.959 12.657 1.00 0.00 N ATOM 1303 CA HIS A 83 2.003 -3.575 11.350 1.00 0.00 C ATOM 1304 C HIS A 83 2.949 -2.787 10.434 1.00 0.00 C ATOM 1305 O HIS A 83 3.023 -3.053 9.232 1.00 0.00 O ATOM 1306 CB HIS A 83 0.631 -3.756 10.703 1.00 0.00 C ATOM 1307 CG HIS A 83 -0.195 -4.705 11.511 1.00 0.00 C ATOM 1308 ND1 HIS A 83 -0.890 -4.316 12.638 1.00 0.00 N ATOM 1309 CD2 HIS A 83 -0.423 -6.029 11.367 1.00 0.00 C ATOM 1310 CE1 HIS A 83 -1.498 -5.365 13.157 1.00 0.00 C ATOM 1311 NE2 HIS A 83 -1.235 -6.416 12.402 1.00 0.00 N ATOM 0 H HIS A 83 1.216 -2.132 12.646 1.00 0.00 H new ATOM 0 HA HIS A 83 2.489 -4.540 11.496 1.00 0.00 H new ATOM 0 HB2 HIS A 83 0.125 -2.793 10.629 1.00 0.00 H new ATOM 0 HB3 HIS A 83 0.746 -4.135 9.687 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -0.038 -6.664 10.583 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -2.108 -5.365 14.048 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -1.580 -7.362 12.563 1.00 0.00 H new ATOM 1319 N VAL A 84 3.683 -1.813 10.984 1.00 0.00 N ATOM 1320 CA VAL A 84 4.652 -1.065 10.187 1.00 0.00 C ATOM 1321 C VAL A 84 6.017 -1.162 10.850 1.00 0.00 C ATOM 1322 O VAL A 84 6.206 -0.761 11.998 1.00 0.00 O ATOM 1323 CB VAL A 84 4.295 0.425 10.014 1.00 0.00 C ATOM 1324 CG1 VAL A 84 5.386 1.096 9.185 1.00 0.00 C ATOM 1325 CG2 VAL A 84 2.943 0.557 9.341 1.00 0.00 C ATOM 0 H VAL A 84 3.624 -1.530 11.962 1.00 0.00 H new ATOM 0 HA VAL A 84 4.649 -1.512 9.193 1.00 0.00 H new ATOM 0 HB VAL A 84 4.234 0.913 10.987 1.00 0.00 H new ATOM 0 HG11 VAL A 84 5.147 2.151 9.054 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.343 1.002 9.698 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.449 0.615 8.209 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.697 1.612 9.222 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.976 0.079 8.362 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.182 0.074 9.955 1.00 0.00 H new ATOM 1335 N TYR A 85 6.987 -1.662 10.109 1.00 0.00 N ATOM 1336 CA TYR A 85 8.318 -1.827 10.657 1.00 0.00 C ATOM 1337 C TYR A 85 9.162 -0.649 10.232 1.00 0.00 C ATOM 1338 O TYR A 85 8.870 -0.033 9.210 1.00 0.00 O ATOM 1339 CB TYR A 85 8.894 -3.147 10.185 1.00 0.00 C ATOM 1340 CG TYR A 85 8.088 -4.304 10.735 1.00 0.00 C ATOM 1341 CD1 TYR A 85 6.969 -4.756 10.049 1.00 0.00 C ATOM 1342 CD2 TYR A 85 8.455 -4.912 11.924 1.00 0.00 C ATOM 1343 CE1 TYR A 85 6.219 -5.805 10.538 1.00 0.00 C ATOM 1344 CE2 TYR A 85 7.707 -5.965 12.417 1.00 0.00 C ATOM 1345 CZ TYR A 85 6.595 -6.411 11.730 1.00 0.00 C ATOM 1346 OH TYR A 85 5.857 -7.461 12.226 1.00 0.00 O ATOM 0 H TYR A 85 6.881 -1.957 9.139 1.00 0.00 H new ATOM 0 HA TYR A 85 8.295 -1.853 11.746 1.00 0.00 H new ATOM 0 HB2 TYR A 85 8.894 -3.182 9.096 1.00 0.00 H new ATOM 0 HB3 TYR A 85 9.932 -3.234 10.507 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.683 -4.281 9.122 1.00 0.00 H new ATOM 0 HD2 TYR A 85 9.323 -4.565 12.465 1.00 0.00 H new ATOM 0 HE1 TYR A 85 5.349 -6.151 10.000 1.00 0.00 H new ATOM 0 HE2 TYR A 85 7.993 -6.441 13.343 1.00 0.00 H new ATOM 0 HH TYR A 85 6.254 -7.772 13.066 1.00 0.00 H new ATOM 1356 N SER A 86 10.210 -0.352 11.002 1.00 0.00 N ATOM 1357 CA SER A 86 11.081 0.804 10.777 1.00 0.00 C ATOM 1358 C SER A 86 11.852 0.776 9.462 1.00 0.00 C ATOM 1359 O SER A 86 12.371 1.803 9.024 1.00 0.00 O ATOM 1360 CB SER A 86 12.078 0.913 11.911 1.00 0.00 C ATOM 1361 OG SER A 86 12.977 -0.162 11.891 1.00 0.00 O ATOM 0 H SER A 86 10.481 -0.914 11.809 1.00 0.00 H new ATOM 0 HA SER A 86 10.414 1.665 10.730 1.00 0.00 H new ATOM 0 HB2 SER A 86 12.626 1.852 11.830 1.00 0.00 H new ATOM 0 HB3 SER A 86 11.550 0.933 12.864 1.00 0.00 H new ATOM 0 HG SER A 86 13.613 -0.070 12.631 1.00 0.00 H new ATOM 1367 N ASN A 87 11.939 -0.394 8.836 1.00 0.00 N ATOM 1368 CA ASN A 87 12.560 -0.526 7.530 1.00 0.00 C ATOM 1369 C ASN A 87 11.545 -0.361 6.395 1.00 0.00 C ATOM 1370 O ASN A 87 11.882 -0.588 5.232 1.00 0.00 O ATOM 1371 CB ASN A 87 13.250 -1.870 7.436 1.00 0.00 C ATOM 1372 CG ASN A 87 12.281 -3.019 7.495 1.00 0.00 C ATOM 1373 OD1 ASN A 87 11.056 -2.845 7.519 1.00 0.00 O ATOM 1374 ND2 ASN A 87 12.818 -4.213 7.520 1.00 0.00 N ATOM 0 H ASN A 87 11.583 -1.269 9.220 1.00 0.00 H new ATOM 0 HA ASN A 87 13.294 0.272 7.419 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.814 -1.921 6.504 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.970 -1.963 8.249 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.222 -5.040 7.561 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.833 -4.316 7.499 1.00 0.00 H new ATOM 1381 N GLY A 88 10.310 0.024 6.724 1.00 0.00 N ATOM 1382 CA GLY A 88 9.258 0.249 5.748 1.00 0.00 C ATOM 1383 C GLY A 88 8.318 -0.940 5.552 1.00 0.00 C ATOM 1384 O GLY A 88 7.307 -0.795 4.866 1.00 0.00 O ATOM 0 H GLY A 88 10.016 0.188 7.687 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.671 1.114 6.056 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.714 0.498 4.790 1.00 0.00 H new ATOM 1388 N HIS A 89 8.609 -2.102 6.137 1.00 0.00 N ATOM 1389 CA HIS A 89 7.749 -3.265 5.911 1.00 0.00 C ATOM 1390 C HIS A 89 6.315 -3.094 6.404 1.00 0.00 C ATOM 1391 O HIS A 89 6.039 -2.601 7.497 1.00 0.00 O ATOM 1392 CB HIS A 89 8.365 -4.513 6.551 1.00 0.00 C ATOM 1393 CG HIS A 89 7.637 -5.789 6.269 1.00 0.00 C ATOM 1394 ND1 HIS A 89 6.473 -6.140 6.918 1.00 0.00 N ATOM 1395 CD2 HIS A 89 7.906 -6.798 5.408 1.00 0.00 C ATOM 1396 CE1 HIS A 89 6.059 -7.312 6.471 1.00 0.00 C ATOM 1397 NE2 HIS A 89 6.911 -7.732 5.553 1.00 0.00 N ATOM 0 H HIS A 89 9.407 -2.263 6.752 1.00 0.00 H new ATOM 0 HA HIS A 89 7.689 -3.376 4.828 1.00 0.00 H new ATOM 0 HB2 HIS A 89 9.393 -4.613 6.202 1.00 0.00 H new ATOM 0 HB3 HIS A 89 8.408 -4.367 7.630 1.00 0.00 H new ATOM 0 HD1 HIS A 89 6.004 -5.582 7.632 1.00 0.00 H new ATOM 0 HD2 HIS A 89 8.747 -6.857 4.733 1.00 0.00 H new ATOM 0 HE1 HIS A 89 5.175 -7.837 6.800 1.00 0.00 H new ATOM 1405 N ILE A 90 5.391 -3.521 5.547 1.00 0.00 N ATOM 1406 CA ILE A 90 3.954 -3.452 5.785 1.00 0.00 C ATOM 1407 C ILE A 90 3.341 -4.831 5.940 1.00 0.00 C ATOM 1408 O ILE A 90 3.419 -5.652 5.024 1.00 0.00 O ATOM 1409 CB ILE A 90 3.260 -2.725 4.629 1.00 0.00 C ATOM 1410 CG1 ILE A 90 3.829 -1.318 4.548 1.00 0.00 C ATOM 1411 CG2 ILE A 90 1.752 -2.717 4.808 1.00 0.00 C ATOM 1412 CD1 ILE A 90 3.384 -0.566 3.334 1.00 0.00 C ATOM 0 H ILE A 90 5.628 -3.935 4.645 1.00 0.00 H new ATOM 0 HA ILE A 90 3.808 -2.903 6.715 1.00 0.00 H new ATOM 0 HB ILE A 90 3.450 -3.247 3.691 1.00 0.00 H new ATOM 0 HG12 ILE A 90 3.534 -0.763 5.438 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.918 -1.373 4.553 1.00 0.00 H new ATOM 0 HG21 ILE A 90 1.289 -2.194 3.971 1.00 0.00 H new ATOM 0 HG22 ILE A 90 1.384 -3.743 4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 90 1.499 -2.209 5.739 1.00 0.00 H new ATOM 0 HD11 ILE A 90 3.827 0.430 3.340 1.00 0.00 H new ATOM 0 HD12 ILE A 90 3.703 -1.100 2.438 1.00 0.00 H new ATOM 0 HD13 ILE A 90 2.297 -0.479 3.338 1.00 0.00 H new ATOM 1424 N CYS A 91 2.725 -5.091 7.086 1.00 0.00 N ATOM 1425 CA CYS A 91 2.140 -6.405 7.289 1.00 0.00 C ATOM 1426 C CYS A 91 0.639 -6.482 7.028 1.00 0.00 C ATOM 1427 O CYS A 91 -0.173 -6.197 7.909 1.00 0.00 O ATOM 1428 CB CYS A 91 2.413 -6.862 8.719 1.00 0.00 C ATOM 1429 SG CYS A 91 1.793 -8.520 9.083 1.00 0.00 S ATOM 0 H CYS A 91 2.620 -4.436 7.861 1.00 0.00 H new ATOM 0 HA CYS A 91 2.612 -7.056 6.554 1.00 0.00 H new ATOM 0 HB2 CYS A 91 3.488 -6.838 8.900 1.00 0.00 H new ATOM 0 HB3 CYS A 91 1.957 -6.153 9.411 1.00 0.00 H new ATOM 0 HG CYS A 91 2.070 -8.826 10.316 1.00 0.00 H new ATOM 1435 N LEU A 92 0.287 -6.875 5.804 1.00 0.00 N ATOM 1436 CA LEU A 92 -1.098 -7.103 5.404 1.00 0.00 C ATOM 1437 C LEU A 92 -1.201 -8.471 4.747 1.00 0.00 C ATOM 1438 O LEU A 92 -0.329 -8.843 3.961 1.00 0.00 O ATOM 1439 CB LEU A 92 -1.596 -6.043 4.416 1.00 0.00 C ATOM 1440 CG LEU A 92 -1.666 -4.597 4.905 1.00 0.00 C ATOM 1441 CD1 LEU A 92 -1.971 -3.689 3.728 1.00 0.00 C ATOM 1442 CD2 LEU A 92 -2.761 -4.483 5.949 1.00 0.00 C ATOM 0 H LEU A 92 0.961 -7.045 5.058 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.718 -7.046 6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.949 -6.070 3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.593 -6.334 4.085 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.715 -4.301 5.347 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.022 -2.655 4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.184 -3.785 2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -2.926 -3.973 3.287 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.819 -3.454 6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.716 -4.769 5.508 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.536 -5.144 6.786 1.00 0.00 H new ATOM 1454 N SER A 93 -2.290 -9.195 5.007 1.00 0.00 N ATOM 1455 CA SER A 93 -2.423 -10.531 4.434 1.00 0.00 C ATOM 1456 C SER A 93 -2.561 -10.521 2.929 1.00 0.00 C ATOM 1457 O SER A 93 -2.097 -11.441 2.258 1.00 0.00 O ATOM 1458 CB SER A 93 -3.656 -11.233 4.938 1.00 0.00 C ATOM 1459 OG SER A 93 -4.787 -10.569 4.443 1.00 0.00 O ATOM 0 H SER A 93 -3.069 -8.891 5.591 1.00 0.00 H new ATOM 0 HA SER A 93 -1.507 -11.040 4.734 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.657 -12.274 4.614 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.668 -11.239 6.028 1.00 0.00 H new ATOM 0 HG SER A 93 -5.570 -11.152 4.525 1.00 0.00 H new ATOM 1465 N ILE A 94 -3.122 -9.438 2.386 1.00 0.00 N ATOM 1466 CA ILE A 94 -3.326 -9.271 0.950 1.00 0.00 C ATOM 1467 C ILE A 94 -2.044 -9.141 0.155 1.00 0.00 C ATOM 1468 O ILE A 94 -2.075 -9.192 -1.073 1.00 0.00 O ATOM 1469 CB ILE A 94 -4.175 -8.023 0.660 1.00 0.00 C ATOM 1470 CG1 ILE A 94 -3.421 -6.772 1.124 1.00 0.00 C ATOM 1471 CG2 ILE A 94 -5.527 -8.151 1.342 1.00 0.00 C ATOM 1472 CD1 ILE A 94 -4.056 -5.472 0.697 1.00 0.00 C ATOM 0 H ILE A 94 -3.450 -8.646 2.939 1.00 0.00 H new ATOM 0 HA ILE A 94 -3.832 -10.184 0.636 1.00 0.00 H new ATOM 0 HB ILE A 94 -4.351 -7.932 -0.412 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -3.349 -6.788 2.211 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -2.403 -6.811 0.736 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -6.125 -7.264 1.133 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -6.043 -9.034 0.964 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.384 -8.247 2.418 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -3.460 -4.637 1.066 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.104 -5.431 -0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -5.064 -5.407 1.107 1.00 0.00 H new ATOM 1484 N LEU A 95 -0.915 -8.970 0.834 1.00 0.00 N ATOM 1485 CA LEU A 95 0.353 -8.861 0.159 1.00 0.00 C ATOM 1486 C LEU A 95 0.992 -10.240 0.024 1.00 0.00 C ATOM 1487 O LEU A 95 1.942 -10.417 -0.744 1.00 0.00 O ATOM 1488 CB LEU A 95 1.226 -7.903 0.969 1.00 0.00 C ATOM 1489 CG LEU A 95 0.632 -6.493 1.095 1.00 0.00 C ATOM 1490 CD1 LEU A 95 1.506 -5.653 2.016 1.00 0.00 C ATOM 1491 CD2 LEU A 95 0.517 -5.881 -0.295 1.00 0.00 C ATOM 0 H LEU A 95 -0.862 -8.905 1.851 1.00 0.00 H new ATOM 0 HA LEU A 95 0.231 -8.470 -0.851 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.376 -8.316 1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.208 -7.835 0.501 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.365 -6.533 1.534 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.084 -4.652 2.105 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.549 -6.118 3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 95 2.512 -5.587 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.096 -4.879 -0.218 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.506 -5.825 -0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -0.133 -6.501 -0.913 1.00 0.00 H new ATOM 1503 N THR A 96 0.434 -11.230 0.733 1.00 0.00 N ATOM 1504 CA THR A 96 0.947 -12.591 0.752 1.00 0.00 C ATOM 1505 C THR A 96 -0.138 -13.636 0.519 1.00 0.00 C ATOM 1506 O THR A 96 -0.276 -14.188 -0.573 1.00 0.00 O ATOM 1507 CB THR A 96 1.598 -12.944 2.105 1.00 0.00 C ATOM 1508 OG1 THR A 96 0.639 -12.752 3.154 1.00 0.00 O ATOM 1509 CG2 THR A 96 2.816 -12.075 2.377 1.00 0.00 C ATOM 0 H THR A 96 -0.395 -11.099 1.313 1.00 0.00 H new ATOM 0 HA THR A 96 1.677 -12.615 -0.057 1.00 0.00 H new ATOM 0 HB THR A 96 1.921 -13.984 2.068 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.048 -12.977 4.016 1.00 0.00 H new ATOM 0 HG21 THR A 96 3.251 -12.349 3.338 1.00 0.00 H new ATOM 0 HG22 THR A 96 3.553 -12.225 1.589 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.517 -11.027 2.400 1.00 0.00 H new ATOM 1517 N GLU A 97 -0.906 -13.888 1.580 1.00 0.00 N ATOM 1518 CA GLU A 97 -1.906 -14.954 1.617 1.00 0.00 C ATOM 1519 C GLU A 97 -3.250 -14.674 0.954 1.00 0.00 C ATOM 1520 O GLU A 97 -3.851 -15.580 0.375 1.00 0.00 O ATOM 1521 CB GLU A 97 -2.176 -15.324 3.076 1.00 0.00 C ATOM 1522 CG GLU A 97 -1.003 -15.993 3.780 1.00 0.00 C ATOM 1523 CD GLU A 97 -1.286 -16.330 5.218 1.00 0.00 C ATOM 1524 OE1 GLU A 97 -2.310 -15.928 5.717 1.00 0.00 O ATOM 1525 OE2 GLU A 97 -0.476 -16.994 5.820 1.00 0.00 O ATOM 0 H GLU A 97 -0.850 -13.352 2.446 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.459 -15.755 1.027 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.446 -14.421 3.624 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.037 -15.991 3.116 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.740 -16.906 3.245 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -0.136 -15.334 3.732 1.00 0.00 H new ATOM 1532 N ASP A 98 -3.719 -13.436 1.032 1.00 0.00 N ATOM 1533 CA ASP A 98 -5.002 -13.062 0.460 1.00 0.00 C ATOM 1534 C ASP A 98 -4.887 -12.366 -0.893 1.00 0.00 C ATOM 1535 O ASP A 98 -5.884 -11.837 -1.386 1.00 0.00 O ATOM 1536 CB ASP A 98 -5.800 -12.208 1.455 1.00 0.00 C ATOM 1537 CG ASP A 98 -6.253 -13.012 2.677 1.00 0.00 C ATOM 1538 OD1 ASP A 98 -6.495 -14.185 2.513 1.00 0.00 O ATOM 1539 OD2 ASP A 98 -6.362 -12.469 3.754 1.00 0.00 O ATOM 0 H ASP A 98 -3.225 -12.670 1.490 1.00 0.00 H new ATOM 0 HA ASP A 98 -5.541 -13.990 0.269 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -5.188 -11.368 1.782 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -6.673 -11.790 0.954 1.00 0.00 H new ATOM 1544 N TRP A 99 -3.692 -12.338 -1.490 1.00 0.00 N ATOM 1545 CA TRP A 99 -3.588 -11.734 -2.812 1.00 0.00 C ATOM 1546 C TRP A 99 -4.441 -12.470 -3.833 1.00 0.00 C ATOM 1547 O TRP A 99 -4.365 -13.692 -3.981 1.00 0.00 O ATOM 1548 CB TRP A 99 -2.172 -11.676 -3.385 1.00 0.00 C ATOM 1549 CG TRP A 99 -2.260 -11.040 -4.750 1.00 0.00 C ATOM 1550 CD1 TRP A 99 -2.278 -11.728 -5.928 1.00 0.00 C ATOM 1551 CD2 TRP A 99 -2.378 -9.637 -5.111 1.00 0.00 C ATOM 1552 NE1 TRP A 99 -2.408 -10.861 -6.980 1.00 0.00 N ATOM 1553 CE2 TRP A 99 -2.467 -9.581 -6.504 1.00 0.00 C ATOM 1554 CE3 TRP A 99 -2.421 -8.442 -4.383 1.00 0.00 C ATOM 1555 CZ2 TRP A 99 -2.595 -8.383 -7.189 1.00 0.00 C ATOM 1556 CZ3 TRP A 99 -2.547 -7.240 -5.069 1.00 0.00 C ATOM 1557 CH2 TRP A 99 -2.631 -7.211 -6.437 1.00 0.00 C ATOM 0 H TRP A 99 -2.825 -12.708 -1.100 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.936 -10.714 -2.647 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -1.518 -11.096 -2.733 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -1.746 -12.677 -3.455 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -2.201 -12.801 -6.018 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -2.454 -11.128 -7.963 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -2.357 -8.454 -3.305 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -2.664 -8.359 -8.