USER MOD reduce.3.24.130724 H: found=0, std=0, add=1462, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1460 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: C 79 TYR OH : rot -158:sc= 1.02 USER MOD Set 1.2: C 83 TYR OH : rot 37:sc= 0.343! USER MOD Set 2.1: C 45 MET CE :methyl -127:sc= -0.181 (180deg=-0.08) USER MOD Set 2.2: C 61 ASN :FLIP amide:sc= -0.846! F(o=-1.9,f=-1!) USER MOD Set 3.1: C 27 HIS :FLIP no HD1:sc= -1.29 F(o=-4.2!,f=-3.1) USER MOD Set 3.2: C 67 SER OG : rot -112:sc= -1.8 USER MOD Set 4.1: B 63 THR OG1 : rot 180:sc= -0.357! USER MOD Set 4.2: B 64 SER OG : rot 67:sc= 0.233 USER MOD Set 4.3: B 65 GLN : amide:sc= 0.145 X(o=0.021,f=-0.36) USER MOD Set 5.1: B 46 LYS NZ :NH3+ -155:sc= 0.92 (180deg=0) USER MOD Set 5.2: B 49 GLN : amide:sc= -1.92! C(o=-1!,f=-13!) USER MOD Set 6.1: A 5 GLN : amide:sc= 0.844 K(o=-2.3,f=-6!) USER MOD Set 6.2: C 108 ASN :FLIP amide:sc= -4.03! C(o=-4.2!,f=-2.3!) USER MOD Set 6.3: C 112 CYS SG : rot 94:sc= 0.883 USER MOD Set 7.1: A 3 THR OG1 : rot -155:sc= 1.06 USER MOD Set 7.2: C 76 TYR OH : rot 26:sc= 0.697 USER MOD Single : A 1 VAL N :NH3+ 169:sc= -2.06! (180deg=-2.36) USER MOD Single : A 6 HIS : no HD1:sc= -0.181 X(o=-0.18,f=-0.37) USER MOD Single : A 8 CYS SG : rot -37:sc= -7.16! USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -89:sc= -7.94! USER MOD Single : A 13 ASN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -147:sc= -0.108 (180deg=-1.13) USER MOD Single : B 6 MET CE :methyl 173:sc= -0.636 (180deg=-0.696) USER MOD Single : B 10 HIS : no HE2:sc= -12.6! C(o=-13!,f=-17!) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 48:sc= -3.56! USER MOD Single : B 13 THR OG1 : rot 150:sc= -5! USER MOD Single : B 16 THR OG1 : rot 171:sc= -2.6! USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 22 SER OG : rot 180:sc= -0.538! USER MOD Single : B 23 THR OG1 : rot 180:sc= -0.163 USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 LYS NZ :NH3+ -119:sc= -0.0194 (180deg=-0.368) USER MOD Single : B 42 GLN : amide:sc= -5.54! C(o=-5.5!,f=-7.3!) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 THR OG1 : rot 159:sc= -1.8! USER MOD Single : B 60 CYS SG : rot -95:sc= 0.0834! USER MOD Single : B 66 THR OG1 : rot -47:sc= 0.204 USER MOD Single : B 70 GLN : amide:sc= -0.408 K(o=-0.41,f=-3.5!) USER MOD Single : B 74 THR OG1 : rot -34:sc= 0.653 USER MOD Single : B 89 CYS SG : rot 62:sc= 0.0772 USER MOD Single : C 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 18 TYR OH : rot -164:sc= 0.0225 USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 24 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 HIS : no HE2:sc= -13.2! C(o=-13!,f=-15!) USER MOD Single : C 38 THR OG1 : rot 88:sc= -3.61! USER MOD Single : C 39 SER OG : rot 112:sc= -0.32! USER MOD Single : C 41 THR OG1 : rot 94:sc= -5.45! USER MOD Single : C 43 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.00209) USER MOD Single : C 58 ASN : amide:sc= -0.542 K(o=-0.54,f=-7.1!) USER MOD Single : C 68 HIS : no HD1:sc= -0.502 X(o=-0.5,f=-0.057) USER MOD Single : C 71 SER OG : rot 180:sc= 0 USER MOD Single : C 72 LYS NZ :NH3+ -141:sc= -0.446 (180deg=-1.1) USER MOD Single : C 74 CYS SG : rot -15:sc= -2.33 USER MOD Single : C 75 MET CE :methyl -177:sc= 0 (180deg=-0.0219) USER MOD Single : C 78 THR OG1 : rot -52:sc= 0.46 USER MOD Single : C 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 14.589 4.554 17.091 1.00 0.00 N ATOM 2 CA VAL A 1 13.902 5.074 15.874 1.00 0.00 C ATOM 3 C VAL A 1 13.274 6.418 16.129 1.00 0.00 C ATOM 4 O VAL A 1 12.728 6.710 17.175 1.00 0.00 O ATOM 5 CB VAL A 1 12.838 4.089 15.472 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.842 3.948 16.610 1.00 0.00 C ATOM 7 CG2 VAL A 1 12.119 4.623 14.231 1.00 0.00 C ATOM 0 H1 VAL A 1 14.848 3.557 16.944 1.00 0.00 H new ATOM 0 H2 VAL A 1 15.448 5.112 17.270 1.00 0.00 H new ATOM 0 H3 VAL A 1 13.951 4.629 17.909 1.00 0.00 H new ATOM 0 HA VAL A 1 14.637 5.196 15.078 1.00 0.00 H new ATOM 0 HB VAL A 1 13.284 3.119 15.253 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.066 3.236 16.328 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.357 3.590 17.502 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.387 4.917 16.818 1.00 0.00 H new ATOM 0 HG21 VAL A 1 11.344 3.919 13.928 1.00 0.00 H new ATOM 0 HG22 VAL A 1 11.664 5.586 14.461 1.00 0.00 H new ATOM 0 HG23 VAL A 1 12.836 4.745 13.419 1.00 0.00 H new ATOM 19 N ALA A 2 13.386 7.228 15.155 1.00 0.00 N ATOM 20 CA ALA A 2 12.847 8.610 15.226 1.00 0.00 C ATOM 21 C ALA A 2 11.701 8.796 14.232 1.00 0.00 C ATOM 22 O ALA A 2 11.688 8.209 13.169 1.00 0.00 O ATOM 23 CB ALA A 2 14.028 9.473 14.816 1.00 0.00 C ATOM 0 H ALA A 2 13.843 6.998 14.272 1.00 0.00 H new ATOM 0 HA ALA A 2 12.450 8.855 16.211 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.735 10.523 14.835 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.853 9.314 15.510 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.344 9.203 13.808 1.00 0.00 H new ATOM 29 N THR A 3 10.750 9.628 14.556 1.00 0.00 N ATOM 30 CA THR A 3 9.628 9.862 13.608 1.00 0.00 C ATOM 31 C THR A 3 10.198 10.351 12.276 1.00 0.00 C ATOM 32 O THR A 3 11.287 10.887 12.222 1.00 0.00 O ATOM 33 CB THR A 3 8.772 10.949 14.261 1.00 0.00 C ATOM 34 OG1 THR A 3 8.471 10.573 15.598 1.00 0.00 O ATOM 35 CG2 THR A 3 7.473 11.120 13.473 1.00 0.00 C ATOM 0 H THR A 3 10.702 10.152 15.430 1.00 0.00 H new ATOM 0 HA THR A 3 9.044 8.964 13.409 1.00 0.00 H new ATOM 0 HB THR A 3 9.320 11.891 14.263 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.646 11.017 15.885 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.864 11.895 13.939 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.705 11.408 12.448 1.00 0.00 H new ATOM 0 HG23 THR A 3 6.923 10.179 13.470 1.00 0.00 H new ATOM 43 N LEU A 4 9.484 10.175 11.200 1.00 0.00 N ATOM 44 CA LEU A 4 10.017 10.640 9.888 1.00 0.00 C ATOM 45 C LEU A 4 10.409 12.120 9.972 1.00 0.00 C ATOM 46 O LEU A 4 11.087 12.643 9.112 1.00 0.00 O ATOM 47 CB LEU A 4 8.873 10.446 8.887 1.00 0.00 C ATOM 48 CG LEU A 4 9.444 10.149 7.496 1.00 0.00 C ATOM 49 CD1 LEU A 4 8.437 10.585 6.431 1.00 0.00 C ATOM 50 CD2 LEU A 4 10.750 10.920 7.292 1.00 0.00 C ATOM 0 H LEU A 4 8.565 9.734 11.170 1.00 0.00 H new ATOM 0 HA LEU A 4 10.908 10.087 9.592 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.231 9.626 9.209 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.253 11.342 8.852 1.00 0.00 H new ATOM 0 HG LEU A 4 9.637 9.080 7.411 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.841 10.375 5.441 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.504 10.037 6.566 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.247 11.654 6.526 1.00 0.00 H new ATOM 0 HD21 LEU A 4 11.149 10.703 6.301 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.559 11.989 7.380 1.00 0.00 H new ATOM 0 HD23 LEU A 4 11.473 10.617 8.049 1.00 0.00 H new ATOM 62 N GLN A 5 9.981 12.800 11.000 1.00 0.00 N ATOM 63 CA GLN A 5 10.320 14.247 11.132 1.00 0.00 C ATOM 64 C GLN A 5 11.831 14.430 11.317 1.00 0.00 C ATOM 65 O GLN A 5 12.433 15.316 10.745 1.00 0.00 O ATOM 66 CB GLN A 5 9.572 14.710 12.381 1.00 0.00 C ATOM 67 CG GLN A 5 9.267 16.203 12.267 1.00 0.00 C ATOM 68 CD GLN A 5 10.284 16.997 13.089 1.00 0.00 C ATOM 69 OE1 GLN A 5 10.184 17.065 14.299 1.00 0.00 O ATOM 70 NE2 GLN A 5 11.265 17.605 12.481 1.00 0.00 N ATOM 0 H GLN A 5 9.411 12.417 11.755 1.00 0.00 H new ATOM 0 HA GLN A 5 10.040 14.817 10.246 1.00 0.00 H new ATOM 0 HB2 GLN A 5 8.646 14.146 12.493 1.00 0.00 H new ATOM 0 HB3 GLN A 5 10.172 14.517 13.270 1.00 0.00 H new ATOM 0 HG2 GLN A 5 9.305 16.514 11.223 1.00 0.00 H new ATOM 0 HG3 GLN A 5 8.257 16.407 12.623 1.00 0.00 H new ATOM 0 HE21 GLN A 5 11.349 17.548 11.466 1.00 0.00 H new ATOM 0 HE22 GLN A 5 11.948 18.137 13.021 1.00 0.00 H new ATOM 79 N HIS A 6 12.443 13.604 12.119 1.00 0.00 N ATOM 80 CA HIS A 6 13.912 13.736 12.349 1.00 0.00 C ATOM 81 C HIS A 6 14.696 13.197 11.148 1.00 0.00 C ATOM 82 O HIS A 6 15.684 13.769 10.734 1.00 0.00 O ATOM 83 CB HIS A 6 14.191 12.892 13.592 1.00 0.00 C ATOM 84 CG HIS A 6 15.447 13.381 14.260 1.00 0.00 C ATOM 85 ND1 HIS A 6 15.669 14.724 14.523 1.00 0.00 N ATOM 86 CD2 HIS A 6 16.555 12.719 14.725 1.00 0.00 C ATOM 87 CE1 HIS A 6 16.869 14.826 15.122 1.00 0.00 C ATOM 88 NE2 HIS A 6 17.452 13.633 15.270 1.00 0.00 N ATOM 0 H HIS A 6 11.991 12.843 12.626 1.00 0.00 H new ATOM 0 HA HIS A 6 14.215 14.775 12.479 1.00 0.00 H new ATOM 0 HB2 HIS A 6 13.351 12.955 14.283 1.00 0.00 H new ATOM 0 HB3 HIS A 6 14.298 11.843 13.316 1.00 0.00 H new ATOM 0 HD2 HIS A 6 16.708 11.651 14.676 1.00 0.00 H new ATOM 0 HE1 HIS A 6 17.308 15.759 15.444 1.00 0.00 H new ATOM 0 HE2 HIS A 6 18.359 13.435 15.692 1.00 0.00 H new ATOM 96 N LEU A 7 14.269 12.096 10.591 1.00 0.00 N ATOM 97 CA LEU A 7 14.999 11.523 9.423 1.00 0.00 C ATOM 98 C LEU A 7 14.947 12.489 8.237 1.00 0.00 C ATOM 99 O LEU A 7 15.952 12.789 7.624 1.00 0.00 O ATOM 100 CB LEU A 7 14.260 10.225 9.088 1.00 0.00 C ATOM 101 CG LEU A 7 14.458 9.197 10.209 1.00 0.00 C ATOM 102 CD1 LEU A 7 15.834 9.382 10.857 1.00 0.00 C ATOM 103 CD2 LEU A 7 13.369 9.381 11.269 1.00 0.00 C ATOM 0 H LEU A 7 13.449 11.570 10.893 1.00 0.00 H new ATOM 0 HA LEU A 7 16.052 11.348 9.644 1.00 0.00 H new ATOM 0 HB2 LEU A 7 13.197 10.427 8.954 1.00 0.00 H new ATOM 0 HB3 LEU A 7 14.629 9.821 8.145 1.00 0.00 H new ATOM 0 HG LEU A 7 14.395 8.194 9.786 1.00 0.00 H new ATOM 0 HD11 LEU A 7 15.964 8.647 11.651 1.00 0.00 H new ATOM 0 HD12 LEU A 7 16.611 9.245 10.105 1.00 0.00 H new ATOM 0 HD13 LEU A 7 15.907 10.386 11.276 1.00 0.00 H new ATOM 0 HD21 LEU A 7 13.510 8.650 12.066 1.00 0.00 H new ATOM 0 HD22 LEU A 7 13.431 10.387 11.684 1.00 0.00 H new ATOM 0 HD23 LEU A 7 12.389 9.237 10.813 1.00 0.00 H new ATOM 115 N CYS A 8 13.783 12.979 7.909 1.00 0.00 N ATOM 116 CA CYS A 8 13.665 13.919 6.767 1.00 0.00 C ATOM 117 C CYS A 8 14.487 15.184 7.030 1.00 0.00 C ATOM 118 O CYS A 8 15.052 15.768 6.127 1.00 0.00 O ATOM 119 CB CYS A 8 12.178 14.244 6.702 1.00 0.00 C ATOM 120 SG CYS A 8 11.719 15.277 8.116 1.00 0.00 S ATOM 0 H CYS A 8 12.907 12.766 8.387 1.00 0.00 H new ATOM 0 HA CYS A 8 14.039 13.498 5.834 1.00 0.00 H new ATOM 0 HB2 CYS A 8 11.949 14.762 5.771 1.00 0.00 H new ATOM 0 HB3 CYS A 8 11.594 13.324 6.706 1.00 0.00 H new ATOM 0 HG CYS A 8 12.388 14.899 9.165 1.00 0.00 H new ATOM 126 N ARG A 9 14.555 15.612 8.260 1.00 0.00 N ATOM 127 CA ARG A 9 15.339 16.839 8.580 1.00 0.00 C ATOM 128 C ARG A 9 16.814 16.631 8.228 1.00 0.00 C ATOM 129 O ARG A 9 17.532 17.570 7.944 1.00 0.00 O ATOM 130 CB ARG A 9 15.169 17.032 10.087 1.00 0.00 C ATOM 131 CG ARG A 9 15.606 18.447 10.472 1.00 0.00 C ATOM 132 CD ARG A 9 14.715 18.967 11.602 1.00 0.00 C ATOM 133 NE ARG A 9 15.497 20.071 12.226 1.00 0.00 N ATOM 134 CZ ARG A 9 15.594 21.224 11.623 1.00 0.00 C ATOM 135 NH1 ARG A 9 14.996 21.416 10.478 1.00 0.00 N ATOM 136 NH2 ARG A 9 16.287 22.187 12.166 1.00 0.00 N ATOM 0 H ARG A 9 14.102 15.166 9.058 1.00 0.00 H new ATOM 0 HA ARG A 9 14.998 17.707 8.016 1.00 0.00 H new ATOM 0 HB2 ARG A 9 14.129 16.871 10.370 1.00 0.00 H new ATOM 0 HB3 ARG A 9 15.764 16.296 10.628 1.00 0.00 H new ATOM 0 HG2 ARG A 9 16.649 18.443 10.789 1.00 0.00 H new ATOM 0 HG3 ARG A 9 15.538 19.108 9.608 1.00 0.00 H new ATOM 0 HD2 ARG A 9 13.760 19.326 11.219 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.494 18.182 12.325 1.00 0.00 H new ATOM 0 HE ARG A 9 15.957 19.925 13.125 1.00 0.00 H new ATOM 0 HH11 ARG A 9 14.452 20.664 10.054 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.073 22.318 10.008 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.752 22.038 13.061 1.00 0.00 H new ATOM 0 HH22 ARG A 9 16.363 23.089 11.695 1.00 0.00 H new ATOM 150 N LYS A 10 17.273 15.410 8.246 1.00 0.00 N ATOM 151 CA LYS A 10 18.703 15.144 7.915 1.00 0.00 C ATOM 152 C LYS A 10 18.995 15.526 6.462 1.00 0.00 C ATOM 153 O LYS A 10 20.050 16.041 6.146 1.00 0.00 O ATOM 154 CB LYS A 10 18.883 13.639 8.119 1.00 0.00 C ATOM 155 CG LYS A 10 20.315 13.353 8.574 1.00 0.00 C ATOM 156 CD LYS A 10 20.502 13.843 10.011 1.00 0.00 C ATOM 157 CE LYS A 10 21.896 13.450 10.507 1.00 0.00 C ATOM 158 NZ LYS A 10 21.996 14.033 11.874 1.00 0.00 N ATOM 0 H LYS A 10 16.720 14.584 8.476 1.00 0.00 H new ATOM 0 HA LYS A 10 19.383 15.726 8.537 1.00 0.00 H new ATOM 0 HB2 LYS A 10 18.174 13.275 8.863 1.00 0.00 H new ATOM 0 HB3 LYS A 10 18.672 13.108 7.191 1.00 0.00 H new ATOM 0 HG2 LYS A 10 20.520 12.284 8.513 1.00 0.00 H new ATOM 0 HG3 LYS A 10 21.024 13.852 7.913 1.00 0.00 H new ATOM 0 HD2 LYS A 10 20.380 14.925 10.056 1.00 0.00 H new ATOM 0 HD3 LYS A 10 19.739 13.409 10.657 1.00 0.00 H new ATOM 0 HE2 LYS A 10 22.016 12.367 10.530 1.00 0.00 H new ATOM 0 HE3 LYS A 10 22.674 13.843 9.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 22.926 13.806 12.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 21.885 15.066 11.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 21.248 13.635 12.477 1.00 0.00 H new ATOM 172 N THR A 11 18.073 15.275 5.573 1.00 0.00 N ATOM 173 CA THR A 11 18.303 15.623 4.140 1.00 0.00 C ATOM 174 C THR A 11 18.569 17.123 3.993 1.00 0.00 C ATOM 175 O THR A 11 19.546 17.535 3.400 1.00 0.00 O ATOM 176 CB THR A 11 17.007 15.235 3.426 1.00 0.00 C ATOM 177 OG1 THR A 11 16.986 13.829 3.221 1.00 0.00 O ATOM 178 CG2 THR A 11 16.930 15.950 2.075 1.00 0.00 C ATOM 0 H THR A 11 17.171 14.844 5.776 1.00 0.00 H new ATOM 0 HA THR A 11 19.169 15.107 3.724 1.00 0.00 H new ATOM 0 HB THR A 11 16.154 15.528 4.037 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.410 13.617 2.363 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.006 15.672 1.568 1.00 0.00 H new ATOM 0 HG22 THR A 11 16.947 17.028 2.233 1.00 0.00 H new ATOM 0 HG23 THR A 11 17.782 15.660 1.461 1.00 0.00 H new ATOM 186 N VAL A 12 17.707 17.944 4.528 1.00 0.00 N ATOM 187 CA VAL A 12 17.913 19.416 4.414 1.00 0.00 C ATOM 188 C VAL A 12 19.166 19.835 5.189 1.00 0.00 C ATOM 189 O VAL A 12 19.930 20.671 4.748 1.00 0.00 O ATOM 190 CB VAL A 12 16.662 20.040 5.032 1.00 0.00 C ATOM 191 CG1 VAL A 12 16.747 21.563 4.927 1.00 0.00 C ATOM 192 CG2 VAL A 12 15.423 19.546 4.281 1.00 0.00 C ATOM 0 H VAL A 12 16.871 17.660 5.038 1.00 0.00 H new ATOM 0 HA VAL A 12 18.058 19.736 3.382 1.00 0.00 H new ATOM 0 HB VAL A 12 16.592 19.751 6.081 1.00 0.00 H new ATOM 0 HG11 VAL A 12 15.855 22.008 5.368 1.00 0.00 H new ATOM 0 HG12 VAL A 12 17.630 21.916 5.460 1.00 0.00 H new ATOM 0 HG13 VAL A 12 16.817 21.852 3.878 1.00 0.00 H new ATOM 0 HG21 VAL A 12 14.530 19.990 4.721 1.00 0.00 H new ATOM 0 HG22 VAL A 12 15.494 19.835 3.232 1.00 0.00 H new ATOM 0 HG23 VAL A 12 15.362 18.460 4.354 1.00 0.00 H new ATOM 202 N ASN A 13 19.385 19.258 6.340 1.00 0.00 N ATOM 203 CA ASN A 13 20.591 19.622 7.138 1.00 0.00 C ATOM 204 C ASN A 13 21.863 19.305 6.346 1.00 0.00 C ATOM 205 O ASN A 13 22.833 20.036 6.391 1.00 0.00 O ATOM 206 CB ASN A 13 20.511 18.755 8.395 1.00 0.00 C ATOM 207 CG ASN A 13 21.404 19.351 9.486 1.00 0.00 C ATOM 208 OD1 ASN A 13 20.915 19.896 10.456 1.00 0.00 O ATOM 209 ND2 ASN A 13 22.701 19.271 9.367 1.00 0.00 N ATOM 0 H ASN A 13 18.782 18.552 6.761 1.00 0.00 H new ATOM 0 HA ASN A 13 20.623 20.685 7.378 1.00 0.00 H new ATOM 0 HB2 ASN A 13 19.480 18.698 8.745 1.00 0.00 H new ATOM 0 HB3 ASN A 13 20.827 17.737 8.168 1.00 0.00 H new ATOM 0 HD21 ASN A 13 23.305 19.666 10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 13 23.111 18.814 8.553 1.00 0.00 H new ATOM 216 N GLY A 14 21.866 18.219 5.623 1.00 0.00 N ATOM 217 CA GLY A 14 23.073 17.854 4.829 1.00 0.00 C ATOM 218 C GLY A 14 23.348 18.938 3.785 1.00 0.00 C ATOM 219 O GLY A 14 24.398 18.972 3.174 1.00 0.00 O ATOM 0 H GLY A 14 21.084 17.568 5.548 1.00 0.00 H new ATOM 0 HA2 GLY A 14 23.934 17.743 5.488 1.00 0.00 H new ATOM 0 HA3 GLY A 14 22.921 16.893 4.338 1.00 0.00 H new ATOM 223 N HIS A 15 22.413 19.824 3.574 1.00 0.00 N ATOM 224 CA HIS A 15 22.624 20.904 2.569 1.00 0.00 C ATOM 225 C HIS A 15 23.211 22.148 3.243 1.00 0.00 C ATOM 226 O HIS A 15 23.068 22.347 4.432 1.00 0.00 O ATOM 227 CB HIS A 15 21.232 21.203 2.012 1.00 0.00 C ATOM 228 CG HIS A 15 21.125 20.661 0.613 1.00 0.00 C ATOM 229 ND1 HIS A 15 21.851 21.192 -0.442 1.00 0.00 N ATOM 230 CD2 HIS A 15 20.383 19.637 0.079 1.00 0.00 C ATOM 231 CE1 HIS A 15 21.533 20.492 -1.546 1.00 0.00 C ATOM 232 NE2 HIS A 15 20.642 19.532 -1.284 1.00 0.00 N ATOM 0 H HIS A 15 21.513 19.847 4.054 1.00 0.00 H new ATOM 0 HA HIS A 15 23.322 20.609 1.786 1.00 0.00 H new ATOM 0 HB2 HIS A 15 20.470 20.752 2.647 1.00 0.00 H new ATOM 0 HB3 HIS A 15 21.052 22.278 2.012 1.00 0.00 H new ATOM 0 HD2 HIS A 15 19.702 19.008 0.633 1.00 0.00 H new ATOM 0 HE1 HIS A 15 21.948 20.683 -2.525 1.00 0.00 H new ATOM 0 HE2 HIS A 15 20.238 18.865 -1.942 1.00 0.00 H new ATOM 241 N MET B 1 12.887 -17.980 12.910 1.00 0.00 N ATOM 242 CA MET B 1 13.168 -16.557 12.562 1.00 0.00 C ATOM 243 C MET B 1 11.896 -15.880 12.043 1.00 0.00 C ATOM 244 O MET B 1 10.837 -16.474 12.004 1.00 0.00 O ATOM 245 CB MET B 1 14.230 -16.620 11.463 1.00 0.00 C ATOM 246 CG MET B 1 15.476 -17.329 11.997 1.00 0.00 C ATOM 247 SD MET B 1 16.075 -16.467 13.472 1.00 0.00 S ATOM 248 CE MET B 1 17.387 -15.519 12.662 1.00 0.00 C ATOM 0 H1 MET B 1 13.480 -18.264 13.715 1.00 0.00 H new ATOM 0 H2 MET B 1 11.884 -18.083 13.165 1.00 0.00 H new ATOM 0 H3 MET B 1 13.100 -18.586 12.092 1.00 0.00 H new ATOM 0 HA MET B 1 13.507 -15.980 13.422 1.00 0.00 H new ATOM 0 HB2 MET B 1 13.840 -17.152 10.595 1.00 0.00 H new ATOM 0 HB3 MET B 1 14.485 -15.614 11.131 1.00 0.00 H new ATOM 0 HG2 MET B 1 15.242 -18.366 12.238 1.00 0.00 H new ATOM 0 HG3 MET B 1 16.253 -17.347 11.233 1.00 0.00 H new ATOM 0 HE1 MET B 1 17.900 -14.903 13.401 1.00 0.00 H new ATOM 0 HE2 MET B 1 18.100 -16.204 12.202 1.00 0.00 H new ATOM 0 HE3 MET B 1 16.952 -14.879 11.894 1.00 0.00 H new ATOM 260 N ASP B 2 11.991 -14.640 11.646 1.00 0.00 N ATOM 261 CA ASP B 2 10.785 -13.928 11.131 1.00 0.00 C ATOM 262 C ASP B 2 11.010 -13.480 9.685 1.00 0.00 C ATOM 263 O ASP B 2 12.106 -13.125 9.298 1.00 0.00 O ATOM 264 CB ASP B 2 10.620 -12.716 12.049 1.00 0.00 C ATOM 265 CG ASP B 2 11.870 -11.838 11.965 1.00 0.00 C ATOM 266 OD1 ASP B 2 12.894 -12.339 11.531 1.00 0.00 O ATOM 267 OD2 ASP B 2 11.781 -10.679 12.337 1.00 0.00 O ATOM 0 H ASP B 2 12.850 -14.089 11.656 1.00 0.00 H new ATOM 0 HA ASP B 2 9.899 -14.564 11.130 1.00 0.00 H new ATOM 0 HB2 ASP B 2 9.740 -12.143 11.757 1.00 0.00 H new ATOM 0 HB3 ASP B 2 10.461 -13.044 13.076 1.00 0.00 H new ATOM 272 N VAL B 3 9.980 -13.493 8.883 1.00 0.00 N ATOM 273 CA VAL B 3 10.134 -13.068 7.463 1.00 0.00 C ATOM 274 C VAL B 3 9.104 -11.985 7.125 1.00 0.00 C ATOM 275 O VAL B 3 7.960 -12.058 7.525 1.00 0.00 O ATOM 276 CB VAL B 