USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1146 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: B 82 SER OG : rot 133:sc= 1.56 USER MOD Set 1.2: B 84 SER OG : rot 180:sc= 1.16 USER MOD Set 2.1: B 83 GLN : amide:sc= -1.4! C(o=-4.9!,f=-24!) USER MOD Set 2.2: B 98 ASN : amide:sc= -3.48! C(o=-4.9!,f=-21!) USER MOD Set 3.1: B 79 LYS NZ :NH3+ 163:sc= -0.127 (180deg=-1.12!) USER MOD Set 3.2: B 121 THR OG1 : rot 14:sc= -0.941! USER MOD Set 4.1: B 71 ASN : amide:sc= -0.804 K(o=-5.8,f=-6.6!) USER MOD Set 4.2: B 128 GLN :FLIP amide:sc= -5.01 F(o=-11!,f=-5.8) USER MOD Set 5.1: A 44 GLN :FLIP amide:sc= -1.62! F(o=-2.6,f=-1.8!) USER MOD Set 5.2: B 67 MET CE :methyl -128:sc= -0.154 (180deg=-0.748) USER MOD Set 6.1: A 5 ASN : amide:sc= -1.14! K(o=-1.8!,f=-3.5) USER MOD Set 6.2: A 62 GLN : amide:sc= -0.698 K(o=-1.8,f=-5!) USER MOD Set 7.1: A 13 LYS NZ :NH3+ -148:sc= 0.137! (180deg=0) USER MOD Set 7.2: A 55 THR OG1 : rot 80:sc= 1.49 USER MOD Set 8.1: A 27 SER OG : rot 35:sc= 1.15 USER MOD Set 8.2: A 30 THR OG1 : rot -131:sc= -0.936! USER MOD Set 9.1: A 17 GLN : amide:sc= -1.24! C(o=-6!,f=-23!) USER MOD Set 9.2: A 32 ASN : amide:sc= -4.75! C(o=-6!,f=-19!) USER MOD Set10.1: A 16 SER OG : rot 141:sc= 1.36 USER MOD Set10.2: A 18 SER OG : rot 72:sc= 0.0453 USER MOD Set11.1: A 4 ASN : amide:sc= -4.97! C(o=-7.3!,f=-26!) USER MOD Set11.2: A 37 ASN :FLIP amide:sc= -2.3 F(o=-10!,f=-7.3) USER MOD Set12.1: A 1 MET CE :methyl -163:sc= -0.255 (180deg=-0.815) USER MOD Set12.2: B 110 GLN : amide:sc= -0.0594 K(o=-0.31,f=-3.3) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0267 (180deg=-0.432) USER MOD Single : A 7 LYS NZ :NH3+ 146:sc= 0.729 (180deg=0.0528) USER MOD Single : A 12 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.11) USER MOD Single : A 14 LYS NZ :NH3+ -177:sc= -0.0624 (180deg=-0.171) USER MOD Single : A 29 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 36 LYS NZ :NH3+ -164:sc=-0.00903 (180deg=-0.316) USER MOD Single : A 38 LYS NZ :NH3+ -155:sc= -0.415 (180deg=-1.33) USER MOD Single : A 39 TYR OH : rot -83:sc= -0.486! USER MOD Single : A 40 ASN : amide:sc= -2.3! C(o=-2.3!,f=-3.5!) USER MOD Single : A 42 SER OG : rot 180:sc= -1.02 USER MOD Single : A 48 LYS NZ :NH3+ -116:sc= 1.44 (180deg=-2.8!) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.264 USER MOD Single : A 52 TYR OH : rot -126:sc= 1.09 USER MOD Single : A 54 ASN : amide:sc= -0.196 K(o=-0.2,f=-2.2!) USER MOD Single : A 64 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.034) USER MOD Single : B 70 ASN : amide:sc= -5.61! C(o=-5.6!,f=-20!) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00418) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 SER OG : rot 180:sc= 0 USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : B 96 THR OG1 : rot -110:sc= -1.67 USER MOD Single : B 102 LYS NZ :NH3+ -161:sc= -0.089 (180deg=-0.662) USER MOD Single : B 103 ASN :FLIP amide:sc= -1.74 F(o=-3.3!,f=-1.7) USER MOD Single : B 104 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0865) USER MOD Single : B 105 TYR OH : rot 105:sc= -1.77 USER MOD Single : B 106 ASN : amide:sc= -4.55! C(o=-4.5!,f=-13!) USER MOD Single : B 108 SER OG : rot 180:sc= 0 USER MOD Single : B 114 LYS NZ :NH3+ -165:sc= 0.48 (180deg=0.407) USER MOD Single : B 117 TYR OH : rot 180:sc= -0.0639 USER MOD Single : B 118 TYR OH : rot 180:sc= 0 USER MOD Single : B 120 ASN : amide:sc= -0.385 K(o=-0.38,f=-2.1!) USER MOD Single : B 130 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.009 13.902 1.546 1.00 0.00 N ATOM 2 CA MET A 1 -0.638 12.745 0.921 1.00 0.00 C ATOM 3 C MET A 1 -0.256 11.468 1.671 1.00 0.00 C ATOM 4 O MET A 1 -0.835 11.159 2.716 1.00 0.00 O ATOM 5 CB MET A 1 -0.237 12.652 -0.564 1.00 0.00 C ATOM 6 CG MET A 1 -0.772 13.871 -1.328 1.00 0.00 C ATOM 7 SD MET A 1 -2.577 13.930 -1.207 1.00 0.00 S ATOM 8 CE MET A 1 -2.927 12.502 -2.260 1.00 0.00 C ATOM 0 H1 MET A 1 -0.496 14.769 1.241 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.072 13.815 2.580 1.00 0.00 H new ATOM 0 H3 MET A 1 0.991 13.949 1.263 1.00 0.00 H new ATOM 0 HA MET A 1 -1.721 12.862 0.972 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.848 12.603 -0.654 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.635 11.736 -1.000 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.341 14.785 -0.919 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.470 13.817 -2.374 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.971 12.527 -2.572 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.284 12.533 -3.140 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.737 11.584 -1.704 1.00 0.00 H new ATOM 18 N ILE A 2 0.787 10.799 1.203 1.00 0.00 N ATOM 19 CA ILE A 2 1.328 9.641 1.885 1.00 0.00 C ATOM 20 C ILE A 2 2.765 9.955 2.263 1.00 0.00 C ATOM 21 O ILE A 2 3.570 10.336 1.395 1.00 0.00 O ATOM 22 CB ILE A 2 1.298 8.416 0.957 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.138 8.102 0.542 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.891 7.191 1.665 1.00 0.00 C ATOM 25 CD1 ILE A 2 -0.116 7.047 -0.563 1.00 0.00 C ATOM 0 H ILE A 2 1.278 11.045 0.343 1.00 0.00 H new ATOM 0 HA ILE A 2 0.734 9.417 2.771 1.00 0.00 H new ATOM 0 HB ILE A 2 1.893 8.647 0.073 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -0.707 7.739 1.398 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.635 9.006 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.862 6.333 0.993 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.924 7.397 1.945 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.309 6.971 2.560 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -1.137 6.816 -0.866 1.00 0.00 H new ATOM 0 HD12 ILE A 2 0.439 7.429 -1.420 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.366 6.142 -0.193 1.00 0.00 H new ATOM 37 N ILE A 3 3.102 9.781 3.526 1.00 0.00 N ATOM 38 CA ILE A 3 4.453 10.051 3.979 1.00 0.00 C ATOM 39 C ILE A 3 5.338 8.835 3.721 1.00 0.00 C ATOM 40 O ILE A 3 4.985 7.707 4.084 1.00 0.00 O ATOM 41 CB ILE A 3 4.450 10.465 5.475 1.00 0.00 C ATOM 42 CG1 ILE A 3 4.046 11.950 5.606 1.00 0.00 C ATOM 43 CG2 ILE A 3 5.839 10.283 6.088 1.00 0.00 C ATOM 44 CD1 ILE A 3 2.792 12.242 4.774 1.00 0.00 C ATOM 0 H ILE A 3 2.464 9.456 4.253 1.00 0.00 H new ATOM 0 HA ILE A 3 4.866 10.888 3.416 1.00 0.00 H new ATOM 0 HB ILE A 3 3.736 9.831 6.001 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.859 12.191 6.652 1.00 0.00 H new ATOM 0 HG13 ILE A 3 4.866 12.587 5.274 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.815 10.579 7.137 1.00 0.00 H new ATOM 0 HG22 ILE A 3 6.136 9.237 6.012 1.00 0.00 H new ATOM 0 HG23 ILE A 3 6.557 10.903 5.552 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.522 13.293 4.879 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.992 12.021 3.725 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.969 11.620 5.126 1.00 0.00 H new ATOM 56 N ASN A 4 6.433 9.064 3.002 1.00 0.00 N ATOM 57 CA ASN A 4 7.347 7.996 2.602 1.00 0.00 C ATOM 58 C ASN A 4 8.593 7.982 3.463 1.00 0.00 C ATOM 59 O ASN A 4 9.448 8.865 3.340 1.00 0.00 O ATOM 60 CB ASN A 4 7.748 8.143 1.130 1.00 0.00 C ATOM 61 CG ASN A 4 8.927 7.226 0.829 1.00 0.00 C ATOM 62 OD1 ASN A 4 9.123 6.233 1.514 1.00 0.00 O ATOM 63 ND2 ASN A 4 9.729 7.498 -0.147 1.00 0.00 N ATOM 0 H ASN A 4 6.712 9.991 2.681 1.00 0.00 H new ATOM 0 HA ASN A 4 6.818 7.053 2.738 1.00 0.00 H new ATOM 0 HB2 ASN A 4 6.905 7.892 0.486 1.00 0.00 H new ATOM 0 HB3 ASN A 4 8.015 9.178 0.917 1.00 0.00 H new ATOM 0 HD21 ASN A 4 10.521 6.885 -0.342 1.00 0.00 H new ATOM 0 HD22 ASN A 4 9.570 8.325 -0.722 1.00 0.00 H new ATOM 70 N ASN A 5 8.741 6.951 4.265 1.00 0.00 N ATOM 71 CA ASN A 5 9.928 6.799 5.100 1.00 0.00 C ATOM 72 C ASN A 5 10.919 5.851 4.452 1.00 0.00 C ATOM 73 O ASN A 5 11.858 5.385 5.103 1.00 0.00 O ATOM 74 CB ASN A 5 9.556 6.239 6.466 1.00 0.00 C ATOM 75 CG ASN A 5 8.557 7.136 7.164 1.00 0.00 C ATOM 76 OD1 ASN A 5 8.769 8.340 7.279 1.00 0.00 O ATOM 77 ND2 ASN A 5 7.472 6.616 7.631 1.00 0.00 N ATOM 0 H ASN A 5 8.057 6.200 4.362 1.00 0.00 H new ATOM 0 HA ASN A 5 10.377 7.786 5.213 1.00 0.00 H new ATOM 0 HB2 ASN A 5 9.136 5.240 6.352 1.00 0.00 H new ATOM 0 HB3 ASN A 5 10.452 6.140 7.079 1.00 0.00 H new ATOM 0 HD21 ASN A 5 6.784 7.206 8.099 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.302 5.615 7.532 1.00 0.00 H new ATOM 84 N LEU A 6 10.674 5.499 3.198 1.00 0.00 N ATOM 85 CA LEU A 6 11.489 4.501 2.531 1.00 0.00 C ATOM 86 C LEU A 6 12.923 4.935 2.479 1.00 0.00 C ATOM 87 O LEU A 6 13.809 4.161 2.797 1.00 0.00 O ATOM 88 CB LEU A 6 10.985 4.240 1.102 1.00 0.00 C ATOM 89 CG LEU A 6 11.925 3.250 0.387 1.00 0.00 C ATOM 90 CD1 LEU A 6 11.977 1.930 1.148 1.00 0.00 C ATOM 91 CD2 LEU A 6 11.441 3.002 -1.043 1.00 0.00 C ATOM 0 H LEU A 6 9.923 5.888 2.628 1.00 0.00 H new ATOM 0 HA LEU A 6 11.412 3.579 3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 6 9.973 3.837 1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 6 10.939 5.177 0.547 1.00 0.00 H new ATOM 0 HG LEU A 6 12.925 3.682 0.355 1.00 0.00 H new ATOM 0 HD11 LEU A 6 12.644 1.239 0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 6 12.347 2.107 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 6 10.977 1.499 1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 6 12.113 2.301 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU A 6 10.434 2.584 -1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 6 11.430 3.944 -1.592 1.00 0.00 H new ATOM 103 N LYS A 7 13.161 6.180 2.114 1.00 0.00 N ATOM 104 CA LYS A 7 14.526 6.648 2.037 1.00 0.00 C ATOM 105 C LYS A 7 15.212 6.539 3.387 1.00 0.00 C ATOM 106 O LYS A 7 16.366 6.132 3.476 1.00 0.00 O ATOM 107 CB LYS A 7 14.618 8.069 1.437 1.00 0.00 C ATOM 108 CG LYS A 7 14.304 9.166 2.472 1.00 0.00 C ATOM 109 CD LYS A 7 12.831 9.587 2.373 1.00 0.00 C ATOM 110 CE LYS A 7 12.726 11.112 2.540 1.00 0.00 C ATOM 111 NZ LYS A 7 13.342 11.774 1.362 1.00 0.00 N ATOM 0 H LYS A 7 12.447 6.867 1.873 1.00 0.00 H new ATOM 0 HA LYS A 7 15.064 5.997 1.348 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.619 8.227 1.037 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.924 8.153 0.601 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.518 8.800 3.476 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.948 10.029 2.304 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.419 9.286 1.410 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.245 9.084 3.142 1.00 0.00 H new ATOM 0 HE2 LYS A 7 11.681 11.409 2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 7 13.230 11.426 3.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 12.826 12.651 1.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.336 11.999 1.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.297 11.136 0.542 1.00 0.00 H new ATOM 125 N LEU A 8 14.496 6.899 4.438 1.00 0.00 N ATOM 126 CA LEU A 8 15.049 6.809 5.775 1.00 0.00 C ATOM 127 C LEU A 8 15.196 5.346 6.177 1.00 0.00 C ATOM 128 O LEU A 8 16.250 4.914 6.642 1.00 0.00 O ATOM 129 CB LEU A 8 14.098 7.497 6.767 1.00 0.00 C ATOM 130 CG LEU A 8 14.005 9.000 6.462 1.00 0.00 C ATOM 131 CD1 LEU A 8 12.936 9.636 7.353 1.00 0.00 C ATOM 132 CD2 LEU A 8 15.359 9.680 6.712 1.00 0.00 C ATOM 0 H LEU A 8 13.540 7.253 4.392 1.00 0.00 H new ATOM 0 HA LEU A 8 16.025 7.295 5.789 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.108 7.045 6.706 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.454 7.347 7.786 1.00 0.00 H new ATOM 0 HG LEU A 8 13.735 9.133 5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 8 12.870 10.702 7.137 1.00 0.00 H new ATOM 0 HD12 LEU A 8 11.972 9.166 7.158 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.203 9.494 8.400 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.278 10.744 6.492 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.646 9.546 7.755 1.00 0.00 H new ATOM 0 HD23 LEU A 8 16.115 9.233 6.067 1.00 0.00 H new ATOM 144 N ILE A 9 14.131 4.589 5.967 1.00 0.00 N ATOM 145 CA ILE A 9 14.107 3.173 6.302 1.00 0.00 C ATOM 146 C ILE A 9 15.066 2.366 5.438 1.00 0.00 C ATOM 147 O ILE A 9 15.739 1.463 5.920 1.00 0.00 O ATOM 148 CB ILE A 9 12.675 2.626 6.200 1.00 0.00 C ATOM 149 CG1 ILE A 9 11.812 3.254 7.296 1.00 0.00 C ATOM 150 CG2 ILE A 9 12.665 1.105 6.380 1.00 0.00 C ATOM 151 CD1 ILE A 9 10.351 2.897 7.040 1.00 0.00 C ATOM 0 H ILE A 9 13.262 4.936 5.561 1.00 0.00 H new ATOM 0 HA ILE A 9 14.448 3.069 7.332 1.00 0.00 H new ATOM 0 HB ILE A 9 12.280 2.874 5.215 1.00 0.00 H new ATOM 0 HG12 ILE A 9 12.123 2.890 8.275 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.940 4.336 7.303 1.00 0.00 H new ATOM 0 HG21 ILE A 9 11.642 0.736 6.305 1.00 0.00 H new ATOM 0 HG22 ILE A 9 13.275 0.643 5.604 1.00 0.00 H new ATOM 0 HG23 ILE A 9 13.070 0.852 7.360 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.727 3.340 7.816 1.00 0.00 H new ATOM 0 HD12 ILE A 9 10.048 3.282 6.066 1.00 0.00 H new ATOM 0 HD13 ILE A 9 10.233 1.813 7.054 1.00 0.00 H new ATOM 163 N ARG A 10 15.069 2.640 4.146 1.00 0.00 N ATOM 164 CA ARG A 10 15.837 1.835 3.214 1.00 0.00 C ATOM 165 C ARG A 10 17.304 1.832 3.601 1.00 0.00 C ATOM 166 O ARG A 10 17.956 0.778 3.606 1.00 0.00 O ATOM 167 CB ARG A 10 15.676 2.348 1.785 1.00 0.00 C ATOM 168 CG ARG A 10 16.418 1.412 0.837 1.00 0.00 C ATOM 169 CD ARG A 10 16.358 1.969 -0.585 1.00 0.00 C ATOM 170 NE ARG A 10 16.734 3.376 -0.573 1.00 0.00 N ATOM 171 CZ ARG A 10 17.923 3.806 -0.163 1.00 0.00 C ATOM 172 NH1 ARG A 10 18.857 2.963 0.181 1.00 0.00 N ATOM 173 NH2 ARG A 10 18.143 5.072 -0.103 1.00 0.00 N ATOM 0 H ARG A 10 14.552 3.409 3.720 1.00 0.00 H new ATOM 0 HA ARG A 10 15.456 0.815 3.258 1.00 0.00 H new ATOM 0 HB2 ARG A 10 14.620 2.395 1.518 1.00 0.00 H new ATOM 0 HB3 ARG A 10 16.071 3.360 1.701 1.00 0.00 H new ATOM 0 HG2 ARG A 10 17.456 1.306 1.153 1.00 0.00 H new ATOM 0 HG3 ARG A 10 15.972 0.418 0.868 1.00 0.00 H new ATOM 0 HD2 ARG A 10 17.029 1.408 -1.235 1.00 0.00 H new ATOM 0 HD3 ARG A 10 15.352 1.854 -0.990 1.00 0.00 H new ATOM 0 HE ARG A 10 16.053 4.064 -0.894 1.00 0.00 H new ATOM 0 HH11 ARG A 10 18.680 1.959 0.137 1.00 0.00 H new ATOM 0 HH12 ARG A 10 19.765 3.307 0.494 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.410 5.730 -0.368 1.00 0.00 H new ATOM 0 HH22 ARG A 10 19.050 5.418 0.210 1.00 0.00 H new ATOM 187 N GLU A 11 17.813 2.995 3.968 1.00 0.00 N ATOM 188 CA GLU A 11 19.190 3.086 4.405 1.00 0.00 C ATOM 189 C GLU A 11 19.357 2.222 5.647 1.00 0.00 C ATOM 190 O GLU A 11 20.326 1.482 5.779 1.00 0.00 O ATOM 191 CB GLU A 11 19.563 4.542 4.727 1.00 0.00 C ATOM 192 CG GLU A 11 19.432 5.435 3.471 1.00 0.00 C ATOM 193 CD GLU A 11 20.407 5.043 2.363 1.00 0.00 C ATOM 194 OE1 GLU A 11 21.385 4.385 2.647 1.00 0.00 O ATOM 195 OE2 GLU A 11 20.166 5.427 1.232 1.00 0.00 O ATOM 0 H GLU A 11 17.300 3.877 3.972 1.00 0.00 H new ATOM 0 HA GLU A 11 19.849 2.738 3.609 1.00 0.00 H new ATOM 0 HB2 GLU A 11 18.915 4.921 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 11 20.585 4.585 5.104 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.412 5.372 3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 11 19.605 6.474 3.750 1.00 0.00 H new ATOM 202 N LYS A 12 18.335 2.228 6.503 1.00 0.00 N ATOM 203 CA LYS A 12 18.328 1.368 7.689 1.00 0.00 C ATOM 204 C LYS A 12 18.361 -0.092 7.270 1.00 0.00 C ATOM 205 O LYS A 12 19.100 -0.905 7.846 1.00 0.00 O ATOM 206 CB LYS A 12 17.070 1.625 8.525 1.00 0.00 C ATOM 207 CG LYS A 12 17.122 3.019 9.135 1.00 0.00 C ATOM 208 CD LYS A 12 15.849 3.261 9.944 1.00 0.00 C ATOM 209 CE LYS A 12 15.841 4.697 10.459 1.00 0.00 C ATOM 210 NZ LYS A 12 16.847 4.845 11.533 1.00 0.00 N ATOM 0 H LYS A 12 17.506 2.814 6.400 1.00 0.00 H new ATOM 0 HA LYS A 12 19.210 1.597 8.288 1.00 0.00 H new ATOM 0 HB2 LYS A 12 16.182 1.526 7.900 1.00 0.00 H new ATOM 0 HB3 LYS A 12 16.989 0.877 9.314 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.998 3.116 9.776 1.00 0.00 H new ATOM 0 HG3 LYS A 12 17.216 3.769 8.350 1.00 0.00 H new ATOM 0 HD2 LYS A 12 14.971 3.081 9.324 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.798 2.563 10.780 1.00 0.00 H new ATOM 0 HE2 LYS A 12 16.060 5.387 9.644 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.851 4.953 10.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 16.715 5.761 12.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.732 4.077 12.