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -2.579 -6.313 -4.515 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -2.727 -6.261 -6.942 1.00 0.00 H new ATOM 1568 N SER A 100 -5.238 -11.689 -4.542 1.00 0.00 N ATOM 1569 CA SER A 100 -6.135 -12.135 -5.585 1.00 0.00 C ATOM 1570 C SER A 100 -6.034 -11.185 -6.762 1.00 0.00 C ATOM 1571 O SER A 100 -5.834 -9.995 -6.537 1.00 0.00 O ATOM 1572 CB SER A 100 -7.574 -12.149 -5.104 1.00 0.00 C ATOM 1573 OG SER A 100 -8.451 -12.461 -6.156 1.00 0.00 O ATOM 0 H SER A 100 -5.276 -10.680 -4.396 1.00 0.00 H new ATOM 0 HA SER A 100 -5.849 -13.147 -5.871 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.687 -12.879 -4.303 1.00 0.00 H new ATOM 0 HB3 SER A 100 -7.832 -11.176 -4.687 1.00 0.00 H new ATOM 0 HG SER A 100 -9.373 -12.466 -5.823 1.00 0.00 H new ATOM 1579 N PRO A 101 -6.149 -11.658 -8.010 1.00 0.00 N ATOM 1580 CA PRO A 101 -6.187 -10.841 -9.210 1.00 0.00 C ATOM 1581 C PRO A 101 -7.278 -9.771 -9.194 1.00 0.00 C ATOM 1582 O PRO A 101 -7.204 -8.797 -9.943 1.00 0.00 O ATOM 1583 CB PRO A 101 -6.408 -11.910 -10.288 1.00 0.00 C ATOM 1584 CG PRO A 101 -5.790 -13.153 -9.710 1.00 0.00 C ATOM 1585 CD PRO A 101 -6.035 -13.104 -8.223 1.00 0.00 C ATOM 0 HA PRO A 101 -5.290 -10.238 -9.355 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.469 -12.052 -10.496 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -5.934 -11.630 -11.229 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -6.236 -14.047 -10.147 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -4.722 -13.191 -9.926 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -6.942 -13.637 -7.936 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.215 -13.542 -7.654 1.00 0.00 H new ATOM 1593 N ALA A 102 -8.306 -9.964 -8.360 1.00 0.00 N ATOM 1594 CA ALA A 102 -9.373 -8.996 -8.158 1.00 0.00 C ATOM 1595 C ALA A 102 -8.869 -7.748 -7.419 1.00 0.00 C ATOM 1596 O ALA A 102 -9.531 -6.709 -7.449 1.00 0.00 O ATOM 1597 CB ALA A 102 -10.507 -9.637 -7.377 1.00 0.00 C ATOM 0 H ALA A 102 -8.415 -10.811 -7.802 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.733 -8.682 -9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -11.304 -8.908 -7.228 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.895 -10.490 -7.933 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.137 -9.973 -6.408 1.00 0.00 H new ATOM 1603 N LEU A 103 -7.720 -7.848 -6.749 1.00 0.00 N ATOM 1604 CA LEU A 103 -7.131 -6.745 -6.012 1.00 0.00 C ATOM 1605 C LEU A 103 -6.334 -5.838 -6.934 1.00 0.00 C ATOM 1606 O LEU A 103 -5.848 -6.244 -7.990 1.00 0.00 O ATOM 1607 CB LEU A 103 -6.215 -7.237 -4.889 1.00 0.00 C ATOM 1608 CG LEU A 103 -6.869 -8.090 -3.800 1.00 0.00 C ATOM 1609 CD1 LEU A 103 -5.798 -8.510 -2.809 1.00 0.00 C ATOM 1610 CD2 LEU A 103 -7.969 -7.292 -3.121 1.00 0.00 C ATOM 0 H LEU A 103 -7.172 -8.707 -6.706 1.00 0.00 H new ATOM 0 HA LEU A 103 -7.958 -6.187 -5.573 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -5.407 -7.816 -5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -5.760 -6.368 -4.414 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.322 -8.983 -4.230 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -6.247 -9.120 -2.025 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -5.032 -9.089 -3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -5.345 -7.623 -2.365 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.434 -7.900 -2.345 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -7.543 -6.395 -2.672 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -8.720 -7.007 -3.858 1.00 0.00 H new ATOM 1622 N SER A 104 -6.208 -4.602 -6.484 1.00 0.00 N ATOM 1623 CA SER A 104 -5.559 -3.490 -7.166 1.00 0.00 C ATOM 1624 C SER A 104 -4.835 -2.591 -6.217 1.00 0.00 C ATOM 1625 O SER A 104 -5.207 -2.548 -5.047 1.00 0.00 O ATOM 1626 CB SER A 104 -6.569 -2.643 -7.901 1.00 0.00 C ATOM 1627 OG SER A 104 -5.979 -1.447 -8.349 1.00 0.00 O ATOM 0 H SER A 104 -6.579 -4.328 -5.574 1.00 0.00 H new ATOM 0 HA SER A 104 -4.849 -3.940 -7.860 1.00 0.00 H new ATOM 0 HB2 SER A 104 -6.968 -3.198 -8.750 1.00 0.00 H new ATOM 0 HB3 SER A 104 -7.409 -2.417 -7.244 1.00 0.00 H new ATOM 0 HG SER A 104 -5.150 -1.651 -8.831 1.00 0.00 H new ATOM 1633 N VAL A 105 -3.813 -1.890 -6.704 1.00 0.00 N ATOM 1634 CA VAL A 105 -3.076 -0.925 -5.889 1.00 0.00 C ATOM 1635 C VAL A 105 -3.983 0.053 -5.155 1.00 0.00 C ATOM 1636 O VAL A 105 -3.634 0.525 -4.076 1.00 0.00 O ATOM 1637 CB VAL A 105 -2.090 -0.109 -6.742 1.00 0.00 C ATOM 1638 CG1 VAL A 105 -2.788 0.837 -7.715 1.00 0.00 C ATOM 1639 CG2 VAL A 105 -1.218 0.698 -5.796 1.00 0.00 C ATOM 0 H VAL A 105 -3.475 -1.973 -7.663 1.00 0.00 H new ATOM 0 HA VAL A 105 -2.540 -1.524 -5.153 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.504 -0.803 -7.345 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.041 1.385 -8.289 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.417 0.261 -8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -3.406 1.541 -7.158 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.506 1.289 -6.372 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.845 1.363 -5.202 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -0.677 0.022 -5.134 1.00 0.00 H new ATOM 1649 N GLN A 106 -5.153 0.361 -5.715 1.00 0.00 N ATOM 1650 CA GLN A 106 -6.050 1.276 -5.036 1.00 0.00 C ATOM 1651 C GLN A 106 -6.667 0.641 -3.785 1.00 0.00 C ATOM 1652 O GLN A 106 -6.969 1.334 -2.814 1.00 0.00 O ATOM 1653 CB GLN A 106 -7.127 1.673 -6.039 1.00 0.00 C ATOM 1654 CG GLN A 106 -8.069 0.546 -6.376 1.00 0.00 C ATOM 1655 CD GLN A 106 -8.941 0.884 -7.559 1.00 0.00 C ATOM 1656 OE1 GLN A 106 -9.960 1.575 -7.473 1.00 0.00 O ATOM 1657 NE2 GLN A 106 -8.504 0.371 -8.704 1.00 0.00 N ATOM 0 H GLN A 106 -5.488 0.000 -6.608 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.502 2.152 -4.690 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.700 2.508 -5.636 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.650 2.025 -6.954 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -7.496 -0.355 -6.592 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -8.696 0.325 -5.512 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -7.655 -0.194 -8.719 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -9.018 0.542 -9.568 1.00 0.00 H new ATOM 1666 N SER A 107 -6.767 -0.689 -3.771 1.00 0.00 N ATOM 1667 CA SER A 107 -7.334 -1.428 -2.659 1.00 0.00 C ATOM 1668 C SER A 107 -6.222 -1.750 -1.682 1.00 0.00 C ATOM 1669 O SER A 107 -6.482 -1.905 -0.491 1.00 0.00 O ATOM 1670 CB SER A 107 -7.982 -2.718 -3.142 1.00 0.00 C ATOM 1671 OG SER A 107 -7.011 -3.613 -3.612 1.00 0.00 O ATOM 0 H SER A 107 -6.453 -1.281 -4.540 1.00 0.00 H new ATOM 0 HA SER A 107 -8.102 -0.823 -2.177 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.543 -3.176 -2.328 1.00 0.00 H new ATOM 0 HB3 SER A 107 -8.696 -2.498 -3.936 1.00 0.00 H new ATOM 0 HG SER A 107 -6.245 -3.111 -3.960 1.00 0.00 H new ATOM 1677 N VAL A 108 -4.991 -1.842 -2.196 1.00 0.00 N ATOM 1678 CA VAL A 108 -3.832 -2.103 -1.356 1.00 0.00 C ATOM 1679 C VAL A 108 -3.522 -0.874 -0.536 1.00 0.00 C ATOM 1680 O VAL A 108 -3.353 -0.985 0.675 1.00 0.00 O ATOM 1681 CB VAL A 108 -2.582 -2.492 -2.170 1.00 0.00 C ATOM 1682 CG1 VAL A 108 -1.392 -2.577 -1.225 1.00 0.00 C ATOM 1683 CG2 VAL A 108 -2.801 -3.829 -2.865 1.00 0.00 C ATOM 0 H VAL A 108 -4.778 -1.739 -3.188 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.082 -2.948 -0.715 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.391 -1.739 -2.935 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.500 -2.852 -1.787 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -1.237 -1.609 -0.748 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.586 -3.331 -0.462 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.911 -4.092 -3.436 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.994 -4.600 -2.119 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.655 -3.754 -3.538 1.00 0.00 H new ATOM 1693 N CYS A 109 -3.454 0.282 -1.188 1.00 0.00 N ATOM 1694 CA CYS A 109 -3.184 1.521 -0.483 1.00 0.00 C ATOM 1695 C CYS A 109 -4.313 1.873 0.453 1.00 0.00 C ATOM 1696 O CYS A 109 -4.042 2.365 1.546 1.00 0.00 O ATOM 1697 CB CYS A 109 -2.997 2.677 -1.447 1.00 0.00 C ATOM 1698 SG CYS A 109 -1.480 2.594 -2.402 1.00 0.00 S ATOM 0 H CYS A 109 -3.582 0.383 -2.195 1.00 0.00 H new ATOM 0 HA CYS A 109 -2.267 1.361 0.083 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -3.844 2.706 -2.132 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -3.010 3.611 -0.885 1.00 0.00 H new ATOM 0 HG CYS A 109 -1.379 1.422 -2.956 1.00 0.00 H new ATOM 1704 N LEU A 110 -5.560 1.644 0.040 1.00 0.00 N ATOM 1705 CA LEU A 110 -6.666 1.926 0.934 1.00 0.00 C ATOM 1706 C LEU A 110 -6.603 0.971 2.126 1.00 0.00 C ATOM 1707 O LEU A 110 -6.941 1.384 3.234 1.00 0.00 O ATOM 1708 CB LEU A 110 -7.996 1.830 0.194 1.00 0.00 C ATOM 1709 CG LEU A 110 -9.218 2.270 1.006 1.00 0.00 C ATOM 1710 CD1 LEU A 110 -9.016 3.719 1.450 1.00 0.00 C ATOM 1711 CD2 LEU A 110 -10.460 2.155 0.135 1.00 0.00 C ATOM 0 H LEU A 110 -5.818 1.277 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 110 -6.587 2.947 1.307 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -7.938 2.439 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -8.143 