3 9.875 -14.332 6.644 1.00 0.00 C ATOM 277 CG1 VAL B 3 8.576 -14.988 7.115 1.00 0.00 C ATOM 278 CG2 VAL B 3 9.752 -13.967 5.163 1.00 0.00 C ATOM 0 H VAL B 3 9.038 -13.780 9.150 1.00 0.00 H new ATOM 0 HA VAL B 3 11.118 -12.646 7.259 1.00 0.00 H new ATOM 0 HB VAL B 3 10.704 -15.027 6.779 1.00 0.00 H new ATOM 0 HG11 VAL B 3 8.391 -15.890 6.531 1.00 0.00 H new ATOM 0 HG12 VAL B 3 8.662 -15.250 8.169 1.00 0.00 H new ATOM 0 HG13 VAL B 3 7.748 -14.292 6.981 1.00 0.00 H new ATOM 0 HG21 VAL B 3 9.567 -14.869 4.580 1.00 0.00 H new ATOM 0 HG22 VAL B 3 8.924 -13.271 5.027 1.00 0.00 H new ATOM 0 HG23 VAL B 3 10.677 -13.500 4.825 1.00 0.00 H new ATOM 288 N PHE B 4 9.502 -10.981 6.392 1.00 0.00 N ATOM 289 CA PHE B 4 8.542 -9.896 6.033 1.00 0.00 C ATOM 290 C PHE B 4 7.923 -10.165 4.658 1.00 0.00 C ATOM 291 O PHE B 4 8.618 -10.330 3.675 1.00 0.00 O ATOM 292 CB PHE B 4 9.382 -8.620 6.000 1.00 0.00 C ATOM 293 CG PHE B 4 8.600 -7.486 6.617 1.00 0.00 C ATOM 294 CD1 PHE B 4 7.408 -7.055 6.025 1.00 0.00 C ATOM 295 CD2 PHE B 4 9.067 -6.866 7.783 1.00 0.00 C ATOM 296 CE1 PHE B 4 6.682 -6.004 6.599 1.00 0.00 C ATOM 297 CE2 PHE B 4 8.341 -5.815 8.356 1.00 0.00 C ATOM 298 CZ PHE B 4 7.148 -5.385 7.764 1.00 0.00 C ATOM 0 H PHE B 4 10.447 -10.864 6.027 1.00 0.00 H new ATOM 0 HA PHE B 4 7.718 -9.825 6.742 1.00 0.00 H new ATOM 0 HB2 PHE B 4 10.314 -8.771 6.544 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.649 -8.374 4.972 1.00 0.00 H new ATOM 0 HD1 PHE B 4 7.048 -7.533 5.126 1.00 0.00 H new ATOM 0 HD2 PHE B 4 9.987 -7.199 8.240 1.00 0.00 H new ATOM 0 HE1 PHE B 4 5.762 -5.671 6.142 1.00 0.00 H new ATOM 0 HE2 PHE B 4 8.701 -5.336 9.254 1.00 0.00 H new ATOM 0 HZ PHE B 4 6.587 -4.575 8.207 1.00 0.00 H new ATOM 308 N LEU B 5 6.621 -10.210 4.580 1.00 0.00 N ATOM 309 CA LEU B 5 5.963 -10.469 3.267 1.00 0.00 C ATOM 310 C LEU B 5 5.094 -9.275 2.863 1.00 0.00 C ATOM 311 O LEU B 5 4.692 -8.473 3.683 1.00 0.00 O ATOM 312 CB LEU B 5 5.102 -11.712 3.490 1.00 0.00 C ATOM 313 CG LEU B 5 5.481 -12.784 2.468 1.00 0.00 C ATOM 314 CD1 LEU B 5 6.988 -13.041 2.532 1.00 0.00 C ATOM 315 CD2 LEU B 5 4.729 -14.079 2.785 1.00 0.00 C ATOM 0 H LEU B 5 5.985 -10.079 5.367 1.00 0.00 H new ATOM 0 HA LEU B 5 6.687 -10.616 2.466 1.00 0.00 H new ATOM 0 HB2 LEU B 5 5.247 -12.091 4.502 1.00 0.00 H new ATOM 0 HB3 LEU B 5 4.046 -11.459 3.393 1.00 0.00 H new ATOM 0 HG LEU B 5 5.213 -12.443 1.468 1.00 0.00 H new ATOM 0 HD11 LEU B 5 7.258 -13.805 1.803 1.00 0.00 H new ATOM 0 HD12 LEU B 5 7.524 -12.119 2.307 1.00 0.00 H new ATOM 0 HD13 LEU B 5 7.257 -13.382 3.532 1.00 0.00 H new ATOM 0 HD21 LEU B 5 4.999 -14.844 2.057 1.00 0.00 H new ATOM 0 HD22 LEU B 5 4.997 -14.420 3.785 1.00 0.00 H new ATOM 0 HD23 LEU B 5 3.655 -13.897 2.739 1.00 0.00 H new ATOM 327 N MET B 6 4.801 -9.154 1.600 1.00 0.00 N ATOM 328 CA MET B 6 3.958 -8.019 1.131 1.00 0.00 C ATOM 329 C MET B 6 3.045 -8.495 0.005 1.00 0.00 C ATOM 330 O MET B 6 3.420 -9.326 -0.799 1.00 0.00 O ATOM 331 CB MET B 6 4.948 -6.973 0.617 1.00 0.00 C ATOM 332 CG MET B 6 4.185 -5.842 -0.074 1.00 0.00 C ATOM 333 SD MET B 6 5.358 -4.754 -0.921 1.00 0.00 S ATOM 334 CE MET B 6 4.565 -3.185 -0.491 1.00 0.00 C ATOM 0 H MET B 6 5.110 -9.794 0.869 1.00 0.00 H new ATOM 0 HA MET B 6 3.321 -7.615 1.918 1.00 0.00 H new ATOM 0 HB2 MET B 6 5.536 -6.576 1.445 1.00 0.00 H new ATOM 0 HB3 MET B 6 5.649 -7.432 -0.080 1.00 0.00 H new ATOM 0 HG2 MET B 6 3.472 -6.253 -0.789 1.00 0.00 H new ATOM 0 HG3 MET B 6 3.611 -5.275 0.659 1.00 0.00 H new ATOM 0 HE1 MET B 6 5.198 -2.358 -0.812 1.00 0.00 H new ATOM 0 HE2 MET B 6 3.598 -3.117 -0.990 1.00 0.00 H new ATOM 0 HE3 MET B 6 4.421 -3.134 0.588 1.00 0.00 H new ATOM 344 N ILE B 7 1.854 -7.977 -0.070 1.00 0.00 N ATOM 345 CA ILE B 7 0.933 -8.406 -1.150 1.00 0.00 C ATOM 346 C ILE B 7 0.782 -7.263 -2.145 1.00 0.00 C ATOM 347 O ILE B 7 0.608 -6.123 -1.760 1.00 0.00 O ATOM 348 CB ILE B 7 -0.381 -8.723 -0.429 1.00 0.00 C ATOM 349 CG1 ILE B 7 -0.646 -10.233 -0.533 1.00 0.00 C ATOM 350 CG2 ILE B 7 -1.540 -7.930 -1.046 1.00 0.00 C ATOM 351 CD1 ILE B 7 -1.942 -10.499 -1.299 1.00 0.00 C ATOM 0 H ILE B 7 1.480 -7.276 0.570 1.00 0.00 H new ATOM 0 HA ILE B 7 1.281 -9.270 -1.716 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.303 -8.435 0.619 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.188 -10.720 -1.038 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -0.711 -10.666 0.465 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -2.465 -8.169 -0.520 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.338 -6.863 -0.958 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.642 -8.195 -2.098 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -2.113 -11.574 -1.363 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.776 -10.029 -0.778 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.862 -10.084 -2.304 1.00 0.00 H new ATOM 363 N ARG B 8 0.870 -7.532 -3.416 1.00 0.00 N ATOM 364 CA ARG B 8 0.753 -6.411 -4.378 1.00 0.00 C ATOM 365 C ARG B 8 -0.515 -6.521 -5.223 1.00 0.00 C ATOM 366 O ARG B 8 -0.885 -7.573 -5.727 1.00 0.00 O ATOM 367 CB ARG B 8 2.005 -6.500 -5.249 1.00 0.00 C ATOM 368 CG ARG B 8 2.858 -5.248 -5.024 1.00 0.00 C ATOM 369 CD ARG B 8 4.195 -5.395 -5.752 1.00 0.00 C ATOM 370 NE ARG B 8 4.443 -4.061 -6.367 1.00 0.00 N ATOM 371 CZ ARG B 8 5.658 -3.704 -6.687 1.00 0.00 C ATOM 372 NH1 ARG B 8 6.658 -4.516 -6.474 1.00 0.00 N ATOM 373 NH2 ARG B 8 5.873 -2.534 -7.223 1.00 0.00 N ATOM 0 H ARG B 8 1.014 -8.457 -3.821 1.00 0.00 H new ATOM 0 HA ARG B 8 0.679 -5.452 -3.865 1.00 0.00 H new ATOM 0 HB2 ARG B 8 2.575 -7.394 -4.998 1.00 0.00 H new ATOM 0 HB3 ARG B 8 1.728 -6.583 -6.300 1.00 0.00 H new ATOM 0 HG2 ARG B 8 2.330 -4.367 -5.388 1.00 0.00 H new ATOM 0 HG3 ARG B 8 3.028 -5.100 -3.958 1.00 0.00 H new ATOM 0 HD2 ARG B 8 4.993 -5.667 -5.062 1.00 0.00 H new ATOM 0 HD3 ARG B 8 4.149 -6.177 -6.510 1.00 0.00 H new ATOM 0 HE ARG B 8 3.663 -3.426 -6.538 1.00 0.00 H new ATOM 0 HH11 ARG B 8 6.491 -5.432 -6.057 1.00 0.00 H new ATOM 0 HH12 ARG B 8 7.606 -4.235 -6.725 1.00 0.00 H new ATOM 0 HH21 ARG B 8 5.093 -1.899 -7.392 1.00 0.00 H new ATOM 0 HH22 ARG B 8 6.821 -2.254 -7.473 1.00 0.00 H new ATOM 387 N ARG B 9 -1.163 -5.402 -5.369 1.00 0.00 N ATOM 388 CA ARG B 9 -2.414 -5.299 -6.161 1.00 0.00 C ATOM 389 C ARG B 9 -2.491 -3.877 -6.711 1.00 0.00 C ATOM 390 O ARG B 9 -1.976 -2.953 -6.111 1.00 0.00 O ATOM 391 CB ARG B 9 -3.554 -5.577 -5.178 1.00 0.00 C ATOM 392 CG ARG B 9 -4.891 -5.214 -5.828 1.00 0.00 C ATOM 393 CD ARG B 9 -5.510 -6.465 -6.455 1.00 0.00 C ATOM 394 NE ARG B 9 -6.940 -6.115 -6.682 1.00 0.00 N ATOM 395 CZ ARG B 9 -7.271 -5.322 -7.665 1.00 0.00 C ATOM 396 NH1 ARG B 9 -6.349 -4.839 -8.453 1.00 0.00 N ATOM 397 NH2 ARG B 9 -8.523 -5.014 -7.861 1.00 0.00 N ATOM 0 H ARG B 9 -0.862 -4.520 -4.954 1.00 0.00 H new ATOM 0 HA ARG B 9 -2.463 -5.997 -6.997 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -3.551 -6.628 -4.890 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -3.412 -4.997 -4.266 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -5.568 -4.795 -5.083 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -4.741 -4.449 -6.590 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -5.014 -6.724 -7.390 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -5.415 -7.326 -5.794 1.00 0.00 H new ATOM 0 HE ARG B 9 -7.661 -6.495 -6.069 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -5.370 -5.081 -8.301 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -6.608 -4.220 -9.221 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -9.244 -5.393 -7.246 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -8.782 -4.394 -8.629 1.00 0.00 H new ATOM 411 N HIS B 10 -3.107 -3.666 -7.829 1.00 0.00 N ATOM 412 CA HIS B 10 -3.152 -2.278 -8.356 1.00 0.00 C ATOM 413 C HIS B 10 -3.693 -1.353 -7.313 1.00 0.00 C ATOM 414 O HIS B 10 -4.568 -1.696 -6.550 1.00 0.00 O ATOM 415 CB HIS B 10 -4.177 -2.242 -9.424 1.00 0.00 C ATOM 416 CG HIS B 10 -3.684 -2.892 -10.685 1.00 0.00 C ATOM 417 ND1 HIS B 10 -3.044 -2.174 -11.684 1.00 0.00 N ATOM 418 CD2 HIS B 10 -3.743 -4.188 -11.133 1.00 0.00 C ATOM 419 CE1 HIS B 10 -2.746 -3.034 -12.673 1.00 0.00 C ATOM 420 NE2 HIS B 10 -3.150 -4.275 -12.389 1.00 0.00 N ATOM 0 H HIS B 10 -3.574 -4.375 -8.394 1.00 0.00 H new ATOM 0 HA HIS B 10 -2.151 -1.993 -8.680 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -5.079 -2.749 -9.081 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -4.452 -1.208 -9.631 1.00 0.00 H new ATOM 0 HD1 HIS B 10 -2.837 -1.175 -11.671 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -4.182 -5.014 -10.593 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -2.241 -2.755 -13.586 1.00 0.00 H new ATOM 428 N LYS B 11 -3.193 -0.181 -7.297 1.00 0.00 N ATOM 429 CA LYS B 11 -3.658 0.825 -6.309 1.00 0.00 C ATOM 430 C LYS B 11 -3.795 0.166 -4.936 1.00 0.00 C ATOM 431 O LYS B 11 -3.747 0.823 -3.914 1.00 0.00 O ATOM 432 CB LYS B 11 -5.023 1.286 -6.823 1.00 0.00 C ATOM 433 CG LYS B 11 -4.919 1.630 -8.310 1.00 0.00 C ATOM 434 CD LYS B 11 -5.345 3.083 -8.529 1.00 0.00 C ATOM 435 CE LYS B 11 -6.859 3.204 -8.343 1.00 0.00 C ATOM 436 NZ LYS B 11 -7.364 3.736 -9.640 1.00 0.00 N ATOM 0 H LYS B 11 -2.466 0.146 -7.933 1.00 0.00 H new ATOM 0 HA LYS B 11 -2.966 1.660 -6.202 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -5.764 0.501 -6.671 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -5.360 2.156 -6.260 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -3.896 1.484 -8.657 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -5.553 0.962 -8.894 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -4.828 3.735 -7.825 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -5.064 3.409 -9.530 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -7.307 2.238 -8.111 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -7.103 3.874 -7.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -8.397 3.847 -9.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -6.925 4.659 -9.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -7.123 3.074 -10.405 1.00 0.00 H new ATOM 450 N THR B 12 -3.978 -1.129 -4.901 1.00 0.00 N ATOM 451 CA THR B 12 -4.130 -1.810 -3.571 1.00 0.00 C ATOM 452 C THR B 12 -2.828 -2.494 -3.123 1.00 0.00 C ATOM 453 O THR B 12 -2.358 -3.431 -3.735 1.00 0.00 O ATOM 454 CB THR B 12 -5.226 -2.856 -3.765 1.00 0.00 C ATOM 455 OG1 THR B 12 -5.796 -2.724 -5.058 1.00 0.00 O ATOM 456 CG2 THR B 12 -6.310 -2.662 -2.705 1.00 0.00 C ATOM 0 H THR B 12 -4.029 -1.739 -5.717 1.00 0.00 H new ATOM 0 HA THR B 12 -4.377 -1.084 -2.797 1.00 0.00 H new ATOM 0 HB THR B 12 -4.793 -3.851 -3.665 1.00 0.00 H new ATOM 0 HG1 THR B 12 -5.081 -2.666 -5.726 1.00 0.00 H new ATOM 0 HG21 THR B 12 -7.092 -3.408 -2.844 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.873 -2.774 -1.713 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.739 -1.665 -2.802 1.00 0.00 H new ATOM 464 N THR B 13 -2.264 -2.041 -2.033 1.00 0.00 N ATOM 465 CA THR B 13 -1.014 -2.664 -1.496 1.00 0.00 C ATOM 466 C THR B 13 -1.177 -2.916 0.007 1.00 0.00 C ATOM 467 O THR B 13 -1.568 -2.035 0.748 1.00 0.00 O ATOM 468 CB THR B 13 0.090 -1.639 -1.758 1.00 0.00 C ATOM 469 OG1 THR B 13 -0.221 -0.428 -1.085 1.00 0.00 O ATOM 470 CG2 THR B 13 0.200 -1.376 -3.260 1.00 0.00 C ATOM 0 H THR B 13 -2.619 -1.257 -1.485 1.00 0.00 H new ATOM 0 HA THR B 13 -0.786 -3.622 -1.964 1.00 0.00 H new ATOM 0 HB THR B 13 1.040 -2.026 -1.390 1.00 0.00 H new ATOM 0 HG1 THR B 13 0.609 0.033 -0.841 1.00 0.00 H new ATOM 0 HG21 THR B 13 0.987 -0.645 -3.445 1.00 0.00 H new ATOM 0 HG22 THR B 13 0.440 -2.306 -3.776 1.00 0.00 H new ATOM 0 HG23 THR B 13 -0.749 -0.989 -3.632 1.00 0.00 H new ATOM 478 N ILE B 14 -0.882 -4.099 0.472 1.00 0.00 N ATOM 479 CA ILE B 14 -1.030 -4.370 1.933 1.00 0.00 C ATOM 480 C ILE B 14 0.285 -4.873 2.522 1.00 0.00 C ATOM 481 O ILE B 14 0.906 -5.777 1.999 1.00 0.00 O ATOM 482 CB ILE B 14 -2.110 -5.457 2.047 1.00 0.00 C ATOM 483 CG1 ILE B 14 -3.013 -5.162 3.244 1.00 0.00 C ATOM 484 CG2 ILE B 14 -1.455 -6.824 2.263 1.00 0.00 C ATOM 485 CD1 ILE B 14 -2.165 -5.080 4.514 1.00 0.00 C ATOM 0 H ILE B 14 -0.548 -4.883 -0.088 1.00 0.00 H new ATOM 0 HA ILE B 14 -1.302 -3.467 2.480 1.00 0.00 H new ATOM 0 HB ILE B 14 -2.694 -5.465 1.127 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -3.546 -4.224 3.089 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.766 -5.943 3.346 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.227 -7.589 2.343 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -0.804 -7.053 1.420 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -0.867 -6.805 3.181 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.809 -4.870 5.368 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -1.652 -6.029 4.671 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.429 -4.283 4.409 1.00 0.00 H new ATOM 497 N PHE B 15 0.695 -4.325 3.628 1.00 0.00 N ATOM 498 CA PHE B 15 1.945 -4.819 4.258 1.00 0.00 C ATOM 499 C PHE B 15 1.576 -6.023 5.121 1.00 0.00 C ATOM 500 O PHE B 15 0.849 -5.903 6.086 1.00 0.00 O ATOM 501 CB PHE B 15 2.452 -3.662 5.121 1.00 0.00 C ATOM 502 CG PHE B 15 3.952 -3.556 4.989 1.00 0.00 C ATOM 503 CD1 PHE B 15 4.555 -3.673 3.731 1.00 0.00 C ATOM 504 CD2 PHE B 15 4.741 -3.340 6.126 1.00 0.00 C ATOM 505 CE1 PHE B 15 5.946 -3.573 3.609 1.00 0.00 C ATOM 506 CE2 PHE B 15 6.133 -3.241 6.005 1.00 0.00 C ATOM 507 CZ PHE B 15 6.734 -3.358 4.745 1.00 0.00 C ATOM 0 H PHE B 15 0.224 -3.565 4.118 1.00 0.00 H new ATOM 0 HA PHE B 15 2.709 -5.124 3.542 1.00 0.00 H new ATOM 0 HB2 PHE B 15 1.982 -2.729 4.810 1.00 0.00 H new ATOM 0 HB3 PHE B 15 2.178 -3.825 6.164 1.00 0.00 H new ATOM 0 HD1 PHE B 15 3.947 -3.840 2.854 1.00 0.00 H new ATOM 0 HD2 PHE B 15 4.276 -3.250 7.097 1.00 0.00 H new ATOM 0 HE1 PHE B 15 6.411 -3.662 2.638 1.00 0.00 H new ATOM 0 HE2 PHE B 15 6.742 -3.075 6.881 1.00 0.00 H new ATOM 0 HZ PHE B 15 7.807 -3.282 4.650 1.00 0.00 H new ATOM 517 N THR B 16 2.038 -7.187 4.764 1.00 0.00 N ATOM 518 CA THR B 16 1.667 -8.390 5.554 1.00 0.00 C ATOM 519 C THR B 16 2.882 -8.953 6.293 1.00 0.00 C ATOM 520 O THR B 16 3.988 -8.948 5.789 1.00 0.00 O ATOM 521 CB THR B 16 1.158 -9.393 4.519 1.00 0.00 C ATOM 522 OG1 THR B 16 0.459 -10.437 5.180 1.00 0.00 O ATOM 523 CG2 THR B 16 2.341 -9.978 3.752 1.00 0.00 C ATOM 0 H THR B 16 2.651 -7.356 3.967 1.00 0.00 H new ATOM 0 HA THR B 16 0.921 -8.164 6.316 1.00 0.00 H new ATOM 0 HB THR B 16 0.488 -8.890 3.822 1.00 0.00 H new ATOM 0 HG1 THR B 16 0.009 -11.001 4.516 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.978 -10.693 3.014 1.00 0.00 H new ATOM 0 HG22 THR B 16 2.879 -9.176 3.246 1.00 0.00 H new ATOM 0 HG23 THR B 16 3.012 -10.483 4.447 1.00 0.00 H new ATOM 531 N ASP B 17 2.683 -9.449 7.480 1.00 0.00 N ATOM 532 CA ASP B 17 3.824 -10.024 8.244 1.00 0.00 C ATOM 533 C ASP B 17 3.504 -11.465 8.647 1.00 0.00 C ATOM 534 O ASP B 17 2.378 -11.793 8.966 1.00 0.00 O ATOM 535 CB ASP B 17 3.962 -9.137 9.482 1.00 0.00 C ATOM 536 CG ASP B 17 5.345 -9.339 10.103 1.00 0.00 C ATOM 537 OD1 ASP B 17 5.528 -10.336 10.782 1.00 0.00 O ATOM 538 OD2 ASP B 17 6.198 -8.494 9.888 1.00 0.00 O ATOM 0 H ASP B 17 1.781 -9.482 7.955 1.00 0.00 H new ATOM 0 HA ASP B 17 4.745 -10.050 7.662 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.823 -8.091 9.210 1.00 0.00 H new ATOM 0 HB3 ASP B 17 3.187 -9.383 10.207 1.00 0.00 H new ATOM 543 N ALA B 18 4.481 -12.326 8.634 1.00 0.00 N ATOM 544 CA ALA B 18 4.228 -13.745 9.015 1.00 0.00 C ATOM 545 C ALA B 18 5.544 -14.436 9.378 1.00 0.00 C ATOM 546 O ALA B 18 6.614 -13.892 9.192 1.00 0.00 O ATOM 547 CB ALA B 18 3.609 -14.385 7.773 1.00 0.00 C ATOM 0 H ALA B 18 5.444 -12.110 8.376 1.00 0.00 H new ATOM 0 HA ALA B 18 3.575 -13.830 9.884 1.00 0.00 H new ATOM 0 HB1 ALA B 18 3.393 -15.434 7.974 1.00 0.00 H new ATOM 0 HB2 ALA B 18 2.685 -13.866 7.519 1.00 0.00 H new ATOM 0 HB3 ALA B 18 4.307 -14.311 6.939 1.00 0.00 H new ATOM 553 N LYS B 19 5.473 -15.634 9.885 1.00 0.00 N ATOM 554 CA LYS B 19 6.721 -16.362 10.248 1.00 0.00 C ATOM 555 C LYS B 19 7.178 -17.227 9.071 1.00 0.00 C ATOM 556 O LYS B 19 6.374 -17.756 8.329 1.00 0.00 O ATOM 557 CB LYS B 19 6.339 -17.235 11.443 1.00 0.00 C ATOM 558 CG LYS B 19 6.330 -16.384 12.715 1.00 0.00 C ATOM 559 CD LYS B 19 4.900 -15.935 13.020 1.00 0.00 C ATOM 560 CE LYS B 19 4.317 -16.804 14.136 1.00 0.00 C ATOM 561 NZ LYS B 19 3.161 -17.507 13.513 1.00 0.00 N ATOM 0 H LYS B 19 4.606 -16.141 10.064 1.00 0.00 H new ATOM 0 HA LYS B 19 7.543 -15.687 10.488 1.00 0.00 H new ATOM 0 HB2 LYS B 19 5.357 -17.679 11.283 1.00 0.00 H new ATOM 0 HB3 LYS B 19 7.047 -18.057 11.548 1.00 0.00 H new ATOM 0 HG2 LYS B 19 6.728 -16.958 13.552 1.00 0.00 H new ATOM 0 HG3 LYS B 19 6.976 -15.515 12.588 1.00 0.00 H new ATOM 0 HD2 LYS B 19 4.893 -14.887 13.320 1.00 0.00 H new ATOM 0 HD3 LYS B 19 4.284 -16.014 12.124 1.00 0.00 H new ATOM 0 HE2 LYS B 19 5.055 -17.513 14.510 1.00 0.00 H new ATOM 0 HE3 LYS B 19 4.000 -16.197 14.984 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 2.709 -18.123 14.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 2.472 -16.807 13.