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.802 4.802 11.123 1.00 0.00 H new ATOM 224 N LYS A 13 17.595 -0.411 6.235 1.00 0.00 N ATOM 225 CA LYS A 13 17.574 -1.764 5.694 1.00 0.00 C ATOM 226 C LYS A 13 18.897 -2.057 5.021 1.00 0.00 C ATOM 227 O LYS A 13 19.213 -3.211 4.728 1.00 0.00 O ATOM 228 CB LYS A 13 16.449 -1.938 4.659 1.00 0.00 C ATOM 229 CG LYS A 13 15.125 -1.320 5.142 1.00 0.00 C ATOM 230 CD LYS A 13 14.886 -1.601 6.633 1.00 0.00 C ATOM 231 CE LYS A 13 14.618 -3.092 6.837 1.00 0.00 C ATOM 232 NZ LYS A 13 13.680 -3.272 7.963 1.00 0.00 N ATOM 0 H LYS A 13 16.981 0.247 5.754 1.00 0.00 H new ATOM 0 HA LYS A 13 17.399 -2.453 6.521 1.00 0.00 H new ATOM 0 HB2 LYS A 13 16.745 -1.473 3.719 1.00 0.00 H new ATOM 0 HB3 LYS A 13 16.302 -2.999 4.457 1.00 0.00 H new ATOM 0 HG2 LYS A 13 15.141 -0.244 4.971 1.00 0.00 H new ATOM 0 HG3 LYS A 13 14.299 -1.724 4.557 1.00 0.00 H new ATOM 0 HD2 LYS A 13 15.755 -1.294 7.215 1.00 0.00 H new ATOM 0 HD3 LYS A 13 14.039 -1.016 6.992 1.00 0.00 H new ATOM 0 HE2 LYS A 13 14.200 -3.525 5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 13 15.552 -3.616 7.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 13.892 -4.165 8.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 13.782 -2.480 8.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 12.705 -3.298 7.602 1.00 0.00 H new ATOM 246 N LYS A 14 19.668 -1.006 4.768 1.00 0.00 N ATOM 247 CA LYS A 14 20.964 -1.146 4.120 1.00 0.00 C ATOM 248 C LYS A 14 20.772 -1.693 2.710 1.00 0.00 C ATOM 249 O LYS A 14 21.615 -2.431 2.187 1.00 0.00 O ATOM 250 CB LYS A 14 21.838 -2.086 4.957 1.00 0.00 C ATOM 251 CG LYS A 14 21.875 -1.542 6.390 1.00 0.00 C ATOM 252 CD LYS A 14 22.453 -2.586 7.347 1.00 0.00 C ATOM 253 CE LYS A 14 22.268 -2.120 8.815 1.00 0.00 C ATOM 254 NZ LYS A 14 21.324 -0.954 8.894 1.00 0.00 N ATOM 0 H LYS A 14 19.416 -0.046 5.003 1.00 0.00 H new ATOM 0 HA LYS A 14 21.457 -0.177 4.046 1.00 0.00 H new ATOM 0 HB2 LYS A 14 21.432 -3.098 4.943 1.00 0.00 H new ATOM 0 HB3 LYS A 14 22.845 -2.140 4.543 1.00 0.00 H new ATOM 0 HG2 LYS A 14 22.478 -0.635 6.425 1.00 0.00 H new ATOM 0 HG3 LYS A 14 20.869 -1.268 6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 14 21.956 -3.544 7.196 1.00 0.00 H new ATOM 0 HD3 LYS A 14 23.511 -2.739 7.136 1.00 0.00 H new ATOM 0 HE2 LYS A 14 21.885 -2.944 9.417 1.00 0.00 H new ATOM 0 HE3 LYS A 14 23.234 -1.840 9.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 21.256 -0.628 9.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 21.678 -0.180 8.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 20.383 -1.246 8.560 1.00 0.00 H new ATOM 268 N ILE A 15 19.671 -1.297 2.094 1.00 0.00 N ATOM 269 CA ILE A 15 19.351 -1.689 0.730 1.00 0.00 C ATOM 270 C ILE A 15 19.526 -0.502 -0.209 1.00 0.00 C ATOM 271 O ILE A 15 18.967 0.574 0.019 1.00 0.00 O ATOM 272 CB ILE A 15 17.911 -2.281 0.656 1.00 0.00 C ATOM 273 CG1 ILE A 15 17.961 -3.807 0.805 1.00 0.00 C ATOM 274 CG2 ILE A 15 17.235 -1.936 -0.667 1.00 0.00 C ATOM 275 CD1 ILE A 15 18.383 -4.185 2.207 1.00 0.00 C ATOM 0 H ILE A 15 18.972 -0.693 2.526 1.00 0.00 H new ATOM 0 HA ILE A 15 20.040 -2.471 0.410 1.00 0.00 H new ATOM 0 HB ILE A 15 17.333 -1.843 1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 15 16.982 -4.233 0.586 1.00 0.00 H new ATOM 0 HG13 ILE A 15 18.660 -4.227 0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 15 16.233 -2.364 -0.686 1.00 0.00 H new ATOM 0 HG22 ILE A 15 17.169 -0.853 -0.770 1.00 0.00 H new ATOM 0 HG23 ILE A 15 17.819 -2.344 -1.492 1.00 0.00 H new ATOM 0 HD11 ILE A 15 18.414 -5.271 2.297 1.00 0.00 H new ATOM 0 HD12 ILE A 15 19.372 -3.776 2.412 1.00 0.00 H new ATOM 0 HD13 ILE A 15 17.668 -3.781 2.924 1.00 0.00 H new ATOM 287 N SER A 16 20.275 -0.697 -1.277 1.00 0.00 N ATOM 288 CA SER A 16 20.461 0.358 -2.246 1.00 0.00 C ATOM 289 C SER A 16 19.196 0.520 -3.054 1.00 0.00 C ATOM 290 O SER A 16 18.571 -0.478 -3.451 1.00 0.00 O ATOM 291 CB SER A 16 21.652 0.049 -3.177 1.00 0.00 C ATOM 292 OG SER A 16 21.763 1.064 -4.189 1.00 0.00 O ATOM 0 H SER A 16 20.759 -1.569 -1.492 1.00 0.00 H new ATOM 0 HA SER A 16 20.681 1.286 -1.719 1.00 0.00 H new ATOM 0 HB2 SER A 16 22.574 -0.000 -2.597 1.00 0.00 H new ATOM 0 HB3 SER A 16 21.516 -0.927 -3.643 1.00 0.00 H new ATOM 0 HG SER A 16 22.709 1.265 -4.348 1.00 0.00 H new ATOM 298 N GLN A 17 18.865 1.751 -3.401 1.00 0.00 N ATOM 299 CA GLN A 17 17.740 1.965 -4.290 1.00 0.00 C ATOM 300 C GLN A 17 17.997 1.177 -5.553 1.00 0.00 C ATOM 301 O GLN A 17 17.073 0.715 -6.217 1.00 0.00 O ATOM 302 CB GLN A 17 17.569 3.450 -4.641 1.00 0.00 C ATOM 303 CG GLN A 17 18.917 4.060 -5.018 1.00 0.00 C ATOM 304 CD GLN A 17 18.705 5.445 -5.573 1.00 0.00 C ATOM 305 OE1 GLN A 17 19.261 5.781 -6.627 1.00 0.00 O ATOM 306 NE2 GLN A 17 17.916 6.265 -4.955 1.00 0.00 N ATOM 0 H GLN A 17 19.345 2.596 -3.091 1.00 0.00 H new ATOM 0 HA GLN A 17 16.825 1.639 -3.795 1.00 0.00 H new ATOM 0 HB2 GLN A 17 16.868 3.557 -5.469 1.00 0.00 H new ATOM 0 HB3 GLN A 17 17.144 3.985 -3.792 1.00 0.00 H new ATOM 0 HG2 GLN A 17 19.566 4.103 -4.143 1.00 0.00 H new ATOM 0 HG3 GLN A 17 19.418 3.434 -5.756 1.00 0.00 H new ATOM 0 HE21 GLN A 17 17.462 5.980 -4.087 1.00 0.00 H new ATOM 0 HE22 GLN A 17 17.748 7.196 -5.336 1.00 0.00 H new ATOM 315 N SER A 18 19.280 1.020 -5.871 1.00 0.00 N ATOM 316 CA SER A 18 19.691 0.299 -7.051 1.00 0.00 C ATOM 317 C SER A 18 19.192 -1.132 -6.998 1.00 0.00 C ATOM 318 O SER A 18 18.578 -1.611 -7.955 1.00 0.00 O ATOM 319 CB SER A 18 21.216 0.297 -7.135 1.00 0.00 C ATOM 320 OG SER A 18 21.718 1.526 -6.605 1.00 0.00 O ATOM 0 H SER A 18 20.052 1.390 -5.316 1.00 0.00 H new ATOM 0 HA SER A 18 19.268 0.789 -7.928 1.00 0.00 H new ATOM 0 HB2 SER A 18 21.622 -0.546 -6.576 1.00 0.00 H new ATOM 0 HB3 SER A 18 21.535 0.176 -8.170 1.00 0.00 H new ATOM 0 HG SER A 18 21.601 1.535 -5.632 1.00 0.00 H new ATOM 326 N GLU A 19 19.378 -1.797 -5.859 1.00 0.00 N ATOM 327 CA GLU A 19 18.866 -3.145 -5.725 1.00 0.00 C ATOM 328 C GLU A 19 17.360 -3.133 -5.569 1.00 0.00 C ATOM 329 O GLU A 19 16.652 -3.870 -6.240 1.00 0.00 O ATOM 330 CB GLU A 19 19.569 -3.945 -4.592 1.00 0.00 C ATOM 331 CG GLU A 19 19.067 -3.549 -3.188 1.00 0.00 C ATOM 332 CD GLU A 19 19.432 -4.636 -2.202 1.00 0.00 C ATOM 333 OE1 GLU A 19 18.725 -5.618 -2.143 1.00 0.00 O ATOM 334 OE2 GLU A 19 20.425 -4.490 -1.533 1.00 0.00 O ATOM 0 H GLU A 19 19.866 -1.431 -5.041 1.00 0.00 H new ATOM 0 HA GLU A 19 19.102 -3.675 -6.648 1.00 0.00 H new ATOM 0 HB2 GLU A 19 19.401 -5.011 -4.747 1.00 0.00 H new ATOM 0 HB3 GLU A 19 20.645 -3.780 -4.649 1.00 0.00 H new ATOM 0 HG2 GLU A 19 19.512 -2.602 -2.884 1.00 0.00 H new ATOM 0 HG3 GLU A 19 17.987 -3.403 -3.203 1.00 0.00 H new ATOM 341 N LEU A 20 16.877 -2.231 -4.736 1.00 0.00 N ATOM 342 CA LEU A 20 15.455 -2.137 -4.437 1.00 0.00 C ATOM 343 C LEU A 20 14.672 -1.857 -5.713 1.00 0.00 C ATOM 344 O LEU A 20 13.664 -2.512 -5.986 1.00 0.00 O ATOM 345 CB LEU A 20 15.203 -1.017 -3.420 1.00 0.00 C ATOM 346 CG LEU A 20 13.710 -0.982 -3.027 1.00 0.00 C ATOM 347 CD1 LEU A 20 13.359 -2.204 -2.173 1.00 0.00 C ATOM 348 CD2 LEU A 20 13.401 0.295 -2.249 1.00 0.00 C ATOM 0 H LEU A 20 17.453 -1.545 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 20 15.122 -3.085 -4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 20 15.817 -1.176 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 20 15.498 -0.057 -3.844 1.00 0.00 H new ATOM 0 HG LEU A 20 13.110 -1.000 -3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 20 12.304 -2.168 -1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 20 13.557 -3.113 -2.740 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.966 -2.202 -1.268 1.00 0.00 H new ATOM 0 HD21 LEU A 20 12.346 0.309 -1.977 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.009 0.326 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 20 13.627 1.163 -2.869 1.00 0.00 H new ATOM 360 N ALA A 21 15.179 -0.956 -6.539 1.00 0.00 N ATOM 361 CA ALA A 21 14.540 -0.698 -7.814 1.00 0.00 C ATOM 362 C ALA A 21 14.496 -1.995 -8.609 1.00 0.00 C ATOM 363 O ALA A 21 13.451 -2.382 -9.150 1.00 0.00 O ATOM 364 CB ALA A 21 15.314 0.369 -8.597 1.00 0.00 C ATOM 0 H ALA A 21 16.015 -0.402 -6.353 1.00 0.00 H new ATOM 0 HA ALA A 21 13.528 -0.329 -7.645 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.820 0.550 -9.552 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.341 1.294 -8.022 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.332 0.022 -8.775 1.00 0.00 H new ATOM 370 N ALA A 22 15.600 -2.722 -8.559 1.00 0.00 N ATOM 371 CA ALA A 22 15.667 -4.036 -9.160 1.00 0.00 C ATOM 372 C ALA A 22 14.731 -4.990 -8.446 1.00 0.00 C ATOM 373 O ALA A 22 14.097 -5.835 -9.079 1.00 0.00 O ATOM 374 CB ALA A 22 17.098 -4.579 -9.138 1.00 0.00 C ATOM 0 H ALA A 22 16.462 -2.420 -8.106 1.00 0.00 H new ATOM 0 HA ALA A 22 15.354 -3.948 -10.200 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.119 -5.568 -9.596 1.00 0.00 H new ATOM 0 HB2 ALA A 22 17.751 -3.907 -9.695 1.00 0.00 H new ATOM 0 HB3 ALA A 22 17.445 -4.649 -8.107 1.00 0.00 H new ATOM 380 N LEU A 23 14.650 -4.869 -7.119 1.00 0.00 N ATOM 381 CA LEU A 23 13.784 -5.752 -6.347 1.00 0.00 C ATOM 382 C LEU A 23 12.361 -5.517 -6.805 1.00 0.00 C ATOM 383 O LEU A 23 11.600 -6.454 -7.068 1.00 0.00 O ATOM 384 CB LEU A 23 13.837 -5.403 -4.842 1.00 0.00 C ATOM 385 CG LEU A 23 15.242 -5.584 -4.247 1.00 0.00 C ATOM 386 CD1 LEU A 23 15.226 -5.257 -2.757 1.00 0.00 C ATOM 387 CD2 LEU A 23 15.772 -6.990 -4.480 1.00 0.00 C ATOM 0 H LEU A 23 15.164 -4.181 -6.568 1.00 0.00 H new ATOM 0 HA LEU A 23 14.110 -6.782 -6.495 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.515 -4.371 -4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 23 13.132 -6.034 -4.301 1.00 0.00 H new ATOM 0 HG LEU A 23 15.914 -4.893 -4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.226 -5.388 -2.345 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.908 -4.224 -2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.532 -5.924 -2.245 1.00 0.00 H new ATOM 0 HD21 LEU A 23 16.768 -7.080 -4.045 1.00 0.00 H new ATOM 0 HD22 LEU A 23 15.104 -7.713 -4.011 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.824 -7.186 -5.551 1.00 0.00 H new ATOM 399 N LEU A 24 12.037 -4.244 -6.953 1.00 0.00 N ATOM 400 CA LEU A 24 10.737 -3.810 -7.425 1.00 0.00 C ATOM 401 C LEU A 24 10.530 -4.132 -8.874 1.00 0.00 C ATOM 402 O LEU A 24 9.383 -4.200 -9.330 1.00 0.00 O ATOM 403 CB LEU A 24 10.509 -2.320 -7.164 1.00 0.00 C ATOM 404 CG LEU A 24 9.855 -2.129 -5.785 1.00 0.00 C ATOM 405 CD1 LEU A 24 10.557 -3.000 -4.737 1.00 0.00 C ATOM 406 CD2 LEU A 24 9.949 -0.659 -5.375 1.00 0.00 C ATOM 0 H LEU A 24 12.676 -3.477 -6.746 1.00 0.00 H new ATOM 0 HA LEU A 24 9.996 -4.369 -6.853 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.458 -1.785 -7.205 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.871 -1.898 -7.941 1.00 0.00 H new ATOM 0 HG LEU A 24 8.808 -2.427 -5.846 1.00 0.00 H new ATOM 0 HD11 LEU A 24 10.083 -2.854 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 24 10.480 -4.049 -5.025 1.00 0.00 H new ATOM 0 HD13 LEU A 24 11.608 -2.717 -4.674 1.00 0.00 H new ATOM 0 HD21 LEU A 24 9.486 -0.523 -4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 24 10.996 -0.362 -5.324 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.432 -0.042 -6.110 1.00 0.00 H new ATOM 418 N GLU A 25 11.635 -4.205 -9.611 1.00 0.00 N ATOM 419 CA GLU A 25 11.614 -4.392 -11.055 1.00 0.00 C ATOM 420 C GLU A 25 11.353 -3.050 -11.731 1.00 0.00 C ATOM 421 O GLU A 25 10.729 -2.978 -12.793 1.00 0.00 O ATOM 422 CB GLU A 25 10.539 -5.432 -11.439 1.00 0.00 C ATOM 423 CG GLU A 25 10.871 -6.768 -10.749 1.00 0.00 C ATOM 424 CD GLU A 25 9.716 -7.738 -10.863 1.00 0.00 C ATOM 425 OE1 GLU A 25 8.594 -7.324 -10.669 1.00 0.00 O ATOM 426 OE2 GLU A 25 9.965 -8.888 -11.117 1.00 0.00 O ATOM 0 H GLU A 25 12.574 -4.135 -9.219 1.00 0.00 H new ATOM 0 HA GLU A 25 12.578 -4.771 -11.394 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.552 -5.085 -11.134 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.510 -5.563 -12.521 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.762 -7.203 -11.201 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.100 -6.592 -9.698 1.00 0.00 H new ATOM 433 N VAL A 26 11.878 -1.993 -11.115 1.00 0.00 N ATOM 434 CA VAL A 26 11.785 -0.627 -11.637 1.00 0.00 C ATOM 435 C VAL A 26 13.165 0.030 -11.662 1.00 0.00 C ATOM 436 O VAL A 26 14.112 -0.481 -11.066 1.00 0.00 O ATOM 437 CB VAL A 26 10.816 0.217 -10.795 1.00 0.00 C ATOM 438 CG1 VAL A 26 9.407 -0.379 -10.870 1.00 0.00 C ATOM 439 CG2 VAL A 26 11.286 0.251 -9.334 1.00 0.00 C ATOM 0 H VAL A 26 12.385 -2.059 -10.232 1.00 0.00 H new ATOM 0 HA VAL A 26 11.400 -0.681 -12.655 1.00 0.00 H new ATOM 0 HB VAL A 26 10.797 1.233 -11.188 1.00 0.00 H new ATOM 0 HG11 VAL A 26 8.725 0.224 -10.271 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.070 -0.387 -11.907 1.00 0.00 H new ATOM 0 HG13 VAL A 26 9.422 -1.399 -10.486 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.594 0.851 -8.743 1.00 0.00 H new ATOM 0 HG22 VAL A 26 11.316 -0.764 -8.938 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.282 0.690 -9.282 1.00 0.00 H new ATOM 449 N SER A 27 13.267 1.168 -12.326 1.00 0.00 N ATOM 450 CA SER A 27 14.519 1.916 -12.389 1.00 0.00 C ATOM 451 C SER A 27 14.786 2.661 -11.072 1.00 0.00 C ATOM 452 O SER A 27 13.864 2.859 -10.265 1.00 0.00 O ATOM 453 CB SER A 27 14.459 2.892 -13.562 1.00 0.00 C ATOM 454 OG SER A 27 13.201 3.587 -13.549 1.00 0.00 O ATOM 0 H SER A 27 12.495 1.600 -12.834 1.00 0.00 H new ATOM 0 HA SER A 27 15.343 1.219 -12.540 1.00 0.00 H new ATOM 0 HB2 SER A 27 15.280 3.605 -13.497 1.00 0.00 H new ATOM 0 HB3 SER A 27 14.579 2.354 -14.502 1.00 0.00 H new ATOM 0 HG SER A 27 12.925 3.746 -12.622 1.00 0.00 H new ATOM 460 N ARG A 28 16.025 3.136 -10.878 1.00 0.00 N ATOM 461 CA ARG A 28 16.363 3.911 -9.677 1.00 0.00 C ATOM 462 C ARG A 28 15.564 5.178 -9.620 1.00 0.00 C ATOM 463 O ARG A 28 15.157 5.607 -8.545 1.00 0.00 O ATOM 464 CB ARG A 28 17.848 4.273 -9.628 1.00 0.00 C ATOM 465 CG ARG A 28 18.681 3.038 -9.332 1.00 0.00 C ATOM 466 CD ARG A 28 20.162 3.420 -9.382 1.00 0.00 C ATOM 467 NE ARG A 28 20.454 4.441 -8.375 1.00 0.00 N ATOM 468 CZ ARG A 28 21.647 5.032 -8.297 1.00 0.00 C ATOM 469 NH1 ARG A 28 22.597 4.696 -9.123 1.00 0.00 N ATOM 470 NH2 ARG A 28 21.851 5.945 -7.396 1.00 0.00 N ATOM 0 H ARG A 28 16.799 2.999 -11.528 1.00 0.00 H new ATOM 0 HA ARG A 28 16.125 3.277 -8.822 1.00 0.00 H new ATOM 0 HB2 ARG A 28 18.155 4.708 -10.579 1.00 0.00 H new ATOM 0 HB3 ARG A 28 18.020 5.029 -8.862 1.00 0.00 H new ATOM 0 HG2 ARG A 28 18.427 2.638 -8.350 1.00 0.00 H new ATOM 0 HG3 ARG A 28 18.468 2.255 -10.060 1.00 0.00 H new ATOM 0 HD2 ARG A 28 20.779 2.539 -9.206 1.00 0.00 H new ATOM 0 HD3 ARG A 28 20.416 3.794 -10.374 1.00 0.00 H new ATOM 0 HE ARG A 28 19.724 4.708 -7.714 1.00 0.00 H new ATOM 0 HH11 ARG A 28 22.429 3.980 -9.830 1.00 0.00 H new ATOM 0 HH12 ARG A 28 23.509 5.149 -9.063 1.00 0.00 H new ATOM 0 HH21 ARG A 28 21.102 6.205 -6.755 1.00 0.00 H new ATOM 0 HH22 ARG A 28 22.761 6.402 -7.330 1.00 0.00 H new ATOM 484 N GLN A 29 15.369 5.799 -10.764 1.00 0.00 N ATOM 485 CA GLN A 29 14.634 7.040 -10.821 1.00 0.00 C ATOM 486 C GLN A 29 13.251 6.824 -10.250 1.00 0.00 C ATOM 487 O GLN A 29 12.734 7.658 -9.499 1.00 0.00 O ATOM 488 CB GLN A 29 14.556 7.553 -12.260 1.00 0.00 C ATOM 489 CG GLN A 29 15.954 8.025 -12.699 1.00 0.00 C ATOM 490 CD GLN A 29 15.937 8.489 -14.146 1.00 0.00 C ATOM 491 OE1 GLN A 29 14.928 8.203 -14.905 1.00 0.00 O flip ATOM 492 NE2 GLN A 29 16.887 9.130 -14.597 1.00 0.00 N flip ATOM 0 H GLN A 29 15.710 5.463 -11.665 1.00 0.00 H new ATOM 0 HA GLN A 29 15.151 7.795 -10.229 1.00 0.00 H new ATOM 0 HB2 GLN A 29 14.200 6.764 -12.922 1.00 0.00 H new ATOM 0 HB3 GLN A 29 13.842 8.374 -12.329 1.00 0.00 H new ATOM 0 HG2 GLN A 29 16.287 8.839 -12.055 1.00 0.00 H new ATOM 0 HG3 GLN A 29 16.671 7.212 -12.581 1.00 0.00 H new ATOM 0 HE21 GLN A 29 17.681 9.355 -13.998 1.00 0.00 H new ATOM 0 HE22 GLN A 29 16.880 9.436 -15.570 1.00 0.00 H new ATOM 501 N THR A 30 12.711 5.648 -10.501 1.00 0.00 N ATOM 502 CA THR A 30 11.436 5.288 -9.944 1.00 0.00 C ATOM 503 C THR A 30 11.521 5.359 -8.419 1.00 0.00 C ATOM 504 O THR A 30 10.729 6.058 -7.769 1.00 0.00 O ATOM 505 CB THR A 30 11.082 3.855 -10.368 1.00 0.00 C ATOM 506 OG1 THR A 30 11.908 3.463 -11.473 1.00 0.00 O ATOM 507 CG2 THR A 30 9.612 3.794 -10.774 1.00 0.00 C ATOM 0 H THR A 30 13.139 4.931 -11.087 1.00 0.00 H new ATOM 0 HA THR A 30 10.669 5.973 -10.304 1.00 0.00 H new ATOM 0 HB THR A 30 11.254 3.175 -9.534 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.348 3.080 -12.180 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.360 2.777 -11.075 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.989 4.088 -9.929 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.436 4.474 -11.608 1.00 0.00 H new ATOM 515 N ILE A 31 12.539 4.694 -7.864 1.00 0.00 N ATOM 516 CA ILE A 31 12.773 4.709 -6.431 1.00 0.00 C ATOM 517 C ILE A 31 13.131 6.106 -5.968 1.00 0.00 C ATOM 518 O ILE A 31 12.624 6.582 -4.957 1.00 0.00 O ATOM 519 CB ILE A 31 13.932 3.747 -6.082 1.00 0.00 C ATOM 520 CG1 ILE A 31 13.538 2.297 -6.385 1.00 0.00 C ATOM 521 CG2 ILE A 31 14.291 3.869 -4.594 1.00 0.00 C ATOM 522 CD1 ILE A 31 12.334 1.894 -5.532 1.00 0.00 C ATOM 0 H ILE A 31 13.212 4.139 -8.394 1.00 0.00 H new ATOM 0 HA ILE A 31 