0.799 -0.127 1.00 0.00 H new ATOM 0 HG LEU A 110 -9.341 1.637 1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -9.879 4.046 2.030 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.119 3.789 2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -8.906 4.356 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -11.335 2.466 0.706 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -10.351 2.795 -0.740 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.585 1.121 -0.185 1.00 0.00 H new ATOM 1723 N SER A 111 -6.230 -0.300 1.903 1.00 0.00 N ATOM 1724 CA SER A 111 -6.055 -1.249 2.999 1.00 0.00 C ATOM 1725 C SER A 111 -4.981 -0.761 3.967 1.00 0.00 C ATOM 1726 O SER A 111 -5.179 -0.887 5.175 1.00 0.00 O ATOM 1727 CB SER A 111 -5.681 -2.631 2.493 1.00 0.00 C ATOM 1728 OG SER A 111 -6.724 -3.202 1.752 1.00 0.00 O ATOM 0 H SER A 111 -6.046 -0.686 0.977 1.00 0.00 H new ATOM 0 HA SER A 111 -7.012 -1.318 3.517 1.00 0.00 H new ATOM 0 HB2 SER A 111 -4.787 -2.564 1.874 1.00 0.00 H new ATOM 0 HB3 SER A 111 -5.437 -3.276 3.337 1.00 0.00 H new ATOM 0 HG SER A 111 -6.733 -2.818 0.850 1.00 0.00 H new ATOM 1734 N ILE A 112 -3.879 -0.215 3.440 1.00 0.00 N ATOM 1735 CA ILE A 112 -2.799 0.364 4.237 1.00 0.00 C ATOM 1736 C ILE A 112 -3.344 1.532 5.056 1.00 0.00 C ATOM 1737 O ILE A 112 -2.975 1.687 6.219 1.00 0.00 O ATOM 1738 CB ILE A 112 -1.617 0.798 3.343 1.00 0.00 C ATOM 1739 CG1 ILE A 112 -0.951 -0.448 2.755 1.00 0.00 C ATOM 1740 CG2 ILE A 112 -0.608 1.585 4.158 1.00 0.00 C ATOM 1741 CD1 ILE A 112 0.023 -0.189 1.636 1.00 0.00 C ATOM 0 H ILE A 112 -3.713 -0.164 2.435 1.00 0.00 H new ATOM 0 HA ILE A 112 -2.415 -0.392 4.921 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.986 1.433 2.537 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -0.429 -0.973 3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -1.729 -1.118 2.390 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.221 1.886 3.518 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.087 2.472 4.572 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.232 0.963 4.970 1.00 0.00 H new ATOM 0 HD11 ILE A 112 0.439 -1.135 1.290 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.492 0.304 0.812 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.828 0.452 1.996 1.00 0.00 H new ATOM 1753 N ILE A 113 -4.186 2.366 4.447 1.00 0.00 N ATOM 1754 CA ILE A 113 -4.832 3.453 5.169 1.00 0.00 C ATOM 1755 C ILE A 113 -5.707 2.913 6.298 1.00 0.00 C ATOM 1756 O ILE A 113 -5.669 3.468 7.397 1.00 0.00 O ATOM 1757 CB ILE A 113 -5.692 4.335 4.239 1.00 0.00 C ATOM 1758 CG1 ILE A 113 -4.791 5.105 3.272 1.00 0.00 C ATOM 1759 CG2 ILE A 113 -6.537 5.288 5.073 1.00 0.00 C ATOM 1760 CD1 ILE A 113 -5.518 5.781 2.127 1.00 0.00 C ATOM 0 H ILE A 113 -4.434 2.308 3.459 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.034 4.067 5.586 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.360 3.704 3.653 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -4.243 5.862 3.833 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -4.053 4.417 2.859 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.143 5.909 4.413 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.189 4.715 5.732 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.885 5.924 5.672 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -4.798 6.301 1.495 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.043 5.031 1.536 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.236 6.498 2.525 1.00 0.00 H new ATOM 1772 N SER A 114 -6.505 1.867 6.033 1.00 0.00 N ATOM 1773 CA SER A 114 -7.354 1.326 7.090 1.00 0.00 C ATOM 1774 C SER A 114 -6.532 0.642 8.177 1.00 0.00 C ATOM 1775 O SER A 114 -6.989 0.593 9.316 1.00 0.00 O ATOM 1776 CB SER A 114 -8.353 0.313 6.558 1.00 0.00 C ATOM 1777 OG SER A 114 -7.736 -0.892 6.194 1.00 0.00 O ATOM 0 H SER A 114 -6.576 1.398 5.130 1.00 0.00 H new ATOM 0 HA SER A 114 -7.886 2.182 7.505 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.110 0.118 7.317 1.00 0.00 H new ATOM 0 HB3 SER A 114 -8.869 0.732 5.694 1.00 0.00 H new ATOM 0 HG SER A 114 -6.836 -0.708 5.852 1.00 0.00 H new ATOM 1783 N MET A 115 -5.354 0.120 7.826 1.00 0.00 N ATOM 1784 CA MET A 115 -4.392 -0.470 8.751 1.00 0.00 C ATOM 1785 C MET A 115 -3.949 0.591 9.728 1.00 0.00 C ATOM 1786 O MET A 115 -3.931 0.368 10.937 1.00 0.00 O ATOM 1787 CB MET A 115 -3.197 -1.043 7.998 1.00 0.00 C ATOM 1788 CG MET A 115 -2.119 -1.675 8.856 1.00 0.00 C ATOM 1789 SD MET A 115 -0.672 -2.116 7.880 1.00 0.00 S ATOM 1790 CE MET A 115 -0.085 -0.457 7.543 1.00 0.00 C ATOM 0 H MET A 115 -5.036 0.097 6.857 1.00 0.00 H new ATOM 0 HA MET A 115 -4.862 -1.292 9.291 1.00 0.00 H new ATOM 0 HB2 MET A 115 -3.560 -1.792 7.294 1.00 0.00 H new ATOM 0 HB3 MET A 115 -2.745 -0.244 7.410 1.00 0.00 H new ATOM 0 HG2 MET A 115 -1.829 -0.982 9.646 1.00 0.00 H new ATOM 0 HG3 MET A 115 -2.516 -2.566 9.343 1.00 0.00 H new ATOM 0 HE1 MET A 115 0.922 -0.505 7.129 1.00 0.00 H new ATOM 0 HE2 MET A 115 -0.750 0.026 6.827 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.070 0.119 8.469 1.00 0.00 H new ATOM 1800 N LEU A 116 -3.569 1.741 9.185 1.00 0.00 N ATOM 1801 CA LEU A 116 -3.178 2.876 9.993 1.00 0.00 C ATOM 1802 C LEU A 116 -4.354 3.333 10.864 1.00 0.00 C ATOM 1803 O LEU A 116 -4.159 3.652 12.036 1.00 0.00 O ATOM 1804 CB LEU A 116 -2.691 3.983 9.051 1.00 0.00 C ATOM 1805 CG LEU A 116 -1.363 3.683 8.332 1.00 0.00 C ATOM 1806 CD1 LEU A 116 -1.141 4.715 7.238 1.00 0.00 C ATOM 1807 CD2 LEU A 116 -0.223 3.731 9.342 1.00 0.00 C ATOM 0 H LEU A 116 -3.525 1.907 8.180 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.369 2.611 10.673 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -3.460 4.167 8.301 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -2.578 4.904 9.623 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.398 2.691 7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.202 4.506 6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.962 4.669 6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -1.100 5.711 7.680 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.720 3.519 8.837 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.178 4.722 9.793 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -0.394 2.986 10.119 1.00 0.00 H new ATOM 1819 N SER A 117 -5.583 3.344 10.334 1.00 0.00 N ATOM 1820 CA SER A 117 -6.717 3.742 11.170 1.00 0.00 C ATOM 1821 C SER A 117 -7.127 2.700 12.218 1.00 0.00 C ATOM 1822 O SER A 117 -7.724 3.058 13.234 1.00 0.00 O ATOM 1823 CB SER A 117 -7.938 4.036 10.319 1.00 0.00 C ATOM 1824 OG SER A 117 -8.462 2.872 9.747 1.00 0.00 O ATOM 0 H SER A 117 -5.811 3.093 9.372 1.00 0.00 H new ATOM 0 HA SER A 117 -6.368 4.630 11.696 1.00 0.00 H new ATOM 0 HB2 SER A 117 -8.701 4.516 10.931 1.00 0.00 H new ATOM 0 HB3 SER A 117 -7.672 4.741 9.531 1.00 0.00 H new ATOM 0 HG SER A 117 -7.764 2.186 9.704 1.00 0.00 H new ATOM 1830 N SER A 118 -6.822 1.423 11.984 1.00 0.00 N ATOM 1831 CA SER A 118 -7.127 0.364 12.941 1.00 0.00 C ATOM 1832 C SER A 118 -6.279 -0.871 12.672 1.00 0.00 C ATOM 1833 O SER A 118 -6.333 -1.460 11.591 1.00 0.00 O ATOM 1834 CB SER A 118 -8.589 -0.018 12.882 1.00 0.00 C ATOM 1835 OG SER A 118 -8.858 -1.059 13.782 1.00 0.00 O ATOM 0 H SER A 118 -6.361 1.098 11.134 1.00 0.00 H new ATOM 0 HA SER A 118 -6.898 0.750 13.934 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.208 0.847 13.121 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.850 -0.327 11.870 1.00 0.00 H new ATOM 0 HG SER A 118 -9.808 -1.295 13.735 1.00 0.00 H new ATOM 1841 N CYS A 119 -5.546 -1.292 13.696 1.00 0.00 N ATOM 1842 CA CYS A 119 -4.617 -2.406 13.575 1.00 0.00 C ATOM 1843 C CYS A 119 -5.300 -3.693 13.151 1.00 0.00 C ATOM 1844 O CYS A 119 -6.407 -4.013 13.588 1.00 0.00 O ATOM 1845 CB CYS A 119 -3.918 -2.640 14.914 1.00 0.00 C ATOM 1846 SG CYS A 119 -2.896 -1.248 15.440 1.00 0.00 S ATOM 0 H CYS A 119 -5.579 -0.874 14.626 1.00 0.00 H new ATOM 0 HA CYS A 119 -3.898 -2.137 12.801 1.00 0.00 H new ATOM 0 HB2 CYS A 119 -4.669 -2.839 15.678 1.00 0.00 H new ATOM 0 HB3 CYS A 119 -3.295 -3.531 14.840 1.00 0.00 H new ATOM 0 HG CYS A 119 -2.688 -1.322 16.721 1.00 0.00 H new ATOM 1852 N LYS A 120 -4.592 -4.457 12.329 1.00 0.00 N ATOM 1853 CA LYS A 120 -5.080 -5.710 11.766 1.00 0.00 C ATOM 1854 C LYS A 120 -4.754 -6.942 12.621 1.00 0.00 C ATOM 1855 O LYS A 120 -4.391 -7.992 12.090 1.00 0.00 O ATOM 1856 CB LYS A 120 -4.480 -5.864 10.368 1.00 0.00 C ATOM 1857 CG LYS A 120 -4.829 -4.713 9.428 1.00 0.00 C ATOM 1858 CD LYS A 120 -6.321 -4.623 9.134 1.00 0.00 C ATOM 1859 CE LYS A 120 -6.604 -3.490 8.157 1.00 0.00 C ATOM 1860 NZ LYS A 120 -8.048 -3.332 7.835 1.00 0.00 N ATOM 0 H LYS A 120 -3.646 -4.219 12.030 1.00 0.00 H new ATOM 0 HA LYS A 120 -6.168 -5.659 11.732 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.396 -5.938 10.452 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.831 -6.799 9.931 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -4.493 -3.775 9.869 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.286 -4.837 8.491 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -6.673 -5.567 8.718 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.871 -4.458 10.060 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -6.229 -2.557 8.577 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.052 -3.669 7.