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 3.494 -18.082 12.713 1.00 0.00 H new ATOM 575 N GLU B 20 8.462 -17.376 8.893 1.00 0.00 N ATOM 576 CA GLU B 20 8.962 -18.207 7.763 1.00 0.00 C ATOM 577 C GLU B 20 8.313 -19.589 7.817 1.00 0.00 C ATOM 578 O GLU B 20 8.082 -20.221 6.805 1.00 0.00 O ATOM 579 CB GLU B 20 10.471 -18.315 7.982 1.00 0.00 C ATOM 580 CG GLU B 20 11.202 -17.983 6.679 1.00 0.00 C ATOM 581 CD GLU B 20 11.884 -19.243 6.142 1.00 0.00 C ATOM 582 OE1 GLU B 20 11.344 -20.317 6.343 1.00 0.00 O ATOM 583 OE2 GLU B 20 12.937 -19.110 5.539 1.00 0.00 O ATOM 0 H GLU B 20 9.185 -16.959 9.480 1.00 0.00 H new ATOM 0 HA GLU B 20 8.727 -17.774 6.791 1.00 0.00 H new ATOM 0 HB2 GLU B 20 10.784 -17.632 8.771 1.00 0.00 H new ATOM 0 HB3 GLU B 20 10.730 -19.322 8.310 1.00 0.00 H new ATOM 0 HG2 GLU B 20 10.498 -17.596 5.943 1.00 0.00 H new ATOM 0 HG3 GLU B 20 11.942 -17.202 6.853 1.00 0.00 H new ATOM 590 N SER B 21 8.008 -20.057 8.995 1.00 0.00 N ATOM 591 CA SER B 21 7.366 -21.391 9.122 1.00 0.00 C ATOM 592 C SER B 21 5.859 -21.223 9.324 1.00 0.00 C ATOM 593 O SER B 21 5.170 -22.141 9.722 1.00 0.00 O ATOM 594 CB SER B 21 8.007 -22.027 10.354 1.00 0.00 C ATOM 595 OG SER B 21 9.292 -22.529 10.009 1.00 0.00 O ATOM 0 H SER B 21 8.177 -19.571 9.876 1.00 0.00 H new ATOM 0 HA SER B 21 7.505 -22.007 8.233 1.00 0.00 H new ATOM 0 HB2 SER B 21 8.094 -21.291 11.154 1.00 0.00 H new ATOM 0 HB3 SER B 21 7.378 -22.834 10.730 1.00 0.00 H new ATOM 0 HG SER B 21 9.707 -22.936 10.798 1.00 0.00 H new ATOM 601 N SER B 22 5.339 -20.056 9.047 1.00 0.00 N ATOM 602 CA SER B 22 3.878 -19.838 9.221 1.00 0.00 C ATOM 603 C SER B 22 3.109 -20.768 8.285 1.00 0.00 C ATOM 604 O SER B 22 2.915 -21.932 8.572 1.00 0.00 O ATOM 605 CB SER B 22 3.646 -18.376 8.847 1.00 0.00 C ATOM 606 OG SER B 22 2.292 -18.200 8.453 1.00 0.00 O ATOM 0 H SER B 22 5.863 -19.249 8.709 1.00 0.00 H new ATOM 0 HA SER B 22 3.538 -20.048 10.235 1.00 0.00 H new ATOM 0 HB2 SER B 22 3.877 -17.731 9.695 1.00 0.00 H new ATOM 0 HB3 SER B 22 4.313 -18.086 8.035 1.00 0.00 H new ATOM 0 HG SER B 22 2.140 -17.262 8.214 1.00 0.00 H new ATOM 612 N THR B 23 2.679 -20.265 7.164 1.00 0.00 N ATOM 613 CA THR B 23 1.929 -21.122 6.201 1.00 0.00 C ATOM 614 C THR B 23 1.263 -20.256 5.131 1.00 0.00 C ATOM 615 O THR B 23 0.450 -19.404 5.429 1.00 0.00 O ATOM 616 CB THR B 23 0.869 -21.844 7.036 1.00 0.00 C ATOM 617 OG1 THR B 23 -0.181 -22.284 6.186 1.00 0.00 O ATOM 618 CG2 THR B 23 0.306 -20.892 8.092 1.00 0.00 C ATOM 0 H THR B 23 2.813 -19.297 6.871 1.00 0.00 H new ATOM 0 HA THR B 23 2.585 -21.824 5.685 1.00 0.00 H new ATOM 0 HB THR B 23 1.322 -22.702 7.532 1.00 0.00 H new ATOM 0 HG1 THR B 23 -0.860 -22.748 6.719 1.00 0.00 H new ATOM 0 HG21 THR B 23 -0.448 -21.410 8.684 1.00 0.00 H new ATOM 0 HG22 THR B 23 1.111 -20.555 8.745 1.00 0.00 H new ATOM 0 HG23 THR B 23 -0.147 -20.031 7.601 1.00 0.00 H new ATOM 626 N VAL B 24 1.596 -20.470 3.887 1.00 0.00 N ATOM 627 CA VAL B 24 0.972 -19.661 2.804 1.00 0.00 C ATOM 628 C VAL B 24 -0.517 -19.474 3.098 1.00 0.00 C ATOM 629 O VAL B 24 -1.117 -18.484 2.728 1.00 0.00 O ATOM 630 CB VAL B 24 1.171 -20.477 1.529 1.00 0.00 C ATOM 631 CG1 VAL B 24 0.376 -19.843 0.387 1.00 0.00 C ATOM 632 CG2 VAL B 24 2.657 -20.496 1.166 1.00 0.00 C ATOM 0 H VAL B 24 2.271 -21.168 3.575 1.00 0.00 H new ATOM 0 HA VAL B 24 1.413 -18.668 2.716 1.00 0.00 H new ATOM 0 HB VAL B 24 0.821 -21.497 1.691 1.00 0.00 H new ATOM 0 HG11 VAL B 24 0.518 -20.426 -0.523 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -0.683 -19.827 0.646 1.00 0.00 H new ATOM 0 HG13 VAL B 24 0.725 -18.823 0.223 1.00 0.00 H new ATOM 0 HG21 VAL B 24 2.802 -21.078 0.256 1.00 0.00 H new ATOM 0 HG22 VAL B 24 3.005 -19.476 1.004 1.00 0.00 H new ATOM 0 HG23 VAL B 24 3.225 -20.948 1.980 1.00 0.00 H new ATOM 642 N PHE B 25 -1.114 -20.418 3.776 1.00 0.00 N ATOM 643 CA PHE B 25 -2.560 -20.294 4.109 1.00 0.00 C ATOM 644 C PHE B 25 -2.766 -19.116 5.064 1.00 0.00 C ATOM 645 O PHE B 25 -3.662 -18.314 4.893 1.00 0.00 O ATOM 646 CB PHE B 25 -2.927 -21.612 4.790 1.00 0.00 C ATOM 647 CG PHE B 25 -4.431 -21.737 4.870 1.00 0.00 C ATOM 648 CD1 PHE B 25 -5.118 -21.222 5.976 1.00 0.00 C ATOM 649 CD2 PHE B 25 -5.137 -22.365 3.837 1.00 0.00 C ATOM 650 CE1 PHE B 25 -6.511 -21.338 6.049 1.00 0.00 C ATOM 651 CE2 PHE B 25 -6.530 -22.480 3.910 1.00 0.00 C ATOM 652 CZ PHE B 25 -7.217 -21.966 5.016 1.00 0.00 C ATOM 0 H PHE B 25 -0.662 -21.268 4.113 1.00 0.00 H new ATOM 0 HA PHE B 25 -3.179 -20.111 3.231 1.00 0.00 H new ATOM 0 HB2 PHE B 25 -2.511 -22.450 4.231 1.00 0.00 H new ATOM 0 HB3 PHE B 25 -2.495 -21.650 5.790 1.00 0.00 H new ATOM 0 HD1 PHE B 25 -4.574 -20.736 6.772 1.00 0.00 H new ATOM 0 HD2 PHE B 25 -4.607 -22.761 2.984 1.00 0.00 H new ATOM 0 HE1 PHE B 25 -7.041 -20.943 6.903 1.00 0.00 H new ATOM 0 HE2 PHE B 25 -7.075 -22.965 3.113 1.00 0.00 H new ATOM 0 HZ PHE B 25 -8.292 -22.054 5.072 1.00 0.00 H new ATOM 662 N GLU B 26 -1.933 -19.001 6.064 1.00 0.00 N ATOM 663 CA GLU B 26 -2.074 -17.867 7.021 1.00 0.00 C ATOM 664 C GLU B 26 -2.025 -16.547 6.254 1.00 0.00 C ATOM 665 O GLU B 26 -2.847 -15.673 6.448 1.00 0.00 O ATOM 666 CB GLU B 26 -0.877 -17.989 7.965 1.00 0.00 C ATOM 667 CG GLU B 26 -0.892 -16.826 8.959 1.00 0.00 C ATOM 668 CD GLU B 26 -1.684 -17.228 10.203 1.00 0.00 C ATOM 669 OE1 GLU B 26 -1.971 -18.405 10.344 1.00 0.00 O ATOM 670 OE2 GLU B 26 -1.990 -16.352 10.996 1.00 0.00 O ATOM 0 H GLU B 26 -1.163 -19.642 6.259 1.00 0.00 H new ATOM 0 HA GLU B 26 -3.017 -17.891 7.567 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -0.916 -18.938 8.499 1.00 0.00 H new ATOM 0 HB3 GLU B 26 0.052 -17.982 7.395 1.00 0.00 H new ATOM 0 HG2 GLU B 26 0.127 -16.557 9.235 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -1.340 -15.946 8.498 1.00 0.00 H new ATOM 677 N LEU B 27 -1.075 -16.401 5.371 1.00 0.00 N ATOM 678 CA LEU B 27 -0.986 -15.141 4.578 1.00 0.00 C ATOM 679 C LEU B 27 -2.293 -14.929 3.810 1.00 0.00 C ATOM 680 O LEU B 27 -2.728 -13.815 3.591 1.00 0.00 O ATOM 681 CB LEU B 27 0.179 -15.360 3.611 1.00 0.00 C ATOM 682 CG LEU B 27 1.494 -15.379 4.391 1.00 0.00 C ATOM 683 CD1 LEU B 27 2.596 -15.985 3.519 1.00 0.00 C ATOM 684 CD2 LEU B 27 1.877 -13.947 4.774 1.00 0.00 C ATOM 0 H LEU B 27 -0.359 -17.097 5.164 1.00 0.00 H new ATOM 0 HA LEU B 27 -0.829 -14.261 5.202 1.00 0.00 H new ATOM 0 HB2 LEU B 27 0.048 -16.300 3.075 1.00 0.00 H new ATOM 0 HB3 LEU B 27 0.199 -14.567 2.864 1.00 0.00 H new ATOM 0 HG LEU B 27 1.374 -15.979 5.293 1.00 0.00 H new ATOM 0 HD11 LEU B 27 3.534 -15.999 4.075 1.00 0.00 H new ATOM 0 HD12 LEU B 27 2.323 -17.004 3.243 1.00 0.00 H new ATOM 0 HD13 LEU B 27 2.718 -15.385 2.617 1.00 0.00 H new ATOM 0 HD21 LEU B 27 2.814 -13.957 5.330 1.00 0.00 H new ATOM 0 HD22 LEU B 27 1.998 -13.349 3.871 1.00 0.00 H new ATOM 0 HD23 LEU B 27 1.092 -13.514 5.394 1.00 0.00 H new ATOM 696 N LYS B 28 -2.924 -15.998 3.406 1.00 0.00 N ATOM 697 CA LYS B 28 -4.210 -15.883 2.657 1.00 0.00 C ATOM 698 C LYS B 28 -5.234 -15.095 3.479 1.00 0.00 C ATOM 699 O LYS B 28 -6.036 -14.355 2.946 1.00 0.00 O ATOM 700 CB LYS B 28 -4.679 -17.324 2.453 1.00 0.00 C ATOM 701 CG LYS B 28 -4.894 -17.584 0.961 1.00 0.00 C ATOM 702 CD LYS B 28 -5.533 -18.961 0.769 1.00 0.00 C ATOM 703 CE LYS B 28 -4.883 -19.664 -0.425 1.00 0.00 C ATOM 704 NZ LYS B 28 -5.317 -21.085 -0.315 1.00 0.00 N ATOM 0 H LYS B 28 -2.602 -16.953 3.563 1.00 0.00 H new ATOM 0 HA LYS B 28 -4.091 -15.355 1.711 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -3.939 -18.018 2.851 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -5.606 -17.497 3.000 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -5.535 -16.812 0.535 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -3.942 -17.536 0.432 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -5.407 -19.561 1.670 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -6.605 -18.856 0.603 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -5.208 -19.223 -1.368 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -3.797 -19.579 -0.391 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -4.911 -21.634 -1.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -4.988 -21.479 0.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -6.355 -21.135 -0.357 1.00 0.00 H new ATOM 718 N ARG B 29 -5.217 -15.255 4.774 1.00 0.00 N ATOM 719 CA ARG B 29 -6.195 -14.526 5.632 1.00 0.00 C ATOM 720 C ARG B 29 -6.036 -13.013 5.449 1.00 0.00 C ATOM 721 O ARG B 29 -7.001 -12.274 5.459 1.00 0.00 O ATOM 722 CB ARG B 29 -5.844 -14.931 7.064 1.00 0.00 C ATOM 723 CG ARG B 29 -7.059 -15.588 7.722 1.00 0.00 C ATOM 724 CD ARG B 29 -8.104 -14.518 8.049 1.00 0.00 C ATOM 725 NE ARG B 29 -9.220 -15.258 8.701 1.00 0.00 N ATOM 726 CZ ARG B 29 -9.090 -15.692 9.925 1.00 0.00 C ATOM 727 NH1 ARG B 29 -7.981 -15.478 10.581 1.00 0.00 N ATOM 728 NH2 ARG B 29 -10.069 -16.342 10.494 1.00 0.00 N ATOM 0 H ARG B 29 -4.567 -15.860 5.276 1.00 0.00 H new ATOM 0 HA ARG B 29 -7.227 -14.770 5.380 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -5.001 -15.622 7.061 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -5.537 -14.055 7.636 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -7.486 -16.337 7.055 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -6.757 -16.107 8.632 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -7.695 -13.756 8.712 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -8.442 -14.008 7.147 1.00 0.00 H new ATOM 0 HE ARG B 29 -10.087 -15.426 8.190 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -7.215 -14.971 10.137 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -7.881 -15.818 11.538 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -10.935 -16.510 9.982 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -9.968 -16.681 11.451 1.00 0.00 H new ATOM 742 N ILE B 30 -4.831 -12.547 5.282 1.00 0.00 N ATOM 743 CA ILE B 30 -4.613 -11.090 5.101 1.00 0.00 C ATOM 744 C ILE B 30 -5.401 -10.587 3.887 1.00 0.00 C ATOM 745 O ILE B 30 -6.044 -9.557 3.939 1.00 0.00 O ATOM 746 CB ILE B 30 -3.107 -10.970 4.863 1.00 0.00 C ATOM 747 CG1 ILE B 30 -2.394 -10.845 6.209 1.00 0.00 C ATOM 748 CG2 ILE B 30 -2.810 -9.734 4.016 1.00 0.00 C ATOM 749 CD1 ILE B 30 -2.957 -9.645 6.963 1.00 0.00 C ATOM 0 H ILE B 30 -3.985 -13.117 5.263 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.947 -10.497 5.953 1.00 0.00 H new ATOM 0 HB ILE B 30 -2.754 -11.857 4.337 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -2.532 -11.755 6.793 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -1.322 -10.724 6.056 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.735 -9.656 3.851 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -3.319 -9.820 3.056 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.163 -8.843 4.536 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -2.452 -9.550 7.925 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -2.796 -8.740 6.378 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -4.025 -9.786 7.126 1.00 0.00 H new ATOM 761 N VAL B 31 -5.366 -11.305 2.798 1.00 0.00 N ATOM 762 CA VAL B 31 -6.120 -10.861 1.596 1.00 0.00 C ATOM 763 C VAL B 31 -7.626 -10.917 1.876 1.00 0.00 C ATOM 764 O VAL B 31 -8.356 -9.987 1.595 1.00 0.00 O ATOM 765 CB VAL B 31 -5.739 -11.858 0.501 1.00 0.00 C ATOM 766 CG1 VAL B 31 -5.951 -11.209 -0.861 1.00 0.00 C ATOM 767 CG2 VAL B 31 -4.265 -12.252 0.642 1.00 0.00 C ATOM 0 H VAL B 31 -4.849 -12.177 2.690 1.00 0.00 H new ATOM 0 HA VAL B 31 -5.885 -9.836 1.310 1.00 0.00 H new ATOM 0 HB VAL B 31 -6.361 -12.748 0.594 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -5.681 -11.915 -1.646 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -6.998 -10.927 -0.971 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -5.326 -10.320 -0.942 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -4.002 -12.962 -0.142 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -3.641 -11.363 0.551 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -4.103 -12.711 1.617 1.00 0.00 H new ATOM 777 N GLU B 32 -8.092 -12.002 2.435 1.00 0.00 N ATOM 778 CA GLU B 32 -9.547 -12.124 2.743 1.00 0.00 C ATOM 779 C GLU B 32 -9.945 -11.117 3.825 1.00 0.00 C ATOM 780 O GLU B 32 -11.111 -10.913 4.099 1.00 0.00 O ATOM 781 CB GLU B 32 -9.724 -13.556 3.250 1.00 0.00 C ATOM 782 CG GLU B 32 -11.208 -13.825 3.513 1.00 0.00 C ATOM 783 CD GLU B 32 -11.348 -14.890 4.602 1.00 0.00 C ATOM 784 OE1 GLU B 32 -10.661 -14.780 5.603 1.00 0.00 O ATOM 785 OE2 GLU B 32 -12.139 -15.800 4.415 1.00 0.00 O ATOM 0 H GLU B 32 -7.526 -12.811 2.692 1.00 0.00 H new ATOM 0 HA GLU B 32 -10.173 -11.919 1.874 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.340 -14.263 2.515 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -9.149 -13.703 4.164 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.706 -12.906 3.822 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -11.696 -14.159 2.597 1.00 0.00 H new ATOM 792 N GLY B 33 -8.985 -10.482 4.437 1.00 0.00 N ATOM 793 CA GLY B 33 -9.304 -9.487 5.493 1.00 0.00 C ATOM 794 C GLY B 33 -9.020 -8.089 4.951 1.00 0.00 C ATOM 795 O GLY B 33 -9.476 -7.096 5.483 1.00 0.00 O ATOM 0 H GLY B 33 -7.991 -10.611 4.249 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -10.350 -9.572 5.789 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -8.704 -9.676 6.383 1.00 0.00 H new ATOM 799 N ILE B 34 -8.272 -8.011 3.887 1.00 0.00 N ATOM 800 CA ILE B 34 -7.948 -6.689 3.289 1.00 0.00 C ATOM 801 C ILE B 34 -8.618 -6.570 1.918 1.00 0.00 C ATOM 802 O ILE B 34 -9.444 -5.708 1.690 1.00 0.00 O ATOM 803 CB ILE B 34 -6.427 -6.697 3.146 1.00 0.00 C ATOM 804 CG1 ILE B 34 -5.790 -6.179 4.436 1.00 0.00 C ATOM 805 CG2 ILE B 34 -6.014 -5.805 1.978 1.00 0.00 C ATOM 806 CD1 ILE B 34 -4.821 -7.230 4.977 1.00 0.00 C ATOM 0 H ILE B 34 -7.869 -8.813 3.403 1.00 0.00 H new ATOM 0 HA ILE B 34 -8.297 -5.851 3.892 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.088 -7.716 2.957 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -5.262 -5.245 4.245 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.561 -5.964 5.175 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -4.928 -5.814 1.880 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -6.465 -6.178 1.058 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -6.354 -4.786 2.161 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -4.364 -6.865 5.897 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -5.363 -8.153 5.183 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -4.043 -7.423 4.238 1.00 0.00 H new ATOM 818 N LEU B 35 -8.268 -7.435 1.007 1.00 0.00 N ATOM 819 CA LEU B 35 -8.883 -7.383 -0.349 1.00 0.00 C ATOM 820 C LEU B 35 -10.131 -8.267 -0.390 1.00 0.00 C ATOM 821 O LEU B 35 -10.839 -8.310 -1.377 1.00 0.00 O ATOM 822 CB LEU B 35 -7.809 -7.923 -1.294 1.00 0.00 C ATOM 823 CG LEU B 35 -6.647 -6.931 -1.367 1.00 0.00 C ATOM 824 CD1 LEU B 35 -5.342 -7.644 -1.009 1.00 0.00 C ATOM 825 CD2 LEU B 35 -6.546 -6.368 -2.787 1.00 0.00 C ATOM 0 H LEU B 35 -7.581 -8.177 1.143 1.00 0.00 H new ATOM 0 HA LEU B 35 -9.195 -6.376 -0.626 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -7.453 -8.891 -0.941 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -8.229 -8.080 -2.287 1.00 0.00 H new ATOM 0 HG LEU B 35 -6.821 -6.117 -0.663 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -4.515 -6.936 -1.061 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -5.412 -8.046 0.002 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.168 -8.459 -1.712 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -5.718 -5.661 -2.840 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -6.373 -7.183 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -7.475 -5.859 -3.043 1.00 0.00 H new ATOM 837 N LYS B 36 -10.409 -8.970 0.675 1.00 0.00 N ATOM 838 CA LYS B 36 -11.615 -9.845 0.692 1.00 0.00 C ATOM 839 C LYS B 36 -11.478 -10.960 -0.347 1.00 0.00 C ATOM 840 O LYS B 36 -12.384 -11.216 -1.116 1.00 0.00 O ATOM 841 CB LYS B 36 -12.781 -8.921 0.336 1.00 0.00 C ATOM 842 CG LYS B 36 -14.095 -9.562 0.785 1.00 0.00 C ATOM 843 CD LYS B 36 -15.127 -9.452 -0.339 1.00 0.00 C ATOM 844 CE LYS B 36 -16.345 -10.313 0.000 1.00 0.00 C ATOM 845 NZ LYS B 36 -15.927 -11.709 -0.310 1.00 0.00 N ATOM 0 H LYS B 36 -9.855 -8.976 1.531 1.00 0.00 H new ATOM 0 HA LYS B 36 -11.758 -10.329 1.658 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -12.652 -7.953 0.820 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -12.801 -8.740 -0.739 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -13.932 -10.609 1.042 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -14.465 -9.067 1.683 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -15.428 -8.413 -0.470 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -14.689 -9.778 -1.282 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -16.623 -10.208 1.049 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -17.213 -10.020 -0.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -16.545 -12.100 -1.049 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -14.943 -11.710 -0.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -16.001 -12.292 0.548 1.00 0.00 H new ATOM 859 N ARG B 37 -10.352 -11.620 -0.388 1.00 0.00 N ATOM 860 CA ARG B 37 -10.169 -12.707 -1.392 1.00 0.00 C ATOM 861 C ARG B 37 -10.538 -14.065 -0.781 1.00 0.00 C ATOM 862 O ARG B 37 -10.067 -14.419 0.281 1.00 0.00 O ATOM 863 CB ARG B 37 -8.679 -12.646 -1.751 1.00 0.00 C ATOM 864 CG ARG B 37 -8.108 -14.059 -1.892 1.00 0.00 C ATOM 865 CD ARG B 37 -7.557 -14.522 -0.542 1.00 0.00 C ATOM 866 NE ARG B 37 -8.169 -15.861 -0.313 1.00 0.00 N ATOM 867 CZ ARG B 37 -8.229 -16.355 0.894 1.00 0.00 C ATOM 868 NH1 ARG B 37 -7.759 -15.676 1.904 1.00 0.00 N ATOM 869 NH2 ARG B 37 -8.760 -17.530 1.092 1.00 0.00 N ATOM 0 H ARG B 37 -9.555 -11.455 0.227 1.00 0.00 H new ATOM 0 HA ARG B 37 -10.805 -12.585 -2.269 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -8.545 -12.098 -2.683 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -8.134 -12.102 -0.980 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -8.884 -14.744 -2.235 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -7.318 -14.071 -2.643 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -6.469 -14.584 -0.560 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -7.824 -13.825 0.253 1.00 0.00 H new ATOM 0 HE ARG B 37 -8.541 -16.392 -1.100 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -7.344 -14.757 1.752 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -7.807 -16.064 2.846 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -9.128 -18.063 0.304 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -8.807 -17.916 2.035 1.00 0.00 H new ATOM 883 N PRO B 38 -11.374 -14.781 -1.489 1.00 0.00 N ATOM 884 CA PRO B 38 -11.823 -16.113 -1.036 1.00 0.00 C ATOM 885 C PRO B 38 -10.852 -17.198 -1.512 1.00 0.00 C ATOM 886 O PRO B 38 -10.082 -16.986 -2.427 1.00 0.00 O ATOM 887 CB PRO B 38 -13.176 -16.270 -1.720 1.00 0.00 C ATOM 888 CG PRO B 38 -13.124 -15.388 -2.936 1.00 0.00 C ATOM 889 CD PRO B 38 -11.982 -14.411 -2.766 1.00 0.00 C ATOM 0 HA PRO B 38 -11.874 -16.205 0.049 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.356 -17.309 -1.998 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -13.987 -15.973 -1.055 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -12.980 -15.988 -3.834 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.066 -14.853 -3.058 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -11.266 -14.490 -3.584 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -12.339 -13.381 -2.753 1.00 0.00 H new ATOM 897 N PRO B 39 -10.930 -18.334 -0.873 1.00 0.00 N ATOM 898 CA PRO B 39 -10.052 -19.474 -1.234 1.00 0.00 C ATOM 899 C PRO B 39 -10.559 -20.158 -2.509 1.00 0.00 C ATOM 900 O PRO B 39 -10.728 -21.360 -2.552 1.00 0.00 O ATOM 901 CB PRO B 39 -10.176 -20.410 -0.036 1.00 0.00 C ATOM 902 CG PRO B 39 -11.501 -20.089 0.582 1.00 0.00 C ATOM 903 CD PRO B 39 -11.829 -18.657 0.239 1.00 0.00 C ATOM 0 HA PRO B 39 -9.023 -19.175 -1.436 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -10.129 -21.454 -0.346 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -9.363 -20.252 0.673 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -12.272 -20.760 0.204 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -11.462 -20.225 1.663 