11.861 4.389 -5.927 1.00 0.00 H new ATOM 0 HB ILE A 31 14.794 4.020 -6.691 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.297 2.190 -7.443 1.00 0.00 H new ATOM 0 HG13 ILE A 31 14.378 1.633 -6.181 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.108 3.187 -4.360 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.598 4.892 -4.377 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.421 3.615 -3.988 1.00 0.00 H new ATOM 0 HD11 ILE A 31 12.060 0.862 -5.753 1.00 0.00 H new ATOM 0 HD12 ILE A 31 12.590 1.983 -4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 31 11.493 2.549 -5.758 1.00 0.00 H new ATOM 534 N ASN A 32 14.011 6.756 -6.710 1.00 0.00 N ATOM 535 CA ASN A 32 14.530 8.056 -6.294 1.00 0.00 C ATOM 536 C ASN A 32 13.421 9.064 -6.162 1.00 0.00 C ATOM 537 O ASN A 32 13.339 9.783 -5.160 1.00 0.00 O ATOM 538 CB ASN A 32 15.557 8.569 -7.303 1.00 0.00 C ATOM 539 CG ASN A 32 16.916 7.949 -7.029 1.00 0.00 C ATOM 540 OD1 ASN A 32 17.662 8.448 -6.182 1.00 0.00 O ATOM 541 ND2 ASN A 32 17.286 6.876 -7.661 1.00 0.00 N ATOM 0 H ASN A 32 14.381 6.412 -7.596 1.00 0.00 H new ATOM 0 HA ASN A 32 15.007 7.925 -5.322 1.00 0.00 H new ATOM 0 HB2 ASN A 32 15.236 8.326 -8.316 1.00 0.00 H new ATOM 0 HB3 ASN A 32 15.626 9.655 -7.243 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.190 6.450 -7.456 1.00 0.00 H new ATOM 0 HD22 ASN A 32 16.673 6.460 -8.362 1.00 0.00 H new ATOM 548 N GLY A 33 12.514 9.063 -7.121 1.00 0.00 N ATOM 549 CA GLY A 33 11.377 9.949 -7.054 1.00 0.00 C ATOM 550 C GLY A 33 10.600 9.669 -5.786 1.00 0.00 C ATOM 551 O GLY A 33 10.226 10.590 -5.052 1.00 0.00 O ATOM 0 H GLY A 33 12.545 8.464 -7.946 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.709 10.987 -7.069 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.738 9.806 -7.925 1.00 0.00 H new ATOM 555 N ILE A 34 10.421 8.400 -5.489 1.00 0.00 N ATOM 556 CA ILE A 34 9.747 8.002 -4.267 1.00 0.00 C ATOM 557 C ILE A 34 10.558 8.431 -3.035 1.00 0.00 C ATOM 558 O ILE A 34 9.999 8.972 -2.066 1.00 0.00 O ATOM 559 CB ILE A 34 9.506 6.479 -4.268 1.00 0.00 C ATOM 560 CG1 ILE A 34 8.498 6.126 -5.362 1.00 0.00 C ATOM 561 CG2 ILE A 34 8.955 6.018 -2.913 1.00 0.00 C ATOM 562 CD1 ILE A 34 8.420 4.606 -5.506 1.00 0.00 C ATOM 0 H ILE A 34 10.732 7.625 -6.075 1.00 0.00 H new ATOM 0 HA ILE A 34 8.781 8.504 -4.220 1.00 0.00 H new ATOM 0 HB ILE A 34 10.455 5.977 -4.454 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.517 6.530 -5.112 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.797 6.577 -6.308 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.792 4.941 -2.934 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.670 6.261 -2.127 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.011 6.524 -2.713 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.702 4.351 -6.285 1.00 0.00 H new ATOM 0 HD12 ILE A 34 9.401 4.215 -5.775 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.101 4.167 -4.561 1.00 0.00 H new ATOM 574 N GLU A 35 11.872 8.206 -3.073 1.00 0.00 N ATOM 575 CA GLU A 35 12.724 8.555 -1.939 1.00 0.00 C ATOM 576 C GLU A 35 12.723 10.052 -1.720 1.00 0.00 C ATOM 577 O GLU A 35 12.552 10.531 -0.592 1.00 0.00 O ATOM 578 CB GLU A 35 14.158 8.068 -2.146 1.00 0.00 C ATOM 579 CG GLU A 35 14.178 6.549 -2.325 1.00 0.00 C ATOM 580 CD GLU A 35 15.569 6.038 -2.046 1.00 0.00 C ATOM 581 OE1 GLU A 35 16.405 6.110 -2.920 1.00 0.00 O ATOM 582 OE2 GLU A 35 15.794 5.602 -0.940 1.00 0.00 O ATOM 0 H GLU A 35 12.362 7.790 -3.865 1.00 0.00 H new ATOM 0 HA GLU A 35 12.317 8.059 -1.058 1.00 0.00 H new ATOM 0 HB2 GLU A 35 14.591 8.551 -3.022 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.773 8.349 -1.291 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.463 6.081 -1.649 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.877 6.286 -3.339 1.00 0.00 H new ATOM 589 N LYS A 36 12.783 10.789 -2.808 1.00 0.00 N ATOM 590 CA LYS A 36 12.667 12.237 -2.743 1.00 0.00 C ATOM 591 C LYS A 36 11.218 12.628 -2.500 1.00 0.00 C ATOM 592 O LYS A 36 10.896 13.802 -2.348 1.00 0.00 O ATOM 593 CB LYS A 36 13.219 12.890 -4.015 1.00 0.00 C ATOM 594 CG LYS A 36 14.750 13.010 -3.899 1.00 0.00 C ATOM 595 CD LYS A 36 15.419 11.670 -4.254 1.00 0.00 C ATOM 596 CE LYS A 36 16.899 11.709 -3.843 1.00 0.00 C ATOM 597 NZ LYS A 36 17.563 12.875 -4.484 1.00 0.00 N ATOM 0 H LYS A 36 12.911 10.414 -3.748 1.00 0.00 H new ATOM 0 HA LYS A 36 13.266 12.602 -1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 36 12.954 12.294 -4.888 1.00 0.00 H new ATOM 0 HB3 LYS A 36 12.775 13.875 -4.155 1.00 0.00 H new ATOM 0 HG2 LYS A 36 15.112 13.793 -4.566 1.00 0.00 H new ATOM 0 HG3 LYS A 36 15.023 13.303 -2.885 1.00 0.00 H new ATOM 0 HD2 LYS A 36 14.911 10.852 -3.744 1.00 0.00 H new ATOM 0 HD3 LYS A 36 15.333 11.481 -5.324 1.00 0.00 H new ATOM 0 HE2 LYS A 36 16.984 11.780 -2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 36 17.395 10.785 -4.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 18.595 12.757 -4.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.268 12.938 -5.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 17.291 13.747 -3.986 1.00 0.00 H new ATOM 611 N ASN A 37 10.349 11.628 -2.470 1.00 0.00 N ATOM 612 CA ASN A 37 8.921 11.833 -2.241 1.00 0.00 C ATOM 613 C ASN A 37 8.327 12.718 -3.319 1.00 0.00 C ATOM 614 O ASN A 37 7.371 13.461 -3.078 1.00 0.00 O ATOM 615 CB ASN A 37 8.648 12.435 -0.843 1.00 0.00 C ATOM 616 CG ASN A 37 8.919 11.413 0.265 1.00 0.00 C ATOM 617 OD1 ASN A 37 9.817 10.491 0.097 1.00 0.00 O flip ATOM 618 ND2 ASN A 37 8.297 11.465 1.327 1.00 0.00 N flip ATOM 0 H ASN A 37 10.611 10.651 -2.603 1.00 0.00 H new ATOM 0 HA ASN A 37 8.441 10.855 -2.283 1.00 0.00 H new ATOM 0 HB2 ASN A 37 9.277 13.312 -0.693 1.00 0.00 H new ATOM 0 HB3 ASN A 37 7.613 12.771 -0.785 1.00 0.00 H new ATOM 0 HD21 ASN A 37 7.589 12.186 1.469 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.490 10.787 2.065 1.00 0.00 H new ATOM 625 N LYS A 38 8.846 12.573 -4.525 1.00 0.00 N ATOM 626 CA LYS A 38 8.323 13.272 -5.688 1.00 0.00 C ATOM 627 C LYS A 38 6.896 12.803 -5.924 1.00 0.00 C ATOM 628 O LYS A 38 5.967 13.598 -6.095 1.00 0.00 O ATOM 629 CB LYS A 38 9.201 12.939 -6.903 1.00 0.00 C ATOM 630 CG LYS A 38 8.784 13.771 -8.123 1.00 0.00 C ATOM 631 CD LYS A 38 9.699 13.423 -9.310 1.00 0.00 C ATOM 632 CE LYS A 38 11.116 13.983 -9.075 1.00 0.00 C ATOM 633 NZ LYS A 38 11.033 15.356 -8.521 1.00 0.00 N ATOM 0 H LYS A 38 9.642 11.968 -4.727 1.00 0.00 H new ATOM 0 HA LYS A 38 8.331 14.351 -5.531 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.247 13.133 -6.665 1.00 0.00 H new ATOM 0 HB3 LYS A 38 9.119 11.877 -7.136 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.744 13.568 -8.378 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.854 14.834 -7.894 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.745 12.342 -9.438 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.285 13.836 -10.230 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.662 13.337 -8.388 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.672 13.993 -10.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 11.903 15.877 -8.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.215 15.848 -8.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.923 15.307 -7.488 1.00 0.00 H new ATOM 647 N TYR A 39 6.737 11.507 -5.810 1.00 0.00 N ATOM 648 CA TYR A 39 5.459 10.837 -5.894 1.00 0.00 C ATOM 649 C TYR A 39 5.492 9.623 -4.985 1.00 0.00 C ATOM 650 O TYR A 39 6.572 9.165 -4.594 1.00 0.00 O ATOM 651 CB TYR A 39 5.168 10.418 -7.344 1.00 0.00 C ATOM 652 CG TYR A 39 6.359 9.671 -7.888 1.00 0.00 C ATOM 653 CD1 TYR A 39 6.448 8.281 -7.744 1.00 0.00 C ATOM 654 CD2 TYR A 39 7.384 10.375 -8.525 1.00 0.00 C ATOM 655 CE1 TYR A 39 7.562 7.600 -8.237 1.00 0.00 C ATOM 656 CE2 TYR A 39 8.495 9.693 -9.015 1.00 0.00 C ATOM 657 CZ TYR A 39 8.585 8.307 -8.873 1.00 0.00 C ATOM 658 OH TYR A 39 9.686 7.642 -9.352 1.00 0.00 O ATOM 0 H TYR A 39 7.516 10.868 -5.651 1.00 0.00 H new ATOM 0 HA TYR A 39 4.665 11.513 -5.577 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.279 9.788 -7.383 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.963 11.297 -7.956 1.00 0.00 H new ATOM 0 HD1 TYR A 39 5.656 7.737 -7.252 1.00 0.00 H new ATOM 0 HD2 TYR A 39 7.315 11.447 -8.637 1.00 0.00 H new ATOM 0 HE1 TYR A 39 7.633 6.528 -8.127 1.00 0.00 H new ATOM 0 HE2 TYR A 39 9.288 10.237 -9.506 1.00 0.00 H new ATOM 0 HH TYR A 39 10.329 7.507 -8.625 1.00 0.00 H new ATOM 668 N ASN A 40 4.337 9.129 -4.614 1.00 0.00 N ATOM 669 CA ASN A 40 4.262 7.982 -3.722 1.00 0.00 C ATOM 670 C ASN A 40 4.346 6.692 -4.519 1.00 0.00 C ATOM 671 O ASN A 40 4.109 6.689 -5.728 1.00 0.00 O ATOM 672 CB ASN A 40 2.970 8.020 -2.905 1.00 0.00 C ATOM 673 CG ASN A 40 3.056 9.102 -1.843 1.00 0.00 C ATOM 674 OD1 ASN A 40 2.309 10.079 -1.890 1.00 0.00 O ATOM 675 ND2 ASN A 40 3.918 8.992 -0.872 1.00 0.00 N ATOM 0 H ASN A 40 3.433 9.497 -4.911 1.00 0.00 H new ATOM 0 HA ASN A 40 5.105 8.023 -3.032 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.121 8.210 -3.561 1.00 0.00 H new ATOM 0 HB3 ASN A 40 2.799 7.051 -2.435 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.972 9.714 -0.154 1.00 0.00 H new ATOM 0 HD22 ASN A 40 4.539 8.184 -0.830 1.00 0.00 H new ATOM 682 N PRO A 41 4.715 5.608 -3.888 1.00 0.00 N ATOM 683 CA PRO A 41 4.841 4.303 -4.593 1.00 0.00 C ATOM 684 C PRO A 41 3.487 3.745 -4.983 1.00 0.00 C ATOM 685 O PRO A 41 2.493 3.938 -4.267 1.00 0.00 O ATOM 686 CB PRO A 41 5.491 3.365 -3.571 1.00 0.00 C ATOM 687 CG PRO A 41 5.860 4.220 -2.407 1.00 0.00 C ATOM 688 CD PRO A 41 4.945 5.436 -2.451 1.00 0.00 C ATOM 0 HA PRO A 41 5.417 4.411 -5.512 1.00 0.00 H new ATOM 0 HB2 PRO A 41 4.802 2.575 -3.272 1.00 0.00 H new ATOM 0 HB3 PRO A 41 6.371 2.878 -3.992 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.735 3.675 -1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.906 4.520 -2.464 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.015 5.264 -1.909 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.415 6.314 -2.007 1.00 0.00 H new ATOM 696 N SER A 42 3.485 2.928 -6.008 1.00 0.00 N ATOM 697 CA SER A 42 2.314 2.172 -6.353 1.00 0.00 C ATOM 698 C SER A 42 2.116 1.113 -5.261 1.00 0.00 C ATOM 699 O SER A 42 3.081 0.751 -4.576 1.00 0.00 O ATOM 700 CB SER A 42 2.523 1.506 -7.706 1.00 0.00 C ATOM 701 OG SER A 42 3.174 2.426 -8.587 1.00 0.00 O ATOM 0 H SER A 42 4.287 2.772 -6.618 1.00 0.00 H new ATOM 0 HA SER A 42 1.435 2.813 -6.421 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.125 0.605 -7.592 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.565 1.198 -8.125 1.00 0.00 H new ATOM 0 HG SER A 42 3.313 2.001 -9.459 1.00 0.00 H new ATOM 707 N LEU A 43 0.896 0.653 -5.059 1.00 0.00 N ATOM 708 CA LEU A 43 0.628 -0.296 -3.981 1.00 0.00 C ATOM 709 C LEU A 43 1.435 -1.563 -4.198 1.00 0.00 C ATOM 710 O LEU A 43 2.086 -2.064 -3.278 1.00 0.00 O ATOM 711 CB LEU A 43 -0.868 -0.645 -3.919 1.00 0.00 C ATOM 712 CG LEU A 43 -1.134 -1.635 -2.765 1.00 0.00 C ATOM 713 CD1 LEU A 43 -0.723 -1.014 -1.431 1.00 0.00 C ATOM 714 CD2 LEU A 43 -2.622 -1.990 -2.719 1.00 0.00 C ATOM 0 H LEU A 43 0.081 0.913 -5.615 1.00 0.00 H new ATOM 0 HA LEU A 43 0.918 0.167 -3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.455 0.262 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.187 -1.083 -4.865 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.547 -2.537 -2.937 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.916 -1.722 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.339 -0.771 -1.455 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.299 -0.105 -1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.804 -2.689 -1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.207 -1.085 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.916 -2.450 -3.663 1.00 0.00 H new ATOM 726 N GLN A 44 1.459 -2.032 -5.436 1.00 0.00 N ATOM 727 CA GLN A 44 2.242 -3.209 -5.771 1.00 0.00 C ATOM 728 C GLN A 44 3.709 -2.947 -5.466 1.00 0.00 C ATOM 729 O GLN A 44 4.370 -3.759 -4.816 1.00 0.00 O ATOM 730 CB GLN A 44 2.065 -3.530 -7.263 1.00 0.00 C ATOM 731 CG GLN A 44 2.851 -4.786 -7.653 1.00 0.00 C ATOM 732 CD GLN A 44 2.558 -5.135 -9.115 1.00 0.00 C ATOM 733 OE1 GLN A 44 3.392 -5.863 -9.784 1.00 0.00 O flip ATOM 734 NE2 GLN A 44 1.532 -4.717 -9.664 1.00 0.00 N flip ATOM 0 H GLN A 44 0.950 -1.620 -6.218 1.00 0.00 H new ATOM 0 HA GLN A 44 1.901 -4.058 -5.178 1.00 0.00 H new ATOM 0 HB2 GLN A 44 1.008 -3.675 -7.484 1.00 0.00 H new ATOM 0 HB3 GLN A 44 2.403 -2.685 -7.863 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.919 -4.618 -7.515 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.573 -5.618 -7.006 1.00 0.00 H new ATOM 0 HE21 GLN A 44 0.871 -4.143 -9.141 1.00 0.00 H new ATOM 0 HE22 GLN A 44 1.346 -4.947 -10.640 1.00 0.00 H new ATOM 743 N LEU A 45 4.197 -1.778 -5.872 1.00 0.00 N ATOM 744 CA LEU A 45 5.570 -1.401 -5.574 1.00 0.00 C ATOM 745 C LEU A 45 5.765 -1.262 -4.077 1.00 0.00 C ATOM 746 O LEU A 45 6.744 -1.757 -3.521 1.00 0.00 O ATOM 747 CB LEU A 45 5.935 -0.077 -6.263 1.00 0.00 C ATOM 748 CG LEU A 45 6.012 -0.270 -7.787 1.00 0.00 C ATOM 749 CD1 LEU A 45 6.119 1.095 -8.464 1.00 0.00 C ATOM 750 CD2 LEU A 45 7.258 -1.090 -8.142 1.00 0.00 C ATOM 0 H LEU A 45 3.668 -1.085 -6.401 1.00 0.00 H new ATOM 0 HA LEU A 45 6.224 -2.187 -5.952 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.191 0.682 -6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.892 0.284 -5.887 1.00 0.00 H new ATOM 0 HG LEU A 45 5.117 -0.791 -8.127 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.174 0.962 -9.544 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.243 1.694 -8.216 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.017 1.605 -8.115 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.309 -1.225 -9.222 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.149 -0.564 -7.799 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.202 -2.065 -7.657 1.00 0.00 H new ATOM 762 N ALA A 46 4.806 -0.615 -3.424 1.00 0.00 N ATOM 763 CA ALA A 46 4.877 -0.394 -1.989 1.00 0.00 C ATOM 764 C ALA A 46 4.941 -1.712 -1.248 1.00 0.00 C ATOM 765 O ALA A 46 5.812 -1.918 -0.397 1.00 0.00 O ATOM 766 CB ALA A 46 3.674 0.432 -1.514 1.00 0.00 C ATOM 0 H ALA A 46 3.970 -0.235 -3.868 1.00 0.00 H new ATOM 0 HA ALA A 46 5.788 0.164 -1.772 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.742 0.588 -0.437 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.672 1.397 -2.022 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.752 -0.102 -1.745 1.00 0.00 H new ATOM 772 N LEU A 47 4.059 -2.624 -1.611 1.00 0.00 N ATOM 773 CA LEU A 47 4.070 -3.940 -1.011 1.00 0.00 C ATOM 774 C LEU A 47 5.356 -4.677 -1.329 1.00 0.00 C ATOM 775 O LEU A 47 5.974 -5.260 -0.434 1.00 0.00 O ATOM 776 CB LEU A 47 2.850 -4.754 -1.394 1.00 0.00 C ATOM 777 CG LEU A 47 1.604 -4.167 -0.713 1.00 0.00 C ATOM 778 CD1 LEU A 47 0.351 -4.835 -1.270 1.00 0.00 C ATOM 779 CD2 LEU A 47 1.683 -4.425 0.796 1.00 0.00 C ATOM 0 H LEU A 47 3.333 -2.478 -2.312 1.00 0.00 H new ATOM 0 HA LEU A 47 4.026 -3.800 0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.722 -4.748 -2.476 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.985 -5.793 -1.094 1.00 0.00 H new ATOM 0 HG LEU A 47 1.560 -3.095 -0.904 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.531 -4.416 -0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.292 -4.659 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.395 -5.907 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.801 -4.010 1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.728 -5.498 0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.577 -3.950 1.200 1.00 0.00 H new ATOM 791 N LYS A 48 5.850 -4.545 -2.566 1.00 0.00 N ATOM 792 CA LYS A 48 7.143 -5.131 -2.863 1.00 0.00 C ATOM 793 C LYS A 48 8.192 -4.552 -1.930 1.00 0.00 C ATOM 794 O LYS A 48 9.017 -5.279 -1.376 1.00 0.00 O ATOM 795 CB LYS A 48 7.609 -4.825 -4.292 1.00 0.00 C ATOM 796 CG LYS A 48 6.869 -5.638 -5.348 1.00 0.00 C ATOM 797 CD LYS A 48 7.463 -5.246 -6.719 1.00 0.00 C ATOM 798 CE LYS A 48 6.877 -6.085 -7.846 1.00 0.00 C ATOM 799 NZ LYS A 48 7.508 -5.703 -9.149 1.00 0.00 N ATOM 0 H LYS A 48 5.393 -4.060 -3.338 1.00 0.00 H new ATOM 0 HA LYS A 48 7.030 -6.208 -2.740 1.00 0.00 H new ATOM 0 HB2 LYS A 48 7.468 -3.763 -4.494 1.00 0.00 H new ATOM 0 HB3 LYS A 48 8.678 -5.025 -4.370 1.00 0.00 H new ATOM 0 HG2 LYS A 48 6.990 -6.706 -5.167 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.800 -5.428 -5.317 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.269 -4.191 -6.912 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.545 -5.372 -6.696 1.00 0.00 H new ATOM 0 HE2 LYS A 48 7.045 -7.144 -7.648 1.00 0.00 H new ATOM 0 HE3 LYS A 48 5.798 -5.937 -7.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.786 -5.300 -9.