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -8.182 -2.484 7.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.381 -4.169 7.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.591 -3.232 8.716 1.00 0.00 H new ATOM 1874 N GLU A 121 -4.873 -6.808 13.942 1.00 0.00 N ATOM 1875 CA GLU A 121 -4.602 -7.874 14.898 1.00 0.00 C ATOM 1876 C GLU A 121 -5.469 -7.702 16.132 1.00 0.00 C ATOM 1877 O GLU A 121 -5.614 -6.588 16.636 1.00 0.00 O ATOM 1878 CB GLU A 121 -3.133 -7.897 15.311 1.00 0.00 C ATOM 1879 CG GLU A 121 -2.769 -9.026 16.266 1.00 0.00 C ATOM 1880 CD GLU A 121 -1.302 -9.065 16.578 1.00 0.00 C ATOM 1881 OE1 GLU A 121 -0.847 -8.253 17.347 1.00 0.00 O ATOM 1882 OE2 GLU A 121 -0.629 -9.911 16.037 1.00 0.00 O ATOM 0 H GLU A 121 -5.167 -5.936 14.383 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.836 -8.820 14.410 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -2.517 -7.981 14.416 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -2.885 -6.945 15.780 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -3.331 -8.909 17.193 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.070 -9.978 15.829 1.00 0.00 H new ATOM 1889 N LYS A 122 -6.049 -8.801 16.601 1.00 0.00 N ATOM 1890 CA LYS A 122 -6.896 -8.784 17.788 1.00 0.00 C ATOM 1891 C LYS A 122 -6.101 -8.492 19.059 1.00 0.00 C ATOM 1892 O LYS A 122 -6.351 -7.496 19.741 1.00 0.00 O ATOM 1893 CB LYS A 122 -7.626 -10.122 17.922 1.00 0.00 C ATOM 1894 CG LYS A 122 -8.571 -10.215 19.110 1.00 0.00 C ATOM 1895 CD LYS A 122 -9.295 -11.551 19.139 1.00 0.00 C ATOM 1896 CE LYS A 122 -10.210 -11.654 20.350 1.00 0.00 C ATOM 1897 NZ LYS A 122 -10.925 -12.959 20.392 1.00 0.00 N ATOM 0 H LYS A 122 -5.947 -9.721 16.174 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.620 -7.978 17.665 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -8.193 -10.304 17.009 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -6.885 -10.918 18.001 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.009 -10.084 20.035 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.299 -9.406 19.062 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -9.880 -11.671 18.227 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -8.567 -12.362 19.160 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.623 -11.531 21.260 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -10.937 -10.842 20.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.539 -12.992 21.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.504 -13.065 19.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.232 -13.733 20.439 1.00 0.00 H new ATOM 1911 N ARG A 123 -5.163 -9.378 19.391 1.00 0.00 N ATOM 1912 CA ARG A 123 -4.312 -9.214 20.567 1.00 0.00 C ATOM 1913 C ARG A 123 -2.897 -9.725 20.346 1.00 0.00 C ATOM 1914 O ARG A 123 -2.690 -10.701 19.624 1.00 0.00 O ATOM 1915 CB ARG A 123 -4.878 -9.938 21.789 1.00 0.00 C ATOM 1916 CG ARG A 123 -6.192 -9.416 22.348 1.00 0.00 C ATOM 1917 CD ARG A 123 -6.007 -8.089 22.987 1.00 0.00 C ATOM 1918 NE ARG A 123 -7.224 -7.618 23.625 1.00 0.00 N ATOM 1919 CZ ARG A 123 -8.207 -6.940 22.998 1.00 0.00 C ATOM 1920 NH1 ARG A 123 -8.121 -6.657 21.716 1.00 0.00 N ATOM 1921 NH2 ARG A 123 -9.270 -6.554 23.682 1.00 0.00 N ATOM 0 H ARG A 123 -4.973 -10.225 18.855 1.00 0.00 H new ATOM 0 HA ARG A 123 -4.286 -8.139 20.743 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -5.013 -10.988 21.529 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -4.132 -9.899 22.583 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -6.927 -9.339 21.547 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -6.588 -10.123 23.077 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -5.210 -8.151 23.728 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -5.688 -7.366 22.236 1.00 0.00 H new ATOM 0 HE ARG A 123 -7.344 -7.814 24.619 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -7.303 -6.951 21.183 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -8.872 -6.144 21.256 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -9.342 -6.769 24.676 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -10.018 -6.041 23.215 1.00 0.00 H new ATOM 1935 N ARG A 124 -1.944 -9.039 20.976 1.00 0.00 N ATOM 1936 CA ARG A 124 -0.527 -9.391 20.967 1.00 0.00 C ATOM 1937 C ARG A 124 -0.340 -10.866 21.339 1.00 0.00 C ATOM 1938 O ARG A 124 -0.735 -11.242 22.444 1.00 0.00 O ATOM 1939 CB ARG A 124 0.238 -8.531 21.959 1.00 0.00 C ATOM 1940 CG ARG A 124 1.748 -8.695 21.932 1.00 0.00 C ATOM 1941 CD ARG A 124 2.398 -7.864 22.979 1.00 0.00 C ATOM 1942 NE ARG A 124 2.189 -6.439 22.767 1.00 0.00 N ATOM 1943 CZ ARG A 124 2.937 -5.646 21.973 1.00 0.00 C ATOM 1944 NH1 ARG A 124 3.958 -6.138 21.309 1.00 0.00 N ATOM 1945 NH2 ARG A 124 2.641 -4.363 21.863 1.00 0.00 N ATOM 0 H ARG A 124 -2.143 -8.200 21.521 1.00 0.00 H new ATOM 0 HA ARG A 124 -0.142 -9.218 19.962 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -0.001 -7.485 21.767 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -0.118 -8.760 22.963 1.00 0.00 H new ATOM 0 HG2 ARG A 124 2.005 -9.743 22.084 1.00 0.00 H new ATOM 0 HG3 ARG A 124 2.130 -8.412 20.951 1.00 0.00 H new ATOM 0 HD2 ARG A 124 2.006 -8.144 23.957 1.00 0.00 H new ATOM 0 HD3 ARG A 124 3.468 -8.073 22.993 1.00 0.00 H new ATOM 0 HE ARG A 124 1.410 -6.003 23.261 1.00 0.00 H new ATOM 0 HH11 ARG A 124 4.191 -7.128 21.391 1.00 0.00 H new ATOM 0 HH12 ARG A 124 4.518 -5.530 20.711 1.00 0.00 H new ATOM 0 HH21 ARG A 124 1.850 -3.976 22.377 1.00 0.00 H new ATOM 0 HH22 ARG A 124 3.204 -3.759 21.264 1.00 0.00 H new ATOM 1959 N PRO A 125 0.221 -11.717 20.471 1.00 0.00 N ATOM 1960 CA PRO A 125 0.431 -13.120 20.753 1.00 0.00 C ATOM 1961 C PRO A 125 1.300 -13.373 21.989 1.00 0.00 C ATOM 1962 O PRO A 125 2.275 -12.657 22.217 1.00 0.00 O ATOM 1963 CB PRO A 125 1.126 -13.581 19.469 1.00 0.00 C ATOM 1964 CG PRO A 125 0.666 -12.606 18.417 1.00 0.00 C ATOM 1965 CD PRO A 125 0.543 -11.270 19.113 1.00 0.00 C ATOM 0 HA PRO A 125 -0.491 -13.650 20.992 1.00 0.00 H new ATOM 0 HB2 PRO A 125 2.210 -13.565 19.577 1.00 0.00 H new ATOM 0 HB3 PRO A 125 0.847 -14.603 19.212 1.00 0.00 H new ATOM 0 HG2 PRO A 125 1.380 -12.553 17.595 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.289 -12.913 17.991 1.00 0.00 H new ATOM 0 HD2 PRO A 125 1.467 -10.693 19.073 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -0.241 -10.647 18.683 1.00 0.00 H new ATOM 1973 N PRO A 126 0.977 -14.394 22.791 1.00 0.00 N ATOM 1974 CA PRO A 126 1.708 -14.794 23.975 1.00 0.00 C ATOM 1975 C PRO A 126 2.993 -15.557 23.673 1.00 0.00 C ATOM 1976 O PRO A 126 3.847 -15.720 24.545 1.00 0.00 O ATOM 1977 CB PRO A 126 0.676 -15.698 24.657 1.00 0.00 C ATOM 1978 CG PRO A 126 -0.130 -16.269 23.519 1.00 0.00 C ATOM 1979 CD PRO A 126 -0.226 -15.172 22.482 1.00 0.00 C ATOM 0 HA PRO A 126 2.057 -13.948 24.568 1.00 0.00 H new ATOM 0 HB2 PRO A 126 1.158 -16.485 25.237 1.00 0.00 H new ATOM 0 HB3 PRO A 126 0.047 -15.134 25.346 1.00 0.00 H new ATOM 0 HG2 PRO A 126 0.352 -17.155 23.106 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -1.120 -16.574 23.857 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -0.215 -15.563 21.465 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -1.137 -14.583 22.587 1.00 0.00 H new ATOM 1987 N ASP A 127 3.123 -16.024 22.435 1.00 0.00 N ATOM 1988 CA ASP A 127 4.266 -16.804 22.001 1.00 0.00 C ATOM 1989 C ASP A 127 5.156 -16.069 21.006 1.00 0.00 C ATOM 1990 O ASP A 127 5.603 -16.669 20.029 1.00 0.00 O ATOM 1991 CB ASP A 127 3.780 -18.128 21.408 1.00 0.00 C ATOM 1992 CG ASP A 127 2.876 -17.964 20.194 1.00 0.00 C ATOM 1993 OD1 ASP A 127 2.461 -16.862 19.925 1.00 0.00 O ATOM 1994 OD2 ASP A 127 2.611 -18.946 19.544 1.00 0.00 O ATOM 0 H ASP A 127 2.430 -15.868 21.703 1.00 0.00 H new ATOM 0 HA ASP A 127 4.884 -16.987 22.880 1.00 0.00 H new ATOM 0 HB2 ASP A 127 4.645 -18.728 21.126 1.00 0.00 H new ATOM 0 HB3 ASP A 127 3.243 -18.684 22.177 1.00 0.00 H new ATOM 1999 N ASN A 128 5.400 -14.783 21.249 1.00 0.00 N ATOM 2000 CA ASN A 128 6.252 -13.990 20.372 1.00 0.00 C ATOM 2001 C ASN A 128 7.718 -14.395 20.431 1.00 0.00 C ATOM 2002 O ASN A 128 8.424 -14.218 19.442 1.00 0.00 O ATOM 2003 CB ASN A 128 6.109 -12.518 20.686 1.00 0.00 C ATOM 2004 CG ASN A 128 4.823 -11.949 20.165 1.00 0.00 C ATOM 2005 OD1 ASN A 128 4.297 -12.412 19.146 1.00 0.00 O ATOM 2006 ND2 ASN A 128 4.308 -10.959 20.841 1.00 0.00 N ATOM 0 H ASN A 128 5.020 -14.271 22.045 1.00 0.00 H new ATOM 0 HA ASN A 128 5.912 -14.186 19.355 1.00 0.00 H new ATOM 0 HB2 ASN A 128 6.158 -12.372 21.765 1.00 0.00 H new ATOM 0 HB3 ASN A 128 6.947 -11.973 20.252 1.00 0.00 H new ATOM 0 HD21 ASN A 128 3.434 -10.532 20.534 1.00 0.00 H new ATOM 0 HD22 ASN A 128 4.780 -10.612 21.676 1.00 0.00 H new ATOM 2013 N SER A 129 8.178 -14.924 21.567 1.00 0.00 N ATOM 2014 CA SER A 129 9.560 -15.380 21.668 1.00 0.00 C ATOM 2015 C SER A 129 9.746 -16.579 20.752 1.00 0.00 C ATOM 2016 O SER A 129 10.763 -16.680 20.065 1.00 0.00 O ATOM 2017 CB SER A 129 9.910 -15.750 23.096 1.00 0.00 C ATOM 2018 OG SER A 129 9.885 -14.627 23.935 1.00 0.00 O ATOM 0 H SER A 129 7.623 -15.045 22.414 1.00 0.00 H new ATOM 0 HA SER A 129 10.226 -14.572 21.365 1.00 0.00 H new ATOM 0 HB2 SER A 129 9.206 -16.497 23.463 1.00 0.00 H new ATOM 0 HB3 SER A 129 10.900 -16.205 23.124 1.00 0.00 H new ATOM 0 HG SER A 129 10.113 -14.897 24.849 1.00 0.00 H new ATOM 2024 N PHE A 130 8.750 -17.467 20.767 1.00 0.00 N ATOM 2025 CA PHE A 130 8.679 -18.647 19.919 1.00 0.00 C ATOM 2026 C PHE A 130 8.687 -18.217 18.467 1.00 0.00 C ATOM 2027 O PHE A 130 9.444 -18.770 17.670 1.00 0.00 O ATOM 2028 CB PHE A 130 7.436 -19.476 20.228 1.00 0.00 C ATOM 2029 CG PHE A 130 7.239 -20.649 19.314 1.00 0.00 C ATOM 2030 CD1 PHE A 130 7.947 -21.827 19.496 1.00 0.00 C ATOM 2031 CD2 PHE A 130 6.337 -20.568 18.265 1.00 0.00 C ATOM 2032 CE1 PHE A 130 7.753 -22.903 18.649 1.00 0.00 C ATOM 2033 CE2 PHE A 130 6.144 -21.639 17.416 1.00 0.00 C ATOM 2034 CZ PHE A 130 6.853 -22.808 17.608 1.00 0.00 C ATOM 0 H PHE A 130 7.948 -17.377 21.391 1.00 0.00 H new ATOM 0 HA PHE A 130 9.547 -19.276 20.117 1.00 0.00 H new ATOM 0 HB2 PHE A 130 7.499 -19.836 21.255 1.00 0.00 H new ATOM 0 HB3 PHE A 130 6.559 -18.832 20.169 1.00 0.00 H new ATOM 0 HD1 PHE A 130 8.656 -21.905 20.307 1.00 0.00 H new ATOM 0 HD2 PHE A 130 5.779 -19.657 18.110 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.306 -23.818 18.803 1.00 0.00 H new ATOM 0 HE2 PHE A 130 5.439 -21.563 16.602 1.00 0.00 H new ATOM 0 HZ PHE A 130 6.703 -23.647 16.944 1.00 0.00 H new ATOM 2044 N TYR A 131 7.812 -17.263 18.139 1.00 0.00 N ATOM 2045 CA TYR A 131 7.729 -16.698 16.802 1.00 0.00 C ATOM 2046 C TYR A 131 9.070 -16.208 16.303 1.00 0.00 C ATOM 2047 O TYR A 131 9.442 -16.538 15.182 1.00 0.00 O ATOM 2048 CB TYR A 131 6.745 -15.536 16.749 1.00 0.00 C ATOM 2049 CG TYR A 131 6.785 -14.848 15.404 1.00 0.00 C ATOM 2050 CD1 TYR A 131 6.134 -15.395 14.309 1.00 0.00 C ATOM 2051 CD2 TYR A 131 7.492 -13.662 15.271 1.00 0.00 C ATOM 2052 CE1 TYR A 131 6.190 -14.756 13.086 1.00 0.00 C ATOM 2053 CE2 TYR A 131 7.549 -13.023 14.050 1.00 0.00 C ATOM 2054 CZ TYR A 131 6.899 -13.566 12.960 1.00 0.00 C ATOM 2055 OH TYR A 131 6.954 -12.931 11.741 1.00 0.00 O ATOM 0 H TYR A 131 7.143 -16.864 18.798 1.00 0.00 H new ATOM 0 HA TYR A 131 7.384 -17.507 16.159 1.00 0.00 H new ATOM 0 HB2 TYR A 131 5.737 -15.901 16.944 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.982 -14.819 17.535 1.00 0.00 H new ATOM 0 HD1 TYR A 131 5.584 -16.319 14.412 1.00 0.00 H new ATOM 0 HD2 TYR A 131 7.999 -13.238 16.125 1.00 0.00 H new ATOM 0 HE1 TYR A 131 5.685 -15.179 12.230 1.00 0.00 H new ATOM 0 HE2 TYR A 131 8.101 -12.100 13.947 1.00 0.00 H new ATOM 0 HH TYR A 131 7.487 -12.113 11.822 1.00 0.00 H new ATOM 2065 N VAL A 132 9.774 -15.405 17.098 1.00 0.00 N ATOM 2066 CA VAL A 132 11.090 -14.920 16.706 1.00 0.00 C ATOM 2067 C VAL A 132 12.076 -16.059 16.503 1.00 0.00 C ATOM 2068 O VAL A 132 12.780 -16.098 15.492 1.00 0.00 O ATOM 2069 CB VAL A 132 11.637 -13.938 17.751 1.00 0.00 C ATOM 2070 CG1 VAL A 132 13.092 -13.614 17.449 1.00 0.00 C ATOM 2071 CG2 VAL A 132 10.808 -12.662 17.709 1.00 0.00 C ATOM 0 H VAL A 132 9.456 -15.080 18.011 1.00 0.00 H new ATOM 0 HA VAL A 132 10.972 -14.404 15.753 1.00 0.00 H new ATOM 0 HB VAL A 132 11.576 -14.388 18.742 1.00 0.00 H new ATOM 0 HG11 VAL A 132 13.472 -12.917 18.196 1.00 0.00 H new ATOM 0 HG12 VAL A 132 13.682 -14.530 17.475 1.00 0.00 H new ATOM 0 HG13 VAL A 132 13.166 -13.163 16.460 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.188 -11.957 18.448 1.00 0.00 H new ATOM 0 HG22 VAL A 132 10.874 -12.218 16.716 1.00 0.00 H new ATOM 0 HG23 VAL A 132 9.767 -12.897 17.933 1.00 0.00 H new ATOM 2081 N ARG A 133 12.102 -17.021 17.420 1.00 0.00 N ATOM 2082 CA ARG A 133 13.012 -18.154 17.303 1.00 0.00 C ATOM 2083 C ARG A 133 12.727 -19.016 16.074 1.00 0.00 C ATOM 2084 O ARG A 133 13.643 -19.625 15.520 1.00 0.00 O ATOM 2085 CB ARG A 133 12.921 -19.008 18.555 1.00 0.00 C ATOM 2086 CG ARG A 133 13.523 -18.367 19.795 1.00 0.00 C ATOM 2087 CD ARG A 133 13.305 -19.199 21.005 1.00 0.00 C ATOM 2088 NE ARG A 133 13.881 -18.587 22.192 1.00 0.00 N ATOM 2089 CZ ARG A 133 13.705 -19.038 23.449 1.00 0.00 C ATOM 2090 NH1 ARG A 133 12.968 -20.105 23.669 1.00 0.00 N ATOM 2091 NH2 ARG A 133 14.276 -18.411 24.462 1.00 0.00 N ATOM 0 H ARG A 133 11.507 -17.039 18.248 1.00 0.00 H new ATOM 0 HA ARG A 133 14.018 -17.750 17.187 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.873 -19.235 18.750 1.00 0.00 H new ATOM 0 HB3 ARG A 133 13.424 -19.957 18.370 1.00 0.00 H new ATOM 0 HG2 ARG A 133 14.592 -18.217 19.644 1.00 0.00 H new ATOM 0 HG3 ARG A 133 13.081 -17.382 19.946 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.236 -19.349 21.156 1.00 0.00 H new ATOM 0 HD3 ARG A 133 13.746 -20.184 20.853 1.00 0.00 H new ATOM 0 HE ARG A 133 14.460 -17.757 22.063 1.00 0.00 H new ATOM 0 HH11 ARG A 133 12.529 -20.592 22.887 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.835 -20.446 24.621 1.00 0.00 H new ATOM 0 HH21 ARG A 133 14.850 -17.585 24.292 1.00 0.00 H new ATOM 0 HH22 ARG A 133 14.143 -18.753 25.414 1.00 0.00 H new ATOM 2105 N THR A 134 11.464 -19.074 15.659 1.00 0.00 N ATOM 2106 CA THR A 134 11.052 -19.813 14.476 1.00 0.00 C ATOM 2107 C THR A 134 10.708 -18.888 13.305 1.00 0.00 C ATOM 2108 O THR A 134 10.051 -19.317 12.351 1.00 0.00 O ATOM 2109 CB THR A 134 9.831 -20.697 14.798 1.00 0.00 C ATOM 2110 OG1 THR A 134 8.748 -19.876 15.250 1.00 0.00 O ATOM 2111 CG2 THR A 134 10.179 -21.691 15.895 1.00 0.00 C ATOM 0 H THR A 134 10.696 -18.606 16.139 1.00 0.00 H new ATOM 0 HA THR A 134 11.897 -20.434 14.179 1.00 0.00 H new ATOM 0 HB THR A 134 9.542 -21.235 13.895 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.960 -19.513 16.135 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.309 -22.310 16.114 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.002 -22.325 15.564 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.476 -21.151 16.794 1.00 0.00 H new ATOM 2119 N CYS A 135 11.126 -17.619 13.353 1.00 0.00 N ATOM 2120 CA CYS A 135 10.750 -16.721 12.271 1.00 0.00 C ATOM 2121 C CYS A 135 11.552 -16.996 11.013 1.00 0.00 C ATOM 2122 O CYS A 135 12.637 -16.457 10.800 1.00 0.00 O ATOM 2123 CB CYS A 135 10.951 -15.255 12.669 1.00 0.00 C ATOM 2124 SG CYS A 135 10.440 -14.084 11.391 1.00 0.00 S ATOM 0 H CYS A 135 