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -12.874 -18.547 -0.050 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -11.662 -17.996 1.090 1.00 0.00 H new ATOM 911 N ASP B 40 -10.802 -19.404 -3.546 1.00 0.00 N ATOM 912 CA ASP B 40 -11.297 -20.019 -4.813 1.00 0.00 C ATOM 913 C ASP B 40 -10.930 -19.138 -6.010 1.00 0.00 C ATOM 914 O ASP B 40 -10.059 -19.467 -6.790 1.00 0.00 O ATOM 915 CB ASP B 40 -12.815 -20.096 -4.648 1.00 0.00 C ATOM 916 CG ASP B 40 -13.424 -20.795 -5.865 1.00 0.00 C ATOM 917 OD1 ASP B 40 -13.057 -20.442 -6.973 1.00 0.00 O ATOM 918 OD2 ASP B 40 -14.248 -21.673 -5.667 1.00 0.00 O ATOM 0 H ASP B 40 -10.680 -18.392 -3.572 1.00 0.00 H new ATOM 0 HA ASP B 40 -10.856 -20.999 -4.996 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.066 -20.642 -3.738 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -13.232 -19.094 -4.544 1.00 0.00 H new ATOM 923 N GLU B 41 -11.586 -18.019 -6.160 1.00 0.00 N ATOM 924 CA GLU B 41 -11.273 -17.119 -7.306 1.00 0.00 C ATOM 925 C GLU B 41 -10.096 -16.207 -6.949 1.00 0.00 C ATOM 926 O GLU B 41 -10.074 -15.042 -7.293 1.00 0.00 O ATOM 927 CB GLU B 41 -12.544 -16.296 -7.524 1.00 0.00 C ATOM 928 CG GLU B 41 -13.759 -17.225 -7.541 1.00 0.00 C ATOM 929 CD GLU B 41 -15.039 -16.391 -7.587 1.00 0.00 C ATOM 930 OE1 GLU B 41 -14.931 -15.177 -7.644 1.00 0.00 O ATOM 931 OE2 GLU B 41 -16.108 -16.980 -7.564 1.00 0.00 O ATOM 0 H GLU B 41 -12.325 -17.690 -5.539 1.00 0.00 H new ATOM 0 HA GLU B 41 -10.989 -17.671 -8.202 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.651 -15.556 -6.731 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -12.478 -15.749 -8.464 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -13.712 -17.886 -8.406 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -13.757 -17.859 -6.655 1.00 0.00 H new ATOM 938 N GLN B 42 -9.122 -16.729 -6.256 1.00 0.00 N ATOM 939 CA GLN B 42 -7.949 -15.894 -5.870 1.00 0.00 C ATOM 940 C GLN B 42 -6.646 -16.596 -6.267 1.00 0.00 C ATOM 941 O GLN B 42 -6.586 -17.806 -6.377 1.00 0.00 O ATOM 942 CB GLN B 42 -8.056 -15.751 -4.347 1.00 0.00 C ATOM 943 CG GLN B 42 -6.724 -16.124 -3.686 1.00 0.00 C ATOM 944 CD GLN B 42 -6.567 -17.645 -3.676 1.00 0.00 C ATOM 945 OE1 GLN B 42 -5.647 -18.177 -4.264 1.00 0.00 O ATOM 946 NE2 GLN B 42 -7.434 -18.374 -3.027 1.00 0.00 N ATOM 0 H GLN B 42 -9.087 -17.698 -5.940 1.00 0.00 H new ATOM 0 HA GLN B 42 -7.942 -14.924 -6.368 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -8.325 -14.727 -4.088 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -8.851 -16.394 -3.969 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -5.896 -15.666 -4.228 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -6.691 -15.738 -2.667 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -8.207 -17.928 -2.533 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -7.338 -19.389 -3.014 1.00 0.00 H new ATOM 955 N ARG B 43 -5.604 -15.842 -6.479 1.00 0.00 N ATOM 956 CA ARG B 43 -4.302 -16.454 -6.865 1.00 0.00 C ATOM 957 C ARG B 43 -3.150 -15.578 -6.365 1.00 0.00 C ATOM 958 O ARG B 43 -3.259 -14.370 -6.309 1.00 0.00 O ATOM 959 CB ARG B 43 -4.322 -16.497 -8.393 1.00 0.00 C ATOM 960 CG ARG B 43 -3.409 -17.621 -8.884 1.00 0.00 C ATOM 961 CD ARG B 43 -4.257 -18.770 -9.433 1.00 0.00 C ATOM 962 NE ARG B 43 -3.522 -20.007 -9.048 1.00 0.00 N ATOM 963 CZ ARG B 43 -3.974 -21.176 -9.415 1.00 0.00 C ATOM 964 NH1 ARG B 43 -5.069 -21.263 -10.118 1.00 0.00 N ATOM 965 NH2 ARG B 43 -3.328 -22.259 -9.077 1.00 0.00 N ATOM 0 H ARG B 43 -5.598 -14.825 -6.401 1.00 0.00 H new ATOM 0 HA ARG B 43 -4.162 -17.446 -6.435 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -5.339 -16.659 -8.749 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -3.990 -15.541 -8.799 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -2.740 -17.247 -9.659 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -2.782 -17.977 -8.066 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -5.261 -18.758 -9.008 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -4.368 -18.697 -10.515 1.00 0.00 H new ATOM 0 HE ARG B 43 -2.666 -19.941 -8.498 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -5.574 -20.417 -10.382 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -5.420 -22.177 -10.404 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -2.472 -22.191 -8.527 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -3.680 -23.173 -9.363 1.00 0.00 H new ATOM 979 N LEU B 44 -2.048 -16.174 -6.000 1.00 0.00 N ATOM 980 CA LEU B 44 -0.897 -15.366 -5.504 1.00 0.00 C ATOM 981 C LEU B 44 0.315 -15.554 -6.418 1.00 0.00 C ATOM 982 O LEU B 44 0.465 -16.573 -7.063 1.00 0.00 O ATOM 983 CB LEU B 44 -0.603 -15.909 -4.105 1.00 0.00 C ATOM 984 CG LEU B 44 -1.632 -15.359 -3.117 1.00 0.00 C ATOM 985 CD1 LEU B 44 -2.335 -16.521 -2.413 1.00 0.00 C ATOM 986 CD2 LEU B 44 -0.926 -14.488 -2.077 1.00 0.00 C ATOM 0 H LEU B 44 -1.895 -17.182 -6.023 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.120 -14.299 -5.488 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -0.636 -16.998 -4.112 1.00 0.00 H new ATOM 0 HB3 LEU B 44 0.402 -15.623 -3.796 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.367 -14.760 -3.655 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -3.069 -16.129 -1.708 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.838 -17.144 -3.153 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.599 -17.119 -1.875 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -1.659 -14.096 -1.373 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -0.191 -15.087 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.424 -13.660 -2.577 1.00 0.00 H new ATOM 998 N TYR B 45 1.186 -14.584 -6.477 1.00 0.00 N ATOM 999 CA TYR B 45 2.386 -14.714 -7.344 1.00 0.00 C ATOM 1000 C TYR B 45 3.648 -14.436 -6.527 1.00 0.00 C ATOM 1001 O TYR B 45 3.726 -13.472 -5.792 1.00 0.00 O ATOM 1002 CB TYR B 45 2.207 -13.658 -8.436 1.00 0.00 C ATOM 1003 CG TYR B 45 1.924 -14.338 -9.753 1.00 0.00 C ATOM 1004 CD1 TYR B 45 0.800 -15.162 -9.888 1.00 0.00 C ATOM 1005 CD2 TYR B 45 2.783 -14.143 -10.841 1.00 0.00 C ATOM 1006 CE1 TYR B 45 0.538 -15.793 -11.110 1.00 0.00 C ATOM 1007 CE2 TYR B 45 2.521 -14.774 -12.063 1.00 0.00 C ATOM 1008 CZ TYR B 45 1.397 -15.599 -12.198 1.00 0.00 C ATOM 1009 OH TYR B 45 1.138 -16.221 -13.402 1.00 0.00 O ATOM 0 H TYR B 45 1.116 -13.707 -5.961 1.00 0.00 H new ATOM 0 HA TYR B 45 2.489 -15.714 -7.765 1.00 0.00 H new ATOM 0 HB2 TYR B 45 1.387 -12.988 -8.177 1.00 0.00 H new ATOM 0 HB3 TYR B 45 3.106 -13.047 -8.516 1.00 0.00 H new ATOM 0 HD1 TYR B 45 0.135 -15.311 -9.050 1.00 0.00 H new ATOM 0 HD2 TYR B 45 3.648 -13.505 -10.738 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -0.328 -16.430 -11.213 1.00 0.00 H new ATOM 0 HE2 TYR B 45 3.185 -14.625 -12.901 1.00 0.00 H new ATOM 0 HH TYR B 45 1.831 -15.979 -14.051 1.00 0.00 H new ATOM 1019 N LYS B 46 4.633 -15.276 -6.648 1.00 0.00 N ATOM 1020 CA LYS B 46 5.893 -15.070 -5.876 1.00 0.00 C ATOM 1021 C LYS B 46 6.961 -14.418 -6.760 1.00 0.00 C ATOM 1022 O LYS B 46 7.481 -15.026 -7.673 1.00 0.00 O ATOM 1023 CB LYS B 46 6.331 -16.473 -5.453 1.00 0.00 C ATOM 1024 CG LYS B 46 7.693 -16.396 -4.760 1.00 0.00 C ATOM 1025 CD LYS B 46 8.492 -17.667 -5.061 1.00 0.00 C ATOM 1026 CE LYS B 46 9.841 -17.288 -5.677 1.00 0.00 C ATOM 1027 NZ LYS B 46 10.413 -18.572 -6.170 1.00 0.00 N ATOM 0 H LYS B 46 4.623 -16.100 -7.249 1.00 0.00 H new ATOM 0 HA LYS B 46 5.748 -14.411 -5.020 1.00 0.00 H new ATOM 0 HB2 LYS B 46 5.593 -16.908 -4.780 1.00 0.00 H new ATOM 0 HB3 LYS B 46 6.391 -17.125 -6.325 1.00 0.00 H new ATOM 0 HG2 LYS B 46 8.240 -15.519 -5.106 1.00 0.00 H new ATOM 0 HG3 LYS B 46 7.560 -16.284 -3.684 1.00 0.00 H new ATOM 0 HD2 LYS B 46 8.646 -18.238 -4.145 1.00 0.00 H new ATOM 0 HD3 LYS B 46 7.934 -18.306 -5.745 1.00 0.00 H new ATOM 0 HE2 LYS B 46 9.717 -16.573 -6.490 1.00 0.00 H new ATOM 0 HE3 LYS B 46 10.495 -16.822 -4.940 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 11.450 -18.498 -6.210 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 10.146 -19.342 -5.524 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 10.044 -18.774 -7.121 1.00 0.00 H new ATOM 1041 N ASP B 47 7.295 -13.185 -6.487 1.00 0.00 N ATOM 1042 CA ASP B 47 8.332 -12.489 -7.302 1.00 0.00 C ATOM 1043 C ASP B 47 7.900 -12.418 -8.770 1.00 0.00 C ATOM 1044 O ASP B 47 7.507 -11.379 -9.263 1.00 0.00 O ATOM 1045 CB ASP B 47 9.591 -13.344 -7.154 1.00 0.00 C ATOM 1046 CG ASP B 47 10.758 -12.462 -6.708 1.00 0.00 C ATOM 1047 OD1 ASP B 47 11.321 -11.785 -7.553 1.00 0.00 O ATOM 1048 OD2 ASP B 47 11.069 -12.477 -5.528 1.00 0.00 O ATOM 0 H ASP B 47 6.893 -12.629 -5.733 1.00 0.00 H new ATOM 0 HA ASP B 47 8.493 -11.463 -6.972 1.00 0.00 H new ATOM 0 HB2 ASP B 47 9.421 -14.137 -6.425 1.00 0.00 H new ATOM 0 HB3 ASP B 47 9.828 -13.828 -8.102 1.00 0.00 H new ATOM 1053 N ASP B 48 7.973 -13.515 -9.471 1.00 0.00 N ATOM 1054 CA ASP B 48 7.571 -13.514 -10.907 1.00 0.00 C ATOM 1055 C ASP B 48 6.858 -14.822 -11.254 1.00 0.00 C ATOM 1056 O ASP B 48 6.756 -15.199 -12.405 1.00 0.00 O ATOM 1057 CB ASP B 48 8.882 -13.394 -11.685 1.00 0.00 C ATOM 1058 CG ASP B 48 8.704 -12.404 -12.838 1.00 0.00 C ATOM 1059 OD1 ASP B 48 7.778 -11.611 -12.775 1.00 0.00 O ATOM 1060 OD2 ASP B 48 9.495 -12.456 -13.764 1.00 0.00 O ATOM 0 H ASP B 48 8.294 -14.414 -9.112 1.00 0.00 H new ATOM 0 HA ASP B 48 6.882 -12.703 -11.144 1.00 0.00 H new ATOM 0 HB2 ASP B 48 9.680 -13.058 -11.023 1.00 0.00 H new ATOM 0 HB3 ASP B 48 9.178 -14.369 -12.072 1.00 0.00 H new ATOM 1065 N GLN B 49 6.366 -15.520 -10.267 1.00 0.00 N ATOM 1066 CA GLN B 49 5.661 -16.804 -10.539 1.00 0.00 C ATOM 1067 C GLN B 49 4.369 -16.880 -9.725 1.00 0.00 C ATOM 1068 O GLN B 49 3.924 -15.904 -9.157 1.00 0.00 O ATOM 1069 CB GLN B 49 6.639 -17.893 -10.094 1.00 0.00 C ATOM 1070 CG GLN B 49 6.674 -17.955 -8.566 1.00 0.00 C ATOM 1071 CD GLN B 49 7.886 -18.772 -8.115 1.00 0.00 C ATOM 1072 OE1 GLN B 49 9.013 -18.360 -8.298 1.00 0.00 O ATOM 1073 NE2 GLN B 49 7.698 -19.924 -7.530 1.00 0.00 N ATOM 0 H GLN B 49 6.422 -15.256 -9.283 1.00 0.00 H new ATOM 0 HA GLN B 49 5.382 -16.909 -11.588 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.335 -18.858 -10.501 1.00 0.00 H new ATOM 0 HB3 GLN B 49 7.635 -17.683 -10.483 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.727 -16.948 -8.152 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.757 -18.407 -8.189 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.751 -20.269 -7.377 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.498 -20.478 -7.226 1.00 0.00 H new ATOM 1082 N LEU B 50 3.767 -18.034 -9.667 1.00 0.00 N ATOM 1083 CA LEU B 50 2.503 -18.180 -8.891 1.00 0.00 C ATOM 1084 C LEU B 50 2.799 -18.762 -7.506 1.00 0.00 C ATOM 1085 O LEU B 50 3.469 -19.767 -7.375 1.00 0.00 O ATOM 1086 CB LEU B 50 1.647 -19.146 -9.708 1.00 0.00 C ATOM 1087 CG LEU B 50 0.353 -19.447 -8.950 1.00 0.00 C ATOM 1088 CD1 LEU B 50 -0.613 -18.271 -9.101 1.00 0.00 C ATOM 1089 CD2 LEU B 50 -0.290 -20.712 -9.522 1.00 0.00 C ATOM 0 H LEU B 50 4.096 -18.885 -10.124 1.00 0.00 H new ATOM 0 HA LEU B 50 2.001 -17.225 -8.733 1.00 0.00 H new ATOM 0 HB2 LEU B 50 1.418 -18.712 -10.681 1.00 0.00 H new ATOM 0 HB3 LEU B 50 2.196 -20.069 -9.892 1.00 0.00 H new ATOM 0 HG LEU B 50 0.578 -19.599 -7.894 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -1.535 -18.486 -8.561 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -0.155 -17.370 -8.694 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -0.838 -18.118 -10.157 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -1.212 -20.927 -8.982 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -0.514 -20.561 -10.578 1.00 0.00 H new ATOM 0 HD23 LEU B 50 0.398 -21.551 -9.414 1.00 0.00 H new ATOM 1101 N LEU B 51 2.304 -18.138 -6.473 1.00 0.00 N ATOM 1102 CA LEU B 51 2.557 -18.654 -5.097 1.00 0.00 C ATOM 1103 C LEU B 51 1.679 -19.878 -4.820 1.00 0.00 C ATOM 1104 O LEU B 51 0.487 -19.864 -5.050 1.00 0.00 O ATOM 1105 CB LEU B 51 2.173 -17.500 -4.168 1.00 0.00 C ATOM 1106 CG LEU B 51 3.170 -17.422 -3.012 1.00 0.00 C ATOM 1107 CD1 LEU B 51 3.869 -16.061 -3.030 1.00 0.00 C ATOM 1108 CD2 LEU B 51 2.424 -17.593 -1.686 1.00 0.00 C ATOM 0 H LEU B 51 1.735 -17.293 -6.522 1.00 0.00 H new ATOM 0 HA LEU B 51 3.592 -18.967 -4.957 1.00 0.00 H new ATOM 0 HB2 LEU B 51 2.167 -16.561 -4.721 1.00 0.00 H new ATOM 0 HB3 LEU B 51 1.164 -17.650 -3.783 1.00 0.00 H new ATOM 0 HG LEU B 51 3.913 -18.213 -3.119 1.00 0.00 H new ATOM 0 HD11 LEU B 51 4.580 -16.006 -2.205 1.00 0.00 H new ATOM 0 HD12 LEU B 51 4.399 -15.936 -3.975 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.127 -15.270 -2.923 1.00 0.00 H new ATOM 0 HD21 LEU B 51 3.133 -17.538 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU B 51 1.682 -16.801 -1.581 1.00 0.00 H new ATOM 0 HD23 LEU B 51 1.925 -18.562 -1.672 1.00 0.00 H new ATOM 1120 N ASP B 52 2.261 -20.938 -4.327 1.00 0.00 N ATOM 1121 CA ASP B 52 1.458 -22.160 -4.035 1.00 0.00 C ATOM 1122 C ASP B 52 1.401 -22.406 -2.525 1.00 0.00 C ATOM 1123 O ASP B 52 2.401 -22.339 -1.838 1.00 0.00 O ATOM 1124 CB ASP B 52 2.198 -23.300 -4.735 1.00 0.00 C ATOM 1125 CG ASP B 52 3.591 -23.457 -4.124 1.00 0.00 C ATOM 1126 OD1 ASP B 52 4.333 -22.489 -4.129 1.00 0.00 O ATOM 1127 OD2 ASP B 52 3.892 -24.544 -3.658 1.00 0.00 O ATOM 0 H ASP B 52 3.256 -21.011 -4.114 1.00 0.00 H new ATOM 0 HA ASP B 52 0.429 -22.069 -4.382 1.00 0.00 H new ATOM 0 HB2 ASP B 52 1.637 -24.229 -4.631 1.00 0.00 H new ATOM 0 HB3 ASP B 52 2.279 -23.094 -5.802 1.00 0.00 H new ATOM 1132 N ASP B 53 0.238 -22.687 -2.002 1.00 0.00 N ATOM 1133 CA ASP B 53 0.123 -22.934 -0.537 1.00 0.00 C ATOM 1134 C ASP B 53 0.755 -24.281 -0.174 1.00 0.00 C ATOM 1135 O ASP B 53 0.803 -24.664 0.979 1.00 0.00 O ATOM 1136 CB ASP B 53 -1.380 -22.949 -0.252 1.00 0.00 C ATOM 1137 CG ASP B 53 -1.638 -23.611 1.104 1.00 0.00 C ATOM 1138 OD1 ASP B 53 -1.633 -22.902 2.096 1.00 0.00 O ATOM 1139 OD2 ASP B 53 -1.835 -24.814 1.126 1.00 0.00 O ATOM 0 H ASP B 53 -0.635 -22.756 -2.525 1.00 0.00 H new ATOM 0 HA ASP B 53 0.640 -22.175 0.050 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.771 -21.931 -0.252 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.904 -23.491 -1.039 1.00 0.00 H new ATOM 1144 N GLY B 54 1.241 -25.001 -1.147 1.00 0.00 N ATOM 1145 CA GLY B 54 1.869 -26.320 -0.856 1.00 0.00 C ATOM 1146 C GLY B 54 3.320 -26.108 -0.421 1.00 0.00 C ATOM 1147 O GLY B 54 4.058 -27.051 -0.208 1.00 0.00 O ATOM 0 H GLY B 54 1.230 -24.733 -2.131 1.00 0.00 H new ATOM 0 HA2 GLY B 54 1.314 -26.834 -0.071 1.00 0.00 H new ATOM 0 HA3 GLY B 54 1.832 -26.956 -1.741 1.00 0.00 H new ATOM 1151 N LYS B 55 3.731 -24.880 -0.274 1.00 0.00 N ATOM 1152 CA LYS B 55 5.104 -24.595 0.156 1.00 0.00 C ATOM 1153 C LYS B 55 5.070 -23.458 1.167 1.00 0.00 C ATOM 1154 O LYS B 55 4.266 -22.550 1.087 1.00 0.00 O ATOM 1155 CB LYS B 55 5.847 -24.175 -1.113 1.00 0.00 C ATOM 1156 CG LYS B 55 6.873 -25.248 -1.483 1.00 0.00 C ATOM 1157 CD LYS B 55 6.201 -26.324 -2.339 1.00 0.00 C ATOM 1158 CE LYS B 55 7.017 -27.616 -2.268 1.00 0.00 C ATOM 1159 NZ LYS B 55 6.199 -28.628 -2.992 1.00 0.00 N ATOM 0 H LYS B 55 3.154 -24.055 -0.440 1.00 0.00 H new ATOM 0 HA LYS B 55 5.591 -25.448 0.629 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.141 -24.035 -1.931 1.00 0.00 H new ATOM 0 HB3 LYS B 55 6.346 -23.219 -0.955 1.00 0.00 H new ATOM 0 HG2 LYS B 55 7.703 -24.800 -2.029 1.00 0.00 H new ATOM 0 HG3 LYS B 55 7.290 -25.694 -0.580 1.00 0.00 H new ATOM 0 HD2 LYS B 55 5.185 -26.503 -1.986 1.00 0.00 H new ATOM 0 HD3 LYS B 55 6.124 -25.986 -3.372 1.00 0.00 H new ATOM 0 HE2 LYS B 55 7.994 -27.492 -2.734 1.00 0.00 H new ATOM 0 HE3 LYS B 55 7.192 -27.916 -1.235 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 6.694 -29.543 -2.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 5.277 -28.730 -2.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 6.054 -28.319 -3.974 1.00 0.00 H new ATOM 1173 N THR B 56 5.938 -23.514 2.104 1.00 0.00 N ATOM 1174 CA THR B 56 6.008 -22.459 3.150 1.00 0.00 C ATOM 1175 C THR B 56 7.026 -21.391 2.746 1.00 0.00 C ATOM 1176 O THR B 56 7.726 -21.527 1.763 1.00 0.00 O ATOM 1177 CB THR B 56 6.463 -23.184 4.416 1.00 0.00 C ATOM 1178 OG1 THR B 56 7.292 -24.282 4.058 1.00 0.00 O ATOM 1179 CG2 THR B 56 5.241 -23.695 5.182 1.00 0.00 C ATOM 0 H THR B 56 6.626 -24.260 2.205 1.00 0.00 H new ATOM 0 HA THR B 56 5.053 -21.953 3.295 1.00 0.00 H new ATOM 0 HB THR B 56 7.023 -22.495 5.048 1.00 0.00 H new ATOM 0 HG1 THR B 56 7.840 -24.542 4.827 1.00 0.00 H new ATOM 0 HG21 THR B 56 5.567 -24.212 6.085 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.605 -22.853 5.456 1.00 0.00 H new ATOM 0 HG23 THR B 56 4.679 -24.385 4.552 1.00 0.00 H new ATOM 1187 N LEU B 57 7.110 -20.332 3.496 1.00 0.00 N ATOM 1188 CA LEU B 57 8.082 -19.253 3.156 1.00 0.00 C ATOM 1189 C LEU B 57 9.483 -19.845 2.982 1.00 0.00 C ATOM 1190 O LEU B 57 10.207 -19.498 2.071 1.00 0.00 O ATOM 1191 CB LEU B 57 8.044 -18.296 4.347 1.00 0.00 C ATOM 1192 CG LEU B 57 6.670 -17.627 4.419 1.00 0.00 C ATOM 1193 CD1 LEU B 57 5.932 -18.105 5.669 1.00 0.00 C ATOM 1194 CD2 LEU B 57 6.847 -16.108 4.481 1.00 0.00 C ATOM 0 H LEU B 57 6.549 -20.164 4.331 1.00 0.00 H new ATOM 0 HA LEU B 57 7.833 -18.748 2.223 1.00 0.00 H new ATOM 0 HB2 LEU B 57 8.245 -18.839 5.270 1.00 0.00 H new ATOM 0 HB3 LEU B 57 8.823 -17.541 4.246 1.00 0.00 H new ATOM 0 HG LEU B 57 6.091 -17.891 3.534 1.00 0.00 H new ATOM 0 HD11 LEU B 57 4.953 -17.627 5.719 1.00 0.00 H new ATOM 0 HD12 LEU B 57 5.806 -19.187 5.626 1.00 0.00 H new ATOM 0 HD13 LEU B 57 6.509 -17.842 6.555 1.00 0.00 H new ATOM 0 HD21 LEU B 57 5.869 -15.630 4.532 1.00 0.00 H new ATOM 0 HD22 LEU B 57 7.427 -15.845 5.366 1.00 0.00 H new ATOM 0 HD23 LEU B 57 7.372 -15.766 3.589 1.00 0.00 H new ATOM 1206 N GLY B 58 9.867 -20.745 3.845 1.00 0.00 N ATOM 1207 CA GLY B 58 11.215 -21.367 3.725 1.00 0.00 C ATOM 1208 C GLY B 58 11.218 -22.328 2.537 1.00 0.00 C ATOM 1209 O GLY B 58 12.169 -22.400 1.785 1.00 0.00 O ATOM 0 H GLY B 58 9.305 -21.077 4.629 1.00 0.00 H new ATOM 0 HA2 GLY B 58 11.974 -20.597 3.587 1.00 0.00 H new ATOM 0 HA3 GLY B 58 11.466 -21.901 4.641 1.00 0.00 H new ATOM 1213 N GLU B 59 10.156 -23.064 2.360 1.00 0.00 N ATOM 1214 CA GLU B 59 10.089 -24.019 1.218 1.00 0.00 C ATOM 1215 C GLU B 59 9.572 -23.304 -0.027 1.00 0.00 C ATOM 1216 O GLU B 59 9.340 -23.903 -1.058 1.00 0.00 O ATOM 1217 CB GLU B 59 9.105 -25.096 1.663 1.00 0.00 C ATOM 1218 CG GLU B 59 9.799 -26.459 1.658 1.00 0.00 C ATOM 1219 CD GLU B 59 10.022 -26.923 3.099 1.00 0.00 C ATOM 1220 OE1 GLU B 59 9.246 -26.529 3.955 1.00 0.00 O ATOM 1221 OE2 GLU B 59 10.965 -27.666 3.322 1.00 0.00 O ATOM 0 H GLU B 59 9.330 -23.045 2.958 1.00 0.00 H new ATOM 0 HA GLU B 59 11.064 -24.438 0.967 1.00 