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 8.253 -4.998 -8.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 7.924 -6.546 -9.594 1.00 0.00 H new ATOM 813 N ILE A 49 8.144 -3.242 -1.737 1.00 0.00 N ATOM 814 CA ILE A 49 9.114 -2.577 -0.883 1.00 0.00 C ATOM 815 C ILE A 49 8.981 -3.100 0.533 1.00 0.00 C ATOM 816 O ILE A 49 9.976 -3.505 1.154 1.00 0.00 O ATOM 817 CB ILE A 49 8.875 -1.057 -0.912 1.00 0.00 C ATOM 818 CG1 ILE A 49 9.215 -0.515 -2.302 1.00 0.00 C ATOM 819 CG2 ILE A 49 9.764 -0.364 0.124 1.00 0.00 C ATOM 820 CD1 ILE A 49 8.684 0.909 -2.440 1.00 0.00 C ATOM 0 H ILE A 49 7.450 -2.624 -2.157 1.00 0.00 H new ATOM 0 HA ILE A 49 10.121 -2.782 -1.246 1.00 0.00 H new ATOM 0 HB ILE A 49 7.829 -0.860 -0.680 1.00 0.00 H new ATOM 0 HG12 ILE A 49 10.294 -0.528 -2.454 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.777 -1.153 -3.069 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.587 0.711 0.095 1.00 0.00 H new ATOM 0 HG22 ILE A 49 9.528 -0.744 1.118 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.811 -0.565 -0.102 1.00 0.00 H new ATOM 0 HD11 ILE A 49 8.927 1.294 -3.431 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.602 0.908 -2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.143 1.544 -1.682 1.00 0.00 H new ATOM 832 N ALA A 50 7.746 -3.218 1.002 1.00 0.00 N ATOM 833 CA ALA A 50 7.519 -3.799 2.312 1.00 0.00 C ATOM 834 C ALA A 50 8.003 -5.243 2.323 1.00 0.00 C ATOM 835 O ALA A 50 8.691 -5.672 3.257 1.00 0.00 O ATOM 836 CB ALA A 50 6.032 -3.724 2.701 1.00 0.00 C ATOM 0 H ALA A 50 6.905 -2.925 0.505 1.00 0.00 H new ATOM 0 HA ALA A 50 8.083 -3.227 3.049 1.00 0.00 H new ATOM 0 HB1 ALA A 50 5.891 -4.167 3.687 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.714 -2.682 2.722 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.437 -4.270 1.970 1.00 0.00 H new ATOM 842 N TYR A 51 7.697 -5.967 1.251 1.00 0.00 N ATOM 843 CA TYR A 51 8.131 -7.355 1.105 1.00 0.00 C ATOM 844 C TYR A 51 9.643 -7.465 1.103 1.00 0.00 C ATOM 845 O TYR A 51 10.214 -8.272 1.839 1.00 0.00 O ATOM 846 CB TYR A 51 7.586 -7.939 -0.207 1.00 0.00 C ATOM 847 CG TYR A 51 8.171 -9.318 -0.451 1.00 0.00 C ATOM 848 CD1 TYR A 51 7.541 -10.462 0.056 1.00 0.00 C ATOM 849 CD2 TYR A 51 9.351 -9.445 -1.200 1.00 0.00 C ATOM 850 CE1 TYR A 51 8.089 -11.727 -0.185 1.00 0.00 C ATOM 851 CE2 TYR A 51 9.895 -10.708 -1.440 1.00 0.00 C ATOM 852 CZ TYR A 51 9.265 -11.849 -0.931 1.00 0.00 C ATOM 853 OH TYR A 51 9.803 -13.094 -1.170 1.00 0.00 O ATOM 0 H TYR A 51 7.148 -5.615 0.467 1.00 0.00 H new ATOM 0 HA TYR A 51 7.742 -7.914 1.956 1.00 0.00 H new ATOM 0 HB2 TYR A 51 6.499 -8.000 -0.162 1.00 0.00 H new ATOM 0 HB3 TYR A 51 7.834 -7.279 -1.038 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.633 -10.368 0.633 1.00 0.00 H new ATOM 0 HD2 TYR A 51 9.839 -8.564 -1.591 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.603 -12.609 0.205 1.00 0.00 H new ATOM 0 HE2 TYR A 51 10.802 -10.804 -2.018 1.00 0.00 H new ATOM 0 HH TYR A 51 10.619 -13.001 -1.704 1.00 0.00 H new ATOM 863 N TYR A 52 10.293 -6.664 0.271 1.00 0.00 N ATOM 864 CA TYR A 52 11.743 -6.722 0.155 1.00 0.00 C ATOM 865 C TYR A 52 12.430 -6.282 1.421 1.00 0.00 C ATOM 866 O TYR A 52 13.482 -6.818 1.781 1.00 0.00 O ATOM 867 CB TYR A 52 12.253 -5.908 -1.026 1.00 0.00 C ATOM 868 CG TYR A 52 11.950 -6.634 -2.318 1.00 0.00 C ATOM 869 CD1 TYR A 52 12.628 -7.824 -2.639 1.00 0.00 C ATOM 870 CD2 TYR A 52 10.998 -6.120 -3.199 1.00 0.00 C ATOM 871 CE1 TYR A 52 12.346 -8.485 -3.840 1.00 0.00 C ATOM 872 CE2 TYR A 52 10.721 -6.778 -4.395 1.00 0.00 C ATOM 873 CZ TYR A 52 11.390 -7.957 -4.718 1.00 0.00 C ATOM 874 OH TYR A 52 11.117 -8.587 -5.908 1.00 0.00 O ATOM 0 H TYR A 52 9.844 -5.972 -0.329 1.00 0.00 H new ATOM 0 HA TYR A 52 11.990 -7.769 -0.020 1.00 0.00 H new ATOM 0 HB2 TYR A 52 11.783 -4.925 -1.032 1.00 0.00 H new ATOM 0 HB3 TYR A 52 13.327 -5.747 -0.932 1.00 0.00 H new ATOM 0 HD1 TYR A 52 13.365 -8.227 -1.960 1.00 0.00 H new ATOM 0 HD2 TYR A 52 10.474 -5.208 -2.953 1.00 0.00 H new ATOM 0 HE1 TYR A 52 12.864 -9.399 -4.089 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.985 -6.373 -5.074 1.00 0.00 H new ATOM 0 HH TYR A 52 11.211 -7.948 -6.645 1.00 0.00 H new ATOM 884 N LEU A 53 11.887 -5.265 2.061 1.00 0.00 N ATOM 885 CA LEU A 53 12.507 -4.726 3.256 1.00 0.00 C ATOM 886 C LEU A 53 12.025 -5.467 4.486 1.00 0.00 C ATOM 887 O LEU A 53 12.380 -5.108 5.609 1.00 0.00 O ATOM 888 CB LEU A 53 12.217 -3.225 3.392 1.00 0.00 C ATOM 889 CG LEU A 53 12.772 -2.471 2.168 1.00 0.00 C ATOM 890 CD1 LEU A 53 12.419 -0.992 2.270 1.00 0.00 C ATOM 891 CD2 LEU A 53 14.301 -2.626 2.083 1.00 0.00 C ATOM 0 H LEU A 53 11.025 -4.799 1.777 1.00 0.00 H new ATOM 0 HA LEU A 53 13.585 -4.861 3.168 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.143 -3.059 3.476 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.671 -2.839 4.305 1.00 0.00 H new ATOM 0 HG LEU A 53 12.324 -2.895 1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 53 12.814 -0.463 1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.335 -0.878 2.303 1.00 0.00 H new ATOM 0 HD13 LEU A 53 12.855 -0.576 3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.674 -2.087 1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.759 -2.219 2.985 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.555 -3.682 1.992 1.00 0.00 H new ATOM 903 N ASN A 54 11.122 -6.427 4.285 1.00 0.00 N ATOM 904 CA ASN A 54 10.549 -7.181 5.401 1.00 0.00 C ATOM 905 C ASN A 54 10.161 -6.225 6.510 1.00 0.00 C ATOM 906 O ASN A 54 10.430 -6.469 7.693 1.00 0.00 O ATOM 907 CB ASN A 54 11.538 -8.233 5.915 1.00 0.00 C ATOM 908 CG ASN A 54 10.841 -9.226 6.843 1.00 0.00 C ATOM 909 OD1 ASN A 54 9.634 -9.119 7.092 1.00 0.00 O ATOM 910 ND2 ASN A 54 11.519 -10.191 7.367 1.00 0.00 N ATOM 0 H ASN A 54 10.773 -6.700 3.366 1.00 0.00 H new ATOM 0 HA ASN A 54 9.659 -7.705 5.053 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.980 -8.765 5.073 1.00 0.00 H new ATOM 0 HB3 ASN A 54 12.354 -7.743 6.446 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.059 -10.861 7.983 1.00 0.00 H new ATOM 0 HD22 ASN A 54 12.514 -10.283 7.165 1.00 0.00 H new ATOM 917 N THR A 55 9.630 -5.093 6.101 1.00 0.00 N ATOM 918 CA THR A 55 9.262 -4.014 6.996 1.00 0.00 C ATOM 919 C THR A 55 7.831 -3.588 6.680 1.00 0.00 C ATOM 920 O THR A 55 7.411 -3.661 5.520 1.00 0.00 O ATOM 921 CB THR A 55 10.229 -2.835 6.771 1.00 0.00 C ATOM 922 OG1 THR A 55 11.574 -3.279 6.958 1.00 0.00 O ATOM 923 CG2 THR A 55 9.925 -1.701 7.749 1.00 0.00 C ATOM 0 H THR A 55 9.438 -4.892 5.120 1.00 0.00 H new ATOM 0 HA THR A 55 9.322 -4.335 8.036 1.00 0.00 H new ATOM 0 HB THR A 55 10.101 -2.465 5.754 1.00 0.00 H new ATOM 0 HG1 THR A 55 11.882 -3.738 6.149 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.617 -0.877 7.577 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.903 -1.354 7.598 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.038 -2.062 8.771 1.00 0.00 H new ATOM 931 N PRO A 56 7.059 -3.196 7.660 1.00 0.00 N ATOM 932 CA PRO A 56 5.638 -2.837 7.388 1.00 0.00 C ATOM 933 C PRO A 56 5.538 -1.729 6.344 1.00 0.00 C ATOM 934 O PRO A 56 6.262 -0.739 6.408 1.00 0.00 O ATOM 935 CB PRO A 56 5.128 -2.337 8.745 1.00 0.00 C ATOM 936 CG PRO A 56 5.981 -3.032 9.748 1.00 0.00 C ATOM 937 CD PRO A 56 7.358 -3.162 9.109 1.00 0.00 C ATOM 0 HA PRO A 56 5.065 -3.675 6.992 1.00 0.00 H new ATOM 0 HB2 PRO A 56 5.221 -1.254 8.828 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.074 -2.578 8.886 1.00 0.00 H new ATOM 0 HG2 PRO A 56 6.034 -2.463 10.676 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.572 -4.011 9.997 1.00 0.00 H new ATOM 0 HD2 PRO A 56 8.002 -2.322 9.367 1.00 0.00 H new ATOM 0 HD3 PRO A 56 7.869 -4.068 9.436 1.00 0.00 H new ATOM 945 N LEU A 57 4.614 -1.888 5.421 1.00 0.00 N ATOM 946 CA LEU A 57 4.392 -0.914 4.361 1.00 0.00 C ATOM 947 C LEU A 57 3.990 0.423 4.954 1.00 0.00 C ATOM 948 O LEU A 57 4.430 1.480 4.497 1.00 0.00 O ATOM 949 CB LEU A 57 3.283 -1.428 3.415 1.00 0.00 C ATOM 950 CG LEU A 57 2.967 -0.386 2.329 1.00 0.00 C ATOM 951 CD1 LEU A 57 2.332 -1.083 1.120 1.00 0.00 C ATOM 952 CD2 LEU A 57 1.981 0.650 2.883 1.00 0.00 C ATOM 0 H LEU A 57 3.992 -2.695 5.380 1.00 0.00 H new ATOM 0 HA LEU A 57 5.315 -0.781 3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.600 -2.361 2.949 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.382 -1.647 3.988 1.00 0.00 H new ATOM 0 HG LEU A 57 3.890 0.109 2.027 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.108 -0.344 0.350 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.025 -1.824 0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.410 -1.577 1.428 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.758 1.388 2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.060 0.151 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.423 1.148 3.746 1.00 0.00 H new ATOM 964 N GLU A 58 3.125 0.361 5.942 1.00 0.00 N ATOM 965 CA GLU A 58 2.559 1.539 6.573 1.00 0.00 C ATOM 966 C GLU A 58 3.643 2.359 7.260 1.00 0.00 C ATOM 967 O GLU A 58 3.653 3.589 7.184 1.00 0.00 O ATOM 968 CB GLU A 58 1.520 1.073 7.581 1.00 0.00 C ATOM 969 CG GLU A 58 0.365 0.427 6.807 1.00 0.00 C ATOM 970 CD GLU A 58 -0.547 -0.314 7.741 1.00 0.00 C ATOM 971 OE1 GLU A 58 -1.180 0.320 8.549 1.00 0.00 O ATOM 972 OE2 GLU A 58 -0.606 -1.515 7.633 1.00 0.00 O ATOM 0 H GLU A 58 2.789 -0.518 6.336 1.00 0.00 H new ATOM 0 HA GLU A 58 2.096 2.180 5.822 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.959 0.358 8.278 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.159 1.914 8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.197 1.194 6.274 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.761 -0.258 6.057 1.00 0.00 H new ATOM 979 N ASP A 59 4.588 1.669 7.887 1.00 0.00 N ATOM 980 CA ASP A 59 5.712 2.345 8.520 1.00 0.00 C ATOM 981 C ASP A 59 6.550 3.052 7.479 1.00 0.00 C ATOM 982 O ASP A 59 7.112 4.127 7.731 1.00 0.00 O ATOM 983 CB ASP A 59 6.571 1.357 9.313 1.00 0.00 C ATOM 984 CG ASP A 59 7.787 2.065 9.881 1.00 0.00 C ATOM 985 OD1 ASP A 59 7.613 3.080 10.522 1.00 0.00 O ATOM 986 OD2 ASP A 59 8.880 1.587 9.664 1.00 0.00 O ATOM 0 H ASP A 59 4.599 0.652 7.970 1.00 0.00 H new ATOM 0 HA ASP A 59 5.316 3.084 9.217 1.00 0.00 H new ATOM 0 HB2 ASP A 59 5.984 0.920 10.121 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.886 0.537 8.668 1.00 0.00 H new ATOM 991 N ILE A 60 6.624 2.453 6.308 1.00 0.00 N ATOM 992 CA ILE A 60 7.392 3.020 5.225 1.00 0.00 C ATOM 993 C ILE A 60 6.572 4.084 4.500 1.00 0.00 C ATOM 994 O ILE A 60 7.039 5.210 4.296 1.00 0.00 O ATOM 995 CB ILE A 60 7.801 1.917 4.238 1.00 0.00 C ATOM 996 CG1 ILE A 60 8.635 0.844 4.959 1.00 0.00 C ATOM 997 CG2 ILE A 60 8.645 2.531 3.123 1.00 0.00 C ATOM 998 CD1 ILE A 60 8.851 -0.353 4.035 1.00 0.00 C ATOM 0 H ILE A 60 6.160 1.573 6.084 1.00 0.00 H new ATOM 0 HA ILE A 60 8.289 3.483 5.636 1.00 0.00 H new ATOM 0 HB ILE A 60 6.903 1.458 3.824 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.596 1.260 5.261 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.126 0.525 5.869 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.939 1.753 2.419 1.00 0.00 H new ATOM 0 HG22 ILE A 60 8.062 3.291 2.602 1.00 0.00 H new ATOM 0 HG23 ILE A 60 9.537 2.988 3.551 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.442 -1.109 4.551 1.00 0.00 H new ATOM 0 HD12 ILE A 60 7.886 -0.775 3.755 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.379 -0.030 3.138 1.00 0.00 H new ATOM 1010 N PHE A 61 5.357 3.722 4.113 1.00 0.00 N ATOM 1011 CA PHE A 61 4.468 4.637 3.417 1.00 0.00 C ATOM 1012 C PHE A 61 3.201 4.828 4.225 1.00 0.00 C ATOM 1013 O PHE A 61 2.384 3.911 4.322 1.00 0.00 O ATOM 1014 CB PHE A 61 4.113 4.078 2.035 1.00 0.00 C ATOM 1015 CG PHE A 61 5.385 3.740 1.290 1.00 0.00 C ATOM 1016 CD1 PHE A 61 6.202 4.760 0.792 1.00 0.00 C ATOM 1017 CD2 PHE A 61 5.748 2.400 1.112 1.00 0.00 C ATOM 1018 CE1 PHE A 61 7.384 4.436 0.114 1.00 0.00 C ATOM 1019 CE2 PHE A 61 6.927 2.078 0.440 1.00 0.00 C ATOM 1020 CZ PHE A 61 7.745 3.097 -0.059 1.00 0.00 C ATOM 0 H PHE A 61 4.964 2.794 4.271 1.00 0.00 H new ATOM 0 HA PHE A 61 4.972 5.596 3.295 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.492 3.189 2.139 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.532 4.809 1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 61 5.922 5.794 0.930 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.114 1.614 1.496 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.016 5.221 -0.275 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.208 1.044 0.305 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.658 2.848 -0.579 1.00 0.00 H new ATOM 1030 N GLN A 62 3.049 5.994 4.831 1.00 0.00 N ATOM 1031 CA GLN A 62 1.876 6.251 5.671 1.00 0.00 C ATOM 1032 C GLN A 62 0.948 7.299 5.078 1.00 0.00 C ATOM 1033 O GLN A 62 1.382 8.390 4.686 1.00 0.00 O ATOM 1034 CB GLN A 62 2.268 6.630 7.116 1.00 0.00 C ATOM 1035 CG GLN A 62 3.466 7.586 7.128 1.00 0.00 C ATOM 1036 CD GLN A 62 4.644 6.975 7.876 1.00 0.00 C ATOM 1037 OE1 GLN A 62 5.418 7.702 8.500 1.00 0.00 O ATOM 1038 NE2 GLN A 62 4.839 5.688 7.854 1.00 0.00 N ATOM 0 H GLN A 62 3.707 6.770 4.763 1.00 0.00 H new ATOM 0 HA GLN A 62 1.326 5.310 5.705 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.420 7.098 7.616 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.512 5.729 7.679 1.00 0.00 H new ATOM 0 HG2 GLN A 62 3.761 7.818 6.105 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.180 8.527 7.598 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.199 5.084 7.338 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.631 5.284 8.353 1.00 0.00 H new ATOM 1047 N TRP A 63 -0.340 6.997 5.115 1.00 0.00 N ATOM 1048 CA TRP A 63 -1.395 7.909 4.684 1.00 0.00 C ATOM 1049 C TRP A 63 -1.817 8.754 5.871 1.00 0.00 C ATOM 1050 O TRP A 63 -1.939 8.247 6.992 1.00 0.00 O ATOM 1051 CB TRP A 63 -2.581 7.067 4.170 1.00 0.00 C ATOM 1052 CG TRP A 63 -3.738 7.908 3.707 1.00 0.00 C ATOM 1053 CD1 TRP A 63 -3.851 8.476 2.492 1.00 0.00 C ATOM 1054 CD2 TRP A 63 -4.962 8.254 4.422 1.00 0.00 C ATOM 1055 NE1 TRP A 63 -5.060 9.137 2.422 1.00 0.00 N ATOM 1056 CE2 TRP A 63 -5.771 9.043 3.579 1.00 0.00 C ATOM 1057 CE3 TRP A 63 -5.439 7.968 5.698 1.00 0.00 C ATOM 1058 CZ2 TRP A 63 -7.011 9.537 3.988 1.00 0.00 C ATOM 1059 CZ3 TRP A 63 -6.687 8.459 6.114 1.00 0.00 C ATOM 1060 CH2 TRP A 63 -7.468 9.241 5.261 1.00 0.00 C ATOM 0 H TRP A 63 -0.690 6.099 5.450 1.00 0.00 H new ATOM 0 HA TRP A 63 -1.048 8.566 3.887 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -2.243 6.438 3.347 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -2.918 6.400 4.964 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -3.116 8.423 1.702 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -5.385 9.640 1.596 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -4.847 7.366 6.371 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.606 10.142 3.320 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -7.047 8.229 7.106 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -8.426 9.614 5.593 1.00 0.00 H new ATOM 1071 N GLN A 64 -1.989 10.040 5.655 1.00 0.00 N ATOM 1072 CA GLN A 64 -2.329 10.931 6.746 1.00 0.00 C ATOM 1073 C GLN A 64 -3.789 11.336 6.661 1.00 0.00 C ATOM 1074 O GLN A 64 -4.279 11.701 5.586 1.00 0.00 O ATOM 1075 CB GLN A 64 -1.415 12.159 6.734 1.00 0.00 C ATOM 1076 CG GLN A 64 0.033 11.709 7.003 1.00 0.00 C ATOM 1077 CD GLN A 64 0.883 12.892 7.451 1.00 0.00 C ATOM 1078 OE1 GLN A 64 1.690 12.763 8.378 1.00 0.00 O ATOM 1079 NE2 GLN A 64 0.756 14.034 6.864 1.00 0.00 N ATOM 0 H GLN A 64 -1.900 10.490 4.744 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.178 10.406 7.689 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -1.479 12.666 5.771 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -1.734 12.873 7.493 1.00 0.00 H new ATOM 0 HG2 GLN A 64 0.043 10.935 7.770 1.00 0.00 H new ATOM 0 HG3 GLN A 64 0.457 11.269 6.100 1.00 0.00 H new ATOM 0 HE21 GLN A 64 0.091 14.143 6.099 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.321 14.828 7.165 1.00 0.00 H new ATOM 1088 N PRO A 65 -4.510 11.190 7.744 1.00 0.00 N ATOM 1089 CA PRO A 65 -5.970 11.441 7.750 1.00 0.00 C ATOM 1090 C PRO A 65 -6.291 12.881 7.407 1.00 0.00 C ATOM 1091 O PRO A 65 -5.531 13.804 7.740 1.00 0.00 O ATOM 1092 CB PRO A 65 -6.385 11.099 9.183 1.00 0.00 C ATOM 1093 CG PRO A 65 -5.171 11.373 10.005 1.00 0.00 C ATOM 1094 CD PRO A 65 -3.978 11.024 9.119 1.00 0.00 C ATOM 0 HA PRO A 65 -6.502 10.851 7.003 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -7.228 11.709 9.507 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -6.694 10.057 9.268 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -5.136 12.418 10.314 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -5.171 10.772 10.914 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -3.132 11.686 9.305 