11.697 -17.210 14.093 1.00 0.00 H new ATOM 0 HA CYS A 135 9.694 -16.903 12.071 1.00 0.00 H new ATOM 0 HB2 CYS A 135 10.388 -15.054 13.581 1.00 0.00 H new ATOM 0 HB3 CYS A 135 12.003 -15.091 12.901 1.00 0.00 H new ATOM 0 HG CYS A 135 9.224 -13.688 11.626 1.00 0.00 H new ATOM 2130 N ASN A 136 10.959 -17.799 10.141 1.00 0.00 N ATOM 2131 CA ASN A 136 11.554 -18.166 8.861 1.00 0.00 C ATOM 2132 C ASN A 136 11.586 -17.022 7.851 1.00 0.00 C ATOM 2133 O ASN A 136 12.241 -17.128 6.813 1.00 0.00 O ATOM 2134 CB ASN A 136 10.813 -19.355 8.288 1.00 0.00 C ATOM 2135 CG ASN A 136 11.110 -20.618 9.049 1.00 0.00 C ATOM 2136 OD1 ASN A 136 12.173 -20.752 9.666 1.00 0.00 O ATOM 2137 ND2 ASN A 136 10.189 -21.545 9.020 1.00 0.00 N ATOM 0 H ASN A 136 10.043 -18.218 10.302 1.00 0.00 H new ATOM 0 HA ASN A 136 12.596 -18.422 9.054 1.00 0.00 H new ATOM 0 HB2 ASN A 136 9.741 -19.160 8.311 1.00 0.00 H new ATOM 0 HB3 ASN A 136 11.091 -19.487 7.242 1.00 0.00 H new ATOM 0 HD21 ASN A 136 10.333 -22.422 9.520 1.00 0.00 H new ATOM 0 HD22 ASN A 136 9.327 -21.391 8.498 1.00 0.00 H new ATOM 2144 N LYS A 137 10.870 -15.939 8.142 1.00 0.00 N ATOM 2145 CA LYS A 137 10.859 -14.757 7.303 1.00 0.00 C ATOM 2146 C LYS A 137 11.810 -13.676 7.822 1.00 0.00 C ATOM 2147 O LYS A 137 11.808 -12.567 7.288 1.00 0.00 O ATOM 2148 CB LYS A 137 9.439 -14.208 7.209 1.00 0.00 C ATOM 2149 CG LYS A 137 8.445 -15.201 6.624 1.00 0.00 C ATOM 2150 CD LYS A 137 8.802 -15.554 5.189 1.00 0.00 C ATOM 2151 CE LYS A 137 7.762 -16.475 4.571 1.00 0.00 C ATOM 2152 NZ LYS A 137 8.119 -16.856 3.177 1.00 0.00 N ATOM 0 H LYS A 137 10.281 -15.862 8.971 1.00 0.00 H new ATOM 0 HA LYS A 137 11.208 -15.047 6.312 1.00 0.00 H new ATOM 0 HB2 LYS A 137 9.105 -13.914 8.204 1.00 0.00 H new ATOM 0 HB3 LYS A 137 9.445 -13.307 6.595 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.431 -16.106 7.231 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.441 -14.778 6.658 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.881 -14.642 4.597 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.779 -16.036 5.163 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.665 -17.374 5.180 1.00 0.00 H new ATOM 0 HE3 LYS A 137 6.791 -15.981 4.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.386 -17.484 2.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.187 -16.000 2.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.034 -17.350 3.176 1.00 0.00 H new ATOM 2166 N ASN A 138 12.597 -13.985 8.859 1.00 0.00 N ATOM 2167 CA ASN A 138 13.542 -13.040 9.445 1.00 0.00 C ATOM 2168 C ASN A 138 14.529 -12.488 8.410 1.00 0.00 C ATOM 2169 O ASN A 138 15.223 -13.281 7.771 1.00 0.00 O ATOM 2170 CB ASN A 138 14.307 -13.710 10.571 1.00 0.00 C ATOM 2171 CG ASN A 138 15.187 -12.769 11.346 1.00 0.00 C ATOM 2172 OD1 ASN A 138 14.792 -11.648 11.687 1.00 0.00 O ATOM 2173 ND2 ASN A 138 16.386 -13.207 11.632 1.00 0.00 N ATOM 0 H ASN A 138 12.593 -14.899 9.312 1.00 0.00 H new ATOM 0 HA ASN A 138 12.965 -12.199 9.831 1.00 0.00 H new ATOM 0 HB2 ASN A 138 13.597 -14.176 11.254 1.00 0.00 H new ATOM 0 HB3 ASN A 138 14.921 -14.509 10.156 1.00 0.00 H new ATOM 0 HD21 ASN A 138 17.033 -12.617 12.155 1.00 0.00 H new ATOM 0 HD22 ASN A 138 16.674 -14.139 11.332 1.00 0.00 H new ATOM 2180 N PRO A 139 14.604 -11.163 8.207 1.00 0.00 N ATOM 2181 CA PRO A 139 15.529 -10.525 7.290 1.00 0.00 C ATOM 2182 C PRO A 139 16.990 -10.856 7.566 1.00 0.00 C ATOM 2183 O PRO A 139 17.410 -10.995 8.716 1.00 0.00 O ATOM 2184 CB PRO A 139 15.221 -9.043 7.540 1.00 0.00 C ATOM 2185 CG PRO A 139 13.797 -9.026 8.020 1.00 0.00 C ATOM 2186 CD PRO A 139 13.622 -10.276 8.845 1.00 0.00 C ATOM 0 HA PRO A 139 15.402 -10.851 6.258 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.895 -8.618 8.284 1.00 0.00 H new ATOM 0 HB3 PRO A 139 15.339 -8.455 6.630 1.00 0.00 H new ATOM 0 HG2 PRO A 139 13.596 -8.135 8.615 1.00 0.00 H new ATOM 0 HG3 PRO A 139 13.102 -9.012 7.180 1.00 0.00 H new ATOM 0 HD2 PRO A 139 13.839 -10.109 9.900 1.00 0.00 H new ATOM 0 HD3 PRO A 139 12.608 -10.672 8.787 1.00 0.00 H new ATOM 2194 N LYS A 140 17.763 -10.956 6.490 1.00 0.00 N ATOM 2195 CA LYS A 140 19.179 -11.284 6.573 1.00 0.00 C ATOM 2196 C LYS A 140 20.012 -10.282 7.352 1.00 0.00 C ATOM 2197 O LYS A 140 20.001 -9.083 7.069 1.00 0.00 O ATOM 2198 CB LYS A 140 19.787 -11.398 5.178 1.00 0.00 C ATOM 2199 CG LYS A 140 21.259 -11.792 5.195 1.00 0.00 C ATOM 2200 CD LYS A 140 21.816 -11.943 3.790 1.00 0.00 C ATOM 2201 CE LYS A 140 23.291 -12.317 3.822 1.00 0.00 C ATOM 2202 NZ LYS A 140 23.849 -12.471 2.451 1.00 0.00 N ATOM 0 H LYS A 140 17.425 -10.812 5.538 1.00 0.00 H new ATOM 0 HA LYS A 140 19.209 -12.233 7.109 1.00 0.00 H new ATOM 0 HB2 LYS A 140 19.227 -12.136 4.604 1.00 0.00 H new ATOM 0 HB3 LYS A 140 19.679 -10.444 4.662 1.00 0.00 H new ATOM 0 HG2 LYS A 140 21.832 -11.037 5.734 1.00 0.00 H new ATOM 0 HG3 LYS A 140 21.378 -12.730 5.737 1.00 0.00 H new ATOM 0 HD2 LYS A 140 21.255 -12.708 3.254 1.00 0.00 H new ATOM 0 HD3 LYS A 140 21.686 -11.010 3.242 1.00 0.00 H new ATOM 0 HE2 LYS A 140 23.850 -11.550 4.358 1.00 0.00 H new ATOM 0 HE3 LYS A 140 23.419 -13.248 4.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 24.855 -12.726 2.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 23.332 -13.220 1.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 23.750 -11.575 1.933 1.00 0.00 H new ATOM 2216 N LYS A 141 20.735 -10.799 8.337 1.00 0.00 N ATOM 2217 CA LYS A 141 21.640 -9.997 9.141 1.00 0.00 C ATOM 2218 C LYS A 141 23.056 -10.224 8.641 1.00 0.00 C ATOM 2219 O LYS A 141 23.473 -11.365 8.441 1.00 0.00 O ATOM 2220 CB LYS A 141 21.533 -10.350 10.624 1.00 0.00 C ATOM 2221 CG LYS A 141 22.419 -9.500 11.525 1.00 0.00 C ATOM 2222 CD LYS A 141 22.235 -9.860 12.990 1.00 0.00 C ATOM 2223 CE LYS A 141 23.141 -9.024 13.882 1.00 0.00 C ATOM 2224 NZ LYS A 141 22.969 -9.366 15.320 1.00 0.00 N ATOM 0 H LYS A 141 20.709 -11.785 8.599 1.00 0.00 H new ATOM 0 HA LYS A 141 21.370 -8.945 9.042 1.00 0.00 H new ATOM 0 HB2 LYS A 141 20.496 -10.238 10.940 1.00 0.00 H new ATOM 0 HB3 LYS A 141 21.796 -11.399 10.758 1.00 0.00 H new ATOM 0 HG2 LYS A 141 23.463 -9.638 11.244 1.00 0.00 H new ATOM 0 HG3 LYS A 141 22.185 -8.446 11.377 1.00 0.00 H new ATOM 0 HD2 LYS A 141 21.195 -9.705 13.277 1.00 0.00 H new ATOM 0 HD3 LYS A 141 22.452 -10.918 13.137 1.00 0.00 H new ATOM 0 HE2 LYS A 141 24.180 -9.180 13.593 1.00 0.00 H new ATOM 0 HE3 LYS A 141 22.924 -7.966 13.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 23.603 -8.776 15.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 21.983 -9.193 15.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 23.201 -10.369 15.468 1.00 0.00 H new ATOM 2238 N THR A 142 23.790 -9.137 8.433 1.00 0.00 N ATOM 2239 CA THR A 142 25.160 -9.245 7.957 1.00 0.00 C ATOM 2240 C THR A 142 26.142 -9.433 9.100 1.00 0.00 C ATOM 2241 O THR A 142 25.821 -9.191 10.264 1.00 0.00 O ATOM 2242 CB THR A 142 25.571 -7.989 7.177 1.00 0.00 C ATOM 2243 OG1 THR A 142 25.516 -6.868 8.066 1.00 0.00 O ATOM 2244 CG2 THR A 142 24.650 -7.747 5.993 1.00 0.00 C ATOM 0 H THR A 142 23.463 -8.183 8.585 1.00 0.00 H new ATOM 0 HA THR A 142 25.191 -10.119 7.307 1.00 0.00 H new ATOM 0 HB THR A 142 26.581 -8.126 6.790 1.00 0.00 H new ATOM 0 HG1 THR A 142 26.397 -6.730 8.473 1.00 0.00 H new ATOM 0 HG21 THR A 142 24.968 -6.850 5.462 1.00 0.00 H new ATOM 0 HG22 THR A 142 24.692 -8.602 5.319 1.00 0.00 H new ATOM 0 HG23 THR A 142 23.628 -7.615 6.348 1.00 0.00 H new ATOM 2252 N LYS A 143 27.344 -9.868 8.747 1.00 0.00 N ATOM 2253 CA LYS A 143 28.415 -10.067 9.712 1.00 0.00 C ATOM 2254 C LYS A 143 29.555 -9.074 9.510 1.00 0.00 C ATOM 2255 O LYS A 143 30.480 -9.014 10.321 1.00 0.00 O ATOM 2256 CB LYS A 143 28.940 -11.498 9.613 1.00 0.00 C ATOM 2257 CG LYS A 143 27.911 -12.555 9.990 1.00 0.00 C ATOM 2258 CD LYS A 143 28.489 -13.957 9.896 1.00 0.00 C ATOM 2259 CE LYS A 143 27.456 -15.006 10.281 1.00 0.00 C ATOM 2260 NZ LYS A 143 27.996 -16.387 10.157 1.00 0.00 N ATOM 0 H LYS A 143 27.603 -10.092 7.786 1.00 0.00 H new ATOM 0 HA LYS A 143 28.004 -9.895 10.707 1.00 0.00 H new ATOM 0 HB2 LYS A 143 29.279 -11.681 8.594 1.00 0.00 H new ATOM 0 HB3 LYS A 143 29.809 -11.602 10.262 1.00 0.00 H new ATOM 0 HG2 LYS A 143 27.558 -12.374 11.005 1.00 0.00 H new ATOM 0 HG3 LYS A 143 27.046 -12.473 9.332 1.00 0.00 H new ATOM 0 HD2 LYS A 143 28.837 -14.142 8.880 1.00 0.00 H new ATOM 0 HD3 LYS A 143 29.357 -14.040 10.551 1.00 0.00 H new ATOM 0 HE2 LYS A 143 27.129 -14.835 11.307 1.00 0.00 H new ATOM 0 HE3 LYS A 143 26.577 -14.901 9.