0.00 H new ATOM 0 HB2 GLU B 59 8.731 -24.871 2.662 1.00 0.00 H new ATOM 0 HB3 GLU B 59 8.243 -25.113 0.996 1.00 0.00 H new ATOM 0 HG2 GLU B 59 9.191 -27.187 1.120 1.00 0.00 H new ATOM 0 HG3 GLU B 59 10.753 -26.392 1.135 1.00 0.00 H new ATOM 1228 N CYS B 60 9.394 -22.022 0.070 1.00 0.00 N ATOM 1229 CA CYS B 60 8.896 -21.239 -1.095 1.00 0.00 C ATOM 1230 C CYS B 60 9.971 -20.252 -1.553 1.00 0.00 C ATOM 1231 O CYS B 60 10.116 -19.977 -2.728 1.00 0.00 O ATOM 1232 CB CYS B 60 7.666 -20.493 -0.579 1.00 0.00 C ATOM 1233 SG CYS B 60 6.886 -19.598 -1.944 1.00 0.00 S ATOM 0 H CYS B 60 9.573 -21.475 0.912 1.00 0.00 H new ATOM 0 HA CYS B 60 8.654 -21.872 -1.949 1.00 0.00 H new ATOM 0 HB2 CYS B 60 6.959 -21.197 -0.140 1.00 0.00 H new ATOM 0 HB3 CYS B 60 7.954 -19.797 0.209 1.00 0.00 H new ATOM 0 HG CYS B 60 7.312 -18.370 -1.957 1.00 0.00 H new ATOM 1239 N GLY B 61 10.730 -19.722 -0.634 1.00 0.00 N ATOM 1240 CA GLY B 61 11.800 -18.760 -1.020 1.00 0.00 C ATOM 1241 C GLY B 61 11.681 -17.482 -0.184 1.00 0.00 C ATOM 1242 O GLY B 61 12.245 -16.459 -0.517 1.00 0.00 O ATOM 0 H GLY B 61 10.656 -19.913 0.365 1.00 0.00 H new ATOM 0 HA2 GLY B 61 12.780 -19.213 -0.869 1.00 0.00 H new ATOM 0 HA3 GLY B 61 11.720 -18.520 -2.080 1.00 0.00 H new ATOM 1246 N PHE B 62 10.956 -17.532 0.899 1.00 0.00 N ATOM 1247 CA PHE B 62 10.809 -16.318 1.752 1.00 0.00 C ATOM 1248 C PHE B 62 11.632 -16.475 3.033 1.00 0.00 C ATOM 1249 O PHE B 62 11.100 -16.692 4.104 1.00 0.00 O ATOM 1250 CB PHE B 62 9.317 -16.239 2.076 1.00 0.00 C ATOM 1251 CG PHE B 62 8.552 -15.852 0.832 1.00 0.00 C ATOM 1252 CD1 PHE B 62 8.636 -14.546 0.336 1.00 0.00 C ATOM 1253 CD2 PHE B 62 7.757 -16.800 0.177 1.00 0.00 C ATOM 1254 CE1 PHE B 62 7.926 -14.187 -0.816 1.00 0.00 C ATOM 1255 CE2 PHE B 62 7.048 -16.442 -0.977 1.00 0.00 C ATOM 1256 CZ PHE B 62 7.132 -15.134 -1.472 1.00 0.00 C ATOM 0 H PHE B 62 10.460 -18.359 1.230 1.00 0.00 H new ATOM 0 HA PHE B 62 11.163 -15.415 1.255 1.00 0.00 H new ATOM 0 HB2 PHE B 62 8.963 -17.200 2.449 1.00 0.00 H new ATOM 0 HB3 PHE B 62 9.143 -15.507 2.865 1.00 0.00 H new ATOM 0 HD1 PHE B 62 9.249 -13.815 0.842 1.00 0.00 H new ATOM 0 HD2 PHE B 62 7.690 -17.807 0.561 1.00 0.00 H new ATOM 0 HE1 PHE B 62 7.991 -13.179 -1.198 1.00 0.00 H new ATOM 0 HE2 PHE B 62 6.437 -17.174 -1.485 1.00 0.00 H new ATOM 0 HZ PHE B 62 6.584 -14.857 -2.360 1.00 0.00 H new ATOM 1266 N THR B 63 12.929 -16.372 2.930 1.00 0.00 N ATOM 1267 CA THR B 63 13.791 -16.519 4.139 1.00 0.00 C ATOM 1268 C THR B 63 14.075 -15.145 4.757 1.00 0.00 C ATOM 1269 O THR B 63 13.172 -14.439 5.160 1.00 0.00 O ATOM 1270 CB THR B 63 15.084 -17.163 3.626 1.00 0.00 C ATOM 1271 OG1 THR B 63 15.929 -16.161 3.078 1.00 0.00 O ATOM 1272 CG2 THR B 63 14.754 -18.192 2.545 1.00 0.00 C ATOM 0 H THR B 63 13.430 -16.192 2.060 1.00 0.00 H new ATOM 0 HA THR B 63 13.319 -17.121 4.916 1.00 0.00 H new ATOM 0 HB THR B 63 15.592 -17.657 4.454 1.00 0.00 H new ATOM 0 HG1 THR B 63 16.756 -16.573 2.752 1.00 0.00 H new ATOM 0 HG21 THR B 63 15.676 -18.648 2.183 1.00 0.00 H new ATOM 0 HG22 THR B 63 14.107 -18.964 2.963 1.00 0.00 H new ATOM 0 HG23 THR B 63 14.243 -17.699 1.718 1.00 0.00 H new ATOM 1280 N SER B 64 15.319 -14.756 4.828 1.00 0.00 N ATOM 1281 CA SER B 64 15.654 -13.429 5.410 1.00 0.00 C ATOM 1282 C SER B 64 16.449 -12.614 4.395 1.00 0.00 C ATOM 1283 O SER B 64 17.191 -11.715 4.737 1.00 0.00 O ATOM 1284 CB SER B 64 16.499 -13.731 6.648 1.00 0.00 C ATOM 1285 OG SER B 64 17.479 -14.706 6.320 1.00 0.00 O ATOM 0 H SER B 64 16.118 -15.303 4.507 1.00 0.00 H new ATOM 0 HA SER B 64 14.768 -12.849 5.668 1.00 0.00 H new ATOM 0 HB2 SER B 64 16.980 -12.821 7.005 1.00 0.00 H new ATOM 0 HB3 SER B 64 15.864 -14.094 7.456 1.00 0.00 H new ATOM 0 HG SER B 64 18.123 -14.323 5.688 1.00 0.00 H new ATOM 1291 N GLN B 65 16.285 -12.927 3.145 1.00 0.00 N ATOM 1292 CA GLN B 65 17.013 -12.180 2.080 1.00 0.00 C ATOM 1293 C GLN B 65 16.006 -11.455 1.188 1.00 0.00 C ATOM 1294 O GLN B 65 16.342 -10.531 0.474 1.00 0.00 O ATOM 1295 CB GLN B 65 17.766 -13.249 1.288 1.00 0.00 C ATOM 1296 CG GLN B 65 18.540 -14.150 2.253 1.00 0.00 C ATOM 1297 CD GLN B 65 19.481 -13.297 3.104 1.00 0.00 C ATOM 1298 OE1 GLN B 65 19.464 -13.377 4.317 1.00 0.00 O ATOM 1299 NE2 GLN B 65 20.310 -12.478 2.517 1.00 0.00 N ATOM 0 H GLN B 65 15.675 -13.672 2.809 1.00 0.00 H new ATOM 0 HA GLN B 65 17.692 -11.427 2.482 1.00 0.00 H new ATOM 0 HB2 GLN B 65 17.065 -13.843 0.702 1.00 0.00 H new ATOM 0 HB3 GLN B 65 18.452 -12.779 0.583 1.00 0.00 H new ATOM 0 HG2 GLN B 65 17.847 -14.695 2.894 1.00 0.00 H new ATOM 0 HG3 GLN B 65 19.110 -14.893 1.695 1.00 0.00 H new ATOM 0 HE21 GLN B 65 20.325 -12.410 1.499 1.00 0.00 H new ATOM 0 HE22 GLN B 65 20.943 -11.906 3.076 1.00 0.00 H new ATOM 1308 N THR B 66 14.770 -11.868 1.230 1.00 0.00 N ATOM 1309 CA THR B 66 13.729 -11.205 0.392 1.00 0.00 C ATOM 1310 C THR B 66 12.508 -10.869 1.250 1.00 0.00 C ATOM 1311 O THR B 66 11.398 -10.783 0.765 1.00 0.00 O ATOM 1312 CB THR B 66 13.370 -12.231 -0.683 1.00 0.00 C ATOM 1313 OG1 THR B 66 12.621 -11.595 -1.709 1.00 0.00 O ATOM 1314 CG2 THR B 66 12.538 -13.355 -0.063 1.00 0.00 C ATOM 0 H THR B 66 14.434 -12.637 1.809 1.00 0.00 H new ATOM 0 HA THR B 66 14.079 -10.270 -0.046 1.00 0.00 H new ATOM 0 HB THR B 66 14.283 -12.650 -1.105 1.00 0.00 H new ATOM 0 HG1 THR B 66 11.913 -11.050 -1.307 1.00 0.00 H new ATOM 0 HG21 THR B 66 12.283 -14.085 -0.831 1.00 0.00 H new ATOM 0 HG22 THR B 66 13.114 -13.842 0.724 1.00 0.00 H new ATOM 0 HG23 THR B 66 11.623 -12.940 0.360 1.00 0.00 H new ATOM 1322 N ALA B 67 12.709 -10.680 2.525 1.00 0.00 N ATOM 1323 CA ALA B 67 11.570 -10.350 3.425 1.00 0.00 C ATOM 1324 C ALA B 67 12.104 -9.843 4.767 1.00 0.00 C ATOM 1325 O ALA B 67 12.654 -10.590 5.550 1.00 0.00 O ATOM 1326 CB ALA B 67 10.817 -11.667 3.603 1.00 0.00 C ATOM 0 H ALA B 67 13.618 -10.740 2.984 1.00 0.00 H new ATOM 0 HA ALA B 67 10.926 -9.569 3.022 1.00 0.00 H new ATOM 0 HB1 ALA B 67 9.959 -11.510 4.256 1.00 0.00 H new ATOM 0 HB2 ALA B 67 10.473 -12.024 2.632 1.00 0.00 H new ATOM 0 HB3 ALA B 67 11.481 -12.408 4.048 1.00 0.00 H new ATOM 1332 N ARG B 68 11.958 -8.575 5.029 1.00 0.00 N ATOM 1333 CA ARG B 68 12.470 -8.011 6.313 1.00 0.00 C ATOM 1334 C ARG B 68 12.237 -6.497 6.346 1.00 0.00 C ATOM 1335 O ARG B 68 11.616 -5.950 5.455 1.00 0.00 O ATOM 1336 CB ARG B 68 13.965 -8.332 6.300 1.00 0.00 C ATOM 1337 CG ARG B 68 14.294 -9.293 7.446 1.00 0.00 C ATOM 1338 CD ARG B 68 15.153 -10.445 6.918 1.00 0.00 C ATOM 1339 NE ARG B 68 16.141 -9.802 6.007 1.00 0.00 N ATOM 1340 CZ ARG B 68 17.122 -9.093 6.498 1.00 0.00 C ATOM 1341 NH1 ARG B 68 17.244 -8.953 7.790 1.00 0.00 N ATOM 1342 NH2 ARG B 68 17.982 -8.528 5.696 1.00 0.00 N ATOM 0 H ARG B 68 11.506 -7.902 4.410 1.00 0.00 H new ATOM 0 HA ARG B 68 11.971 -8.425 7.189 1.00 0.00 H new ATOM 0 HB2 ARG B 68 14.243 -8.779 5.346 1.00 0.00 H new ATOM 0 HB3 ARG B 68 14.545 -7.415 6.403 1.00 0.00 H new ATOM 0 HG2 ARG B 68 14.824 -8.763 8.237 1.00 0.00 H new ATOM 0 HG3 ARG B 68 13.375 -9.682 7.883 1.00 0.00 H new ATOM 0 HD2 ARG B 68 15.651 -10.971 7.732 1.00 0.00 H new ATOM 0 HD3 ARG B 68 14.546 -11.179 6.388 1.00 0.00 H new ATOM 0 HE ARG B 68 16.051 -9.916 4.997 1.00 0.00 H new ATOM 0 HH11 ARG B 68 16.573 -9.397 8.417 1.00 0.00 H new ATOM 0 HH12 ARG B 68 18.010 -8.399 8.173 1.00 0.00 H new ATOM 0 HH21 ARG B 68 17.888 -8.640 4.687 1.00 0.00 H new ATOM 0 HH22 ARG B 68 18.748 -7.974 6.078 1.00 0.00 H new ATOM 1356 N PRO B 69 12.748 -5.861 7.368 1.00 0.00 N ATOM 1357 CA PRO B 69 12.589 -4.390 7.497 1.00 0.00 C ATOM 1358 C PRO B 69 13.414 -3.682 6.421 1.00 0.00 C ATOM 1359 O PRO B 69 13.158 -2.546 6.072 1.00 0.00 O ATOM 1360 CB PRO B 69 13.121 -4.091 8.896 1.00 0.00 C ATOM 1361 CG PRO B 69 14.053 -5.218 9.200 1.00 0.00 C ATOM 1362 CD PRO B 69 13.513 -6.430 8.485 1.00 0.00 C ATOM 0 HA PRO B 69 11.562 -4.048 7.367 1.00 0.00 H new ATOM 0 HB2 PRO B 69 13.638 -3.132 8.926 1.00 0.00 H new ATOM 0 HB3 PRO B 69 12.312 -4.040 9.624 1.00 0.00 H new ATOM 0 HG2 PRO B 69 15.063 -4.987 8.862 1.00 0.00 H new ATOM 0 HG3 PRO B 69 14.109 -5.395 10.274 1.00 0.00 H new ATOM 0 HD2 PRO B 69 14.316 -7.078 8.132 1.00 0.00 H new ATOM 0 HD3 PRO B 69 12.881 -7.032 9.138 1.00 0.00 H new ATOM 1370 N GLN B 70 14.393 -4.355 5.882 1.00 0.00 N ATOM 1371 CA GLN B 70 15.229 -3.737 4.813 1.00 0.00 C ATOM 1372 C GLN B 70 14.644 -4.094 3.445 1.00 0.00 C ATOM 1373 O GLN B 70 14.251 -3.236 2.681 1.00 0.00 O ATOM 1374 CB GLN B 70 16.617 -4.355 4.983 1.00 0.00 C ATOM 1375 CG GLN B 70 17.664 -3.241 5.080 1.00 0.00 C ATOM 1376 CD GLN B 70 18.836 -3.560 4.150 1.00 0.00 C ATOM 1377 OE1 GLN B 70 18.890 -4.623 3.563 1.00 0.00 O ATOM 1378 NE2 GLN B 70 19.785 -2.679 3.991 1.00 0.00 N ATOM 0 H GLN B 70 14.651 -5.309 6.136 1.00 0.00 H new ATOM 0 HA GLN B 70 15.265 -2.650 4.881 1.00 0.00 H new ATOM 0 HB2 GLN B 70 16.644 -4.973 5.880 1.00 0.00 H new ATOM 0 HB3 GLN B 70 16.842 -5.008 4.139 1.00 0.00 H new ATOM 0 HG2 GLN B 70 17.219 -2.284 4.807 1.00 0.00 H new ATOM 0 HG3 GLN B 70 18.016 -3.147 6.107 1.00 0.00 H new ATOM 0 HE21 GLN B 70 19.740 -1.787 4.483 1.00 0.00 H new ATOM 0 HE22 GLN B 70 20.572 -2.882 3.374 1.00 0.00 H new ATOM 1387 N ALA B 71 14.567 -5.362 3.142 1.00 0.00 N ATOM 1388 CA ALA B 71 13.988 -5.786 1.835 1.00 0.00 C ATOM 1389 C ALA B 71 12.868 -6.799 2.078 1.00 0.00 C ATOM 1390 O ALA B 71 13.122 -7.943 2.402 1.00 0.00 O ATOM 1391 CB ALA B 71 15.147 -6.434 1.076 1.00 0.00 C ATOM 0 H ALA B 71 14.881 -6.123 3.744 1.00 0.00 H new ATOM 0 HA ALA B 71 13.559 -4.955 1.276 1.00 0.00 H new ATOM 0 HB1 ALA B 71 14.799 -6.773 0.100 1.00 0.00 H new ATOM 0 HB2 ALA B 71 15.947 -5.706 0.943 1.00 0.00 H new ATOM 0 HB3 ALA B 71 15.522 -7.286 1.643 1.00 0.00 H new ATOM 1397 N PRO B 72 11.659 -6.335 1.921 1.00 0.00 N ATOM 1398 CA PRO B 72 10.475 -7.198 2.133 1.00 0.00 C ATOM 1399 C PRO B 72 10.201 -8.068 0.907 1.00 0.00 C ATOM 1400 O PRO B 72 10.809 -7.912 -0.133 1.00 0.00 O ATOM 1401 CB PRO B 72 9.344 -6.198 2.340 1.00 0.00 C ATOM 1402 CG PRO B 72 9.781 -4.947 1.639 1.00 0.00 C ATOM 1403 CD PRO B 72 11.287 -4.970 1.539 1.00 0.00 C ATOM 0 HA PRO B 72 10.600 -7.888 2.967 1.00 0.00 H new ATOM 0 HB2 PRO B 72 8.408 -6.573 1.926 1.00 0.00 H new ATOM 0 HB3 PRO B 72 9.172 -6.014 3.401 1.00 0.00 H new ATOM 0 HG2 PRO B 72 9.334 -4.890 0.646 1.00 0.00 H new ATOM 0 HG3 PRO B 72 9.449 -4.066 2.189 1.00 0.00 H new ATOM 0 HD2 PRO B 72 11.621 -4.736 0.528 1.00 0.00 H new ATOM 0 HD3 PRO B 72 11.740 -4.234 2.203 1.00 0.00 H new ATOM 1411 N ALA B 73 9.276 -8.979 1.028 1.00 0.00 N ATOM 1412 CA ALA B 73 8.936 -9.864 -0.124 1.00 0.00 C ATOM 1413 C ALA B 73 7.565 -9.473 -0.680 1.00 0.00 C ATOM 1414 O ALA B 73 6.633 -9.235 0.060 1.00 0.00 O ATOM 1415 CB ALA B 73 8.896 -11.278 0.456 1.00 0.00 C ATOM 0 H ALA B 73 8.738 -9.150 1.878 1.00 0.00 H new ATOM 0 HA ALA B 73 9.655 -9.785 -0.940 1.00 0.00 H new ATOM 0 HB1 ALA B 73 8.651 -11.988 -0.334 1.00 0.00 H new ATOM 0 HB2 ALA B 73 9.870 -11.526 0.878 1.00 0.00 H new ATOM 0 HB3 ALA B 73 8.138 -11.329 1.238 1.00 0.00 H new ATOM 1421 N THR B 74 7.438 -9.386 -1.975 1.00 0.00 N ATOM 1422 CA THR B 74 6.129 -8.989 -2.569 1.00 0.00 C ATOM 1423 C THR B 74 5.456 -10.173 -3.260 1.00 0.00 C ATOM 1424 O THR B 74 6.085 -10.947 -3.953 1.00 0.00 O ATOM 1425 CB THR B 74 6.473 -7.909 -3.594 1.00 0.00 C ATOM 1426 OG1 THR B 74 6.493 -6.640 -2.956 1.00 0.00 O ATOM 1427 CG2 THR B 74 5.428 -7.904 -4.715 1.00 0.00 C ATOM 0 H THR B 74 8.182 -9.572 -2.647 1.00 0.00 H new ATOM 0 HA THR B 74 5.433 -8.637 -1.807 1.00 0.00 H new ATOM 0 HB THR B 74 7.454 -8.118 -4.021 1.00 0.00 H new ATOM 0 HG1 THR B 74 5.817 -6.620 -2.246 1.00 0.00 H new ATOM 0 HG21 THR B 74 5.679 -7.132 -5.443 1.00 0.00 H new ATOM 0 HG22 THR B 74 5.417 -8.877 -5.207 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.444 -7.700 -4.294 1.00 0.00 H new ATOM 1435 N VAL B 75 4.172 -10.294 -3.095 1.00 0.00 N ATOM 1436 CA VAL B 75 3.431 -11.398 -3.761 1.00 0.00 C ATOM 1437 C VAL B 75 2.307 -10.791 -4.608 1.00 0.00 C ATOM 1438 O VAL B 75 1.678 -9.827 -4.220 1.00 0.00 O ATOM 1439 CB VAL B 75 2.878 -12.289 -2.635 1.00 0.00 C ATOM 1440 CG1 VAL B 75 3.670 -12.068 -1.342 1.00 0.00 C ATOM 1441 CG2 VAL B 75 1.405 -11.961 -2.389 1.00 0.00 C ATOM 0 H VAL B 75 3.599 -9.672 -2.524 1.00 0.00 H new ATOM 0 HA VAL B 75 4.061 -11.990 -4.425 1.00 0.00 H new ATOM 0 HB VAL B 75 2.975 -13.331 -2.938 1.00 0.00 H new ATOM 0 HG11 VAL B 75 3.267 -12.705 -0.555 1.00 0.00 H new ATOM 0 HG12 VAL B 75 4.718 -12.318 -1.510 1.00 0.00 H new ATOM 0 HG13 VAL B 75 3.590 -11.024 -1.040 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.019 -12.595 -1.591 1.00 0.00 H new ATOM 0 HG22 VAL B 75 1.309 -10.915 -2.100 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.835 -12.139 -3.301 1.00 0.00 H new ATOM 1451 N GLY B 76 2.060 -11.333 -5.764 1.00 0.00 N ATOM 1452 CA GLY B 76 1.000 -10.783 -6.634 1.00 0.00 C ATOM 1453 C GLY B 76 -0.292 -11.528 -6.357 1.00 0.00 C ATOM 1454 O GLY B 76 -0.301 -12.709 -6.083 1.00 0.00 O ATOM 0 H GLY B 76 2.554 -12.141 -6.143 1.00 0.00 H new ATOM 0 HA2 GLY B 76 0.870 -9.718 -6.444 1.00 0.00 H new ATOM 0 HA3 GLY B 76 1.279 -10.888 -7.682 1.00 0.00 H new ATOM 1458 N LEU B 77 -1.378 -10.836 -6.416 1.00 0.00 N ATOM 1459 CA LEU B 77 -2.688 -11.474 -6.145 1.00 0.00 C ATOM 1460 C LEU B 77 -3.574 -11.409 -7.382 1.00 0.00 C ATOM 1461 O LEU B 77 -3.909 -10.352 -7.876 1.00 0.00 O ATOM 1462 CB LEU B 77 -3.325 -10.678 -4.999 1.00 0.00 C ATOM 1463 CG LEU B 77 -2.576 -9.361 -4.768 1.00 0.00 C ATOM 1464 CD1 LEU B 77 -3.336 -8.524 -3.739 1.00 0.00 C ATOM 1465 CD2 LEU B 77 -1.164 -9.650 -4.245 1.00 0.00 C ATOM 0 H LEU B 77 -1.421 -9.842 -6.643 1.00 0.00 H new ATOM 0 HA LEU B 77 -2.568 -12.525 -5.882 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.370 -10.471 -5.231 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -3.313 -11.273 -4.086 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.505 -8.816 -5.709 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.807 -7.586 -3.571 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.339 -8.314 -4.110 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.404 -9.075 -2.801 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -0.637 -8.710 -4.083 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -1.229 -10.197 -3.304 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.621 -10.249 -4.976 1.00 0.00 H new ATOM 1477 N ALA B 78 -3.953 -12.543 -7.868 1.00 0.00 N ATOM 1478 CA ALA B 78 -4.831 -12.606 -9.073 1.00 0.00 C ATOM 1479 C ALA B 78 -6.190 -13.209 -8.706 1.00 0.00 C ATOM 1480 O ALA B 78 -6.310 -13.963 -7.763 1.00 0.00 O ATOM 1481 CB ALA B 78 -4.097 -13.517 -10.054 1.00 0.00 C ATOM 0 H ALA B 78 -3.692 -13.450 -7.482 1.00 0.00 H new ATOM 0 HA ALA B 78 -5.020 -11.619 -9.494 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.682 -13.613 -10.969 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -3.123 -13.088 -10.290 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.961 -14.501 -9.605 1.00 0.00 H new ATOM 1487 N PHE B 79 -7.214 -12.885 -9.447 1.00 0.00 N ATOM 1488 CA PHE B 79 -8.562 -13.447 -9.140 1.00 0.00 C ATOM 1489 C PHE B 79 -9.194 -14.015 -10.413 1.00 0.00 C ATOM 1490 O PHE B 79 -9.317 -13.336 -11.412 1.00 0.00 O ATOM 1491 CB PHE B 79 -9.378 -12.263 -8.624 1.00 0.00 C ATOM 1492 CG PHE B 79 -8.884 -11.865 -7.254 1.00 0.00 C ATOM 1493 CD1 PHE B 79 -7.622 -11.280 -7.108 1.00 0.00 C ATOM 1494 CD2 PHE B 79 -9.690 -12.081 -6.131 1.00 0.00 C ATOM 1495 CE1 PHE B 79 -7.165 -10.909 -5.838 1.00 0.00 C ATOM 1496 CE2 PHE B 79 -9.234 -11.711 -4.860 1.00 0.00 C ATOM 1497 CZ PHE B 79 -7.971 -11.125 -4.714 1.00 0.00 C ATOM 0 H PHE B 79 -7.177 -12.257 -10.250 1.00 0.00 H new ATOM 0 HA PHE B 79 -8.516 -14.258 -8.413 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -9.291 -11.422 -9.311 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -10.434 -12.529 -8.578 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -7.000 -11.114 -7.975 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -10.664 -12.533 -6.245 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -6.191 -10.456 -5.725 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -9.856 -11.878 -3.993 1.00 0.00 H new ATOM 0 HZ PHE B 79 -7.618 -10.839 -3.734 1.00 0.00 H new ATOM 1507 N ARG B 80 -9.595 -15.256 -10.387 1.00 0.00 N ATOM 1508 CA ARG B 80 -10.218 -15.862 -11.599 1.00 0.00 C ATOM 1509 C ARG B 80 -11.725 -16.038 -11.390 1.00 0.00 C ATOM 1510 O ARG B 80 -12.162 -16.890 -10.643 1.00 0.00 O ATOM 1511 CB ARG B 80 -9.535 -17.220 -11.760 1.00 0.00 C ATOM 1512 CG ARG B 80 -8.536 -17.155 -12.916 1.00 0.00 C ATOM 1513 CD ARG B 80 -7.493 -18.264 -12.755 1.00 0.00 C ATOM 1514 NE ARG B 80 -8.105 -19.461 -13.395 1.00 0.00 N ATOM 1515 CZ ARG B 80 -7.366 -20.496 -13.688 1.00 0.00 C ATOM 1516 NH1 ARG B 80 -6.088 -20.485 -13.420 1.00 0.00 N ATOM 1517 NH2 ARG B 80 -7.904 -21.545 -14.249 1.00 0.00 N ATOM 0 H ARG B 80 -9.519 -15.876 -9.581 1.00 0.00 H new ATOM 0 HA ARG B 80 -10.093 -15.237 -12.483 1.00 0.00 H new ATOM 0 HB2 ARG B 80 -9.023 -17.493 -10.837 1.00 0.00 H new ATOM 0 HB3 ARG B 80 -10.279 -17.993 -11.952 1.00 0.00 H new ATOM 0 HG2 ARG B 80 -9.057 -17.267 -13.867 1.00 0.00 H new ATOM 0 HG3 ARG B 80 -8.047 -16.181 -12.933 1.00 0.00 H new ATOM 0 HD2 ARG B 80 -6.553 -17.995 -13.237 1.00 0.00 H new ATOM 0 HD3 ARG B 80 -7.271 -18.448 -11.704 1.00 0.00 H new ATOM 0 HE ARG B 80 -9.103 -19.472 -13.605 1.00 0.00 H new ATOM 0 HH11 ARG B 80 -5.666 -19.667 -12.981 1.00 0.00 H new ATOM 0 HH12 ARG B 80 -5.512 -21.295 -13.650 1.00 0.00 H new ATOM 0 HH21 ARG B 80 -8.902 -21.556 -14.458 1.00 0.00 H new ATOM 0 HH22 ARG B 80 -7.326 -22.354 -14.478 1.00 0.00 H new ATOM 1599 N GLU B 86 -8.677 -9.993 -12.808 1.00 0.00 N ATOM 1600 CA GLU B 86 -8.703 -8.526 -12.539 1.00 0.00 C ATOM 1601 C GLU B 86 -7.329 -8.050 -12.057 1.00 0.00 C ATOM 1602 O GLU B 86 -6.948 -6.915 -12.266 1.00 0.00 O ATOM 1603 CB GLU B 86 -9.751 -8.338 -11.442 1.00 0.00 C ATOM 1604 CG GLU B 86 -9.573 -9.418 -10.373 1.00 0.00 C ATOM 1605 CD GLU B 86 -9.923 -8.840 -9.000 1.00 0.00 C ATOM 1606 OE1 GLU B 86 -9.157 -8.028 -8.507 1.00 0.00 O ATOM 1607 OE2 GLU B 86 -10.951 -9.220 -8.464 1.00 0.00 O ATOM 0 HA GLU B 86 -8.943 -7.949 -13.432 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -9.651 -7.349 -10.995 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -10.753 -8.395 -11.868 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -10.213 -10.272 -10.594 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -8.545 -9.781 -10.375 1.00 0.00 H new ATOM 1614 N ALA B 87 -6.578 -8.908 -11.417 1.00 0.00 N ATOM 1615 CA ALA B 87 -5.230 -8.493 -10.930 1.00 0.00 C ATOM 1616 C ALA B 87 -4.134 -9.255 -11.685 1.00 0.00 C ATOM 1617 O ALA B 87 -4.241 -9.490 -12.872 1.00 0.00 O ATOM 1618 CB ALA B 87 -5.214 -8.842 -9.440 1.00 0.00 C ATOM 0 H ALA B 87 -6.838 -9.873 -11.212 1.00 0.00 H new ATOM 0 HA ALA B 87 -5.041 -7.432 -11.094 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -4.251 -8.565 -9.012 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -6.008 -8.297 -8.930 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -5.371 -9.913 -9.316 1.00 0.00 H new ATOM 1624 N LEU B 88 -3.070 -9.615 -11.009 1.00 0.00 N ATOM 1625 CA LEU B 88 -1.945 -10.337 -11.679 1.00 0.00 C ATOM 1626 C LEU B 88 -1.021 -9.307 -12.319 1.00 0.00 C ATOM 1627 O LEU B 88 0.070 -9.611 -12.758 1.00 0.00 O ATOM 1628 CB LEU B 88 -2.577 -11.242 -12.739 1.00 0.00 C ATOM 1629 CG LEU B 88 -1.708 -12.488 -12.927 1.00 0.00 C ATOM 1630 CD1 LEU B 88 -0.239 -12.077 -13.039 1.00 0.00 C ATOM 1631 CD2 LEU B 88 -1.875 -13.413 -11.721 1.00 0.00 C ATOM 0 H LEU B 88 -2.933 -9.438 -10.014 1.00 0.00 H new ATOM 0 HA LEU B 88 -1.357 -10.933 -10.981 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.583 -11.530 -12.434 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -2.671 -10.705 -13.683 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.015 -13.006 -13.836 1.00 0.00 H new ATOM 0 HD11 LEU B 88 0.378 -12.965 -13.173 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.111 -11.414 -13.895 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.064 -11.558 -12.129 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -1.256 -14.300 -11.855 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -1.568 -12.889 -10.816 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -2.920 -13.709 -11.632 1.00 0.00 H new ATOM 1643 N CYS B 89 -1.443 -8.076 -12.337 1.00 0.00 N ATOM 1644 CA CYS B 89 -0.599 -7.004 -12.896 1.00 0.00 C ATOM 1645 C CYS B 89 -0.364 -6.008 -11.776 1.00 0.00 C ATOM 1646 O CYS B 89 -1.272 -5.334 -11.333 1.00 0.00 O ATOM 1647 CB CYS B 89 -1.416 -6.380 -14.027 1.00 0.00 C ATOM 1648 SG CYS B 89 -2.151 -7.690 -15.039 1.00 0.00 S ATOM 0 H CYS B 89 -2.349 -7.770 -11.982 1.00 0.00 H new ATOM 0 HA CYS B 89 0.363 -7.345 -13.277 1.00 0.00 H new ATOM 0 HB2 CYS B 89 -2.198 -5.742 -13.615 1.00 0.00 H new ATOM 0 HB3 CYS B 89 -0.778 -5.745 -14.643 1.00 0.00 H new ATOM 0 HG CYS B 89 -2.961 -8.399 -14.310 1.00 0.00 H new ATOM 1654 N ILE B 90 0.824 -5.937 -11.281 1.00 0.00 N ATOM 1655 CA ILE B 90 1.072 -5.012 -10.154 1.00 0.00 C ATOM 1656 C ILE B 90 1.485 -3.645 -10.673 1.00 0.00 C ATOM 1657 O ILE B 90 2.576 -3.451 -11.172 1.00 0.00 O ATOM 1658 CB ILE B 90 2.213 -5.652 -9.367 1.00 0.00 C ATOM 1659 CG1 ILE B 90 1.733 -6.970 -8.753 1.00 0.00 C ATOM 1660 CG2 ILE B 90 2.660 -4.704 -8.256 1.00 0.00 C ATOM 1661 CD1 ILE B 90 0.359 -6.768 -8.112 1.00 0.00 C ATOM 0 H ILE B 90 1.631 -6.472 -11.601 1.00 0.00 H new ATOM 0 HA ILE B 90 0.184 -4.861 -9.541 1.00 0.00 H new ATOM 0 HB ILE B 90 3.051 -5.847 -10.036 1.00 0.00 H new ATOM 0 HG12 ILE B 90 1.677 -7.741 -9.521 1.00 0.00 H new ATOM 0 HG13 ILE B 90 2.447 -7.316 -8.005 1.00 0.00 H new ATOM 0 HG21 ILE B 90 3.475 -5.161 -7.694 1.00 0.00 H new ATOM 0 HG22 ILE B 90 3.002 -3.766 -8.694 1.00 0.00 H new ATOM 0 HG23 ILE B 90 1.823 -4.508 -7.586 1.00 0.00 H new ATOM 0 HD11 ILE B 90 0.019 -7.707 -7.676 1.00 0.00 H new ATOM 0 HD12 ILE B 90 0.429 -6.010 -7.332 1.00 0.00 H new ATOM 0 HD13 ILE B 90 -0.352 -6.442 -8.871 1.00 0.00 H new ATOM 1673 N GLU B 91 0.607 -2.695 -10.548 1.00 0.00 N ATOM 1674 CA GLU B 91 0.924 -1.318 -11.022 1.00 0.00 C ATOM 1675 C GLU B 91 1.869 -0.639 -10.028 1.00 0.00 C ATOM 1676 O GLU B 91 1.487 -0.332 -8.916 1.00 0.00 O ATOM 1677 CB GLU B 91 -0.422 -0.594 -11.067 1.00 0.00 C ATOM 1678 CG GLU B 91 -0.676 -0.074 -12.483 1.00 0.00 C ATOM 1679 CD GLU B 91 -0.446 -1.201 -13.491 1.00 0.00 C ATOM 1680 OE1 GLU B 91 -0.255 -2.326 -13.059 1.00 0.00 O ATOM 1681 OE2 GLU B 91 -0.467 -0.922 -14.679 1.00 0.00 O ATOM 0 H GLU B 91 -0.320 -2.810 -10.137 1.00 0.00 H new ATOM 0 HA GLU B 91 1.417 -1.311 -11.994 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -1.222 -1.272 -10.769 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -0.425 0.234 -10.358 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -1.696 0.300 -12.567 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -0.011 0.762 -12.699 1.00 0.00 H new ATOM 1688 N PRO B 92 3.084 -0.438 -10.463 1.00 0.00 N ATOM 1689 CA PRO B 92 4.109 0.199 -9.601 1.00 0.00 C ATOM 1690 C PRO B 92 3.803 1.686 -9.404 1.00 0.00 C ATOM 1691 O PRO B 92 3.065 2.284 -10.161 1.00 0.00 O ATOM 1692 CB PRO B 92 5.405 0.008 -10.385 1.00 0.00 C ATOM 1693 CG PRO B 92 4.975 -0.138 -11.809 1.00 0.00 C ATOM 1694 CD PRO B 92 3.611 -0.777 -11.790 1.00 0.00 C ATOM 0 HA PRO B 92 4.153 -0.232 -8.601 1.00 0.00 H new ATOM 0 HB2 PRO B 92 6.072 0.861 -10.259 1.00 0.00 H new ATOM 0 HB3 PRO B 92 5.947 -0.874 -10.044 1.00 0.00 H new ATOM 0 HG2 PRO B 92 4.940 0.833 -12.303 1.00 0.00 H new ATOM 0 HG3 PRO B 92 5.682 -0.753 -12.365 1.00 0.00 H new ATOM 0 HD2 PRO B 92 2.975 -0.387 -12.585 1.00 0.00 H new ATOM 0 HD3 PRO B 92 3.673 -1.856 -11.932 1.00 0.00 H new ATOM 1702 N PHE B 93 4.365 2.282 -8.389 1.00 0.00 N ATOM 1703 CA PHE B 93 4.108 3.731 -8.137 1.00 0.00 C ATOM 1704 C PHE B 93 4.527 4.564 -9.355 1.00 0.00 C ATOM 1705 O PHE B 93 4.050 4.356 -10.453 1.00 0.00 O ATOM 1706 CB PHE B 93 4.968 4.080 -6.921 1.00 0.00 C ATOM 1707 CG PHE B 93 4.791 3.026 -5.856 1.00 0.00 C ATOM 1708 CD1 PHE B 93 3.545 2.412 -5.678 1.00 0.00 C ATOM 1709 CD2 PHE B 93 5.872 2.661 -5.045 1.00 0.00 C ATOM 1710 CE1 PHE B 93 3.381 1.434 -4.689 1.00 0.00 C ATOM 1711 CE2 PHE B 93 5.709 1.683 -4.058 1.00 0.00 C ATOM 1712 CZ PHE B 93 4.463 1.069 -3.880 1.00 0.00 C ATOM 0 H PHE B 93 4.991 1.830 -7.723 1.00 0.00 H new ATOM 0 HA PHE B 93 3.053 3.940 -7.961 1.00 0.00 H new ATOM 0 HB2 PHE B 93 6.017 4.145 -7.211 1.00 0.00 H new ATOM 0 HB3 PHE B 93 4.684 5.057 -6.530 1.00 0.00 H new ATOM 0 HD1 PHE B 93 2.710 2.693 -6.303 1.00 0.00 H new ATOM 0 HD2 PHE B 93 6.833 3.135 -5.181 1.00 0.00 H new ATOM 0 HE1 PHE B 93 2.420 0.962 -4.551 1.00 0.00 H new ATOM 0 HE2 PHE B 93 6.544 1.402 -3.433 1.00 0.00 H new ATOM 0 HZ PHE B 93 4.337 0.314 -3.118 1.00 0.00 H new ATOM 2071 N MET C 17 -4.841 -5.095 14.765 1.00 0.00 N ATOM 2072 CA MET C 17 -5.678 -4.107 14.028 1.00 0.00 C ATOM 2073 C MET C 17 -4.962 -3.668 12.748 1.00 0.00 C ATOM 2074 O MET C 17 -3.763 -3.815 12.619 1.00 0.00 O ATOM 2075 CB MET C 17 -5.839 -2.927 14.986 1.00 0.00 C ATOM 2076 CG MET C 17 -7.136 -3.090 15.784 1.00 0.00 C ATOM 2077 SD MET C 17 -8.553 -2.903 14.674 1.00 0.00 S ATOM 2078 CE MET C 17 -9.734 -3.865 15.650 1.00 0.00 C ATOM 0 HA MET C 17 -6.642 -4.520 13.730 1.00 0.00 H new ATOM 0 HB2 MET C 17 -4.987 -2.876 15.664 1.00 0.00 H new ATOM 0 HB3 MET C 17 -5.858 -1.991 14.427 1.00 0.00 H new ATOM 0 HG2 MET C 17 -7.161 -4.069 16.262 1.00 0.00 H new ATOM 0 HG3 MET C 17 -7.182 -2.346 16.579 1.00 0.00 H new ATOM 0 HE1 MET C 17 -10.698 -3.882 15.141 1.00 0.00 H new ATOM 0 HE2 MET C 17 -9.366 -4.884 15.765 1.00 0.00 H new ATOM 0 HE3 MET C 17 -9.851 -3.408 16.633 1.00 0.00 H new ATOM 2088 N TYR C 18 -5.682 -3.135 11.799 1.00 0.00 N ATOM 2089 CA TYR C 18 -5.031 -2.696 10.532 1.00 0.00 C ATOM 2090 C TYR C 18 -5.570 -1.332 10.095 1.00 0.00 C ATOM 2091 O TYR C 18 -6.704 -0.985 10.361 1.00 0.00 O ATOM 2092 CB TYR C 18 -5.398 -3.771 9.508 1.00 0.00 C ATOM 2093 CG TYR C 18 -4.203 -4.663 9.265 1.00 0.00 C ATOM 2094 CD1 TYR C 18 -3.819 -5.594 10.237 1.00 0.00 C ATOM 2095 CD2 TYR C 18 -3.481 -4.557 8.071 1.00 0.00 C ATOM 2096 CE1 TYR C 18 -2.710 -6.422 10.013 1.00 0.00 C ATOM 2097 CE2 TYR C 18 -2.374 -5.385 7.848 1.00 0.00 C ATOM 2098 CZ TYR C 18 -1.989 -6.316 8.819 1.00 0.00 C ATOM 2099 OH TYR C 18 -0.898 -7.132 8.598 1.00 0.00 O ATOM 0 H TYR C 18 -6.690 -2.985 11.846 1.00 0.00 H new ATOM 0 HA TYR C 18 -3.952 -2.585 10.642 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -6.239 -4.362 9.871 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -5.714 -3.306 8.574 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -4.376 -5.674 11.159 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -3.777 -3.837 7.322 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -2.413 -7.141 10.762 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -1.817 -5.305 6.926 1.00 0.00 H new ATOM 0 HH TYR C 18 -0.362 -6.769 7.862 1.00 0.00 H new ATOM 2109 N VAL C 19 -4.765 -0.559 9.420 1.00 0.00 N ATOM 2110 CA VAL C 19 -5.226 0.783 8.958 1.00 0.00 C ATOM 2111 C VAL C 19 -4.835 0.995 7.493 1.00 0.00 C ATOM 2112 O VAL C 19 -3.818 0.511 7.037 1.00 0.00 O ATOM 2113 CB VAL C 19 -4.503 1.785 9.859 1.00 0.00 C ATOM 2114 CG1 VAL C 19 -2.993 1.676 9.640 1.00 0.00 C ATOM 2115 CG2 VAL C 19 -4.966 3.203 9.515 1.00 0.00 C ATOM 0 H VAL C 19 -3.806 -0.798 9.167 1.00 0.00 H new ATOM 0 HA VAL C 19 -6.309 0.893 9.019 1.00 0.00 H new ATOM 0 HB VAL C 19 -4.734 1.567 10.902 1.00 0.00 H new ATOM 0 HG11 VAL C 19 -2.480 2.391 10.283 1.00 0.00 H new ATOM 0 HG12 VAL C 19 -2.662 0.666 9.883 1.00 0.00 H new ATOM 0 HG13 VAL C 19 -2.760 1.893 8.598 1.00 0.00 H new ATOM 0 HG21 VAL C 19 -4.452 3.919 10.156 1.00 0.00 H new ATOM 0 HG22 VAL C 19 -4.735 3.418 8.472 1.00 0.00 H new ATOM 0 HG23 VAL C 19 -6.042 3.283 9.672 1.00 0.00 H new ATOM 2125 N LYS C 20 -5.637 1.708 6.749 1.00 0.00 N ATOM 2126 CA LYS C 20 -5.317 1.942 5.319 1.00 0.00 C ATOM 2127 C LYS C 20 -4.787 3.364 5.116 1.00 0.00 C ATOM 2128 O LYS C 20 -5.295 4.313 5.677 1.00 0.00 O ATOM 2129 CB LYS C 20 -6.647 1.758 4.588 1.00 0.00 C ATOM 2130 CG LYS C 20 -7.807 2.253 5.457 1.00 0.00 C ATOM 2131 CD LYS C 20 -9.066 2.387 4.598 1.00 0.00 C ATOM 2132 CE LYS C 20 -10.236 1.685 5.293 1.00 0.00 C ATOM 2133 NZ LYS C 20 -11.242 1.461 4.218 1.00 0.00 N ATOM 0 H LYS C 20 -6.502 2.138 7.075 1.00 0.00 H new ATOM 0 HA LYS C 20 -4.547 1.264 4.951 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -6.630 2.306 3.646 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -6.792 0.706 4.342 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -7.985 1.556 6.276 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -7.555 3.214 5.905 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -9.301 3.440 4.441 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -8.897 1.948 3.615 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -9.921 0.743 5.742 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -10.645 2.299 6.095 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -12.075 0.983 4.616 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -11.528 2.376 3.814 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -10.826 0.868 3.472 1.00 0.00 H new ATOM 2147 N LEU C 21 -3.770 3.517 4.311 1.00 0.00 N ATOM 2148 CA LEU C 21 -3.212 4.877 4.066 1.00 0.00 C ATOM 2149 C LEU C 21 -3.373 5.237 2.586 1.00 0.00 C ATOM 2150 O LEU C 21 -3.014 4.475 1.712 1.00 0.00 O ATOM 2151 CB LEU C 21 -1.726 4.793 4.439 1.00 0.00 C ATOM 2152 CG LEU C 21 -1.489 3.649 5.432 1.00 0.00 C ATOM 2153 CD1 LEU C 21 0.000 3.562 5.765 1.00 0.00 C ATOM 2154 CD2 LEU C 21 -2.276 3.909 6.717 1.00 0.00 C ATOM 0 H LEU C 21 -3.302 2.759 3.813 1.00 0.00 H new ATOM 0 HA LEU C 21 -3.723 5.642 4.650 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -1.128 4.634 3.542 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -1.400 5.737 4.877 1.00 0.00 H new ATOM 0 HG LEU C 21 -1.822 2.712 4.984 1.00 0.00 H new ATOM 0 HD11 LEU C 21 0.168 2.749 6.471 1.00 0.00 H new ATOM 0 HD12 LEU C 21 0.566 3.374 4.853 1.00 0.00 H new ATOM 0 HD13 LEU C 21 0.329 4.502 6.209 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -2.105 3.094 7.420 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -1.946 4.847 7.162 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -3.339 3.972 6.486 1.00 0.00 H new ATOM 2166 N ILE C 22 -3.914 6.389 2.297 1.00 0.00 N ATOM 2167 CA ILE C 22 -4.100 6.786 0.877 1.00 0.00 C ATOM 2168 C ILE C 22 -3.142 7.923 0.519 1.00 0.00 C ATOM 2169 O ILE C 22 -2.888 8.811 1.309 1.00 0.00 O ATOM 2170 CB ILE C 22 -5.553 7.252 0.787 1.00 0.00 C ATOM 2171 CG1 ILE C 22 -6.459 6.051 0.508 1.00 0.00 C ATOM 2172 CG2 ILE C 22 -5.699 8.273 -0.343 1.00 0.00 C ATOM 2173 CD1 ILE C 22 -6.365 5.060 1.669 1.00 0.00 C ATOM 0 H ILE C 22 -4.235 7.071 2.985 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.892 5.970 0.185 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.841 7.715 1.731 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -7.490 6.382 0.381 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -6.162 5.567 -0.422 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -6.736 8.603 -0.404 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -5.057 9.131 -0.144 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -5.408 7.814 -1.288 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -7.010 4.204 1.470 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.335 4.720 1.775 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -6.683 5.548 2.590 1.00 0.00 H new ATOM 2185 N SER C 23 -2.613 7.899 -0.668 1.00 0.00 N ATOM 2186 CA SER C 23 -1.669 8.972 -1.093 1.00 0.00 C ATOM 2187 C SER C 23 -2.271 9.772 -2.251 1.00 0.00 C ATOM 2188 O SER C 23 -3.079 9.275 -3.010 1.00 0.00 O ATOM 2189 CB SER C 23 -0.409 8.236 -1.546 1.00 0.00 C ATOM 2190 OG SER C 23 -0.408 6.925 -0.996 1.00 0.00 O ATOM 0 H SER C 23 -2.793 7.180 -1.368 1.00 0.00 H new ATOM 0 HA SER C 23 -1.458 9.680 -0.292 1.00 0.00 H new ATOM 0 HB2 SER C 23 -0.374 8.186 -2.634 1.00 0.00 H new ATOM 0 HB3 SER C 23 0.479 8.779 -1.223 1.00 0.00 H new ATOM 0 HG SER C 23 0.398 6.449 -1.286 1.00 0.00 H new ATOM 2196 N SER C 24 -1.885 11.012 -2.392 1.00 0.00 N ATOM 2197 CA SER C 24 -2.436 11.844 -3.499 1.00 0.00 C ATOM 2198 C SER C 24 -2.209 11.158 -4.849 1.00 0.00 C ATOM 2199 O SER C 24 -2.815 11.506 -5.842 1.00 0.00 O ATOM 2200 CB SER C 24 -1.660 13.159 -3.429 1.00 0.00 C ATOM 2201 OG SER C 24 -2.539 14.202 -3.030 1.00 0.00 O ATOM 0 H SER C 24 -1.212 11.484 -1.788 1.00 0.00 H new ATOM 0 HA SER C 24 -3.511 11.997 -3.401 1.00 0.00 H new ATOM 0 HB2 SER C 24 -0.836 13.071 -2.721 1.00 0.00 H new ATOM 0 HB3 SER C 24 -1.222 13.388 -4.400 1.00 0.00 H new ATOM 0 HG SER C 24 -2.044 15.047 -2.982 1.00 0.00 H new ATOM 2207 N ASP C 25 -1.338 10.187 -4.896 1.00 0.00 N ATOM 2208 CA ASP C 25 -1.075 9.483 -6.184 1.00 0.00 C ATOM 2209 C ASP C 25 -2.314 8.697 -6.619 1.00 0.00 C ATOM 2210 O ASP C 25 -2.533 8.463 -7.790 1.00 0.00 O ATOM 2211 CB ASP C 25 0.087 8.534 -5.889 1.00 0.00 C ATOM 2212 CG ASP C 25 0.758 8.126 -7.202 1.00 0.00 C ATOM 2213 OD1 ASP C 25 0.519 8.789 -8.198 1.00 0.00 O ATOM 2214 OD2 ASP C 25 1.499 7.158 -7.189 1.00 0.00 O ATOM 0 H ASP C 25 -0.797 9.851 -4.099 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.839 10.176 -6.992 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.810 9.020 -5.234 1.00 0.00 H new ATOM 0 HB3 ASP C 25 -0.275 7.650 -5.363 1.00 0.00 H new ATOM 2219 N GLY C 26 -3.126 8.286 -5.683 1.00 0.00 N ATOM 2220 CA GLY C 26 -4.350 7.516 -6.044 1.00 0.00 C ATOM 2221 C GLY C 26 -4.217 6.078 -5.537 1.00 0.00 C ATOM 2222 O GLY C 26 -5.166 5.320 -5.534 1.00 0.00 O ATOM 0 H GLY C 26 -2.995 8.450 -4.685 1.00 0.00 H new ATOM 0 HA2 GLY C 26 -5.231 7.987 -5.607 1.00 0.00 H new ATOM 0 HA3 GLY C 26 -4.489 7.520 -7.125 1.00 0.00 H new ATOM 2226 N HIS C 27 -3.045 5.696 -5.108 1.00 0.00 N ATOM 2227 CA HIS C 27 -2.853 4.307 -4.601 1.00 0.00 C ATOM 2228 C HIS C 27 -3.179 4.243 -3.106 1.00 0.00 C ATOM 2229 O HIS C 27 -3.497 5.240 -2.489 1.00 0.00 O ATOM 2230 CB HIS C 27 -1.376 3.996 -4.843 1.00 0.00 C ATOM 2231 CG HIS C 27 -1.007 4.383 -6.248 1.00 0.00 C ATOM 2232 ND1 HIS C 27 -1.770 4.731 -7.334 1.00 0.00 N flip ATOM 2233 CD2 HIS C 27 0.310 4.445 -6.675 1.00 0.00 C flip ATOM 2234 CE1 HIS C 27 -0.943 5.006 -8.420 1.00 0.00 C flip ATOM 2235 NE2 HIS C 27 0.300 4.818 -7.968 1.00 0.00 N flip ATOM 0 H HIS C 27 -2.213 6.285 -5.087 1.00 0.00 H new ATOM 0 HA HIS C 27 -3.505 3.590 -5.100 1.00 0.00 H new ATOM 0 HB2 HIS C 27 -0.757 4.540 -4.130 1.00 0.00 H new ATOM 0 HB3 HIS C 27 -1.186 2.934 -4.685 1.00 0.00 H new ATOM 0 HD2 HIS C 27 1.185 4.233 -6.079 1.00 0.00 H new ATOM 0 HE1 HIS C 27 -1.242 5.306 -9.413 1.00 0.00 H new ATOM 0 HE2 HIS C 27 1.139 4.942 -8.534 1.00 0.00 H new ATOM 2243 N GLU C 28 -3.101 3.079 -2.520 1.00 0.00 N ATOM 2244 CA GLU C 28 -3.406 2.960 -1.066 1.00 0.00 C ATOM 2245 C GLU C 28 -2.540 1.877 -0.426 1.00 0.00 C ATOM 2246 O GLU C 28 -2.043 0.984 -1.083 1.00 0.00 O ATOM 2247 CB GLU C 28 -4.883 2.573 -0.994 1.00 0.00 C ATOM 2248 CG GLU C 28 -5.200 2.018 0.396 1.00 0.00 C ATOM 2249 CD GLU C 28 -6.715 1.877 0.556 1.00 0.00 C ATOM 2250 OE1 GLU C 28 -7.429 2.664 -0.042 1.00 0.00 O ATOM 2251 OE2 GLU C 28 -7.133 0.985 1.274 1.00 0.00 O ATOM 0 H GLU C 28 -2.840 2.209 -2.983 1.00 0.00 H new ATOM 0 HA GLU C 28 -3.202 3.887 -0.531 1.00 0.00 H new ATOM 0 HB2 GLU C 28 -5.508 3.442 -1.201 1.00 0.00 H new ATOM 0 HB3 GLU C 28 -5.112 1.827 -1.755 1.00 0.00 H new ATOM 0 HG2 GLU C 28 -4.718 1.050 0.531 1.00 0.00 H new ATOM 0 HG3 GLU C 28 -4.803 2.682 1.164 1.00 0.00 H new ATOM 2258 N PHE C 29 -2.365 1.955 0.860 1.00 0.00 N ATOM 2259 CA PHE C 29 -1.538 0.943 1.577 1.00 0.00 C ATOM 2260 C PHE C 29 -2.163 0.647 2.938 1.00 0.00 C ATOM 2261 O PHE C 29 -2.594 1.539 3.636 1.00 0.00 O ATOM 2262 CB PHE C 29 -0.168 1.600 1.750 1.00 0.00 C ATOM 2263 CG PHE C 29 0.803 1.017 0.752 1.00 0.00 C ATOM 2264 CD1 PHE C 29 1.408 -0.220 1.006 1.00 0.00 C ATOM 2265 CD2 PHE C 29 1.099 1.713 -0.426 1.00 0.00 C ATOM 2266 CE1 PHE C 29 2.309 -0.760 0.081 1.00 0.00 C ATOM 2267 CE2 PHE C 29 2.001 1.173 -1.350 1.00 0.00 C ATOM 2268 CZ PHE C 29 2.606 -0.065 -1.097 1.00 0.00 C ATOM 0 H PHE C 29 -2.762 2.683 1.454 1.00 0.00 H new ATOM 0 HA PHE C 29 -1.468 -0.001 1.037 1.00 0.00 H new ATOM 0 HB2 PHE C 29 -0.249 2.677 1.607 1.00 0.00 H new ATOM 0 HB3 PHE C 29 0.198 1.440 2.764 1.00 0.00 H new ATOM 0 HD1 PHE C 29 1.180 -0.757 1.915 1.00 0.00 H new ATOM 0 HD2 PHE C 29 0.631 2.667 -0.622 1.00 0.00 H new ATOM 0 HE1 PHE C 29 2.776 -1.714 0.276 1.00 0.00 H new ATOM 0 HE2 PHE C 29 2.231 1.711 -2.258 1.00 0.00 H new ATOM 0 HZ PHE C 29 3.301 -0.483 -1.810 1.00 0.00 H new ATOM 2278 N ILE C 30 -2.221 -0.594 3.323 1.00 0.00 N ATOM 2279 CA ILE C 30 -2.824 -0.922 4.646 1.00 0.00 C ATOM 2280 C ILE C 30 -1.739 -1.355 5.631 1.00 0.00 C ATOM 2281 O ILE C 30 -1.010 -2.299 5.396 1.00 0.00 O ATOM 2282 CB ILE C 30 -3.788 -2.074 4.374 1.00 0.00 C ATOM 2283 CG1 ILE C 30 -4.572 -1.797 3.085 1.00 0.00 C ATOM 2284 CG2 ILE C 30 -4.765 -2.207 5.543 1.00 0.00 C ATOM 2285 CD1 ILE C 30 -3.841 -2.417 1.892 1.00 0.00 C ATOM 0 H ILE C 30 -1.881 -1.392 2.786 1.00 0.00 H new ATOM 0 HA ILE C 30 -3.331 -0.064 5.088 1.00 0.00 H new ATOM 0 HB ILE C 30 -3.223 -2.999 4.262 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -5.577 -2.212 