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.631 10.006 9.295 1.00 0.00 H new ATOM 1102 N GLU A 66 -7.388 13.062 6.703 1.00 0.00 N ATOM 1103 CA GLU A 66 -7.819 14.363 6.248 1.00 0.00 C ATOM 1104 C GLU A 66 -9.232 14.641 6.732 1.00 0.00 C ATOM 1105 O GLU A 66 -10.137 13.987 6.273 1.00 0.00 O ATOM 1106 CB GLU A 66 -7.758 14.429 4.712 1.00 0.00 C ATOM 1107 CG GLU A 66 -7.761 13.003 4.131 1.00 0.00 C ATOM 1108 CD GLU A 66 -7.762 13.053 2.626 1.00 0.00 C ATOM 1109 OE1 GLU A 66 -7.024 13.832 2.079 1.00 0.00 O ATOM 1110 OE2 GLU A 66 -8.507 12.317 2.034 1.00 0.00 O ATOM 1111 OXT GLU A 66 -9.386 15.483 7.571 1.00 0.00 O ATOM 0 H GLU A 66 -8.010 12.302 6.429 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.153 15.122 6.658 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.610 14.990 4.328 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.859 14.959 4.396 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.885 12.457 4.483 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.638 12.461 4.484 1.00 0.00 H new TER 1118 GLU A 66 ATOM 1119 N MET B 67 -1.821 -7.578 -8.738 1.00 0.00 N ATOM 1120 CA MET B 67 -1.322 -8.892 -8.346 1.00 0.00 C ATOM 1121 C MET B 67 -1.130 -8.962 -6.834 1.00 0.00 C ATOM 1122 O MET B 67 -0.290 -9.711 -6.324 1.00 0.00 O ATOM 1123 CB MET B 67 -0.012 -9.182 -9.070 1.00 0.00 C ATOM 1124 CG MET B 67 -0.297 -9.323 -10.568 1.00 0.00 C ATOM 1125 SD MET B 67 1.229 -9.727 -11.443 1.00 0.00 S ATOM 1126 CE MET B 67 2.020 -8.109 -11.291 1.00 0.00 C ATOM 0 HA MET B 67 -2.054 -9.649 -8.628 1.00 0.00 H new ATOM 0 HB2 MET B 67 0.702 -8.377 -8.896 1.00 0.00 H new ATOM 0 HB3 MET B 67 0.438 -10.096 -8.684 1.00 0.00 H new ATOM 0 HG2 MET B 67 -1.040 -10.103 -10.735 1.00 0.00 H new ATOM 0 HG3 MET B 67 -0.716 -8.395 -10.957 1.00 0.00 H new ATOM 0 HE1 MET B 67 2.344 -7.768 -12.275 1.00 0.00 H new ATOM 0 HE2 MET B 67 1.310 -7.394 -10.875 1.00 0.00 H new ATOM 0 HE3 MET B 67 2.884 -8.187 -10.632 1.00 0.00 H new ATOM 1136 N ILE B 68 -1.932 -8.187 -6.137 1.00 0.00 N ATOM 1137 CA ILE B 68 -1.911 -8.110 -4.699 1.00 0.00 C ATOM 1138 C ILE B 68 -3.178 -8.736 -4.153 1.00 0.00 C ATOM 1139 O ILE B 68 -4.274 -8.487 -4.665 1.00 0.00 O ATOM 1140 CB ILE B 68 -1.812 -6.649 -4.268 1.00 0.00 C ATOM 1141 CG1 ILE B 68 -0.524 -6.032 -4.821 1.00 0.00 C ATOM 1142 CG2 ILE B 68 -1.798 -6.548 -2.748 1.00 0.00 C ATOM 1143 CD1 ILE B 68 -0.562 -4.521 -4.593 1.00 0.00 C ATOM 0 H ILE B 68 -2.631 -7.581 -6.567 1.00 0.00 H new ATOM 0 HA ILE B 68 -1.048 -8.649 -4.308 1.00 0.00 H new ATOM 0 HB ILE B 68 -2.677 -6.112 -4.658 1.00 0.00 H new ATOM 0 HG12 ILE B 68 0.345 -6.466 -4.326 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -0.428 -6.251 -5.884 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -1.727 -5.501 -2.454 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -2.716 -6.976 -2.346 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -0.941 -7.094 -2.355 1.00 0.00 H new ATOM 0 HD11 ILE B 68 0.351 -4.071 -4.983 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.424 -4.097 -5.108 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -0.640 -4.316 -3.525 1.00 0.00 H new ATOM 1155 N ILE B 69 -3.015 -9.604 -3.191 1.00 0.00 N ATOM 1156 CA ILE B 69 -4.116 -10.360 -2.639 1.00 0.00 C ATOM 1157 C ILE B 69 -4.885 -9.502 -1.638 1.00 0.00 C ATOM 1158 O ILE B 69 -4.284 -8.854 -0.780 1.00 0.00 O ATOM 1159 CB ILE B 69 -3.529 -11.605 -1.985 1.00 0.00 C ATOM 1160 CG1 ILE B 69 -2.833 -12.423 -3.078 1.00 0.00 C ATOM 1161 CG2 ILE B 69 -4.630 -12.453 -1.339 1.00 0.00 C ATOM 1162 CD1 ILE B 69 -1.973 -13.499 -2.442 1.00 0.00 C ATOM 0 H ILE B 69 -2.112 -9.810 -2.764 1.00 0.00 H new ATOM 0 HA ILE B 69 -4.824 -10.655 -3.413 1.00 0.00 H new ATOM 0 HB ILE B 69 -2.826 -11.313 -1.205 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -3.575 -12.878 -3.734 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -2.217 -11.771 -3.697 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -4.186 -13.336 -0.879 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -5.142 -11.865 -0.577 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -5.346 -12.762 -2.101 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -1.480 -14.079 -3.222 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -1.221 -13.034 -1.805 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -2.600 -14.158 -1.842 1.00 0.00 H new ATOM 1174 N ASN B 70 -6.198 -9.408 -1.843 1.00 0.00 N ATOM 1175 CA ASN B 70 -7.069 -8.521 -1.058 1.00 0.00 C ATOM 1176 C ASN B 70 -7.894 -9.277 -0.021 1.00 0.00 C ATOM 1177 O ASN B 70 -8.781 -10.051 -0.377 1.00 0.00 O ATOM 1178 CB ASN B 70 -8.023 -7.775 -1.988 1.00 0.00 C ATOM 1179 CG ASN B 70 -8.967 -6.897 -1.176 1.00 0.00 C ATOM 1180 OD1 ASN B 70 -8.731 -6.654 0.003 1.00 0.00 O ATOM 1181 ND2 ASN B 70 -10.032 -6.427 -1.733 1.00 0.00 N ATOM 0 H ASN B 70 -6.692 -9.943 -2.557 1.00 0.00 H new ATOM 0 HA ASN B 70 -6.416 -7.826 -0.530 1.00 0.00 H new ATOM 0 HB2 ASN B 70 -7.455 -7.162 -2.688 1.00 0.00 H new ATOM 0 HB3 ASN B 70 -8.596 -8.488 -2.581 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -10.679 -5.853 -1.193 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -10.227 -6.630 -2.713 1.00 0.00 H new ATOM 1188 N ASN B 71 -7.670 -8.975 1.251 1.00 0.00 N ATOM 1189 CA ASN B 71 -8.470 -9.556 2.339 1.00 0.00 C ATOM 1190 C ASN B 71 -9.504 -8.564 2.848 1.00 0.00 C ATOM 1191 O ASN B 71 -10.114 -8.786 3.898 1.00 0.00 O ATOM 1192 CB ASN B 71 -7.588 -9.979 3.510 1.00 0.00 C ATOM 1193 CG ASN B 71 -6.696 -11.132 3.120 1.00 0.00 C ATOM 1194 OD1 ASN B 71 -7.166 -12.269 2.962 1.00 0.00 O ATOM 1195 ND2 ASN B 71 -5.438 -10.916 2.944 1.00 0.00 N ATOM 0 H ASN B 71 -6.942 -8.332 1.562 1.00 0.00 H new ATOM 0 HA ASN B 71 -8.973 -10.431 1.928 1.00 0.00 H new ATOM 0 HB2 ASN B 71 -6.979 -9.136 3.835 1.00 0.00 H new ATOM 0 HB3 ASN B 71 -8.212 -10.266 4.356 1.00 0.00 H new ATOM 0 HD21 ASN B 71 -4.822 -11.682 2.673 1.00 0.00 H new ATOM 0 HD22 ASN B 71 -5.058 -9.979 3.076 1.00 0.00 H new ATOM 1202 N LEU B 72 -9.705 -7.474 2.121 1.00 0.00 N ATOM 1203 CA LEU B 72 -10.626 -6.436 2.577 1.00 0.00 C ATOM 1204 C LEU B 72 -12.005 -7.011 2.750 1.00 0.00 C ATOM 1205 O LEU B 72 -12.667 -6.759 3.757 1.00 0.00 O ATOM 1206 CB LEU B 72 -10.679 -5.280 1.570 1.00 0.00 C ATOM 1207 CG LEU B 72 -11.703 -4.224 2.022 1.00 0.00 C ATOM 1208 CD1 LEU B 72 -11.353 -3.699 3.418 1.00 0.00 C ATOM 1209 CD2 LEU B 72 -11.714 -3.064 1.024 1.00 0.00 C ATOM 0 H LEU B 72 -9.252 -7.284 1.227 1.00 0.00 H new ATOM 0 HA LEU B 72 -10.267 -6.056 3.533 1.00 0.00 H new ATOM 0 HB2 LEU B 72 -9.693 -4.824 1.477 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -10.949 -5.659 0.584 1.00 0.00 H new ATOM 0 HG LEU B 72 -12.690 -4.685 2.061 1.00 0.00 H new ATOM 0 HD11 LEU B 72 -12.088 -2.953 3.721 1.00 0.00 H new ATOM 0 HD12 LEU B 72 -11.359 -4.525 4.129 1.00 0.00 H new ATOM 0 HD13 LEU B 72 -10.362 -3.245 3.398 1.00 0.00 H new ATOM 0 HD21 LEU B 72 -12.439 -2.316 1.344 1.00 0.00 H new ATOM 0 HD22 LEU B 72 -10.723 -2.613 0.980 1.00 0.00 H new ATOM 0 HD23 LEU B 72 -11.988 -3.436 0.037 1.00 0.00 H new ATOM 1221 N LYS B 73 -12.425 -7.816 1.794 1.00 0.00 N ATOM 1222 CA LYS B 73 -13.722 -8.440 1.870 1.00 0.00 C ATOM 1223 C LYS B 73 -13.897 -9.159 3.198 1.00 0.00 C ATOM 1224 O LYS B 73 -14.939 -9.033 3.848 1.00 0.00 O ATOM 1225 CB LYS B 73 -13.929 -9.385 0.668 1.00 0.00 C ATOM 1226 CG LYS B 73 -12.946 -10.569 0.697 1.00 0.00 C ATOM 1227 CD LYS B 73 -13.055 -11.325 -0.640 1.00 0.00 C ATOM 1228 CE LYS B 73 -11.952 -12.389 -0.747 1.00 0.00 C ATOM 1229 NZ LYS B 73 -12.368 -13.615 -0.026 1.00 0.00 N ATOM 0 H LYS B 73 -11.886 -8.050 0.960 1.00 0.00 H new ATOM 0 HA LYS B 73 -14.491 -7.669 1.821 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -14.952 -9.761 0.673 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -13.799 -8.827 -0.260 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -11.927 -10.212 0.849 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -13.178 -11.234 1.529 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -14.034 -11.798 -0.718 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -12.973 -10.623 -1.470 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.757 -12.620 -1.794 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -11.022 -12.006 -0.326 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -11.619 -14.333 -0.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -12.533 -13.390 0.976 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -13.245 -13.984 -0.446 1.00 0.00 H new ATOM 1243 N LEU B 74 -12.871 -9.890 3.621 1.00 0.00 N ATOM 1244 CA LEU B 74 -12.924 -10.578 4.909 1.00 0.00 C ATOM 1245 C LEU B 74 -12.896 -9.561 6.055 1.00 0.00 C ATOM 1246 O LEU B 74 -13.661 -9.654 7.019 1.00 0.00 O ATOM 1247 CB LEU B 74 -11.700 -11.489 5.060 1.00 0.00 C ATOM 1248 CG LEU B 74 -11.648 -12.532 3.937 1.00 0.00 C ATOM 1249 CD1 LEU B 74 -10.426 -13.432 4.132 1.00 0.00 C ATOM 1250 CD2 LEU B 74 -12.921 -13.372 3.911 1.00 0.00 C ATOM 0 H LEU B 74 -12.004 -10.021 3.101 1.00 0.00 H new ATOM 0 HA LEU B 74 -13.844 -11.161 4.947 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -10.791 -10.888 5.045 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -11.734 -11.992 6.027 1.00 0.00 H new ATOM 0 HG LEU B 74 -11.569 -12.012 2.982 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -10.389 -14.173 3.334 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -9.520 -12.826 4.107 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -10.497 -13.938 5.095 1.00 0.00 H new ATOM 0 HD21 LEU B 74 -12.858 -14.104 3.105 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -13.035 -13.890 4.863 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -13.781 -12.724 3.746 1.00 0.00 H new ATOM 1262 N ILE B 75 -11.986 -8.603 5.934 1.00 0.00 N ATOM 1263 CA ILE B 75 -11.780 -7.573 6.950 1.00 0.00 C ATOM 1264 C ILE B 75 -12.992 -6.694 7.097 1.00 0.00 C ATOM 1265 O ILE B 75 -13.385 -6.342 8.208 1.00 0.00 O ATOM 1266 CB ILE B 75 -10.533 -6.742 6.627 1.00 0.00 C ATOM 1267 CG1 ILE B 75 -9.291 -7.617 6.786 1.00 0.00 C ATOM 1268 CG2 ILE B 75 -10.426 -5.544 7.577 1.00 0.00 C ATOM 1269 CD1 ILE B 75 -8.092 -6.878 6.231 1.00 0.00 C ATOM 0 H ILE B 75 -11.367 -8.516 5.128 1.00 0.00 H new ATOM 0 HA ILE B 75 -11.622 -8.072 7.906 1.00 0.00 H new ATOM 0 HB ILE B 75 -10.609 -6.377 5.603 1.00 0.00 H new ATOM 0 HG12 ILE B 75 -9.132 -7.857 7.837 1.00 0.00 H new ATOM 0 HG13 ILE B 75 -9.427 -8.562 6.260 1.00 0.00 H new ATOM 0 HG21 ILE B 75 -9.535 -4.965 7.334 1.00 0.00 H new ATOM 0 HG22 ILE B 75 -11.309 -4.914 7.469 1.00 0.00 H new ATOM 0 HG23 ILE B 75 -10.358 -5.900 8.605 1.00 0.00 H new ATOM 0 HD11 ILE B 75 -7.201 -7.496 6.341 1.00 0.00 H new ATOM 0 HD12 ILE B 75 -8.255 -6.661 5.175 1.00 0.00 H new ATOM 0 HD13 ILE B 75 -7.955 -5.944 6.777 1.00 0.00 H new ATOM 1281 N ARG B 76 -13.569 -6.314 5.986 1.00 0.00 N ATOM 1282 CA ARG B 76 -14.697 -5.413 6.000 1.00 0.00 C ATOM 1283 C ARG B 76 -15.759 -5.985 6.919 1.00 0.00 C ATOM 1284 O ARG B 76 -16.334 -5.270 7.747 1.00 0.00 O ATOM 1285 CB ARG B 76 -15.267 -5.301 4.596 1.00 0.00 C ATOM 1286 CG ARG B 76 -16.393 -4.269 4.564 1.00 0.00 C ATOM 1287 CD ARG B 76 -17.248 -4.549 3.339 1.00 0.00 C ATOM 1288 NE ARG B 76 -17.861 -5.872 3.492 1.00 0.00 N ATOM 1289 CZ ARG B 76 -17.600 -6.880 2.666 1.00 0.00 C ATOM 1290 NH1 ARG B 76 -16.757 -6.720 1.695 1.00 0.00 N ATOM 1291 NH2 ARG B 76 -18.165 -8.037 2.861 1.00 0.00 N ATOM 0 H ARG B 76 -13.276 -6.615 5.056 1.00 0.00 H new ATOM 0 HA ARG B 76 -14.385 -4.428 6.348 1.00 0.00 H new ATOM 0 HB2 ARG B 76 -14.480 -5.013 3.898 1.00 0.00 H new ATOM 0 HB3 ARG B 76 -15.643 -6.271 4.270 1.00 0.00 H new ATOM 0 HG2 ARG B 76 -16.994 -4.332 5.471 1.00 0.00 H new ATOM 0 HG3 ARG B 76 -15.984 -3.259 4.521 1.00 0.00 H new ATOM 0 HD2 ARG B 76 -18.018 -3.785 3.232 1.00 0.00 H new ATOM 0 HD3 ARG B 76 -16.638 -4.516 2.436 1.00 0.00 H new ATOM 0 HE ARG B 76 -18.513 -6.025 4.262 1.00 0.00 H new ATOM 0 HH11 ARG B 76 -16.294 -5.821 1.565 1.00 0.00 H new ATOM 0 HH12 ARG B 76 -16.557 -7.493 1.061 1.00 0.00 H new ATOM 0 HH21 ARG B 76 -18.805 -8.167 3.645 1.00 0.00 H new ATOM 0 HH22 ARG B 76 -17.968 -8.814 2.230 1.00 0.00 H new ATOM 1305 N GLU B 77 -15.958 -7.286 6.820 1.00 0.00 N ATOM 1306 CA GLU B 77 -16.894 -7.977 7.676 1.00 0.00 C ATOM 1307 C GLU B 77 -16.469 -7.847 9.130 1.00 0.00 C ATOM 1308 O GLU B 77 -17.314 -7.667 10.008 1.00 0.00 O ATOM 1309 CB GLU B 77 -16.982 -9.448 7.285 1.00 0.00 C ATOM 1310 CG GLU B 77 -17.557 -9.567 5.866 1.00 0.00 C ATOM 1311 CD GLU B 77 -18.986 -9.065 5.826 1.00 0.00 C ATOM 1312 OE1 GLU B 77 -19.770 -9.518 6.617 1.00 0.00 O ATOM 1313 OE2 GLU B 77 -19.279 -8.230 5.001 1.00 0.00 O ATOM 0 H GLU B 77 -15.478 -7.886 6.149 1.00 0.00 H new ATOM 0 HA GLU B 77 -17.878 -7.524 7.555 1.00 0.00 H new ATOM 0 HB2 GLU B 77 -15.994 -9.907 7.328 1.00 0.00 H new ATOM 0 HB3 GLU B 77 -17.614 -9.986 7.991 1.00 0.00 H new ATOM 0 HG2 GLU B 77 -16.945 -8.993 5.170 1.00 0.00 H new ATOM 0 HG3 GLU B 77 -17.522 -10.606 5.539 1.00 0.00 H new ATOM 1320 N LYS B 78 -15.158 -7.871 9.384 1.00 0.00 N ATOM 1321 CA LYS B 78 -14.673 -7.669 10.739 1.00 0.00 C ATOM 1322 C LYS B 78 -15.080 -6.268 11.180 1.00 0.00 C ATOM 1323 O LYS B 78 -15.543 -6.057 12.304 1.00 0.00 O ATOM 1324 CB LYS B 78 -13.131 -7.736 10.779 1.00 0.00 C ATOM 1325 CG LYS B 78 -12.606 -9.124 10.402 1.00 0.00 C ATOM 1326 CD LYS B 78 -11.068 -9.069 10.448 1.00 0.00 C ATOM 1327 CE LYS B 78 -10.465 -10.365 9.915 1.00 0.00 C ATOM 1328 NZ LYS B 78 -10.665 -11.456 10.896 1.00 0.00 N ATOM 0 H LYS B 78 -14.433 -8.025 8.683 1.00 0.00 H new ATOM 0 HA LYS B 78 -15.090 -8.441 11.386 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -12.718 -6.994 10.095 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -12.783 -7.476 11.779 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -12.983 -9.877 11.094 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -12.949 -9.406 9.407 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -10.712 -8.226 9.856 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -10.736 -8.902 11.473 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -10.930 -10.629 8.965 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -9.401 -10.229 9.722 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -10.222 -12.327 10.541 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -10.231 -11.191 11.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -11.683 -11.617 11.034 1.00 0.00 H new ATOM 1342 N LYS B 79 -14.886 -5.308 10.278 1.00 0.00 N ATOM 1343 CA LYS B 79 -15.227 -3.912 10.542 1.00 0.00 C ATOM 1344 C LYS B 79 -16.736 -3.736 10.605 1.00 0.00 C ATOM 1345 O LYS B 79 -17.239 -2.844 11.288 1.00 0.00 O ATOM 1346 CB LYS B 79 -14.659 -2.987 9.451 1.00 0.00 C ATOM 1347 CG LYS B 79 -13.232 -3.411 9.031 1.00 0.00 C ATOM 1348 CD LYS B 79 -12.375 -3.834 10.242 1.00 0.00 C ATOM 1349 CE LYS B 79 -12.003 -2.606 11.071 1.00 0.00 C ATOM 1350 NZ LYS B 79 -10.633 -2.759 11.610 1.00 0.00 N ATOM 0 H LYS B 79 -14.492 -5.473 9.352 1.00 0.00 H new ATOM 0 HA LYS B 79 -14.786 -3.642 11.501 1.00 0.00 H new ATOM 0 HB2 LYS B 79 -15.315 -3.004 8.581 1.00 0.00 H new ATOM 0 HB3 LYS B 79 -14.641 -1.960 9.817 1.00 0.00 H new ATOM 0 HG2 LYS B 79 -13.293 -4.238 8.323 1.00 0.00 H new ATOM 0 HG3 LYS B 79 -12.746 -2.584 8.514 1.00 0.00 H new ATOM 0 HD2 LYS B 79 -12.926 -4.546 10.857 1.00 0.00 H new ATOM 0 HD3 LYS B 79 -11.472 -4.340 9.900 1.00 0.00 H new ATOM 0 HE2 LYS B 79 -12.063 -1.709 10.455 1.00 0.00 H new ATOM 0 HE3 LYS B 79 -12.713 -2.479 11.888 1.00 0.00 H new ATOM 0 HZ1 LYS B 79 -10.276 -1.832 11.920 1.00 0.00 H new ATOM 0 HZ2 LYS B 79 -10.649 -3.412 12.419 1.00 0.00 H new ATOM 0 HZ3 LYS B 79 -10.009 -3.140 10.870 1.00 0.00 H new ATOM 1364 N LYS B 80 -17.432 -4.481 9.755 1.00 0.00 N ATOM 1365 CA LYS B 80 -18.870 -4.323 9.568 1.00 0.00 C ATOM 1366 C LYS B 80 -19.163 -2.954 8.956 1.00 0.00 C ATOM 1367 O LYS B 80 -20.121 -2.261 9.327 1.00 0.00 O ATOM 1368 CB LYS B 80 -19.620 -4.538 10.894 1.00 0.00 C ATOM 1369 CG LYS B 80 -19.457 -6.015 11.296 1.00 0.00 C ATOM 1370 CD LYS B 80 -20.143 -6.299 12.637 1.00 0.00 C ATOM 1371 CE LYS B 80 -19.932 -7.782 12.995 1.00 0.00 C ATOM 1372 NZ LYS B 80 -20.484 -8.073 14.344 1.00 0.00 N ATOM 0 H LYS B 80 -17.017 -5.211 9.176 1.00 0.00 H new ATOM 0 HA LYS B 80 -19.230 -5.084 8.876 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -19.219 -3.885 11.669 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -20.675 -4.288 10.781 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -19.883 -6.655 10.523 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -18.398 -6.262 11.366 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -19.729 -5.659 13.416 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -21.207 -6.074 12.572 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -20.418 -8.415 12.252 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -18.869 -8.021 12.