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 27.262 -17.072 10.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 28.285 -16.560 9.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 28.819 -16.495 10.783 1.00 0.00 H new ATOM 2274 N TRP A 144 29.492 -8.305 8.426 1.00 0.00 N ATOM 2275 CA TRP A 144 30.521 -7.323 8.116 1.00 0.00 C ATOM 2276 C TRP A 144 30.012 -5.910 8.383 1.00 0.00 C ATOM 2277 O TRP A 144 30.745 -5.069 8.904 1.00 0.00 O ATOM 2278 CB TRP A 144 30.971 -7.488 6.655 1.00 0.00 C ATOM 2279 CG TRP A 144 29.907 -7.237 5.623 1.00 0.00 C ATOM 2280 CD1 TRP A 144 29.037 -8.154 5.114 1.00 0.00 C ATOM 2281 CD2 TRP A 144 29.615 -5.988 4.945 1.00 0.00 C ATOM 2282 NE1 TRP A 144 28.215 -7.562 4.187 1.00 0.00 N ATOM 2283 CE2 TRP A 144 28.555 -6.238 4.071 1.00 0.00 C ATOM 2284 CE3 TRP A 144 30.162 -4.699 5.009 1.00 0.00 C ATOM 2285 CZ2 TRP A 144 28.016 -5.243 3.270 1.00 0.00 C ATOM 2286 CZ3 TRP A 144 29.624 -3.703 4.202 1.00 0.00 C ATOM 2287 CH2 TRP A 144 28.578 -3.969 3.356 1.00 0.00 C ATOM 0 H TRP A 144 28.733 -8.346 7.745 1.00 0.00 H new ATOM 0 HA TRP A 144 31.382 -7.489 8.763 1.00 0.00 H new ATOM 0 HB2 TRP A 144 31.802 -6.808 6.469 1.00 0.00 H new ATOM 0 HB3 TRP A 144 31.352 -8.501 6.522 1.00 0.00 H new ATOM 0 HD1 TRP A 144 28.999 -9.195 5.398 1.00 0.00 H new ATOM 0 HE1 TRP A 144 27.472 -8.031 3.669 1.00 0.00 H new ATOM 0 HE3 TRP A 144 30.986 -4.484 5.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 144 27.191 -5.447 2.604 1.00 0.00 H new ATOM 0 HZ3 TRP A 144 30.036 -2.705 4.242 1.00 0.00 H new ATOM 0 HH2 TRP A 144 28.180 -3.174 2.742 1.00 0.00 H new ATOM 2298 N TRP A 145 28.762 -5.649 8.016 1.00 0.00 N ATOM 2299 CA TRP A 145 28.181 -4.333 8.207 1.00 0.00 C ATOM 2300 C TRP A 145 27.606 -4.186 9.603 1.00 0.00 C ATOM 2301 O TRP A 145 26.827 -5.021 10.065 1.00 0.00 O ATOM 2302 CB TRP A 145 27.110 -4.057 7.155 1.00 0.00 C ATOM 2303 CG TRP A 145 26.519 -2.692 7.271 1.00 0.00 C ATOM 2304 CD1 TRP A 145 25.260 -2.364 7.676 1.00 0.00 C ATOM 2305 CD2 TRP A 145 27.189 -1.443 6.988 1.00 0.00 C ATOM 2306 NE1 TRP A 145 25.099 -0.999 7.658 1.00 0.00 N ATOM 2307 CE2 TRP A 145 26.270 -0.422 7.240 1.00 0.00 C ATOM 2308 CE3 TRP A 145 28.476 -1.116 6.550 1.00 0.00 C ATOM 2309 CZ2 TRP A 145 26.591 0.912 7.062 1.00 0.00 C ATOM 2310 CZ3 TRP A 145 28.798 0.221 6.366 1.00 0.00 C ATOM 2311 CH2 TRP A 145 27.878 1.208 6.615 1.00 0.00 C ATOM 0 H TRP A 145 28.137 -6.331 7.587 1.00 0.00 H new ATOM 0 HA TRP A 145 28.977 -3.597 8.091 1.00 0.00 H new ATOM 0 HB2 TRP A 145 27.544 -4.176 6.162 1.00 0.00 H new ATOM 0 HB3 TRP A 145 26.317 -4.799 7.248 1.00 0.00 H new ATOM 0 HD1 TRP A 145 24.500 -3.073 7.968 1.00 0.00 H new ATOM 0 HE1 TRP A 145 24.248 -0.498 7.914 1.00 0.00 H new ATOM 0 HE3 TRP A 145 29.205 -1.889 6.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 25.873 1.693 7.262 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 29.786 0.488 6.022 1.00 0.00 H new ATOM 0 HH2 TRP A 145 28.158 2.240 6.461 1.00 0.00 H new ATOM 2322 N TYR A 146 28.025 -3.119 10.268 1.00 0.00 N ATOM 2323 CA TYR A 146 27.577 -2.786 11.610 1.00 0.00 C ATOM 2324 C TYR A 146 26.173 -2.197 11.600 1.00 0.00 C ATOM 2325 O TYR A 146 25.706 -1.712 10.574 1.00 0.00 O ATOM 2326 CB TYR A 146 28.574 -1.814 12.226 1.00 0.00 C ATOM 2327 CG TYR A 146 28.782 -0.575 11.384 1.00 0.00 C ATOM 2328 CD1 TYR A 146 27.933 0.509 11.512 1.00 0.00 C ATOM 2329 CD2 TYR A 146 29.835 -0.526 10.484 1.00 0.00 C ATOM 2330 CE1 TYR A 146 28.133 1.639 10.751 1.00 0.00 C ATOM 2331 CE2 TYR A 146 30.040 0.608 9.725 1.00 0.00 C ATOM 2332 CZ TYR A 146 29.195 1.691 9.858 1.00 0.00 C ATOM 2333 OH TYR A 146 29.402 2.825 9.106 1.00 0.00 O ATOM 0 H TYR A 146 28.695 -2.452 9.884 1.00 0.00 H new ATOM 0 HA TYR A 146 27.530 -3.695 12.210 1.00 0.00 H new ATOM 0 HB2 TYR A 146 28.224 -1.520 13.216 1.00 0.00 H new ATOM 0 HB3 TYR A 146 29.530 -2.319 12.363 1.00 0.00 H new ATOM 0 HD1 TYR A 146 27.111 0.469 12.211 1.00 0.00 H new ATOM 0 HD2 TYR A 146 30.494 -1.375 10.377 1.00 0.00 H new ATOM 0 HE1 TYR A 146 27.466 2.483 10.848 1.00 0.00 H new ATOM 0 HE2 TYR A 146 30.862 0.648 9.026 1.00 0.00 H new ATOM 0 HH TYR A 146 29.024 2.698 8.211 1.00 0.00 H new ATOM 2343 N HIS A 147 25.499 -2.217 12.745 1.00 0.00 N ATOM 2344 CA HIS A 147 24.141 -1.695 12.786 1.00 0.00 C ATOM 2345 C HIS A 147 24.153 -0.201 12.522 1.00 0.00 C ATOM 2346 O HIS A 147 24.947 0.523 13.119 1.00 0.00 O ATOM 2347 CB HIS A 147 23.466 -1.946 14.133 1.00 0.00 C ATOM 2348 CG HIS A 147 21.996 -1.667 14.083 1.00 0.00 C ATOM 2349 ND1 HIS A 147 21.467 -0.394 14.006 1.00 0.00 N ATOM 2350 CD2 HIS A 147 20.942 -2.515 14.095 1.00 0.00 C ATOM 2351 CE1 HIS A 147 20.146 -0.478 13.972 1.00 0.00 C ATOM 2352 NE2 HIS A 147 19.804 -1.751 14.027 1.00 0.00 N ATOM 0 H HIS A 147 25.857 -2.577 13.630 1.00 0.00 H new ATOM 0 HA HIS A 147 23.575 -2.219 12.015 1.00 0.00 H new ATOM 0 HB2 HIS A 147 23.629 -2.981 14.433 1.00 0.00 H new ATOM 0 HB3 HIS A 147 23.929 -1.317 14.894 1.00 0.00 H new ATOM 0 HD2 HIS A 147 20.988 -3.593 14.148 1.00 0.00 H new ATOM 0 HE1 HIS A 147 19.463 0.356 13.910 1.00 0.00 H new ATOM 0 HE2 HIS A 147 18.849 -2.109 14.020 1.00 0.00 H new ATOM 2360 N ASP A 148 23.230 0.254 11.683 1.00 0.00 N ATOM 2361 CA ASP A 148 23.135 1.643 11.251 1.00 0.00 C ATOM 2362 C ASP A 148 23.086 2.659 12.391 1.00 0.00 C ATOM 2363 O ASP A 148 23.686 3.730 12.291 1.00 0.00 O ATOM 2364 CB ASP A 148 21.894 1.797 10.377 1.00 0.00 C ATOM 2365 CG ASP A 148 22.056 1.103 9.030 1.00 0.00 C ATOM 2366 OD1 ASP A 148 23.160 0.737 8.695 1.00 0.00 O ATOM 2367 OD2 ASP A 148 21.072 0.943 8.349 1.00 0.00 O ATOM 0 H ASP A 148 22.512 -0.345 11.276 1.00 0.00 H new ATOM 0 HA ASP A 148 24.050 1.862 10.700 1.00 0.00 H new ATOM 0 HB2 ASP A 148 21.030 1.383 10.897 1.00 0.00 H new ATOM 0 HB3 ASP A 148 21.692 2.856 10.217 1.00 0.00 H new ATOM 2372 N ASP A 149 22.442 2.315 13.504 1.00 0.00 N ATOM 2373 CA ASP A 149 22.323 3.236 14.628 1.00 0.00 C ATOM 2374 C ASP A 149 23.575 3.324 15.498 1.00 0.00 C ATOM 2375 O ASP A 149 23.568 4.034 16.505 1.00 0.00 O ATOM 2376 CB ASP A 149 21.129 2.857 15.501 1.00 0.00 C ATOM 2377 CG ASP A 149 19.801 3.108 14.799 1.00 0.00 C ATOM 2378 OD1 ASP A 149 19.772 3.901 13.888 1.00 0.00 O ATOM 2379 OD2 ASP A 149 18.825 2.508 15.182 1.00 0.00 O ATOM 0 H ASP A 149 21.997 1.409 13.650 1.00 0.00 H new ATOM 0 HA ASP A 149 22.180 4.221 14.184 1.00 0.00 H new ATOM 0 HB2 ASP A 149 21.200 1.804 15.774 1.00 0.00 H new ATOM 0 HB3 ASP A 149 21.162 3.430 16.428 1.00 0.00 H new ATOM 2384 N THR A 150 24.640 2.608 15.133 1.00 0.00 N ATOM 2385 CA THR A 150 25.894 2.667 15.859 1.00 0.00 C ATOM 2386 C THR A 150 26.937 3.368 14.989 1.00 0.00 C ATOM 2387 O THR A 150 28.112 3.402 15.357 1.00 0.00 O ATOM 2388 CB THR A 150 26.408 1.262 16.231 1.00 0.00 C ATOM 2389 OG1 THR A 150 26.669 0.508 15.041 1.00 0.00 O ATOM 2390 CG2 THR A 150 25.344 0.529 17.035 1.00 0.00 C ATOM 0 H THR A 150 24.651 1.978 14.331 1.00 0.00 H new ATOM 0 HA THR A 150 25.725 3.218 16.784 1.00 0.00 H new ATOM 0 HB THR A 150 27.322 1.366 16.815 1.00 0.00 H new ATOM 0 HG1 THR A 150 25.822 0.295 14.597 1.00 0.00 H new ATOM 0 HG21 THR A 150 25.707 -0.465 17.298 1.00 0.00 H new ATOM 0 HG22 THR A 150 25.126 1.088 17.945 1.00 0.00 H new ATOM 0 HG23 THR A 150 24.436 0.437 16.439 1.00 0.00 H new ATOM 2398 N CYS A 151 26.519 3.905 13.834 1.00 0.00 N ATOM 2399 CA CYS A 151 27.428 4.607 12.933 1.00 0.00 C ATOM 2400 C CYS A 151 28.093 5.819 13.582 1.00 0.00 C ATOM 2401 O CYS A 151 29.290 6.033 13.386 1.00 0.00 O ATOM 2402 CB CYS A 151 26.674 5.078 11.689 1.00 0.00 C ATOM 2403 SG CYS A 151 27.713 5.927 10.476 1.00 0.00 S ATOM 2404 OXT CYS A 151 27.378 6.746 13.959 1.00 0.00 O ATOM 0 H CYS A 151 25.554 3.863 13.506 1.00 0.00 H new ATOM 0 HA CYS A 151 28.210 3.894 12.670 1.00 0.00 H new ATOM 0 HB2 CYS A 151 26.207 4.216 11.212 1.00 0.00 H new ATOM 0 HB3 CYS A 151 25.870 5.747 11.996 1.00 0.00 H new ATOM 0 HG CYS A 151 26.987 6.286 9.459 1.00 0.00 H new TER 2410 CYS A 151