3.163 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -4.681 -0.722 2.938 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -5.454 -3.029 5.350 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -4.210 -2.406 6.460 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -5.328 -1.280 5.654 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -4.401 -2.218 0.978 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -2.845 -1.982 1.809 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -3.755 -3.494 2.038 1.00 0.00 H new ATOM 2297 N VAL C 31 -1.629 -0.673 6.738 1.00 0.00 N ATOM 2298 CA VAL C 31 -0.595 -1.048 7.743 1.00 0.00 C ATOM 2299 C VAL C 31 -1.262 -1.371 9.083 1.00 0.00 C ATOM 2300 O VAL C 31 -2.361 -0.931 9.362 1.00 0.00 O ATOM 2301 CB VAL C 31 0.310 0.180 7.864 1.00 0.00 C ATOM 2302 CG1 VAL C 31 0.668 0.688 6.467 1.00 0.00 C ATOM 2303 CG2 VAL C 31 -0.421 1.282 8.634 1.00 0.00 C ATOM 0 H VAL C 31 -2.210 0.127 6.990 1.00 0.00 H new ATOM 0 HA VAL C 31 -0.030 -1.933 7.450 1.00 0.00 H new ATOM 0 HB VAL C 31 1.220 -0.092 8.398 1.00 0.00 H new ATOM 0 HG11 VAL C 31 1.313 1.563 6.552 1.00 0.00 H new ATOM 0 HG12 VAL C 31 1.190 -0.095 5.918 1.00 0.00 H new ATOM 0 HG13 VAL C 31 -0.243 0.959 5.934 1.00 0.00 H new ATOM 0 HG21 VAL C 31 0.225 2.156 8.719 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -1.332 1.555 8.102 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -0.677 0.921 9.630 1.00 0.00 H new ATOM 2313 N LYS C 32 -0.615 -2.148 9.908 1.00 0.00 N ATOM 2314 CA LYS C 32 -1.218 -2.515 11.223 1.00 0.00 C ATOM 2315 C LYS C 32 -1.325 -1.288 12.130 1.00 0.00 C ATOM 2316 O LYS C 32 -0.497 -0.399 12.088 1.00 0.00 O ATOM 2317 CB LYS C 32 -0.257 -3.542 11.824 1.00 0.00 C ATOM 2318 CG LYS C 32 -0.960 -4.304 12.948 1.00 0.00 C ATOM 2319 CD LYS C 32 0.084 -4.847 13.927 1.00 0.00 C ATOM 2320 CE LYS C 32 0.201 -6.363 13.762 1.00 0.00 C ATOM 2321 NZ LYS C 32 1.325 -6.559 12.805 1.00 0.00 N ATOM 0 H LYS C 32 0.307 -2.546 9.729 1.00 0.00 H new ATOM 0 HA LYS C 32 -2.228 -2.910 11.113 1.00 0.00 H new ATOM 0 HB2 LYS C 32 0.078 -4.237 11.054 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.631 -3.042 12.210 1.00 0.00 H new ATOM 0 HG2 LYS C 32 -1.655 -3.645 13.469 1.00 0.00 H new ATOM 0 HG3 LYS C 32 -1.547 -5.124 12.534 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.049 -4.375 13.744 1.00 0.00 H new ATOM 0 HD3 LYS C 32 -0.201 -4.603 14.951 1.00 0.00 H new ATOM 0 HE2 LYS C 32 0.405 -6.850 14.716 1.00 0.00 H new ATOM 0 HE3 LYS C 32 -0.725 -6.791 13.377 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 1.467 -7.576 12.640 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.100 -6.091 11.904 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 2.194 -6.147 13.201 1.00 0.00 H new ATOM 2335 N ARG C 33 -2.338 -1.238 12.954 1.00 0.00 N ATOM 2336 CA ARG C 33 -2.497 -0.073 13.872 1.00 0.00 C ATOM 2337 C ARG C 33 -1.132 0.339 14.429 1.00 0.00 C ATOM 2338 O ARG C 33 -0.753 1.492 14.382 1.00 0.00 O ATOM 2339 CB ARG C 33 -3.407 -0.574 14.994 1.00 0.00 C ATOM 2340 CG ARG C 33 -3.655 0.555 15.997 1.00 0.00 C ATOM 2341 CD ARG C 33 -4.757 1.476 15.469 1.00 0.00 C ATOM 2342 NE ARG C 33 -5.279 2.178 16.673 1.00 0.00 N ATOM 2343 CZ ARG C 33 -6.017 1.536 17.537 1.00 0.00 C ATOM 2344 NH1 ARG C 33 -6.300 0.276 17.347 1.00 0.00 N ATOM 2345 NH2 ARG C 33 -6.473 2.155 18.592 1.00 0.00 N ATOM 0 H ARG C 33 -3.061 -1.953 13.031 1.00 0.00 H new ATOM 0 HA ARG C 33 -2.916 0.800 13.371 1.00 0.00 H new ATOM 0 HB2 ARG C 33 -4.354 -0.921 14.580 1.00 0.00 H new ATOM 0 HB3 ARG C 33 -2.947 -1.425 15.496 1.00 0.00 H new ATOM 0 HG2 ARG C 33 -3.945 0.140 16.963 1.00 0.00 H new ATOM 0 HG3 ARG C 33 -2.738 1.122 16.156 1.00 0.00 H new ATOM 0 HD2 ARG C 33 -4.364 2.183 14.738 1.00 0.00 H new ATOM 0 HD3 ARG C 33 -5.543 0.907 14.972 1.00 0.00 H new ATOM 0 HE ARG C 33 -5.060 3.163 16.823 1.00 0.00 H new ATOM 0 HH11 ARG C 33 -5.944 -0.208 16.523 1.00 0.00 H new ATOM 0 HH12 ARG C 33 -6.877 -0.225 18.023 1.00 0.00 H new ATOM 0 HH21 ARG C 33 -6.252 3.140 18.741 1.00 0.00 H new ATOM 0 HH22 ARG C 33 -7.050 1.654 19.268 1.00 0.00 H new ATOM 2359 N GLU C 34 -0.387 -0.600 14.944 1.00 0.00 N ATOM 2360 CA GLU C 34 0.958 -0.268 15.491 1.00 0.00 C ATOM 2361 C GLU C 34 1.828 0.315 14.377 1.00 0.00 C ATOM 2362 O GLU C 34 2.515 1.300 14.562 1.00 0.00 O ATOM 2363 CB GLU C 34 1.531 -1.597 15.982 1.00 0.00 C ATOM 2364 CG GLU C 34 0.580 -2.216 17.007 1.00 0.00 C ATOM 2365 CD GLU C 34 1.289 -2.334 18.358 1.00 0.00 C ATOM 2366 OE1 GLU C 34 2.312 -1.689 18.526 1.00 0.00 O ATOM 2367 OE2 GLU C 34 0.798 -3.067 19.201 1.00 0.00 O ATOM 0 H GLU C 34 -0.652 -1.583 15.010 1.00 0.00 H new ATOM 0 HA GLU C 34 0.916 0.469 16.293 1.00 0.00 H new ATOM 0 HB2 GLU C 34 1.670 -2.278 15.142 1.00 0.00 H new ATOM 0 HB3 GLU C 34 2.512 -1.439 16.430 1.00 0.00 H new ATOM 0 HG2 GLU C 34 -0.314 -1.601 17.107 1.00 0.00 H new ATOM 0 HG3 GLU C 34 0.254 -3.200 16.669 1.00 0.00 H new ATOM 2374 N HIS C 35 1.792 -0.280 13.216 1.00 0.00 N ATOM 2375 CA HIS C 35 2.602 0.247 12.087 1.00 0.00 C ATOM 2376 C HIS C 35 2.246 1.716 11.855 1.00 0.00 C ATOM 2377 O HIS C 35 3.099 2.544 11.619 1.00 0.00 O ATOM 2378 CB HIS C 35 2.195 -0.605 10.886 1.00 0.00 C ATOM 2379 CG HIS C 35 3.265 -1.626 10.607 1.00 0.00 C ATOM 2380 ND1 HIS C 35 3.096 -2.636 9.674 1.00 0.00 N ATOM 2381 CD2 HIS C 35 4.520 -1.807 11.133 1.00 0.00 C ATOM 2382 CE1 HIS C 35 4.221 -3.375 9.668 1.00 0.00 C ATOM 2383 NE2 HIS C 35 5.122 -2.912 10.539 1.00 0.00 N ATOM 0 H HIS C 35 1.236 -1.108 13.003 1.00 0.00 H new ATOM 0 HA HIS C 35 3.675 0.197 12.270 1.00 0.00 H new ATOM 0 HB2 HIS C 35 1.246 -1.103 11.085 1.00 0.00 H new ATOM 0 HB3 HIS C 35 2.045 0.028 10.012 1.00 0.00 H new ATOM 0 HD1 HIS C 35 2.270 -2.791 9.097 1.00 0.00 H new ATOM 0 HD2 HIS C 35 4.972 -1.186 11.893 1.00 0.00 H new ATOM 0 HE1 HIS C 35 4.376 -4.237 9.036 1.00 0.00 H new ATOM 2391 N ALA C 36 0.986 2.041 11.931 1.00 0.00 N ATOM 2392 CA ALA C 36 0.565 3.457 11.729 1.00 0.00 C ATOM 2393 C ALA C 36 0.668 4.223 13.047 1.00 0.00 C ATOM 2394 O ALA C 36 0.755 5.435 13.066 1.00 0.00 O ATOM 2395 CB ALA C 36 -0.888 3.371 11.265 1.00 0.00 C ATOM 0 H ALA C 36 0.228 1.387 12.125 1.00 0.00 H new ATOM 0 HA ALA C 36 1.190 3.982 11.007 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -1.275 4.375 11.093 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -0.941 2.798 10.339 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -1.486 2.878 12.031 1.00 0.00 H new ATOM 2401 N LEU C 37 0.669 3.527 14.148 1.00 0.00 N ATOM 2402 CA LEU C 37 0.779 4.224 15.460 1.00 0.00 C ATOM 2403 C LEU C 37 2.136 4.925 15.561 1.00 0.00 C ATOM 2404 O LEU C 37 2.381 5.695 16.469 1.00 0.00 O ATOM 2405 CB LEU C 37 0.664 3.116 16.509 1.00 0.00 C ATOM 2406 CG LEU C 37 0.051 3.686 17.789 1.00 0.00 C ATOM 2407 CD1 LEU C 37 -1.451 3.394 17.811 1.00 0.00 C ATOM 2408 CD2 LEU C 37 0.714 3.034 19.004 1.00 0.00 C ATOM 0 H LEU C 37 0.599 2.511 14.198 1.00 0.00 H new ATOM 0 HA LEU C 37 0.012 4.987 15.594 1.00 0.00 H new ATOM 0 HB2 LEU C 37 0.046 2.303 16.128 1.00 0.00 H new ATOM 0 HB3 LEU C 37 1.648 2.697 16.720 1.00 0.00 H new ATOM 0 HG LEU C 37 0.211 4.764 17.820 1.00 0.00 H new ATOM 0 HD11 LEU C 37 -1.887 3.800 18.723 1.00 0.00 H new ATOM 0 HD12 LEU C 37 -1.924 3.857 16.945 1.00 0.00 H new ATOM 0 HD13 LEU C 37 -1.613 2.316 17.780 1.00 0.00 H new ATOM 0 HD21 LEU C 37 0.278 3.439 19.917 1.00 0.00 H new ATOM 0 HD22 LEU C 37 0.553 1.956 18.972 1.00 0.00 H new ATOM 0 HD23 LEU C 37 1.784 3.241 18.990 1.00 0.00 H new ATOM 2420 N THR C 38 3.020 4.669 14.632 1.00 0.00 N ATOM 2421 CA THR C 38 4.356 5.326 14.677 1.00 0.00 C ATOM 2422 C THR C 38 4.258 6.762 14.169 1.00 0.00 C ATOM 2423 O THR C 38 5.244 7.462 14.054 1.00 0.00 O ATOM 2424 CB THR C 38 5.260 4.486 13.783 1.00 0.00 C ATOM 2425 OG1 THR C 38 4.470 3.586 13.023 1.00 0.00 O ATOM 2426 CG2 THR C 38 6.243 3.699 14.648 1.00 0.00 C ATOM 0 H THR C 38 2.873 4.035 13.847 1.00 0.00 H new ATOM 0 HA THR C 38 4.749 5.381 15.692 1.00 0.00 H new ATOM 0 HB THR C 38 5.814 5.140 13.109 1.00 0.00 H new ATOM 0 HG1 THR C 38 4.184 4.022 12.193 1.00 0.00 H new ATOM 0 HG21 THR C 38 6.890 3.098 14.009 1.00 0.00 H new ATOM 0 HG22 THR C 38 6.851 4.392 15.230 1.00 0.00 H new ATOM 0 HG23 THR C 38 5.691 3.045 15.323 1.00 0.00 H new ATOM 2434 N SER C 39 3.071 7.207 13.883 1.00 0.00 N ATOM 2435 CA SER C 39 2.890 8.596 13.405 1.00 0.00 C ATOM 2436 C SER C 39 1.885 9.303 14.307 1.00 0.00 C ATOM 2437 O SER C 39 0.711 8.993 14.308 1.00 0.00 O ATOM 2438 CB SER C 39 2.341 8.470 11.987 1.00 0.00 C ATOM 2439 OG SER C 39 3.361 8.813 11.058 1.00 0.00 O ATOM 0 H SER C 39 2.213 6.662 13.961 1.00 0.00 H new ATOM 0 HA SER C 39 3.816 9.171 13.420 1.00 0.00 H new ATOM 0 HB2 SER C 39 1.996 7.452 11.807 1.00 0.00 H new ATOM 0 HB3 SER C 39 1.480 9.126 11.858 1.00 0.00 H new ATOM 0 HG SER C 39 3.627 8.015 10.554 1.00 0.00 H new ATOM 2445 N GLY C 40 2.337 10.246 15.077 1.00 0.00 N ATOM 2446 CA GLY C 40 1.412 10.978 15.986 1.00 0.00 C ATOM 2447 C GLY C 40 0.235 11.545 15.185 1.00 0.00 C ATOM 2448 O GLY C 40 -0.610 12.237 15.716 1.00 0.00 O ATOM 0 H GLY C 40 3.311 10.545 15.118 1.00 0.00 H new ATOM 0 HA2 GLY C 40 1.045 10.307 16.763 1.00 0.00 H new ATOM 0 HA3 GLY C 40 1.945 11.786 16.488 1.00 0.00 H new ATOM 2452 N THR C 41 0.169 11.260 13.910 1.00 0.00 N ATOM 2453 CA THR C 41 -0.957 11.786 13.088 1.00 0.00 C ATOM 2454 C THR C 41 -1.969 10.674 12.800 1.00 0.00 C ATOM 2455 O THR C 41 -3.157 10.849 12.973 1.00 0.00 O ATOM 2456 CB THR C 41 -0.310 12.276 11.791 1.00 0.00 C ATOM 2457 OG1 THR C 41 1.099 12.117 11.873 1.00 0.00 O ATOM 2458 CG2 THR C 41 -0.649 13.752 11.578 1.00 0.00 C ATOM 0 H THR C 41 0.845 10.687 13.405 1.00 0.00 H new ATOM 0 HA THR C 41 -1.500 12.583 13.596 1.00 0.00 H new ATOM 0 HB THR C 41 -0.690 11.693 10.952 1.00 0.00 H new ATOM 0 HG1 THR C 41 1.355 11.258 11.477 1.00 0.00 H new ATOM 0 HG21 THR C 41 -0.188 14.101 10.654 1.00 0.00 H new ATOM 0 HG22 THR C 41 -1.730 13.871 11.512 1.00 0.00 H new ATOM 0 HG23 THR C 41 -0.270 14.337 12.416 1.00 0.00 H new ATOM 2466 N ILE C 42 -1.511 9.529 12.367 1.00 0.00 N ATOM 2467 CA ILE C 42 -2.466 8.420 12.079 1.00 0.00 C ATOM 2468 C ILE C 42 -3.197 8.029 13.364 1.00 0.00 C ATOM 2469 O ILE C 42 -4.408 7.929 13.397 1.00 0.00 O ATOM 2470 CB ILE C 42 -1.600 7.266 11.568 1.00 0.00 C ATOM 2471 CG1 ILE C 42 -1.396 7.416 10.060 1.00 0.00 C ATOM 2472 CG2 ILE C 42 -2.298 5.934 11.854 1.00 0.00 C ATOM 2473 CD1 ILE C 42 0.101 7.453 9.746 1.00 0.00 C ATOM 0 H ILE C 42 -0.527 9.315 12.202 1.00 0.00 H new ATOM 0 HA ILE C 42 -3.226 8.698 11.349 1.00 0.00 H new ATOM 0 HB ILE C 42 -0.635 7.286 12.074 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -1.868 6.586 9.535 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -1.875 8.330 9.707 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -1.680 5.114 11.489 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -2.449 5.825 12.928 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -3.263 5.913 11.348 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.245 7.560 8.671 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.560 8.298 10.259 1.00 0.00 H new ATOM 0 HD13 ILE C 42 0.567 6.527 10.084 1.00 0.00 H new ATOM 2485 N LYS C 43 -2.471 7.816 14.427 1.00 0.00 N ATOM 2486 CA LYS C 43 -3.123 7.442 15.713 1.00 0.00 C ATOM 2487 C LYS C 43 -3.970 8.612 16.226 1.00 0.00 C ATOM 2488 O LYS C 43 -5.015 8.422 16.816 1.00 0.00 O ATOM 2489 CB LYS C 43 -1.962 7.149 16.667 1.00 0.00 C ATOM 2490 CG LYS C 43 -2.394 7.417 18.112 1.00 0.00 C ATOM 2491 CD LYS C 43 -1.389 6.775 19.071 1.00 0.00 C ATOM 2492 CE LYS C 43 -0.019 7.431 18.887 1.00 0.00 C ATOM 2493 NZ LYS C 43 0.875 6.730 19.851 1.00 0.00 N ATOM 0 H LYS C 43 -1.454 7.885 14.460 1.00 0.00 H new ATOM 0 HA LYS C 43 -3.792 6.587 15.615 1.00 0.00 H new ATOM 0 HB2 LYS C 43 -1.645 6.112 16.560 1.00 0.00 H new ATOM 0 HB3 LYS C 43 -1.105 7.773 16.413 1.00 0.00 H new ATOM 0 HG2 LYS C 43 -2.451 8.490 18.293 1.00 0.00 H new ATOM 0 HG3 LYS C 43 -3.390 7.011 18.287 1.00 0.00 H new ATOM 0 HD2 LYS C 43 -1.726 6.894 20.101 1.00 0.00 H new ATOM 0 HD3 LYS C 43 -1.320 5.704 18.880 1.00 0.00 H new ATOM 0 HE2 LYS C 43 0.338 7.319 17.863 1.00 0.00 H new ATOM 0 HE3 LYS C 43 -0.062 8.500 19.094 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 1.705 7.325 20.051 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 0.358 6.549 20.735 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 1.187 5.827 19.441 1.00 0.00 H new ATOM 2507 N ALA C 44 -3.527 9.820 16.003 1.00 0.00 N ATOM 2508 CA ALA C 44 -4.306 10.999 16.476 1.00 0.00 C ATOM 2509 C ALA C 44 -5.423 11.329 15.482 1.00 0.00 C ATOM 2510 O ALA C 44 -6.396 11.973 15.817 1.00 0.00 O ATOM 2511 CB ALA C 44 -3.294 12.142 16.543 1.00 0.00 C ATOM 0 H ALA C 44 -2.660 10.041 15.514 1.00 0.00 H new ATOM 0 HA ALA C 44 -4.782 10.819 17.440 1.00 0.00 H new ATOM 0 HB1 ALA C 44 -3.792 13.049 16.885 1.00 0.00 H new ATOM 0 HB2 ALA C 44 -2.497 11.882 17.239 1.00 0.00 H new ATOM 0 HB3 ALA C 44 -2.870 12.311 15.553 1.00 0.00 H new ATOM 2517 N MET C 45 -5.290 10.892 14.259 1.00 0.00 N ATOM 2518 CA MET C 45 -6.344 11.182 13.245 1.00 0.00 C ATOM 2519 C MET C 45 -7.218 9.944 13.022 1.00 0.00 C ATOM 2520 O MET C 45 -8.305 10.030 12.484 1.00 0.00 O ATOM 2521 CB MET C 45 -5.580 11.542 11.970 1.00 0.00 C ATOM 2522 CG MET C 45 -5.037 10.269 11.318 1.00 0.00 C ATOM 2523 SD MET C 45 -5.938 9.945 9.783 1.00 0.00 S ATOM 2524 CE MET C 45 -5.142 11.224 8.779 1.00 0.00 C ATOM 0 H MET C 45 -4.498 10.347 13.918 1.00 0.00 H new ATOM 0 HA MET C 45 -7.010 11.986 13.558 1.00 0.00 H new ATOM 0 HB2 MET C 45 -6.238 12.066 11.276 1.00 0.00 H new ATOM 0 HB3 MET C 45 -4.760 12.220 12.205 1.00 0.00 H new ATOM 0 HG2 MET C 45 -3.973 10.379 11.111 1.00 0.00 H new ATOM 0 HG3 MET C 45 -5.143 9.425 11.999 1.00 0.00 H new ATOM 0 HE1 MET C 45 -5.905 11.851 8.318 1.00 0.00 H new ATOM 0 HE2 MET C 45 -4.502 11.838 9.413 1.00 0.00 H new ATOM 0 HE3 MET C 45 -4.540 10.754 8.002 1.00 0.00 H new ATOM 2534 N LEU C 46 -6.754 8.795 13.432 1.00 0.00 N ATOM 2535 CA LEU C 46 -7.561 7.555 13.244 1.00 0.00 C ATOM 2536 C LEU C 46 -9.031 7.828 13.567 1.00 0.00 C ATOM 2537 O LEU C 46 -9.923 7.207 13.024 1.00 0.00 O ATOM 2538 CB LEU C 46 -6.973 6.547 14.232 1.00 0.00 C ATOM 2539 CG LEU C 46 -6.928 5.163 13.583 1.00 0.00 C ATOM 2540 CD1 LEU C 46 -5.777 5.108 12.577 1.00 0.00 C ATOM 2541 CD2 LEU C 46 -6.711 4.100 14.662 1.00 0.00 C ATOM 0 H LEU C 46 -5.852 8.661 13.889 1.00 0.00 H new ATOM 0 HA LEU C 46 -7.524 7.189 12.218 1.00 0.00 H new ATOM 0 HB2 LEU C 46 -5.970 6.854 14.528 1.00 0.00 H new ATOM 0 HB3 LEU C 46 -7.577 6.516 15.139 1.00 0.00 H new ATOM 0 HG LEU C 46 -7.870 4.973 13.069 1.00 0.00 H new ATOM 0 HD11 LEU C 46 -5.745 4.122 12.114 1.00 0.00 H new ATOM 0 HD12 LEU C 46 -5.930 5.865 11.808 1.00 0.00 H new ATOM 0 HD13 LEU C 46 -4.835 5.298 13.091 1.00 0.00 H new ATOM 0 HD21 LEU C 46 -6.679 3.113 14.200 1.00 0.00 H new ATOM 0 HD22 LEU C 46 -5.769 4.291 15.176 1.00 0.00 H new ATOM 0 HD23 LEU C 46 -7.530 4.138 15.380 1.00 0.00 H new ATOM 2697 N ASN C 58 -9.835 3.116 11.656 1.00 0.00 N ATOM 2698 CA ASN C 58 -8.438 2.728 11.308 1.00 0.00 C ATOM 2699 C ASN C 58 -8.143 3.065 9.844 1.00 0.00 C ATOM 2700 O ASN C 58 -7.928 2.192 9.027 1.00 0.00 O ATOM 2701 CB ASN C 58 -8.381 1.216 11.535 1.00 0.00 C ATOM 2702 CG ASN C 58 -7.553 0.919 12.786 1.00 0.00 C ATOM 2703 OD1 ASN C 58 -6.339 0.946 12.746 1.00 0.00 O ATOM 2704 ND2 ASN C 58 -8.162 0.632 13.904 1.00 0.00 N ATOM 0 HA ASN C 58 -7.699 3.259 11.908 1.00 0.00 H new ATOM 0 HB2 ASN C 58 -9.389 0.816 11.650 1.00 0.00 H new ATOM 0 HB3 ASN C 58 -7.940 0.724 10.668 1.00 0.00 H new ATOM 0 HD21 ASN C 58 -7.619 0.431 14.744 1.00 0.00 H new ATOM 0 HD22 ASN C 58 -9.181 0.609 13.938 1.00 0.00 H new ATOM 2711 N GLU C 59 -8.130 4.325 9.507 1.00 0.00 N ATOM 2712 CA GLU C 59 -7.846 4.716 8.097 1.00 0.00 C ATOM 2713 C GLU C 59 -6.979 5.977 8.062 1.00 0.00 C ATOM 2714 O GLU C 59 -7.017 6.792 8.961 1.00 0.00 O ATOM 2715 CB GLU C 59 -9.216 4.988 7.475 1.00 0.00 C ATOM 2716 CG GLU C 59 -10.052 5.841 8.431 1.00 0.00 C ATOM 2717 CD GLU C 59 -11.282 5.051 8.879 1.00 0.00 C ATOM 2718 OE1 GLU C 59 -11.105 3.964 9.401 1.00 0.00 O ATOM 2719 OE2 GLU C 59 -12.382 5.547 8.690 1.00 0.00 O ATOM 0 H GLU C 59 -8.304 5.101 10.146 1.00 0.00 H new ATOM 0 HA GLU C 59 -7.301 3.942 7.556 1.00 0.00 H new ATOM 0 HB2 GLU C 59 -9.098 5.502 6.521 1.00 0.00 H new ATOM 0 HB3 GLU C 59 -9.727 4.047 7.269 1.00 0.00 H new ATOM 0 HG2 GLU C 59 -9.455 6.126 9.297 1.00 0.00 H new ATOM 0 HG3 GLU C 59 -10.359 6.763 7.938 1.00 0.00 H new ATOM 2726 N VAL C 60 -6.197 6.141 7.030 1.00 0.00 N ATOM 2727 CA VAL C 60 -5.326 7.349 6.938 1.00 0.00 C ATOM 2728 C VAL C 60 -5.422 7.963 5.540 1.00 0.00 C ATOM 2729 O VAL C 60 -5.715 7.290 4.572 1.00 0.00 O ATOM 2730 CB VAL C 60 -3.907 6.845 7.202 1.00 0.00 C ATOM 2731 CG1 VAL C 60 -3.043 7.996 7.718 1.00 0.00 C ATOM 2732 CG2 VAL C 60 -3.942 5.727 8.247 1.00 0.00 C ATOM 0 H VAL C 60 -6.123 5.492 6.247 1.00 0.00 H new ATOM 0 HA VAL C 60 -5.621 8.121 7.649 1.00 0.00 H new ATOM 0 HB VAL C 60 -3.484 6.459 6.274 1.00 0.00 H new ATOM 0 HG11 VAL C 60 -2.032 7.636 7.906 1.00 0.00 H new ATOM 0 HG12 VAL C 60 -3.013 8.791 6.973 1.00 0.00 H new ATOM 0 HG13 VAL C 60 -3.468 8.383 8.644 1.00 0.00 H new ATOM 0 HG21 VAL C 60 -2.929 5.370 8.432 1.00 0.00 H new ATOM 0 HG22 VAL C 60 -4.368 6.109 9.175 1.00 0.00 H new ATOM 0 HG23 VAL C 60 -4.555 4.904 7.879 1.00 0.00 H new ATOM 2742 N ASN C 61 -5.173 9.239 5.427 1.00 0.00 N ATOM 2743 CA ASN C 61 -5.242 9.899 4.096 1.00 0.00 C ATOM 2744 C ASN C 61 -4.054 10.846 3.920 1.00 0.00 C ATOM 2745 O ASN C 61 -3.924 11.834 4.614 1.00 0.00 O ATOM 2746 CB ASN C 61 -6.556 10.682 4.110 1.00 0.00 C ATOM 2747 CG ASN C 61 -6.682 11.446 5.430 1.00 0.00 C ATOM 2748 OD1 ASN C 61 -7.527 11.029 6.332 1.00 0.00 O flip ATOM 2749 ND2 ASN C 61 -6.005 12.432 5.641 1.00 0.00 N flip ATOM 0 H ASN C 61 -4.924 9.853 6.202 1.00 0.00 H new ATOM 0 HA ASN C 61 -5.205 9.183 3.275 1.00 0.00 H new ATOM 0 HB2 ASN C 61 -6.586 11.377 3.271 1.00 0.00 H new ATOM 0 HB3 ASN C 61 -7.399 10.001 3.990 1.00 0.00 H new ATOM 0 HD21 ASN C 61 -5.344 12.758 4.935 1.00 0.00 H new ATOM 0 HD22 ASN C 61 -6.097 12.934 6.524 1.00 0.00 H new ATOM 2756 N PHE C 62 -3.188 10.549 2.995 1.00 0.00 N ATOM 2757 CA PHE C 62 -2.006 11.429 2.767 1.00 0.00 C ATOM 2758 C PHE C 62 -2.247 12.331 1.553 1.00 0.00 C ATOM 2759 O PHE C 62 -2.052 11.931 0.422 1.00 0.00 O ATOM 2760 CB PHE C 62 -0.842 10.474 2.502 1.00 0.00 C ATOM 2761 CG PHE C 62 -0.594 9.623 3.725 1.00 0.00 C ATOM 2762 CD1 PHE C 62 -0.807 10.152 5.004 1.00 0.00 C ATOM 2763 CD2 PHE C 62 -0.148 8.304 3.580 1.00 0.00 C ATOM 2764 CE1 PHE C 62 -0.575 9.363 6.137 1.00 0.00 C