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -20.334 -9.077 14.571 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -20.002 -7.482 15.051 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -21.503 -7.864 14.355 1.00 0.00 H new ATOM 1386 N ILE B 81 -18.336 -2.603 7.982 1.00 0.00 N ATOM 1387 CA ILE B 81 -18.443 -1.361 7.218 1.00 0.00 C ATOM 1388 C ILE B 81 -18.992 -1.650 5.828 1.00 0.00 C ATOM 1389 O ILE B 81 -18.661 -2.676 5.226 1.00 0.00 O ATOM 1390 CB ILE B 81 -17.047 -0.668 7.136 1.00 0.00 C ATOM 1391 CG1 ILE B 81 -16.905 0.392 8.227 1.00 0.00 C ATOM 1392 CG2 ILE B 81 -16.811 -0.023 5.776 1.00 0.00 C ATOM 1393 CD1 ILE B 81 -17.180 -0.213 9.588 1.00 0.00 C ATOM 0 H ILE B 81 -17.551 -3.186 7.691 1.00 0.00 H new ATOM 0 HA ILE B 81 -19.133 -0.684 7.722 1.00 0.00 H new ATOM 0 HB ILE B 81 -16.299 -1.447 7.282 1.00 0.00 H new ATOM 0 HG12 ILE B 81 -15.900 0.813 8.205 1.00 0.00 H new ATOM 0 HG13 ILE B 81 -17.598 1.212 8.039 1.00 0.00 H new ATOM 0 HG21 ILE B 81 -15.828 0.448 5.762 1.00 0.00 H new ATOM 0 HG22 ILE B 81 -16.859 -0.785 4.998 1.00 0.00 H new ATOM 0 HG23 ILE B 81 -17.577 0.731 5.593 1.00 0.00 H new ATOM 0 HD11 ILE B 81 -17.075 0.554 10.355 1.00 0.00 H new ATOM 0 HD12 ILE B 81 -18.194 -0.612 9.611 1.00 0.00 H new ATOM 0 HD13 ILE B 81 -16.469 -1.017 9.779 1.00 0.00 H new ATOM 1405 N SER B 82 -19.844 -0.770 5.327 1.00 0.00 N ATOM 1406 CA SER B 82 -20.391 -0.957 3.998 1.00 0.00 C ATOM 1407 C SER B 82 -19.309 -0.664 2.980 1.00 0.00 C ATOM 1408 O SER B 82 -18.393 0.120 3.250 1.00 0.00 O ATOM 1409 CB SER B 82 -21.614 -0.038 3.767 1.00 0.00 C ATOM 1410 OG SER B 82 -21.204 1.250 3.278 1.00 0.00 O ATOM 0 H SER B 82 -20.166 0.067 5.813 1.00 0.00 H new ATOM 0 HA SER B 82 -20.730 -1.987 3.891 1.00 0.00 H new ATOM 0 HB2 SER B 82 -22.293 -0.503 3.053 1.00 0.00 H new ATOM 0 HB3 SER B 82 -22.165 0.082 4.700 1.00 0.00 H new ATOM 0 HG SER B 82 -21.763 1.503 2.514 1.00 0.00 H new ATOM 1416 N GLN B 83 -19.431 -1.210 1.789 1.00 0.00 N ATOM 1417 CA GLN B 83 -18.475 -0.853 0.761 1.00 0.00 C ATOM 1418 C GLN B 83 -18.652 0.613 0.485 1.00 0.00 C ATOM 1419 O GLN B 83 -17.699 1.326 0.225 1.00 0.00 O ATOM 1420 CB GLN B 83 -18.671 -1.644 -0.550 1.00 0.00 C ATOM 1421 CG GLN B 83 -19.888 -2.556 -0.457 1.00 0.00 C ATOM 1422 CD GLN B 83 -20.040 -3.331 -1.746 1.00 0.00 C ATOM 1423 OE1 GLN B 83 -20.957 -3.061 -2.525 1.00 0.00 O ATOM 1424 NE2 GLN B 83 -19.194 -4.259 -2.038 1.00 0.00 N ATOM 0 H GLN B 83 -20.152 -1.877 1.514 1.00 0.00 H new ATOM 0 HA GLN B 83 -17.474 -1.093 1.119 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -18.793 -0.951 -1.383 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -17.781 -2.238 -0.758 1.00 0.00 H new ATOM 0 HG2 GLN B 83 -19.777 -3.243 0.382 1.00 0.00 H new ATOM 0 HG3 GLN B 83 -20.784 -1.965 -0.268 1.00 0.00 H new ATOM 0 HE21 GLN B 83 -18.436 -4.480 -1.392 1.00 0.00 H new ATOM 0 HE22 GLN B 83 -19.282 -4.772 -2.915 1.00 0.00 H new ATOM 1433 N SER B 84 -19.904 1.038 0.527 1.00 0.00 N ATOM 1434 CA SER B 84 -20.277 2.404 0.233 1.00 0.00 C ATOM 1435 C SER B 84 -19.617 3.387 1.177 1.00 0.00 C ATOM 1436 O SER B 84 -19.032 4.377 0.726 1.00 0.00 O ATOM 1437 CB SER B 84 -21.796 2.528 0.350 1.00 0.00 C ATOM 1438 OG SER B 84 -22.287 1.417 1.114 1.00 0.00 O ATOM 0 H SER B 84 -20.692 0.438 0.768 1.00 0.00 H new ATOM 0 HA SER B 84 -19.942 2.643 -0.776 1.00 0.00 H new ATOM 0 HB2 SER B 84 -22.063 3.468 0.834 1.00 0.00 H new ATOM 0 HB3 SER B 84 -22.252 2.538 -0.640 1.00 0.00 H new ATOM 0 HG SER B 84 -23.261 1.484 1.199 1.00 0.00 H new ATOM 1444 N GLU B 85 -19.675 3.119 2.483 1.00 0.00 N ATOM 1445 CA GLU B 85 -19.068 4.040 3.422 1.00 0.00 C ATOM 1446 C GLU B 85 -17.569 4.037 3.262 1.00 0.00 C ATOM 1447 O GLU B 85 -16.965 5.078 3.051 1.00 0.00 O ATOM 1448 CB GLU B 85 -19.508 3.773 4.874 1.00 0.00 C ATOM 1449 CG GLU B 85 -18.910 2.476 5.425 1.00 0.00 C ATOM 1450 CD GLU B 85 -19.476 2.208 6.790 1.00 0.00 C ATOM 1451 OE1 GLU B 85 -19.206 2.983 7.681 1.00 0.00 O ATOM 1452 OE2 GLU B 85 -20.189 1.240 6.931 1.00 0.00 O ATOM 0 H GLU B 85 -20.121 2.300 2.896 1.00 0.00 H new ATOM 0 HA GLU B 85 -19.426 5.043 3.189 1.00 0.00 H new ATOM 0 HB2 GLU B 85 -19.204 4.609 5.504 1.00 0.00 H new ATOM 0 HB3 GLU B 85 -20.596 3.719 4.919 1.00 0.00 H new ATOM 0 HG2 GLU B 85 -19.135 1.645 4.756 1.00 0.00 H new ATOM 0 HG3 GLU B 85 -17.824 2.557 5.479 1.00 0.00 H new ATOM 1459 N LEU B 86 -17.003 2.846 3.164 1.00 0.00 N ATOM 1460 CA LEU B 86 -15.579 2.685 2.911 1.00 0.00 C ATOM 1461 C LEU B 86 -15.230 3.330 1.576 1.00 0.00 C ATOM 1462 O LEU B 86 -14.253 4.075 1.472 1.00 0.00 O ATOM 1463 CB LEU B 86 -15.218 1.195 2.860 1.00 0.00 C ATOM 1464 CG LEU B 86 -13.706 1.022 2.623 1.00 0.00 C ATOM 1465 CD1 LEU B 86 -12.918 1.494 3.848 1.00 0.00 C ATOM 1466 CD2 LEU B 86 -13.392 -0.447 2.340 1.00 0.00 C ATOM 0 H LEU B 86 -17.513 1.968 3.257 1.00 0.00 H new ATOM 0 HA LEU B 86 -15.018 3.162 3.714 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -15.505 0.712 3.794 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -15.777 0.705 2.063 1.00 0.00 H new ATOM 0 HG LEU B 86 -13.414 1.626 1.764 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -11.851 1.366 3.666 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -13.130 2.547 4.034 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -13.211 0.906 4.718 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -12.321 -0.565 2.173 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -13.695 -1.055 3.193 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -13.935 -0.771 1.452 1.00 0.00 H new ATOM 1478 N ALA B 87 -16.063 3.102 0.573 1.00 0.00 N ATOM 1479 CA ALA B 87 -15.851 3.747 -0.705 1.00 0.00 C ATOM 1480 C ALA B 87 -15.901 5.252 -0.503 1.00 0.00 C ATOM 1481 O ALA B 87 -15.037 5.981 -0.993 1.00 0.00 O ATOM 1482 CB ALA B 87 -16.903 3.310 -1.733 1.00 0.00 C ATOM 0 H ALA B 87 -16.876 2.487 0.620 1.00 0.00 H new ATOM 0 HA ALA B 87 -14.876 3.454 -1.095 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -16.715 3.813 -2.682 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -16.845 2.231 -1.876 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -17.897 3.576 -1.372 1.00 0.00 H new ATOM 1488 N ALA B 88 -16.837 5.693 0.328 1.00 0.00 N ATOM 1489 CA ALA B 88 -16.910 7.092 0.712 1.00 0.00 C ATOM 1490 C ALA B 88 -15.670 7.479 1.510 1.00 0.00 C ATOM 1491 O ALA B 88 -15.118 8.574 1.328 1.00 0.00 O ATOM 1492 CB ALA B 88 -18.178 7.376 1.531 1.00 0.00 C ATOM 0 H ALA B 88 -17.554 5.101 0.747 1.00 0.00 H new ATOM 0 HA ALA B 88 -16.954 7.693 -0.196 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -18.206 8.431 1.804 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -19.058 7.132 0.936 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -18.171 6.767 2.435 1.00 0.00 H new ATOM 1498 N LEU B 89 -15.198 6.560 2.364 1.00 0.00 N ATOM 1499 CA LEU B 89 -13.992 6.818 3.150 1.00 0.00 C ATOM 1500 C LEU B 89 -12.859 7.011 2.167 1.00 0.00 C ATOM 1501 O LEU B 89 -12.054 7.930 2.276 1.00 0.00 O ATOM 1502 CB LEU B 89 -13.618 5.590 4.020 1.00 0.00 C ATOM 1503 CG LEU B 89 -14.705 5.243 5.050 1.00 0.00 C ATOM 1504 CD1 LEU B 89 -14.297 3.994 5.840 1.00 0.00 C ATOM 1505 CD2 LEU B 89 -14.953 6.397 6.001 1.00 0.00 C ATOM 0 H LEU B 89 -15.626 5.648 2.524 1.00 0.00 H new ATOM 0 HA LEU B 89 -14.162 7.681 3.793 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -13.447 4.729 3.373 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -12.681 5.789 4.539 1.00 0.00 H new ATOM 0 HG LEU B 89 -15.631 5.046 4.510 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -15.072 3.754 6.568 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -14.171 3.155 5.155 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -13.358 4.183 6.359 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -15.727 6.119 6.716 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -14.033 6.632 6.535 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -15.278 7.271 5.436 1.00 0.00 H new ATOM 1517 N LEU B 90 -12.842 6.146 1.180 1.00 0.00 N ATOM 1518 CA LEU B 90 -11.872 6.198 0.105 1.00 0.00 C ATOM 1519 C LEU B 90 -12.096 7.364 -0.827 1.00 0.00 C ATOM 1520 O LEU B 90 -11.145 7.823 -1.475 1.00 0.00 O ATOM 1521 CB LEU B 90 -11.797 4.872 -0.648 1.00 0.00 C ATOM 1522 CG LEU B 90 -10.715 3.968 -0.022 1.00 0.00 C ATOM 1523 CD1 LEU B 90 -10.801 3.992 1.514 1.00 0.00 C ATOM 1524 CD2 LEU B 90 -10.894 2.534 -0.529 1.00 0.00 C ATOM 0 H LEU B 90 -13.507 5.377 1.098 1.00 0.00 H new ATOM 0 HA LEU B 90 -10.901 6.365 0.571 1.00 0.00 H new ATOM 0 HB2 LEU B 90 -12.764 4.371 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU B 90 -11.568 5.053 -1.698 1.00 0.00 H new ATOM 0 HG LEU B 90 -9.735 4.343 -0.315 1.00 0.00 H new ATOM 0 HD11 LEU B 90 -10.028 3.347 1.932 1.00 0.00 H new ATOM 0 HD12 LEU B 90 -10.655 5.012 1.871 1.00 0.00 H new ATOM 0 HD13 LEU B 90 -11.781 3.634 1.829 1.00 0.00 H new ATOM 0 HD21 LEU B 90 -10.130 1.894 -0.088 1.00 0.00 H new ATOM 0 HD22 LEU B 90 -11.881 2.169 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU B 90 -10.798 2.517 -1.615 1.00 0.00 H new ATOM 1536 N GLU B 91 -13.355 7.777 -0.952 1.00 0.00 N ATOM 1537 CA GLU B 91 -13.776 8.802 -1.905 1.00 0.00 C ATOM 1538 C GLU B 91 -13.946 8.152 -3.273 1.00 0.00 C ATOM 1539 O GLU B 91 -13.690 8.763 -4.317 1.00 0.00 O ATOM 1540 CB GLU B 91 -12.741 9.938 -1.979 1.00 0.00 C ATOM 1541 CG GLU B 91 -12.557 10.566 -0.587 1.00 0.00 C ATOM 1542 CD GLU B 91 -11.448 11.592 -0.623 1.00 0.00 C ATOM 1543 OE1 GLU B 91 -10.416 11.301 -1.199 1.00 0.00 O ATOM 1544 OE2 GLU B 91 -11.626 12.647 -0.077 1.00 0.00 O ATOM 0 H GLU B 91 -14.120 7.406 -0.389 1.00 0.00 H new ATOM 0 HA GLU B 91 -14.721 9.235 -1.578 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -11.789 9.552 -2.343 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -13.070 10.696 -2.690 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -13.487 11.035 -0.265 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -12.322 9.791 0.142 1.00 0.00 H new ATOM 1551 N VAL B 92 -14.371 6.898 -3.240 1.00 0.00 N ATOM 1552 CA VAL B 92 -14.619 6.101 -4.431 1.00 0.00 C ATOM 1553 C VAL B 92 -16.010 5.464 -4.348 1.00 0.00 C ATOM 1554 O VAL B 92 -16.665 5.534 -3.309 1.00 0.00 O ATOM 1555 CB VAL B 92 -13.530 5.023 -4.596 1.00 0.00 C ATOM 1556 CG1 VAL B 92 -12.151 5.694 -4.718 1.00 0.00 C ATOM 1557 CG2 VAL B 92 -13.530 4.080 -3.391 1.00 0.00 C ATOM 0 H VAL B 92 -14.556 6.398 -2.371 1.00 0.00 H new ATOM 0 HA VAL B 92 -14.584 6.749 -5.307 1.00 0.00 H new ATOM 0 HB VAL B 92 -13.740 4.448 -5.498 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -11.383 4.929 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -12.142 6.352 -5.587 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -11.949 6.277 -3.819 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -12.756 3.324 -3.521 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -13.332 4.650 -2.483 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -14.502 3.594 -3.309 1.00 0.00 H new ATOM 1567 N SER B 93 -16.472 4.881 -5.443 1.00 0.00 N ATOM 1568 CA SER B 93 -17.790 4.237 -5.481 1.00 0.00 C ATOM 1569 C SER B 93 -17.703 2.783 -4.970 1.00 0.00 C ATOM 1570 O SER B 93 -16.599 2.220 -4.886 1.00 0.00 O ATOM 1571 CB SER B 93 -18.327 4.266 -6.912 1.00 0.00 C ATOM 1572 OG SER B 93 -17.881 5.465 -7.556 1.00 0.00 O ATOM 0 H SER B 93 -15.958 4.837 -6.323 1.00 0.00 H new ATOM 0 HA SER B 93 -18.471 4.783 -4.828 1.00 0.00 H new ATOM 0 HB2 SER B 93 -17.979 3.392 -7.462 1.00 0.00 H new ATOM 0 HB3 SER B 93 -19.416 4.225 -6.906 1.00 0.00 H new ATOM 0 HG SER B 93 -18.221 5.489 -8.475 1.00 0.00 H new ATOM 1578 N ARG B 94 -18.858 2.148 -4.704 1.00 0.00 N ATOM 1579 CA ARG B 94 -18.868 0.736 -4.278 1.00 0.00 C ATOM 1580 C ARG B 94 -18.260 -0.134 -5.352 1.00 0.00 C ATOM 1581 O ARG B 94 -17.537 -1.082 -5.056 1.00 0.00 O ATOM 1582 CB ARG B 94 -20.287 0.226 -3.984 1.00 0.00 C ATOM 1583 CG ARG B 94 -20.832 0.841 -2.701 1.00 0.00 C ATOM 1584 CD ARG B 94 -22.290 0.396 -2.508 1.00 0.00 C ATOM 1585 NE ARG B 94 -22.374 -1.063 -2.408 1.00 0.00 N ATOM 1586 CZ ARG B 94 -23.540 -1.700 -2.340 1.00 0.00 C ATOM 1587 NH1 ARG B 94 -24.654 -1.018 -2.344 1.00 0.00 N ATOM 1588 NH2 ARG B 94 -23.560 -3.000 -2.271 1.00 0.00 N ATOM 0 H ARG B 94 -19.780 2.579 -4.774 1.00 0.00 H new ATOM 0 HA ARG B 94 -18.284 0.680 -3.359 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -20.945 0.471 -4.817 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -20.276 -0.860 -3.895 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -20.228 0.529 -1.849 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -20.775 1.928 -2.752 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -22.699 0.852 -1.606 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -22.896 0.744 -3.344 1.00 0.00 H new ATOM 0 HE ARG B 94 -21.512 -1.608 -2.390 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -24.628 0.000 -2.399 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -25.549 -1.504 -2.292 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -22.685 -3.524 -2.269 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -24.451 -3.494 -2.219 1.00 0.00 H new ATOM 1602 N GLN B 95 -18.535 0.200 -6.601 1.00 0.00 N ATOM 1603 CA GLN B 95 -17.997 -0.572 -7.706 1.00 0.00 C ATOM 1604 C GLN B 95 -16.487 -0.638 -7.561 1.00 0.00 C ATOM 1605 O GLN B 95 -15.875 -1.696 -7.734 1.00 0.00 O ATOM 1606 CB GLN B 95 -18.346 0.081 -9.053 1.00 0.00 C ATOM 1607 CG GLN B 95 -19.856 0.020 -9.310 1.00 0.00 C ATOM 1608 CD GLN B 95 -20.176 0.698 -10.637 1.00 0.00 C ATOM 1609 OE1 GLN B 95 -19.511 0.440 -11.640 1.00 0.00 O ATOM 1610 NE2 GLN B 95 -21.133 1.559 -10.708 1.00 0.00 N ATOM 0 H GLN B 95 -19.120 0.990 -6.873 1.00 0.00 H new ATOM 0 HA GLN B 95 -18.431 -1.572 -7.685 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -18.013 1.119 -9.057 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -17.814 -0.427 -9.858 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -20.190 -1.017 -9.330 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -20.393 0.512 -8.499 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -21.687 1.776 -9.879 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -21.337 2.023 -11.593 1.00 0.00 H new ATOM 1619 N THR B 96 -15.908 0.475 -7.150 1.00 0.00 N ATOM 1620 CA THR B 96 -14.489 0.546 -6.918 1.00 0.00 C ATOM 1621 C THR B 96 -14.103 -0.447 -5.824 1.00 0.00 C ATOM 1622 O THR B 96 -13.193 -1.268 -6.001 1.00 0.00 O ATOM 1623 CB THR B 96 -14.119 1.964 -6.463 1.00 0.00 C ATOM 1624 OG1 THR B 96 -15.200 2.845 -6.750 1.00 0.00 O ATOM 1625 CG2 THR B 96 -12.868 2.439 -7.202 1.00 0.00 C ATOM 0 H THR B 96 -16.409 1.345 -6.971 1.00 0.00 H new ATOM 0 HA THR B 96 -13.958 0.303 -7.838 1.00 0.00 H new ATOM 0 HB THR B 96 -13.920 1.958 -5.391 1.00 0.00 H new ATOM 0 HG1 THR B 96 -14.944 3.452 -7.475 1.00 0.00 H new ATOM 0 HG21 THR B 96 -12.612 3.446 -6.874 1.00 0.00 H new ATOM 0 HG22 THR B 96 -12.039 1.765 -6.985 1.00 0.00 H new ATOM 0 HG23 THR B 96 -13.060 2.445 -8.275 1.00 0.00 H new ATOM 1633 N ILE B 97 -14.822 -0.377 -4.697 1.00 0.00 N ATOM 1634 CA ILE B 97 -14.565 -1.260 -3.569 1.00 0.00 C ATOM 1635 C ILE B 97 -14.853 -2.691 -3.976 1.00 0.00 C ATOM 1636 O ILE B 97 -14.052 -3.589 -3.742 1.00 0.00 O ATOM 1637 CB ILE B 97 -15.462 -0.875 -2.373 1.00 0.00 C ATOM 1638 CG1 ILE B 97 -15.087 0.523 -1.860 1.00 0.00 C ATOM 1639 CG2 ILE B 97 -15.275 -1.887 -1.234 1.00 0.00 C ATOM 1640 CD1 ILE B 97 -13.634 0.541 -1.382 1.00 0.00 C ATOM 0 H ILE B 97 -15.585 0.284 -4.549 1.00 0.00 H new ATOM 0 HA ILE B 97 -13.521 -1.163 -3.273 1.00 0.00 H new ATOM 0 HB ILE B 97 -16.501 -0.877 -2.703 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -15.225 1.258 -2.653 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -15.749 0.808 -1.043 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -15.911 -1.610 -0.393 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -15.549 -2.883 -1.583 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -14.232 -1.888 -0.916 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -13.382 1.538 -1.021 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -13.508 -0.180 -0.574 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -12.975 0.278 -2.210 1.00 0.00 H new ATOM 1652 N ASN B 98 -15.962 -2.874 -4.664 1.00 0.00 N ATOM 1653 CA ASN B 98 -16.345 -4.184 -5.142 1.00 0.00 C ATOM 1654 C ASN B 98 -15.269 -4.709 -6.065 1.00 0.00 C ATOM 1655 O ASN B 98 -14.882 -5.874 -5.986 1.00 0.00 O ATOM 1656 CB ASN B 98 -17.687 -4.115 -5.889 1.00 0.00 C ATOM 1657 CG ASN B 98 -18.849 -4.141 -4.901 1.00 0.00 C ATOM 1658 OD1 ASN B 98 -19.201 -5.208 -4.389 1.00 0.00 O ATOM 1659 ND2 ASN B 98 -19.476 -3.039 -4.595 1.00 0.00 N ATOM 0 H ASN B 98 -16.615 -2.128 -4.904 1.00 0.00 H new ATOM 0 HA ASN B 98 -16.460 -4.855 -4.291 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -17.731 -3.205 -6.487 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -17.770 -4.955 -6.579 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -20.254 -3.061 -3.935 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -19.189 -2.155 -5.015 1.00 0.00 H new ATOM 1666 N GLY B 99 -14.724 -3.830 -6.884 1.00 0.00 N ATOM 1667 CA GLY B 99 -13.628 -4.212 -7.751 1.00 0.00 C ATOM 1668 C GLY B 99 -12.450 -4.674 -6.915 1.00 0.00 C ATOM 1669 O GLY B 99 -11.837 -5.711 -7.200 1.00 0.00 O ATOM 0 H GLY B 99 -15.019 -2.857 -6.967 1.00 0.00 H new ATOM 0 HA2 GLY B 99 -13.944 -5.010 -8.423 1.00 0.00 H new ATOM 0 HA3 GLY B 99 -13.334 -3.368 -8.375 1.00 0.00 H new ATOM 1673 N ILE B 100 -12.171 -3.932 -5.852 1.00 0.00 N ATOM 1674 CA ILE B 100 -11.113 -4.294 -4.922 1.00 0.00 C ATOM 1675 C ILE B 100 -11.464 -5.622 -4.230 1.00 0.00 C ATOM 1676 O ILE B 100 -10.629 -6.534 -4.136 1.00 0.00 O ATOM 1677 CB ILE B 100 -10.934 -3.172 -3.877 1.00 0.00 C ATOM 1678 CG1 ILE B 100 -10.405 -1.911 -4.572 1.00 0.00 C ATOM 1679 CG2 ILE B 100 -9.930 -3.608 -2.804 1.00 0.00 C ATOM 1680 CD1 ILE B 100 -10.471 -0.725 -3.603 1.00 0.00 C ATOM 0 H ILE B 100 -12.665 -3.073 -5.613 1.00 0.00 H new ATOM 0 HA ILE B 100 -10.177 -4.419 -5.466 1.00 0.00 H new ATOM 0 HB ILE B 100 -11.897 -2.966 -3.409 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -9.378 -2.068 -4.901 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -10.996 -1.699 -5.463 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -9.811 -2.810 -2.072 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -10.297 -4.506 -2.306 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -8.968 -3.819 -3.270 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -10.095 0.170 -4.098 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -11.504 -0.563 -3.296 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -9.861 -0.938 -2.725 1.00 0.00 H new ATOM 1692 N GLU B 101 -12.719 -5.734 -3.797 1.00 0.00 N ATOM 1693 CA GLU B 101 -13.217 -6.937 -3.135 1.00 0.00 C ATOM 1694 C GLU B 101 -13.095 -8.128 -4.063 1.00 0.00 C ATOM 1695 O GLU B 101 -12.707 -9.219 -3.653 1.00 0.00 O ATOM 1696 CB GLU B 101 -14.705 -6.752 -2.832 1.00 0.00 C ATOM 1697 CG GLU B 101 -14.923 -5.638 -1.795 1.00 0.00 C ATOM 1698 CD GLU B 101 -15.140 -6.224 -0.414 1.00 0.00 C ATOM 1699 OE1 GLU B 101 -15.605 -7.354 -0.333 1.00 0.00 O ATOM 1700 OE2 GLU B 101 -14.901 -5.528 0.549 1.00 0.00 O ATOM 0 H GLU B 101 -13.416 -4.996 -3.895 1.00 0.00 H new ATOM 0 HA GLU B 101 -12.639 -7.103 -2.226 1.00 0.00 H new ATOM 0 HB2 GLU B 101 -15.239 -6.508 -3.750 1.00 0.00 H new ATOM 0 HB3 GLU B 101 -15.123 -7.687 -2.459 1.00 0.00 H new ATOM 0 HG2 GLU B 101 -14.059 -4.973 -1.781 1.00 0.00 H new ATOM 0 HG3 GLU B 101 -15.785 -5.034 -2.079 1.00 0.00 H new ATOM 1707 N LYS B 102 -13.499 -7.917 -5.298 1.00 0.00 N ATOM 1708 CA LYS B 102 -13.541 -8.960 -6.301 1.00 0.00 C ATOM 1709 C LYS B 102 -12.196 -9.081 -6.975 1.00 0.00 C ATOM 1710 O LYS B 102 -11.975 -9.950 -7.822 1.00 0.00 O ATOM 1711 CB LYS B 102 -14.631 -8.609 -7.287 1.00 0.00 C ATOM 1712 CG LYS B 102 -15.930 -8.593 -6.487 1.00 0.00 C ATOM 1713 CD LYS B 102 -17.074 -8.072 -7.323 1.00 0.00 C ATOM 1714 CE LYS B 102 -18.287 -7.917 -6.408 1.00 0.00 C ATOM 1715 NZ LYS B 102 -18.630 -9.224 -5.793 1.00 0.00 N ATOM 0 H LYS B 102 -13.811 -7.007 -5.637 1.00 0.00 H new ATOM 0 HA LYS B 102 -13.762 -9.928 -5.851 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -14.444 -7.639 -7.747 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -14.678 -9.340 -8.094 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -16.159 -9.600 -6.138 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -15.808 -7.969 -5.602 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -16.812 -7.116 -7.776 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -17.296 -8.760 -8.138 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -18.074 -7.184 -5.630 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -19.136 -7.540 -6.977 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -19.609 -9.197 -5.444 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -18.537 -9.977 -6.504 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -17.985 -9.415 -5.000 1.00 0.00 H new ATOM 1729 N ASN B 103 -11.303 -8.196 -6.587 1.00 0.00 N ATOM 1730 CA ASN B 103 -9.937 -8.172 -7.086 1.00 0.00 C ATOM 1731 C ASN B 103 -9.882 -7.972 -8.591 1.00 0.00 C ATOM 1732 O ASN B 103 -8.976 -8.480 -9.256 1.00 0.00 O ATOM 1733 CB ASN B 103 -9.167 -9.454 -6.707 1.00 0.00 C ATOM 1734 CG ASN B 103 -9.332 -9.794 -5.226 1.00 0.00 C ATOM 1735 OD1 ASN B 103 -9.868 -8.940 -4.412 1.00 0.00 O flip ATOM 1736 ND2 ASN B 103 -8.954 -10.882 -4.800 1.00 0.00 N flip ATOM 0 H ASN B 103 -11.504 -7.462 -5.908 1.00 0.00 H new ATOM 0 HA ASN B 103 -9.456 -7.319 -6.607 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -9.524 -10.286 -7.314 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -8.109 -9.324 -6.935 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -8.531 -11.559 -5.435 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -9.063 -11.108 -3.811 1.00 0.00 H new ATOM 1743 N LYS B 104 -10.767 -7.136 -9.115 1.00 0.00 N ATOM 1744 CA LYS B 104 -10.695 -6.790 -10.532 1.00 0.00 C ATOM 1745 C LYS B 104 -9.354 -6.123 -10.794 1.00 0.00 C ATOM 1746 O LYS B 104 -8.663 -6.409 -11.779 1.00 0.00 O ATOM 1747 CB LYS B 104 -11.812 -5.805 -10.913 1.00 0.00 C ATOM 1748 CG LYS B 104 -13.188 -6.483 -10.884 1.00 0.00 C ATOM 1749 CD LYS B 104 -14.257 -5.439 -11.257 1.00 0.00 C ATOM 1750 CE LYS B 104 -15.652 -6.071 -11.242 1.00 0.00 C ATOM 1751 NZ LYS B 104 -15.801 -6.962 -12.419 1.00 0.00 N ATOM 0 H LYS B 104 -11.526 -6.693 -8.598 1.00 0.00 H new ATOM 0 HA LYS B 104 -10.809 -7.698 -11.125 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -11.806 -4.961 -10.224 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -11.623 -5.405 -11.909 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -13.213 -7.318 -11.585 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -13.388 -6.892 -9.894 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -14.221 -4.606 -10.555 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -14.046 -5.032 -12.246 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -15.797 -6.638 -10.322 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -16.416 -5.294 -11.261 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -16.797 -7.245 -12.516 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -15.499 -6.458 -13.277 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -15.212 -7.809 -12.290 1.00 0.00 H new ATOM 1765 N TYR B 105 -8.977 -5.280 -9.866 1.00 0.00 N ATOM 1766 CA TYR B 105 -7.713 -4.580 -9.890 1.00 0.00 C ATOM 1767 C TYR B 105 -7.274 -4.352 -8.464 1.00 0.00 C ATOM 1768 O TYR B 105 -8.105 -4.381 -7.546 1.00 0.00 O ATOM 1769 CB TYR B 105 -7.881 -3.227 -10.588 1.00 0.00 C ATOM 1770 CG TYR B 105 -8.940 -2.431 -9.856 1.00 0.00 C ATOM 1771 CD1 TYR B 105 -10.288 -2.633 -10.153 1.00 0.00 C ATOM 1772 CD2 TYR B 105 -8.571 -1.505 -8.873 1.00 0.00 C ATOM 1773 CE1 TYR B 105 -11.269 -1.912 -9.479 1.00 0.00 C ATOM 1774 CE2 TYR B 105 -9.555 -0.780 -8.194 1.00 0.00 C ATOM 1775 CZ TYR B 105 -10.906 -0.988 -8.499 1.00 0.00 C ATOM 1776 OH TYR B 105 -11.877 -0.279 -7.842 1.00 0.00 O ATOM 0 H TYR B 105 -9.552 -5.055 -9.054 1.00 0.00 H new ATOM 0 HA TYR B 105 -6.971 -5.168 -10.431 1.00 0.00 H new ATOM 0 HB2 TYR B 105 -6.936 -2.684 -10.592 1.00 0.00 H new ATOM 0 HB3 TYR B 105 -8.170 -3.372 -11.629 1.00 0.00 H new ATOM 0 HD1 TYR B 105 -10.571 -3.351 -10.908 1.00 0.00 H new ATOM 0 HD2 TYR B 105 -7.528 -1.351 -8.640 1.00 0.00 H new ATOM 0 HE1 TYR B 105 -12.311 -2.068 -9.715 1.00 0.00 H new ATOM 0 HE2 TYR B 105 -9.274 -0.062 -7.437 1.00 0.00 H new ATOM 0 HH TYR B 105 -11.989 -0.639 -6.937 1.00 0.00 H new ATOM 1786 N ASN B 106 -6.006 -4.070 -8.271 1.00 0.00 N ATOM 1787 CA ASN B 106 -5.517 -3.753 -6.945 1.00 0.00 C ATOM 1788 C ASN B 106 -5.644 -2.264 -6.705 1.00 0.00 C ATOM 1789 O ASN B 106 -5.364 -1.462 -7.597 1.00 0.00 O ATOM 1790 CB ASN B 106 -4.071 -4.205 -6.765 1.00 0.00 C ATOM 1791 CG ASN B 106 -4.031 -5.704 -6.504 1.00 0.00 C ATOM 1792 OD1 ASN B 106 -3.323 -6.437 -7.190 1.00 0.00 O ATOM 1793 ND2 ASN B 106 -4.755 -6.212 -5.550 1.00 0.00 N ATOM 0 H ASN B 106 -5.299 -4.053 -9.006 1.00 0.00 H new ATOM 0 HA ASN B 106 -6.120 -4.290 -6.213 1.00 0.00 H new ATOM 0 HB2 ASN B 106 -3.491 -3.966 -7.657 1.00 0.00 H new ATOM 0 HB3 ASN B 106 -3.613 -3.669 -5.934 1.00 0.00 H new ATOM 0 HD21 ASN B 106 -4.734 -7.216 -5.373 1.00 0.00 H new ATOM 0 HD22 ASN B 106 -5.344 -5.606 -4.979 1.00 0.00 H new ATOM 1800 N PRO B 107 -6.127 -1.879 -5.558 1.00 0.00 N ATOM 1801 CA PRO B 107 -6.369 -0.441 -5.250 1.00 0.00 C ATOM 1802 C PRO B 107 -5.073 0.336 -5.146 1.00 0.00 C ATOM 1803 O PRO B 107 -4.024 -0.226 -4.811 1.00 0.00 O ATOM 1804 CB PRO B 107 -7.057 -0.490 -3.891 1.00 0.00 C ATOM 1805 CG PRO B 107 -6.490 -1.696 -3.227 1.00 0.00 C ATOM 1806 CD PRO B 107 -6.214 -2.713 -4.341 1.00 0.00 C ATOM 0 HA PRO B 107 -6.952 0.057 -6.025 1.00 0.00 H new ATOM 0 HB2 PRO B 107 -6.857 0.412 -3.313 1.00 0.00 H new ATOM 0 HB3 PRO B 107 -8.139 -0.567 -3.997 1.00 0.00 H new ATOM 0 HG2 PRO B 107 -5.574 -1.449 -2.690 1.00 0.00 H new ATOM 0 HG3 PRO B 107 -7.189 -2.101 -2.495 1.00 0.00 H new ATOM 0 HD2 PRO B 107 -5.289 -3.261 -4.163 1.00 0.00 H new ATOM 0 HD3 PRO B 107 -7.012 -3.451 -4.417 1.00 0.00 H new ATOM 1814 N SER B 108 -5.147 1.627 -5.414 1.00 0.00 N ATOM 1815 CA SER B 108 -3.987 2.476 -5.299 1.00 0.00 C ATOM 1816 C SER B 108 -3.513 2.514 -3.840 1.00 0.00 C ATOM 1817 O SER B 108 -4.286 2.217 -2.912 1.00 0.00 O ATOM 1818 CB SER B 108 -4.302 3.889 -5.806 1.00 0.00 C ATOM 1819 OG SER B 108 -5.033 3.803 -7.036 1.00 0.00 O ATOM 0 H SER B 108 -5.998 2.105 -5.712 1.00 0.00 H new ATOM 0 HA SER B 108 -3.187 2.068 -5.916 1.00 0.00 H new ATOM 0 HB2 SER B 108 -4.884 4.433 -5.062 1.00 0.00 H new ATOM 0 HB3 SER B 108 -3.378 4.447 -5.958 1.00 0.00 H new ATOM 0 HG SER B 108 -5.236 4.705 -7.360 1.00 0.00 H new ATOM 1825 N LEU B 109 -2.253 2.855 -3.643 1.00 0.00 N ATOM 1826 CA LEU B 109 -1.662 2.853 -2.315 1.00 0.00 C ATOM 1827 C LEU B 109 -2.415 3.818 -1.412 1.00 0.00 C ATOM 1828 O LEU B 109 -2.762 3.483 -0.275 1.00 0.00 O ATOM 1829 CB LEU B 109 -0.180 3.260 -2.404 1.00 0.00 C ATOM 1830 CG LEU B 109 0.458 3.279 -1.005 1.00 0.00 C ATOM 1831 CD1 LEU B 109 0.362 1.903 -0.357 1.00 0.00 C ATOM 1832 CD2 LEU B 109 1.926 3.692 -1.112 1.00 0.00 C ATOM 0 H LEU B 109 -1.616 3.138 -4.388 1.00 0.00 H new ATOM 0 HA LEU B 109 -1.730 1.850 -1.894 1.00 0.00 H new ATOM 0 HB2 LEU B 109 0.357 2.562 -3.046 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -0.094 4.245 -2.863 1.00 0.00 H new ATOM 0 HG LEU B 109 -0.080 3.998 -0.387 1.00 0.00 H new ATOM 0 HD11 LEU B 109 0.818 1.934 0.632 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -0.686 1.617 -0.265 1.00 0.00 H new ATOM 0 HD13 LEU B 109 0.885 1.173 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU B 109 2.374 3.704 -0.118 1.00 0.00 H new ATOM 0 HD22 LEU B 109 2.459 2.980 -1.742 1.00 0.00 H new ATOM 0 HD23 LEU B 109 1.993 4.687 -1.552 1.00 0.00 H new ATOM 1844 N GLN B 110 -2.729 4.984 -1.941 1.00 0.00 N ATOM 1845 CA GLN B 110 -3.472 5.974 -1.182 1.00 0.00 C ATOM 1846 C GLN B 110 -4.817 5.397 -0.754 1.00 0.00 C ATOM 1847 O GLN B 110 -5.203 5.496 0.409 1.00 0.00 O ATOM 1848 CB GLN B 110 -3.685 7.226 -2.050 1.00 0.00 C ATOM 1849 CG GLN B 110 -4.472 8.299 -1.289 1.00 0.00 C ATOM 1850 CD GLN B 110 -4.630 9.535 -2.170 1.00 0.00 C ATOM 1851 OE1 GLN B 110 -3.855 9.733 -3.108 1.00 0.00 O ATOM 1852 NE2 GLN B 110 -5.590 10.373 -1.936 1.00 0.00 N ATOM 0 H GLN B 110 -2.483 5.270 -2.889 1.00 0.00 H new ATOM 0 HA GLN B 110 -2.909 6.247 -0.289 1.00 0.00 H new ATOM 0 HB2 GLN B 110 -2.719 7.628 -2.357 1.00 0.00 H new ATOM 0 HB3 GLN B 110 -4.221 6.955 -2.960 1.00 0.00 H new ATOM 0 HG2 GLN B 110 -5.451 7.914 -1.005 1.00 0.00 H new ATOM 0 HG3 GLN B 110 -3.953 8.560 -0.367 1.00 0.00 H new ATOM 0 HE21 GLN B 110 -6.232 10.210 -1.160 1.00 0.00 H new ATOM 0 HE22 GLN B 110 -5.704 11.196 -2.528 1.00 0.00 H new ATOM 1861 N LEU B 111 -5.499 4.739 -1.681 1.00 0.00 N ATOM 1862 CA LEU B 111 -6.768 4.107 -1.357 1.00 0.00 C ATOM 1863 C LEU B 111 -6.573 2.982 -0.349 1.00 0.00 C ATOM 1864 O LEU B 111 -7.327 2.871 0.620 1.00 0.00 O ATOM 1865 CB LEU B 111 -7.454 3.564 -2.617 1.00 0.00 C ATOM 1866 CG LEU B 111 -7.908 4.719 -3.525 1.00 0.00 C ATOM 1867 CD1 LEU B 111 -8.504 4.139 -4.809 1.00 0.00 C ATOM 1868 CD2 LEU B 111 -8.970 5.568 -2.808 1.00 0.00 C ATOM 0 H LEU B 111 -5.200 4.630 -2.650 1.00 0.00 H new ATOM 0 HA LEU B 111 -7.409 4.869 -0.914 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.767 2.915 -3.161 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -8.313 2.955 -2.336 1.00 0.00 H new ATOM 0 HG LEU B 111 -7.051 5.350 -3.762 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -8.829 4.952 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -7.750 3.542 -5.323 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -9.358 3.509 -4.561 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -9.285 6.383 -3.460 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -9.831 4.945 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -8.549 5.979 -1.890 1.00 0.00 H new ATOM 1880 N ALA B 112 -5.544 2.170 -0.565 1.00 0.00 N ATOM 1881 CA ALA B 112 -5.257 1.053 0.328 1.00 0.00 C ATOM 1882 C ALA B 112 -4.945 1.561 1.716 1.00 0.00 C ATOM 1883 O ALA B 112 -5.463 1.048 2.712 1.00 0.00 O ATOM 1884 CB ALA B 112 -4.078 0.226 -0.198 1.00 0.00 C ATOM 0 H ALA B 112 -4.897 2.263 -1.348 1.00 0.00 H new ATOM 0 HA ALA B 112 -6.140 0.415 0.369 1.00 0.00 H new ATOM 0 HB1 ALA B 112 -3.881 -0.602 0.483 1.00 0.00 H new ATOM 0 HB2 ALA B 112 -4.321 -0.167 -1.185 1.00 0.00 H new ATOM 0 HB3 ALA B 112 -3.192 0.858 -0.267 1.00 0.00 H new ATOM 1890 N LEU B 113 -4.130 2.597 1.784 1.00 0.00 N ATOM 1891 CA LEU B 113 -3.783 3.189 3.065 1.00 0.00 C ATOM 1892 C LEU B 113 -5.009 3.768 3.754 1.00 0.00 C ATOM 1893 O LEU B 113 -5.181 3.597 4.971 1.00 0.00 O ATOM 1894 CB LEU B 113 -2.701 4.246 2.927 1.00 0.00 C ATOM 1895 CG LEU B 113 -1.354 3.599 2.564 1.00 0.00 C ATOM 1896 CD1 LEU B 113 -0.357 4.696 2.212 1.00 0.00 C ATOM 1897 CD2 LEU B 113 -0.818 2.815 3.771 1.00 0.00 C ATOM 0 H LEU B 113 -3.698 3.044 0.975 1.00 0.00 H new ATOM 0 HA LEU B 113 -3.385 2.387 3.687 1.00 0.00 H new ATOM 0 HB2 LEU B 113 -2.984 4.965 2.158 1.00 0.00 H new ATOM 0 HB3 LEU B 113 -2.605 4.799 3.861 1.00 0.00 H new ATOM 0 HG LEU B 113 -1.490 2.925 1.718 1.00 0.00 H new ATOM 0 HD11 LEU B 113 0.602 4.247 1.953 1.00 0.00 H new ATOM 0 HD12 LEU B 113 -0.731 5.268 1.363 1.00 0.00 H new ATOM 0 HD13 LEU B 113 -0.228 5.359 3.068 1.00 0.00 H new ATOM 0 HD21 LEU B 113 0.137 2.357 3.512 1.00 0.00 H new ATOM 0 HD22 LEU B 113 -0.679 3.493 4.613 1.00 0.00 H new ATOM 0 HD23 LEU B 113 -1.531 2.038 4.046 1.00 0.00 H new ATOM 1909 N LYS B 114 -5.899 4.406 2.985 1.00 0.00 N ATOM 1910 CA LYS B 114 -7.108 4.930 3.596 1.00 0.00 C ATOM 1911 C LYS B 114 -7.883 3.804 4.253 1.00 0.00 C ATOM 1912 O LYS B 114 -8.383 3.953 5.368 1.00 0.00 O ATOM 1913 CB LYS B 114 -8.052 5.548 2.566 1.00 0.00 C ATOM 1914 CG LYS B 114 -7.580 6.902 2.049 1.00 0.00 C ATOM 1915 CD LYS B 114 -8.647 7.362 1.040 1.00 0.00 C ATOM 1916 CE LYS B 114 -8.403 8.775 0.536 1.00 0.00 C ATOM 1917 NZ LYS B 114 -9.649 9.257 -0.131 1.00 0.00 N ATOM 0 H LYS B 114 -5.806 4.564 1.982 1.00 0.00 H new ATOM 0 HA LYS B 114 -6.787 5.686 4.312 1.00 0.00 H new ATOM 0 HB2 LYS B 114 -8.159 4.863 1.725 1.00 0.00 H new ATOM 0 HB3 LYS B 114 -9.040 5.662 3.012 1.00 0.00 H new ATOM 0 HG2 LYS B 114 -7.479 7.618 2.865 1.00 0.00 H new ATOM 0 HG3 LYS B 114 -6.602 6.820 1.574 1.00 0.00 H new ATOM 0 HD2 LYS B 114 -8.661 6.676 0.193 1.00 0.00 H new ATOM 0 HD3 LYS B 114 -9.630 7.312 1.508 1.00 0.00 H new ATOM 0 HE2 LYS B 114 -8.137 9.433 1.364 1.00 0.00 H new ATOM 0 HE3 LYS B 114 -7.568 8.789 -0.164 1.00 0.00 H new ATOM 0 HZ1 LYS B 114 -9.435 10.102 -0.698 1.00 0.00 H new ATOM 0 HZ2 LYS B 114 -10.022 8.510 -0.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 114 -10.359 9.495 0.591 1.00 0.00 H new ATOM 1931 N ILE B 115 -7.996 2.680 3.550 1.00 0.00 N ATOM 1932 CA ILE B 115 -8.783 1.570 4.055 1.00 0.00 C ATOM 1933 C ILE B 115 -8.161 1.091 5.348 1.00 0.00 C ATOM 1934 O ILE B 115 -8.848 0.903 6.358 1.00 0.00 O ATOM 1935 CB ILE B 115 -8.781 0.407 3.040 1.00 0.00 C ATOM 1936 CG1 ILE B 115 -9.509 0.816 1.760 1.00 0.00 C ATOM 1937 CG2 ILE B 115 -9.509 -0.809 3.632 1.00 0.00 C ATOM 1938 CD1 ILE B 115 -9.312 -0.270 0.695 1.00 0.00 C ATOM 0 H ILE B 115 -7.558 2.519 2.643 1.00 0.00 H new ATOM 0 HA ILE B 115 -9.810 1.898 4.217 1.00 0.00 H new ATOM 0 HB ILE B 115 -7.744 0.157 2.816 1.00 0.00 H new ATOM 0 HG12 ILE B 115 -10.571 0.956 1.961 1.00 0.00 H new ATOM 0 HG13 ILE B 115 -9.125 1.770 1.399 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -9.503 -1.625 2.909 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -9.003 -1.128 4.543 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -10.539 -0.539 3.865 1.00 0.00 H new ATOM 0 HD11 ILE B 115 -9.830 0.019 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE B 115 -8.248 -0.388 0.488 1.00 0.00 H new ATOM 0 HD13 ILE B 115 -9.717 -1.214 1.059 1.00 0.00 H new ATOM 1950 N ALA B 116 -6.849 0.956 5.329 1.00 0.00 N ATOM 1951 CA ALA B 116 -6.133 0.533 6.505 1.00 0.00 C ATOM 1952 C ALA B 116 -6.369 1.507 7.644 1.00 0.00 C ATOM 1953 O ALA B 116 -6.738 1.103 8.750 1.00 0.00 O ATOM 1954 CB ALA B 116 -4.628 0.425 6.209 1.00 0.00 C ATOM 0 H ALA B 116 -6.264 1.134 4.513 1.00 0.00 H new ATOM 0 HA ALA B 116 -6.503 -0.449 6.798 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -4.102 0.104 7.108 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -4.465 -0.303 5.414 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.248 1.397 5.894 1.00 0.00 H new ATOM 1960 N TYR B 117 -6.153 2.795 7.373 1.00 0.00 N ATOM 1961 CA TYR B 117 -6.330 3.823 8.399 1.00 0.00 C ATOM 1962 C TYR B 117 -7.777 3.911 8.874 1.00 0.00 C ATOM 1963 O TYR B 117 -8.043 3.925 10.081 1.00 0.00 O ATOM 1964 CB TYR B 117 -5.876 5.195 7.891 1.00 0.00 C ATOM 1965 CG TYR B 117 -6.044 6.213 9.000 1.00 0.00 C ATOM 1966 CD1 TYR B 117 -4.998 6.440 9.903 1.00 0.00 C ATOM 1967 CD2 TYR B 117 -7.244 6.928 9.127 1.00 0.00 C ATOM 1968 CE1 TYR B 117 -5.147 7.379 10.928 1.00 0.00 C ATOM 1969 CE2 TYR B 117 -7.394 7.864 10.155 1.00 0.00 C ATOM 1970 CZ TYR B 117 -6.348 8.091 11.056 1.00 0.00 C ATOM 1971 OH TYR B 117 -6.504 9.017 12.064 1.00 0.00 O ATOM 0 H TYR B 117 -5.859 3.148 6.463 1.00 0.00 H new ATOM 0 HA TYR B 117 -5.708 3.529 9.244 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -4.834 5.153 7.574 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -6.463 5.487 7.020 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -4.074 5.889 9.807 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -8.052 6.756 8.431 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -4.338 7.556 11.621 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -8.319 8.413 10.254 1.00 0.00 H new ATOM 0 HH TYR B 117 -7.396 9.418 12.005 1.00 0.00 H new ATOM 1981 N TYR B 118 -8.716 4.000 7.930 1.00 0.00 N ATOM 1982 CA TYR B 118 -10.120 4.153 8.296 1.00 0.00 C ATOM 1983 C TYR B 118 -10.592 2.966 9.085 1.00 0.00 C ATOM 1984 O TYR B 118 -11.319 3.110 10.071 1.00 0.00 O ATOM 1985 CB TYR B 118 -11.023 4.359 7.077 1.00 0.00 C ATOM 1986 CG TYR B 118 -10.964 5.800 6.614 1.00 0.00 C ATOM 1987 CD1 TYR B 118 -11.500 6.814 7.414 1.00 0.00 C ATOM 1988 CD2 TYR B 118 -10.380 6.121 5.386 1.00 0.00 C ATOM 1989 CE1 TYR B 118 -11.450 8.143 6.983 1.00 0.00 C ATOM 1990 CE2 TYR B 118 -10.331 7.448 4.955 1.00 0.00 C ATOM 1991 CZ TYR B 118 -10.865 8.458 5.752 1.00 0.00 C ATOM 1992 OH TYR B 118 -10.819 9.767 5.328 1.00 0.00 O ATOM 0 H TYR B 118 -8.533 3.969 6.927 1.00 0.00 H new ATOM 0 HA TYR B 118 -10.189 5.050 8.911 1.00 0.00 H new ATOM 0 HB2 TYR B 118 -10.710 3.698 6.269 1.00 0.00 H new ATOM 0 HB3 TYR B 118 -12.050 4.093 7.328 1.00 0.00 H new ATOM 0 HD1 TYR B 118 -11.952 6.571 8.364 1.00 0.00 H new ATOM 0 HD2 TYR B 118 -9.965 5.339 4.767 1.00 0.00 H new ATOM 0 HE1 TYR B 118 -11.863 8.927 7.601 1.00 0.00 H new ATOM 0 HE2 TYR B 118 -9.879 7.691 4.005 1.00 0.00 H new ATOM 0 HH TYR B 118 -10.379 9.812 4.453 1.00 0.00 H new ATOM 2002 N LEU B 119 -10.163 1.795 8.670 1.00 0.00 N ATOM 2003 CA LEU B 119 -10.530 0.582 9.363 1.00 0.00 C ATOM 2004 C LEU B 119 -9.577 0.338 10.525 1.00 0.00 C ATOM 2005 O LEU B 119 -9.735 -0.625 11.275 1.00 0.00 O ATOM 2006 CB LEU B 119 -10.517 -0.616 8.395 1.00 0.00 C ATOM 2007 CG LEU B 119 -11.520 -0.371 7.242 1.00 0.00 C ATOM 2008 CD1 LEU B 119 -11.497 -1.548 6.259 1.00 0.00 C ATOM 2009 CD2 LEU B 119 -12.944 -0.177 7.788 1.00 0.00 C ATOM 0 H LEU B 119 -9.561 1.658 7.858 1.00 0.00 H new ATOM 0 HA LEU B 119 -11.541 0.694 9.755 1.00 0.00 H new ATOM 0 HB2 LEU B 119 -9.514 -0.759 7.992 1.00 0.00 H new ATOM 0 HB3 LEU B 119 -10.779 -1.529 8.929 1.00 0.00 H new ATOM 0 HG LEU B 119 -11.221 0.538 6.720 1.00 0.00 H new ATOM 0 HD11 LEU B 119 -12.207 -1.363 5.453 1.00 0.00 H new ATOM 0 HD12 LEU B 119 -10.495 -1.655 5.843 1.00 0.00 H new ATOM 0 HD13 LEU B 119 -11.772 -2.464 6.782 1.00 0.00 H new ATOM 0 HD21 LEU B 119 -13.631 -0.006 6.959 1.00 0.00 H new ATOM 0 HD22 LEU B 119 -13.249 -1.069 8.334 1.00 0.00 H new ATOM 0 HD23 LEU B 119 -12.963 0.683 8.458 1.00 0.00 H new ATOM 2021 N ASN B 120 -8.537 1.160 10.621 1.00 0.00 N ATOM 2022 CA ASN B 120 -7.514 0.993 11.653 1.00 0.00 C ATOM 2023 C ASN B 120 -6.991 -0.422 11.618 1.00 0.00 C ATOM 2024 O ASN B 120 -6.802 -1.067 12.650 1.00 0.00 O ATOM 2025 CB ASN B 120 -8.056 1.329 13.044 1.00 0.00 C ATOM 2026 CG ASN B 120 -6.911 1.406 14.046 1.00 0.00 C ATOM 2027 OD1 ASN B 120 -5.758 1.600 13.659 1.00 0.00 O ATOM 2028 ND2 ASN B 120 -7.154 1.274 15.311 1.00 0.00 N ATOM 0 H ASN B 120 -8.378 1.951 9.996 1.00 0.00 H new ATOM 0 HA ASN B 120 -6.700 1.688 11.446 1.00 0.00 H new ATOM 0 HB2 ASN B 120 -8.589 2.279 13.015 1.00 0.00 H new ATOM 0 HB3 ASN B 120 -8.773 0.570 13.357 1.00 0.00 H new ATOM 0 HD21 ASN B 120 -6.391 1.331 15.986 1.00 0.00 H new ATOM 0 HD22 ASN B 120 -8.108 1.113 15.633 1.00 0.00 H new ATOM 2035 N THR B 121 -6.836 -0.921 10.418 1.00 0.00 N ATOM 2036 CA THR B 121 -6.406 -2.278 10.182 1.00 0.00 C ATOM 2037 C THR B 121 -5.165 -2.247 9.309 1.00 0.00 C ATOM 2038 O THR B 121 -5.027 -1.352 8.466 1.00 0.00 O ATOM 2039 CB THR B 121 -7.539 -3.039 9.476 1.00 0.00 C ATOM 2040 OG1 THR B 121 -8.782 -2.752 10.131 1.00 0.00 O ATOM 2041 CG2 THR B 121 -7.275 -4.545 9.512 1.00 0.00 C ATOM 0 H THR B 121 -7.007 -0.389 9.564 1.00 0.00 H new ATOM 0 HA THR B 121 -6.171 -2.780 11.121 1.00 0.00 H new ATOM 0 HB THR B 121 -7.587 -2.719 8.435 1.00 0.00 H new ATOM 0 HG1 THR B 121 -8.669 -1.979 10.722 1.00 0.00 H new ATOM 0 HG21 THR B 121 -8.087 -5.069 9.008 1.00 0.00 H new ATOM 0 HG22 THR B 121 -6.334 -4.762 9.006 1.00 0.00 H new ATOM 0 HG23 THR B 121 -7.216 -4.879 10.548 1.00 0.00 H new ATOM 2049 N PRO B 122 -4.226 -3.127 9.523 1.00 0.00 N ATOM 2050 CA PRO B 122 -2.975 -3.077 8.719 1.00 0.00 C ATOM 2051 C PRO B 122 -3.275 -3.227 7.230 1.00 0.00 C ATOM 2052 O PRO B 122 -4.101 -4.047 6.829 1.00 0.00 O ATOM 2053 CB PRO B 122 -2.152 -4.262 9.239 1.00 0.00 C ATOM 2054 CG PRO B 122 -2.674 -4.499 10.613 1.00 0.00 C ATOM 2055 CD PRO B 122 -4.166 -4.214 10.527 1.00 0.00 C ATOM 0 HA PRO B 122 -2.449 -2.127 8.820 1.00 0.00 H new ATOM 0 HB2 PRO B 122 -2.279 -5.142 8.608 1.00 0.00 H new ATOM 0 HB3 PRO B 122 -1.087 -4.031 9.253 1.00 0.00 H new ATOM 0 HG2 PRO B 122 -2.487 -5.524 10.934 1.00 0.00 H new ATOM 0 HG3 PRO B 122 -2.189 -3.844 11.337 1.00 0.00 H new ATOM 0 HD2 PRO B 122 -4.729 -5.091 10.210 1.00 0.00 H new ATOM 0 HD3 PRO B 122 -4.576 -3.902 11.488 1.00 0.00 H new ATOM 2063 N LEU B 123 -2.564 -2.472 6.418 1.00 0.00 N ATOM 2064 CA LEU B 123 -2.726 -2.528 4.977 1.00 0.00 C ATOM 2065 C LEU B 123 -2.374 -3.908 4.486 1.00 0.00 C ATOM 2066 O LEU B 123 -3.065 -4.480 3.641 1.00 0.00 O ATOM 2067 CB LEU B 123 -1.818 -1.479 4.316 1.00 0.00 C ATOM 2068 CG LEU B 123 -1.936 -1.539 2.785 1.00 0.00 C ATOM 2069 CD1 LEU B 123 -1.609 -0.165 2.206 1.00 0.00 C ATOM 2070 CD2 LEU B 123 -0.938 -2.571 2.226 1.00 0.00 C ATOM 0 H LEU B 123 -1.860 -1.805 6.735 1.00 0.00 H new ATOM 0 HA LEU B 123 -3.762 -2.312 4.715 1.00 0.00 H new ATOM 0 HB2 LEU B 123 -2.090 -0.484 4.667 1.00 0.00 H new ATOM 0 HB3 LEU B 123 -0.783 -1.650 4.612 1.00 0.00 H new ATOM 0 HG LEU B 123 -2.950 -1.830 2.511 1.00 0.00 H new ATOM 0 HD11 LEU B 123 -1.690 -0.199 1.120 1.00 0.00 H new ATOM 0 HD12 LEU B 123 -2.309 0.572 2.599 1.00 0.00 H new ATOM 0 HD13 LEU B 123 -0.593 0.115 2.485 1.00 0.00 H new ATOM 0 HD21 LEU B 123 -1.025 -2.610 1.140 1.00 0.00 H new ATOM 0 HD22 LEU B 123 0.077 -2.280 2.498 1.00 0.00 H new ATOM 0 HD23 LEU B 123 -1.158 -3.553 2.643 1.00 0.00 H new ATOM 2082 N GLU B 124 -1.302 -4.430 5.032 1.00 0.00 N ATOM 2083 CA GLU B 124 -0.795 -5.727 4.667 1.00 0.00 C ATOM 2084 C GLU B 124 -1.787 -6.799 5.055 1.00 0.00 C ATOM 2085 O GLU B 124 -1.999 -7.755 4.319 1.00 0.00 O ATOM 2086 CB GLU B 124 0.534 -5.948 5.360 1.00 0.00 C ATOM 2087 CG GLU B 124 1.536 -4.941 4.789 1.00 0.00 C ATOM 2088 CD GLU B 124 2.854 -5.015 5.509 1.00 0.00 C ATOM 2089 OE1 GLU B 124 3.072 -5.958 6.237 1.00 0.00 O ATOM 2090 OE2 GLU B 124 3.637 -4.127 5.322 1.00 0.00 O ATOM 0 H GLU B 124 -0.752 -3.959 5.750 1.00 0.00 H new ATOM 0 HA GLU B 124 -0.649 -5.778 3.588 1.00 0.00 H new ATOM 0 HB2 GLU B 124 0.430 -5.814 6.437 1.00 0.00 H new ATOM 0 HB3 GLU B 124 0.884 -6.968 5.198 1.00 0.00 H new ATOM 0 HG2 GLU B 124 1.687 -5.137 3.728 1.00 0.00 H new ATOM 0 HG3 GLU B 124 1.130 -3.933 4.872 1.00 0.00 H new ATOM 2097 N ASP B 125 -2.449 -6.606 6.182 1.00 0.00 N ATOM 2098 CA ASP B 125 -3.479 -7.536 6.591 1.00 0.00 C ATOM 2099 C ASP B 125 -4.569 -7.545 5.543 1.00 0.00 C ATOM 2100 O ASP B 125 -5.156 -8.595 5.245 1.00 0.00 O ATOM 2101 CB ASP B 125 -4.079 -7.140 7.948 1.00 0.00 C ATOM 2102 CG ASP B 125 -5.038 -8.218 8.417 1.00 0.00 C ATOM 2103 OD1 ASP B 125 -4.580 -9.299 8.702 1.00 0.00 O ATOM 2104 OD2 ASP B 125 -6.221 -7.961 8.475 1.00 0.00 O ATOM 0 H ASP B 125 -2.293 -5.825 6.820 1.00 0.00 H new ATOM 0 HA ASP B 125 -3.036 -8.527 6.693 1.00 0.00 H new ATOM 0 HB2 ASP B 125 -3.285 -7.002 8.681 1.00 0.00 H new ATOM 0 HB3 ASP B 125 -4.602 -6.187 7.861 1.00 0.00 H new ATOM 2109 N ILE B 126 -4.798 -6.389 4.940 1.00 0.00 N ATOM 2110 CA ILE B 126 -5.802 -6.268 3.896 1.00 0.00 C ATOM 2111 C ILE B 126 -5.232 -6.707 2.549 1.00 0.00 C ATOM 2112 O ILE B 126 -5.822 -7.537 1.849 1.00 0.00 O ATOM 2113 CB ILE B 126 -6.260 -4.810 3.767 1.00 0.00 C ATOM 2114 CG1 ILE B 126 -6.832 -4.297 5.096 1.00 0.00 C ATOM 2115 CG2 ILE B 126 -7.362 -4.743 2.711 1.00 0.00 C ATOM 2116 CD1 ILE B 126 -6.989 -2.778 5.026 1.00 0.00 C ATOM 0 H ILE B 126 -4.303 -5.523 5.155 1.00 0.00 H new ATOM 0 HA ILE B 126 -6.643 -6.905 4.168 1.00 0.00 H new ATOM 0 HB ILE B 126 -5.405 -4.194 3.489 1.00 0.00 H new ATOM 0 HG12 ILE B 126 -7.796 -4.765 5.295 1.00 0.00 H new ATOM 0 HG13 ILE B 126 -6.170 -4.568 5.919 1.00 0.00 H new ATOM 0 HG21 ILE B 126 -7.702 -3.713 2.604 1.00 0.00 H new ATOM 0 HG22 ILE B 126 -6.973 -5.098 1.756 1.00 0.00 H new ATOM 0 HG23 ILE B 126 -8.199 -5.371 3.018 1.00 0.00 H new ATOM 0 HD11 ILE B 126 -7.395 -2.410 5.968 1.00 0.00 H new ATOM 0 HD12 ILE B 126 -6.017 -2.320 4.847 1.00 0.00 H new ATOM 0 HD13 ILE B 126 -7.668 -2.519 4.213 1.00 0.00 H new ATOM 2128 N PHE B 127 -4.105 -6.127 2.174 1.00 0.00 N ATOM 2129 CA PHE B 127 -3.508 -6.384 0.871 1.00 0.00 C ATOM 2130 C PHE B 127 -2.193 -7.132 0.996 1.00 0.00 C ATOM 2131 O PHE B 127 -1.252 -6.639 1.612 1.00 0.00 O ATOM 2132 CB PHE B 127 -3.300 -5.065 0.131 1.00 0.00 C ATOM 2133 CG PHE B 127 -4.645 -4.407 -0.073 1.00 0.00 C ATOM 2134 CD1 PHE B 127 -5.522 -4.889 -1.052 1.00 0.00 C ATOM 2135 CD2 PHE B 127 -5.020 -3.325 0.730 1.00 0.00 C ATOM 2136 CE1 PHE B 127 -6.771 -4.287 -1.225 1.00 0.00 C ATOM 2137 CE2 PHE B 127 -6.270 -2.723 0.559 1.00 0.00 C ATOM 2138 CZ PHE B 127 -7.147 -3.204 -0.419 1.00 0.00 C ATOM 0 H PHE B 127 -3.582 -5.472 2.755 1.00 0.00 H new ATOM 0 HA PHE B 127 -4.191 -7.016 0.303 1.00 0.00 H new ATOM 0 HB2 PHE B 127 -2.642 -4.411 0.703 1.00 0.00 H new ATOM 0 HB3 PHE B 127 -2.817 -5.243 -0.830 1.00 0.00 H new ATOM 0 HD1 PHE B 127 -5.234 -5.725 -1.672 1.00 0.00 H new ATOM 0 HD2 PHE B 127 -4.342 -2.954 1.484 1.00 0.00 H new ATOM 0 HE1 PHE B 127 -7.448 -4.657 -1.981 1.00 0.00 H new ATOM 0 HE2 PHE B 127 -6.558 -1.888 1.181 1.00 0.00 H new ATOM 0 HZ PHE B 127 -8.113 -2.741 -0.553 1.00 0.00 H new ATOM 2148 N GLN B 128 -2.120 -8.305 0.374 1.00 0.00 N ATOM 2149 CA GLN B 128 -0.902 -9.109 0.410 1.00 0.00 C ATOM 2150 C GLN B 128 -0.212 -9.097 -0.942 1.00 0.00 C ATOM 2151 O GLN B 128 -0.825 -9.445 -1.961 1.00 0.00 O ATOM 2152 CB GLN B 128 -1.199 -10.572 0.814 1.00 0.00 C ATOM 2153 CG GLN B 128 -2.625 -10.704 1.364 1.00 0.00 C ATOM 2154 CD GLN B 128 -2.752 -9.926 2.650 1.00 0.00 C ATOM 2155 OE1 GLN B 128 -3.561 -8.924 2.716 1.00 0.00 O flip ATOM 2156 NE2 GLN B 128 -2.083 -10.237 3.627 1.00 0.00 N flip ATOM 0 H GLN B 128 -2.885 -8.719 -0.158 1.00 0.00 H new ATOM 0 HA GLN B 128 -0.247 -8.665 1.160 1.00 0.00 H new ATOM 0 HB2 GLN B 128 -1.075 -11.225 -0.050 1.00 0.00 H new ATOM 0 HB3 GLN B 128 -0.482 -10.899 1.567 1.00 0.00 H new ATOM 0 HG2 GLN B 128 -3.342 -10.333 0.632 1.00 0.00 H new ATOM 0 HG3 GLN B 128 -2.861 -11.754 1.539 1.00 0.00 H new ATOM 0 HE21 GLN B 128 -1.443 -11.029 3.575 1.00 0.00 H new ATOM 0 HE22 GLN B 128 -2.166 -9.704 4.493 1.00 0.00 H new ATOM 2165 N TRP B 129 1.082 -8.828 -0.931 1.00 0.00 N ATOM 2166 CA TRP B 129 1.896 -8.931 -2.127 1.00 0.00 C ATOM 2167 C TRP B 129 2.735 -10.175 -2.016 1.00 0.00 C ATOM 2168 O TRP B 129 3.490 -10.339 -1.053 1.00 0.00 O ATOM 2169 CB TRP B 129 2.808 -7.708 -2.276 1.00 0.00 C ATOM 2170 CG TRP B 129 3.619 -7.818 -3.537 1.00 0.00 C ATOM 2171 CD1 TRP B 129 3.258 -7.321 -4.740 1.00 0.00 C ATOM 2172 CD2 TRP B 129 4.909 -8.462 -3.741 1.00 0.00 C ATOM 2173 NE1 TRP B 129 4.252 -7.621 -5.654 1.00 0.00 N ATOM 2174 CE2 TRP B 129 5.275 -8.327 -5.090 1.00 0.00 C ATOM 2175 CE3 TRP B 129 5.784 -9.143 -2.899 1.00 0.00 C ATOM 2176 CZ2 TRP B 129 6.466 -8.847 -5.584 1.00 0.00 C ATOM 2177 CZ3 TRP B 129 6.982 -9.668 -3.398 1.00 0.00 C ATOM 2178 CH2 TRP B 129 7.318 -9.522 -4.738 1.00 0.00 C ATOM 0 H TRP B 129 1.594 -8.534 -0.099 1.00 0.00 H new ATOM 0 HA TRP B 129 1.249 -8.977 -3.003 1.00 0.00 H new ATOM 0 HB2 TRP B 129 2.208 -6.798 -2.299 1.00 0.00 H new ATOM 0 HB3 TRP B 129 3.471 -7.632 -1.414 1.00 0.00 H new ATOM 0 HD1 TRP B 129 2.347 -6.781 -4.952 1.00 0.00 H new ATOM 0 HE1 TRP B 129 4.224 -7.346 -6.636 1.00 0.00 H new ATOM 0 HE3 TRP B 129 5.537 -9.267 -1.855 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 6.722 -8.722 -6.626 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 7.653 -10.193 -2.734 1.00 0.00 H new ATOM 0 HH2 TRP B 129 8.242 -9.935 -5.114 1.00 0.00 H new ATOM 2189 N GLN B 130 2.554 -11.076 -2.939 1.00 0.00 N ATOM 2190 CA GLN B 130 3.269 -12.325 -2.910 1.00 0.00 C ATOM 2191 C GLN B 130 4.081 -12.478 -4.172 1.00 0.00 C ATOM 2192 O GLN B 130 3.571 -12.253 -5.269 1.00 0.00 O ATOM 2193 CB GLN B 130 2.289 -13.496 -2.760 1.00 0.00 C ATOM 2194 CG GLN B 130 1.356 -13.233 -1.567 1.00 0.00 C ATOM 2195 CD GLN B 130 0.916 -14.551 -0.951 1.00 0.00 C ATOM 2196 OE1 GLN B 130 0.264 -15.359 -1.612 1.00 0.00 O ATOM 2197 NE2 GLN B 130 1.231 -14.818 0.272 1.00 0.00 N ATOM 0 H GLN B 130 1.914 -10.970 -3.726 1.00 0.00 H new ATOM 0 HA GLN B 130 3.943 -12.328 -2.053 1.00 0.00 H new ATOM 0 HB2 GLN B 130 1.705 -13.615 -3.673 1.00 0.00 H new ATOM 0 HB3 GLN B 130 2.837 -14.426 -2.609 1.00 0.00 H new ATOM 0 HG2 GLN B 130 1.869 -12.626 -0.821 1.00 0.00 H new ATOM 0 HG3 GLN B 130 0.484 -12.666 -1.894 1.00 0.00 H new ATOM 0 HE21 GLN B 130 1.771 -14.147 0.818 1.00 0.00 H new ATOM 0 HE22 GLN B 130 0.940 -15.700 0.693 1.00 0.00 H new ATOM 2206 N PRO B 131 5.315 -12.875 -4.057 1.00 0.00 N ATOM 2207 CA PRO B 131 6.176 -13.077 -5.257 1.00 0.00 C ATOM 2208 C PRO B 131 5.543 -14.100 -6.177 1.00 0.00 C ATOM 2209 O PRO B 131 4.912 -15.048 -5.710 1.00 0.00 O ATOM 2210 CB PRO B 131 7.478 -13.642 -4.678 1.00 0.00 C ATOM 2211 CG PRO B 131 7.480 -13.214 -3.256 1.00 0.00 C ATOM 2212 CD PRO B 131 6.024 -13.234 -2.821 1.00 0.00 C ATOM 0 HA PRO B 131 6.323 -12.164 -5.835 1.00 0.00 H new ATOM 0 HB2 PRO B 131 7.510 -14.728 -4.764 1.00 0.00 H new ATOM 0 HB3 PRO B 131 8.348 -13.254 -5.209 1.00 0.00 H new ATOM 0 HG2 PRO B 131 8.081 -13.887 -2.645 1.00 0.00 H new ATOM 0 HG3 PRO B 131 7.908 -12.217 -3.147 1.00 0.00 H new ATOM 0 HD2 PRO B 131 5.725 -14.215 -2.452 1.00 0.00 H new ATOM 0 HD3 PRO B 131 5.830 -12.520 -2.021 1.00 0.00 H new ATOM 2220 N GLU B 132 5.681 -13.895 -7.476 1.00 0.00 N ATOM 2221 CA GLU B 132 5.107 -14.802 -8.447 1.00 0.00 C ATOM 2222 C GLU B 132 5.847 -16.128 -8.401 1.00 0.00 C ATOM 2223 O GLU B 132 7.056 -16.105 -8.460 1.00 0.00 O ATOM 2224 CB GLU B 132 5.219 -14.204 -9.846 1.00 0.00 C ATOM 2225 CG GLU B 132 4.377 -12.927 -9.928 1.00 0.00 C ATOM 2226 CD GLU B 132 4.586 -12.211 -11.255 1.00 0.00 C ATOM 2227 OE1 GLU B 132 5.325 -12.712 -12.088 1.00 0.00 O ATOM 2228 OE2 GLU B 132 4.011 -11.166 -11.418 1.00 0.00 O ATOM 2229 OXT GLU B 132 5.202 -17.138 -8.312 1.00 0.00 O ATOM 0 H GLU B 132 6.187 -13.107 -7.880 1.00 0.00 H new ATOM 0 HA GLU B 132 4.055 -14.962 -8.210 1.00 0.00 H new ATOM 0 HB2 GLU B 132 6.261 -13.980 -10.074 1.00 0.00 H new ATOM 0 HB3 GLU B 132 4.878 -14.925 -10.589 1.00 0.00 H new ATOM 0 HG2 GLU B 132 3.323 -13.176 -9.809 1.00 0.00 H new ATOM 0 HG3 GLU B 132 4.642 -12.261 -9.107 1.00 0.00 H new TER 2236 GLU B 132