ATOM 2765 CE2 PHE C 62 0.084 7.514 4.712 1.00 0.00 C ATOM 2766 CZ PHE C 62 -0.130 8.043 5.990 1.00 0.00 C ATOM 0 H PHE C 62 -3.246 9.734 2.385 1.00 0.00 H new ATOM 0 HA PHE C 62 -1.809 12.083 3.617 1.00 0.00 H new ATOM 0 HB2 PHE C 62 -1.067 9.839 1.645 1.00 0.00 H new ATOM 0 HB3 PHE C 62 0.056 11.040 2.252 1.00 0.00 H new ATOM 0 HD1 PHE C 62 -1.151 11.170 5.116 1.00 0.00 H new ATOM 0 HD2 PHE C 62 0.017 7.896 2.594 1.00 0.00 H new ATOM 0 HE1 PHE C 62 -0.739 9.772 7.123 1.00 0.00 H new ATOM 0 HE2 PHE C 62 0.428 6.496 4.599 1.00 0.00 H new ATOM 0 HZ PHE C 62 0.048 7.433 6.863 1.00 0.00 H new ATOM 2776 N ARG C 63 -2.670 13.545 1.778 1.00 0.00 N ATOM 2777 CA ARG C 63 -2.924 14.471 0.636 1.00 0.00 C ATOM 2778 C ARG C 63 -1.727 15.403 0.433 1.00 0.00 C ATOM 2779 O ARG C 63 -1.785 16.346 -0.331 1.00 0.00 O ATOM 2780 CB ARG C 63 -4.164 15.268 1.042 1.00 0.00 C ATOM 2781 CG ARG C 63 -5.178 15.255 -0.103 1.00 0.00 C ATOM 2782 CD ARG C 63 -6.513 15.821 0.387 1.00 0.00 C ATOM 2783 NE ARG C 63 -6.206 17.216 0.808 1.00 0.00 N ATOM 2784 CZ ARG C 63 -7.175 18.028 1.136 1.00 0.00 C ATOM 2785 NH1 ARG C 63 -8.415 17.621 1.091 1.00 0.00 N ATOM 2786 NH2 ARG C 63 -6.904 19.250 1.506 1.00 0.00 N ATOM 0 H ARG C 63 -2.851 13.936 2.702 1.00 0.00 H new ATOM 0 HA ARG C 63 -3.072 13.938 -0.303 1.00 0.00 H new ATOM 0 HB2 ARG C 63 -4.608 14.837 1.940 1.00 0.00 H new ATOM 0 HB3 ARG C 63 -3.886 16.294 1.284 1.00 0.00 H new ATOM 0 HG2 ARG C 63 -4.805 15.847 -0.939 1.00 0.00 H new ATOM 0 HG3 ARG C 63 -5.315 14.238 -0.469 1.00 0.00 H new ATOM 0 HD2 ARG C 63 -7.264 15.803 -0.403 1.00 0.00 H new ATOM 0 HD3 ARG C 63 -6.909 15.236 1.217 1.00 0.00 H new ATOM 0 HE ARG C 63 -5.239 17.538 0.840 1.00 0.00 H new ATOM 0 HH11 ARG C 63 -8.628 16.667 0.799 1.00 0.00 H new ATOM 0 HH12 ARG C 63 -9.170 18.257 1.348 1.00 0.00 H new ATOM 0 HH21 ARG C 63 -5.936 19.570 1.539 1.00 0.00 H new ATOM 0 HH22 ARG C 63 -7.660 19.885 1.762 1.00 0.00 H new ATOM 2800 N GLU C 64 -0.642 15.146 1.111 1.00 0.00 N ATOM 2801 CA GLU C 64 0.559 16.016 0.955 1.00 0.00 C ATOM 2802 C GLU C 64 1.820 15.158 0.833 1.00 0.00 C ATOM 2803 O GLU C 64 2.880 15.525 1.302 1.00 0.00 O ATOM 2804 CB GLU C 64 0.606 16.861 2.229 1.00 0.00 C ATOM 2805 CG GLU C 64 -0.244 18.120 2.041 1.00 0.00 C ATOM 2806 CD GLU C 64 0.663 19.352 2.040 1.00 0.00 C ATOM 2807 OE1 GLU C 64 1.834 19.201 1.735 1.00 0.00 O ATOM 2808 OE2 GLU C 64 0.170 20.426 2.344 1.00 0.00 O ATOM 0 H GLU C 64 -0.535 14.372 1.766 1.00 0.00 H new ATOM 0 HA GLU C 64 0.507 16.634 0.059 1.00 0.00 H new ATOM 0 HB2 GLU C 64 0.235 16.283 3.075 1.00 0.00 H new ATOM 0 HB3 GLU C 64 1.636 17.136 2.458 1.00 0.00 H new ATOM 0 HG2 GLU C 64 -0.797 18.062 1.104 1.00 0.00 H new ATOM 0 HG3 GLU C 64 -0.980 18.198 2.841 1.00 0.00 H new ATOM 2815 N ILE C 65 1.715 14.017 0.211 1.00 0.00 N ATOM 2816 CA ILE C 65 2.908 13.134 0.063 1.00 0.00 C ATOM 2817 C ILE C 65 2.727 12.198 -1.137 1.00 0.00 C ATOM 2818 O ILE C 65 1.659 11.661 -1.350 1.00 0.00 O ATOM 2819 CB ILE C 65 2.971 12.342 1.372 1.00 0.00 C ATOM 2820 CG1 ILE C 65 3.830 13.102 2.387 1.00 0.00 C ATOM 2821 CG2 ILE C 65 3.589 10.965 1.117 1.00 0.00 C ATOM 2822 CD1 ILE C 65 2.985 13.448 3.616 1.00 0.00 C ATOM 0 H ILE C 65 0.855 13.657 -0.202 1.00 0.00 H new ATOM 0 HA ILE C 65 3.825 13.695 -0.116 1.00 0.00 H new ATOM 0 HB ILE C 65 1.962 12.218 1.764 1.00 0.00 H new ATOM 0 HG12 ILE C 65 4.686 12.495 2.681 1.00 0.00 H new ATOM 0 HG13 ILE C 65 4.224 14.013 1.936 1.00 0.00 H new ATOM 0 HG21 ILE C 65 3.631 10.406 2.052 1.00 0.00 H new ATOM 0 HG22 ILE C 65 2.979 10.420 0.396 1.00 0.00 H new ATOM 0 HG23 ILE C 65 4.597 11.086 0.721 1.00 0.00 H new ATOM 0 HD11 ILE C 65 3.597 13.989 4.338 1.00 0.00 H new ATOM 0 HD12 ILE C 65 2.143 14.071 3.315 1.00 0.00 H new ATOM 0 HD13 ILE C 65 2.612 12.530 4.071 1.00 0.00 H new ATOM 2834 N PRO C 66 3.787 12.036 -1.881 1.00 0.00 N ATOM 2835 CA PRO C 66 3.754 11.154 -3.074 1.00 0.00 C ATOM 2836 C PRO C 66 3.724 9.684 -2.647 1.00 0.00 C ATOM 2837 O PRO C 66 4.047 9.348 -1.525 1.00 0.00 O ATOM 2838 CB PRO C 66 5.055 11.485 -3.801 1.00 0.00 C ATOM 2839 CG PRO C 66 5.969 12.007 -2.738 1.00 0.00 C ATOM 2840 CD PRO C 66 5.104 12.650 -1.685 1.00 0.00 C ATOM 0 HA PRO C 66 2.874 11.307 -3.699 1.00 0.00 H new ATOM 0 HB2 PRO C 66 5.474 10.602 -4.283 1.00 0.00 H new ATOM 0 HB3 PRO C 66 4.893 12.228 -4.582 1.00 0.00 H new ATOM 0 HG2 PRO C 66 6.561 11.199 -2.309 1.00 0.00 H new ATOM 0 HG3 PRO C 66 6.670 12.730 -3.154 1.00 0.00 H new ATOM 0 HD2 PRO C 66 5.488 12.459 -0.683 1.00 0.00 H new ATOM 0 HD3 PRO C 66 5.062 13.732 -1.810 1.00 0.00 H new ATOM 2848 N SER C 67 3.339 8.806 -3.532 1.00 0.00 N ATOM 2849 CA SER C 67 3.285 7.361 -3.171 1.00 0.00 C ATOM 2850 C SER C 67 4.665 6.874 -2.722 1.00 0.00 C ATOM 2851 O SER C 67 4.798 6.196 -1.723 1.00 0.00 O ATOM 2852 CB SER C 67 2.858 6.650 -4.454 1.00 0.00 C ATOM 2853 OG SER C 67 1.440 6.552 -4.487 1.00 0.00 O ATOM 0 H SER C 67 3.060 9.026 -4.488 1.00 0.00 H new ATOM 0 HA SER C 67 2.598 7.167 -2.348 1.00 0.00 H new ATOM 0 HB2 SER C 67 3.216 7.199 -5.324 1.00 0.00 H new ATOM 0 HB3 SER C 67 3.304 5.656 -4.498 1.00 0.00 H new ATOM 0 HG SER C 67 1.175 5.613 -4.398 1.00 0.00 H new ATOM 2859 N HIS C 68 5.694 7.218 -3.446 1.00 0.00 N ATOM 2860 CA HIS C 68 7.060 6.773 -3.049 1.00 0.00 C ATOM 2861 C HIS C 68 7.368 7.241 -1.623 1.00 0.00 C ATOM 2862 O HIS C 68 7.990 6.538 -0.849 1.00 0.00 O ATOM 2863 CB HIS C 68 8.002 7.438 -4.053 1.00 0.00 C ATOM 2864 CG HIS C 68 8.238 6.505 -5.209 1.00 0.00 C ATOM 2865 ND1 HIS C 68 7.742 6.758 -6.477 1.00 0.00 N ATOM 2866 CD2 HIS C 68 8.914 5.313 -5.301 1.00 0.00 C ATOM 2867 CE1 HIS C 68 8.122 5.740 -7.273 1.00 0.00 C ATOM 2868 NE2 HIS C 68 8.840 4.832 -6.605 1.00 0.00 N ATOM 0 H HIS C 68 5.649 7.786 -4.292 1.00 0.00 H new ATOM 0 HA HIS C 68 7.164 5.688 -3.057 1.00 0.00 H new ATOM 0 HB2 HIS C 68 7.571 8.374 -4.409 1.00 0.00 H new ATOM 0 HB3 HIS C 68 8.948 7.686 -3.572 1.00 0.00 H new ATOM 0 HD2 HIS C 68 9.425 4.823 -4.485 1.00 0.00 H new ATOM 0 HE1 HIS C 68 7.877 5.667 -8.322 1.00 0.00 H new ATOM 0 HE2 HIS C 68 9.246 3.971 -6.972 1.00 0.00 H new ATOM 2876 N VAL C 69 6.929 8.417 -1.264 1.00 0.00 N ATOM 2877 CA VAL C 69 7.190 8.914 0.109 1.00 0.00 C ATOM 2878 C VAL C 69 6.275 8.188 1.096 1.00 0.00 C ATOM 2879 O VAL C 69 6.612 7.989 2.247 1.00 0.00 O ATOM 2880 CB VAL C 69 6.863 10.403 0.048 1.00 0.00 C ATOM 2881 CG1 VAL C 69 6.595 10.921 1.458 1.00 0.00 C ATOM 2882 CG2 VAL C 69 8.044 11.161 -0.558 1.00 0.00 C ATOM 0 H VAL C 69 6.402 9.051 -1.864 1.00 0.00 H new ATOM 0 HA VAL C 69 8.214 8.742 0.441 1.00 0.00 H new ATOM 0 HB VAL C 69 5.979 10.556 -0.571 1.00 0.00 H new ATOM 0 HG11 VAL C 69 6.361 11.985 1.416 1.00 0.00 H new ATOM 0 HG12 VAL C 69 5.753 10.381 1.890 1.00 0.00 H new ATOM 0 HG13 VAL C 69 7.480 10.768 2.076 1.00 0.00 H new ATOM 0 HG21 VAL C 69 7.810 12.225 -0.601 1.00 0.00 H new ATOM 0 HG22 VAL C 69 8.929 11.009 0.060 1.00 0.00 H new ATOM 0 HG23 VAL C 69 8.236 10.790 -1.565 1.00 0.00 H new ATOM 2892 N LEU C 70 5.119 7.780 0.645 1.00 0.00 N ATOM 2893 CA LEU C 70 4.179 7.053 1.542 1.00 0.00 C ATOM 2894 C LEU C 70 4.853 5.780 2.061 1.00 0.00 C ATOM 2895 O LEU C 70 4.690 5.399 3.203 1.00 0.00 O ATOM 2896 CB LEU C 70 2.965 6.738 0.651 1.00 0.00 C ATOM 2897 CG LEU C 70 2.452 5.313 0.900 1.00 0.00 C ATOM 2898 CD1 LEU C 70 3.454 4.299 0.342 1.00 0.00 C ATOM 2899 CD2 LEU C 70 2.268 5.084 2.403 1.00 0.00 C ATOM 0 H LEU C 70 4.786 7.920 -0.309 1.00 0.00 H new ATOM 0 HA LEU C 70 3.884 7.625 2.422 1.00 0.00 H new ATOM 0 HB2 LEU C 70 2.168 7.455 0.850 1.00 0.00 H new ATOM 0 HB3 LEU C 70 3.241 6.851 -0.398 1.00 0.00 H new ATOM 0 HG LEU C 70 1.493 5.184 0.398 1.00 0.00 H new ATOM 0 HD11 LEU C 70 3.087 3.288 0.521 1.00 0.00 H new ATOM 0 HD12 LEU C 70 3.574 4.458 -0.730 1.00 0.00 H new ATOM 0 HD13 LEU C 70 4.416 4.428 0.837 1.00 0.00 H new ATOM 0 HD21 LEU C 70 1.904 4.071 2.575 1.00 0.00 H new ATOM 0 HD22 LEU C 70 3.223 5.217 2.911 1.00 0.00 H new ATOM 0 HD23 LEU C 70 1.546 5.801 2.795 1.00 0.00 H new ATOM 2911 N SER C 71 5.619 5.124 1.231 1.00 0.00 N ATOM 2912 CA SER C 71 6.312 3.886 1.678 1.00 0.00 C ATOM 2913 C SER C 71 7.549 4.284 2.466 1.00 0.00 C ATOM 2914 O SER C 71 8.029 3.562 3.318 1.00 0.00 O ATOM 2915 CB SER C 71 6.699 3.154 0.395 1.00 0.00 C ATOM 2916 OG SER C 71 7.967 2.534 0.572 1.00 0.00 O ATOM 0 H SER C 71 5.793 5.394 0.263 1.00 0.00 H new ATOM 0 HA SER C 71 5.694 3.255 2.317 1.00 0.00 H new ATOM 0 HB2 SER C 71 5.946 2.405 0.149 1.00 0.00 H new ATOM 0 HB3 SER C 71 6.737 3.854 -0.440 1.00 0.00 H new ATOM 0 HG SER C 71 8.218 2.062 -0.249 1.00 0.00 H new ATOM 2922 N LYS C 72 8.055 5.450 2.190 1.00 0.00 N ATOM 2923 CA LYS C 72 9.259 5.935 2.924 1.00 0.00 C ATOM 2924 C LYS C 72 8.984 5.907 4.427 1.00 0.00 C ATOM 2925 O LYS C 72 9.505 5.082 5.151 1.00 0.00 O ATOM 2926 CB LYS C 72 9.468 7.369 2.441 1.00 0.00 C ATOM 2927 CG LYS C 72 10.884 7.518 1.882 1.00 0.00 C ATOM 2928 CD LYS C 72 11.890 6.937 2.878 1.00 0.00 C ATOM 2929 CE LYS C 72 12.558 5.702 2.269 1.00 0.00 C ATOM 2930 NZ LYS C 72 12.484 4.662 3.333 1.00 0.00 N ATOM 0 H LYS C 72 7.688 6.091 1.487 1.00 0.00 H new ATOM 0 HA LYS C 72 10.140 5.319 2.743 1.00 0.00 H new ATOM 0 HB2 LYS C 72 8.735 7.616 1.673 1.00 0.00 H new ATOM 0 HB3 LYS C 72 9.315 8.067 3.264 1.00 0.00 H new ATOM 0 HG2 LYS C 72 10.965 7.003 0.925 1.00 0.00 H new ATOM 0 HG3 LYS C 72 11.105 8.569 1.697 1.00 0.00 H new ATOM 0 HD2 LYS C 72 12.643 7.684 3.128 1.00 0.00 H new ATOM 0 HD3 LYS C 72 11.385 6.670 3.806 1.00 0.00 H new ATOM 0 HE2 LYS C 72 12.042 5.379 1.365 1.00 0.00 H new ATOM 0 HE3 LYS C 72 13.591 5.909 1.990 1.00 0.00 H new ATOM 0 HZ1 LYS C 72 13.366 4.112 3.342 1.00 0.00 H new ATOM 0 HZ2 LYS C 72 12.352 5.120 4.257 1.00 0.00 H new ATOM 0 HZ3 LYS C 72 11.682 4.027 3.143 1.00 0.00 H new ATOM 2944 N VAL C 73 8.158 6.797 4.894 1.00 0.00 N ATOM 2945 CA VAL C 73 7.831 6.820 6.350 1.00 0.00 C ATOM 2946 C VAL C 73 7.179 5.498 6.752 1.00 0.00 C ATOM 2947 O VAL C 73 7.366 5.014 7.851 1.00 0.00 O ATOM 2948 CB VAL C 73 6.866 8.000 6.590 1.00 0.00 C ATOM 2949 CG1 VAL C 73 6.229 8.490 5.287 1.00 0.00 C ATOM 2950 CG2 VAL C 73 5.755 7.571 7.554 1.00 0.00 C ATOM 0 H VAL C 73 7.693 7.511 4.333 1.00 0.00 H new ATOM 0 HA VAL C 73 8.731 6.945 6.952 1.00 0.00 H new ATOM 0 HB VAL C 73 7.448 8.817 7.016 1.00 0.00 H new ATOM 0 HG11 VAL C 73 5.557 9.321 5.501 1.00 0.00 H new ATOM 0 HG12 VAL C 73 7.010 8.822 4.602 1.00 0.00 H new ATOM 0 HG13 VAL C 73 5.666 7.677 4.829 1.00 0.00 H new ATOM 0 HG21 VAL C 73 5.076 8.407 7.721 1.00 0.00 H new ATOM 0 HG22 VAL C 73 5.203 6.735 7.124 1.00 0.00 H new ATOM 0 HG23 VAL C 73 6.195 7.266 8.503 1.00 0.00 H new ATOM 2960 N CYS C 74 6.411 4.905 5.879 1.00 0.00 N ATOM 2961 CA CYS C 74 5.759 3.619 6.241 1.00 0.00 C ATOM 2962 C CYS C 74 6.838 2.617 6.651 1.00 0.00 C ATOM 2963 O CYS C 74 6.666 1.838 7.569 1.00 0.00 O ATOM 2964 CB CYS C 74 5.042 3.158 4.971 1.00 0.00 C ATOM 2965 SG CYS C 74 3.280 3.558 5.095 1.00 0.00 S ATOM 0 H CYS C 74 6.209 5.252 4.941 1.00 0.00 H new ATOM 0 HA CYS C 74 5.061 3.714 7.073 1.00 0.00 H new ATOM 0 HB2 CYS C 74 5.476 3.645 4.098 1.00 0.00 H new ATOM 0 HB3 CYS C 74 5.174 2.085 4.835 1.00 0.00 H new ATOM 0 HG CYS C 74 2.984 3.834 6.330 1.00 0.00 H new ATOM 2971 N MET C 75 7.971 2.657 6.006 1.00 0.00 N ATOM 2972 CA MET C 75 9.063 1.734 6.404 1.00 0.00 C ATOM 2973 C MET C 75 9.468 2.075 7.834 1.00 0.00 C ATOM 2974 O MET C 75 9.804 1.214 8.624 1.00 0.00 O ATOM 2975 CB MET C 75 10.209 2.010 5.427 1.00 0.00 C ATOM 2976 CG MET C 75 11.376 1.068 5.731 1.00 0.00 C ATOM 2977 SD MET C 75 12.934 1.880 5.295 1.00 0.00 S ATOM 2978 CE MET C 75 14.019 0.462 5.595 1.00 0.00 C ATOM 0 H MET C 75 8.184 3.283 5.229 1.00 0.00 H new ATOM 0 HA MET C 75 8.778 0.683 6.372 1.00 0.00 H new ATOM 0 HB2 MET C 75 9.869 1.866 4.401 1.00 0.00 H new ATOM 0 HB3 MET C 75 10.533 3.047 5.513 1.00 0.00 H new ATOM 0 HG2 MET C 75 11.376 0.800 6.788 1.00 0.00 H new ATOM 0 HG3 MET C 75 11.266 0.141 5.168 1.00 0.00 H new ATOM 0 HE1 MET C 75 15.056 0.757 5.436 1.00 0.00 H new ATOM 0 HE2 MET C 75 13.893 0.118 6.622 1.00 0.00 H new ATOM 0 HE3 MET C 75 13.762 -0.344 4.908 1.00 0.00 H new ATOM 2988 N TYR C 76 9.404 3.334 8.179 1.00 0.00 N ATOM 2989 CA TYR C 76 9.747 3.745 9.565 1.00 0.00 C ATOM 2990 C TYR C 76 8.619 3.302 10.502 1.00 0.00 C ATOM 2991 O TYR C 76 8.820 3.095 11.682 1.00 0.00 O ATOM 2992 CB TYR C 76 9.861 5.275 9.523 1.00 0.00 C ATOM 2993 CG TYR C 76 9.268 5.858 10.784 1.00 0.00 C ATOM 2994 CD1 TYR C 76 7.883 6.017 10.889 1.00 0.00 C ATOM 2995 CD2 TYR C 76 10.098 6.217 11.855 1.00 0.00 C ATOM 2996 CE1 TYR C 76 7.324 6.537 12.061 1.00 0.00 C ATOM 2997 CE2 TYR C 76 9.538 6.733 13.029 1.00 0.00 C ATOM 2998 CZ TYR C 76 8.151 6.894 13.131 1.00 0.00 C ATOM 2999 OH TYR C 76 7.600 7.403 14.290 1.00 0.00 O ATOM 0 H TYR C 76 9.128 4.094 7.557 1.00 0.00 H new ATOM 0 HA TYR C 76 10.673 3.298 9.926 1.00 0.00 H new ATOM 0 HB2 TYR C 76 10.906 5.570 9.429 1.00 0.00 H new ATOM 0 HB3 TYR C 76 9.340 5.665 8.649 1.00 0.00 H new ATOM 0 HD1 TYR C 76 7.244 5.738 10.064 1.00 0.00 H new ATOM 0 HD2 TYR C 76 11.168 6.096 11.774 1.00 0.00 H new ATOM 0 HE1 TYR C 76 6.254 6.663 12.140 1.00 0.00 H new ATOM 0 HE2 TYR C 76 10.176 7.007 13.856 1.00 0.00 H new ATOM 0 HH TYR C 76 6.679 7.080 14.384 1.00 0.00 H new ATOM 3009 N PHE C 77 7.429 3.139 9.975 1.00 0.00 N ATOM 3010 CA PHE C 77 6.294 2.692 10.832 1.00 0.00 C ATOM 3011 C PHE C 77 6.584 1.280 11.332 1.00 0.00 C ATOM 3012 O PHE C 77 6.249 0.917 12.443 1.00 0.00 O ATOM 3013 CB PHE C 77 5.072 2.671 9.908 1.00 0.00 C ATOM 3014 CG PHE C 77 4.329 3.992 9.948 1.00 0.00 C ATOM 3015 CD1 PHE C 77 4.652 4.976 10.896 1.00 0.00 C ATOM 3016 CD2 PHE C 77 3.311 4.233 9.014 1.00 0.00 C ATOM 3017 CE1 PHE C 77 3.957 6.192 10.905 1.00 0.00 C ATOM 3018 CE2 PHE C 77 2.618 5.448 9.027 1.00 0.00 C ATOM 3019 CZ PHE C 77 2.941 6.426 9.970 1.00 0.00 C ATOM 0 H PHE C 77 7.199 3.296 8.994 1.00 0.00 H new ATOM 0 HA PHE C 77 6.138 3.340 11.694 1.00 0.00 H new ATOM 0 HB2 PHE C 77 5.389 2.460 8.887 1.00 0.00 H new ATOM 0 HB3 PHE C 77 4.402 1.865 10.206 1.00 0.00 H new ATOM 0 HD1 PHE C 77 5.435 4.796 11.617 1.00 0.00 H new ATOM 0 HD2 PHE C 77 3.061 3.478 8.283 1.00 0.00 H new ATOM 0 HE1 PHE C 77 4.205 6.950 11.634 1.00 0.00 H new ATOM 0 HE2 PHE C 77 1.833 5.630 8.308 1.00 0.00 H new ATOM 0 HZ PHE C 77 2.406 7.364 9.978 1.00 0.00 H new ATOM 3029 N THR C 78 7.222 0.484 10.518 1.00 0.00 N ATOM 3030 CA THR C 78 7.556 -0.904 10.942 1.00 0.00 C ATOM 3031 C THR C 78 8.945 -0.921 11.579 1.00 0.00 C ATOM 3032 O THR C 78 9.217 -1.683 12.485 1.00 0.00 O ATOM 3033 CB THR C 78 7.538 -1.736 9.659 1.00 0.00 C ATOM 3034 OG1 THR C 78 8.748 -1.525 8.945 1.00 0.00 O ATOM 3035 CG2 THR C 78 6.350 -1.318 8.791 1.00 0.00 C ATOM 0 H THR C 78 7.526 0.736 9.577 1.00 0.00 H new ATOM 0 HA THR C 78 6.855 -1.297 11.678 1.00 0.00 H new ATOM 0 HB THR C 78 7.443 -2.792 9.912 1.00 0.00 H new ATOM 0 HG1 THR C 78 8.898 -0.563 8.833 1.00 0.00 H new ATOM 0 HG21 THR C 78 6.340 -1.913 7.877 1.00 0.00 H new ATOM 0 HG22 THR C 78 5.423 -1.481 9.340 1.00 0.00 H new ATOM 0 HG23 THR C 78 6.440 -0.262 8.536 1.00 0.00 H new ATOM 3043 N TYR C 79 9.823 -0.075 11.115 1.00 0.00 N ATOM 3044 CA TYR C 79 11.191 -0.031 11.698 1.00 0.00 C ATOM 3045 C TYR C 79 11.112 0.412 13.160 1.00 0.00 C ATOM 3046 O TYR C 79 11.818 -0.092 14.010 1.00 0.00 O ATOM 3047 CB TYR C 79 11.947 1.001 10.860 1.00 0.00 C ATOM 3048 CG TYR C 79 13.377 0.550 10.673 1.00 0.00 C ATOM 3049 CD1 TYR C 79 13.656 -0.627 9.967 1.00 0.00 C ATOM 3050 CD2 TYR C 79 14.424 1.310 11.207 1.00 0.00 C ATOM 3051 CE1 TYR C 79 14.982 -1.042 9.795 1.00 0.00 C ATOM 3052 CE2 TYR C 79 15.750 0.895 11.035 1.00 0.00 C ATOM 3053 CZ TYR C 79 16.029 -0.281 10.329 1.00 0.00 C ATOM 3054 OH TYR C 79 17.335 -0.692 10.160 1.00 0.00 O ATOM 0 H TYR C 79 9.651 0.587 10.358 1.00 0.00 H new ATOM 0 HA TYR C 79 11.686 -1.002 11.681 1.00 0.00 H new ATOM 0 HB2 TYR C 79 11.463 1.123 9.891 1.00 0.00 H new ATOM 0 HB3 TYR C 79 11.923 1.973 11.353 1.00 0.00 H new ATOM 0 HD1 TYR C 79 12.848 -1.214 9.555 1.00 0.00 H new ATOM 0 HD2 TYR C 79 14.209 2.217 11.752 1.00 0.00 H new ATOM 0 HE1 TYR C 79 15.197 -1.949 9.250 1.00 0.00 H new ATOM 0 HE2 TYR C 79 16.557 1.482 11.447 1.00 0.00 H new ATOM 0 HH TYR C 79 17.898 -0.286 10.852 1.00 0.00 H new ATOM 3064 N LYS C 80 10.250 1.348 13.461 1.00 0.00 N ATOM 3065 CA LYS C 80 10.124 1.814 14.870 1.00 0.00 C ATOM 3066 C LYS C 80 9.596 0.680 15.752 1.00 0.00 C ATOM 3067 O LYS C 80 9.960 0.558 16.905 1.00 0.00 O ATOM 3068 CB LYS C 80 9.119 2.964 14.822 1.00 0.00 C ATOM 3069 CG LYS C 80 8.613 3.260 16.235 1.00 0.00 C ATOM 3070 CD LYS C 80 8.623 4.771 16.477 1.00 0.00 C ATOM 3071 CE LYS C 80 9.035 5.054 17.923 1.00 0.00 C ATOM 3072 NZ LYS C 80 9.105 6.538 18.020 1.00 0.00 N ATOM 0 H LYS C 80 9.631 1.807 12.793 1.00 0.00 H new ATOM 0 HA LYS C 80 11.081 2.128 15.288 1.00 0.00 H new ATOM 0 HB2 LYS C 80 9.587 3.853 14.399 1.00 0.00 H new ATOM 0 HB3 LYS C 80 8.283 2.704 14.172 1.00 0.00 H new ATOM 0 HG2 LYS C 80 7.604 2.868 16.360 1.00 0.00 H new ATOM 0 HG3 LYS C 80 9.243 2.759 16.970 1.00 0.00 H new ATOM 0 HD2 LYS C 80 9.316 5.256 15.789 1.00 0.00 H new ATOM 0 HD3 LYS C 80 7.635 5.188 16.281 1.00 0.00 H new ATOM 0 HE2 LYS C 80 8.310 4.646 18.627 1.00 0.00 H new ATOM 0 HE3 LYS C 80 9.997 4.597 18.156 1.00 0.00 H new ATOM 0 HZ1 LYS C 80 9.382 6.810 18.985 1.00 0.00 H new ATOM 0 HZ2 LYS C 80 9.808 6.897 17.343 1.00 0.00 H new ATOM 0 HZ3 LYS C 80 8.173 6.945 17.800 1.00 0.00 H new ATOM 3086 N VAL C 81 8.740 -0.152 15.221 1.00 0.00 N ATOM 3087 CA VAL C 81 8.196 -1.275 16.037 1.00 0.00 C ATOM 3088 C VAL C 81 9.344 -2.134 16.571 1.00 0.00 C ATOM 3089 O VAL C 81 9.264 -2.697 17.645 1.00 0.00 O ATOM 3090 CB VAL C 81 7.322 -2.079 15.074 1.00 0.00 C ATOM 3091 CG1 VAL C 81 6.959 -3.421 15.714 1.00 0.00 C ATOM 3092 CG2 VAL C 81 6.041 -1.297 14.774 1.00 0.00 C ATOM 0 H VAL C 81 8.396 -0.103 14.262 1.00 0.00 H new ATOM 0 HA VAL C 81 7.629 -0.927 16.900 1.00 0.00 H new ATOM 0 HB VAL C 81 7.869 -2.253 14.147 1.00 0.00 H new ATOM 0 HG11 VAL C 81 6.336 -3.995 15.028 1.00 0.00 H new ATOM 0 HG12 VAL C 81 7.870 -3.979 15.930 1.00 0.00 H new ATOM 0 HG13 VAL C 81 6.412 -3.246 16.641 1.00 0.00 H new ATOM 0 HG21 VAL C 81 5.417 -1.870 14.087 1.00 0.00 H new ATOM 0 HG22 VAL C 81 5.495 -1.124 15.701 1.00 0.00 H new ATOM 0 HG23 VAL C 81 6.297 -0.340 14.319 1.00 0.00 H new ATOM 3102 N ARG C 82 10.414 -2.231 15.832 1.00 0.00 N ATOM 3103 CA ARG C 82 11.571 -3.045 16.299 1.00 0.00 C ATOM 3104 C ARG C 82 12.597 -2.141 16.984 1.00 0.00 C ATOM 3105 O ARG C 82 13.551 -2.605 17.577 1.00 0.00 O ATOM 3106 CB ARG C 82 12.160 -3.665 15.030 1.00 0.00 C ATOM 3107 CG ARG C 82 13.456 -4.402 15.374 1.00 0.00 C ATOM 3108 CD ARG C 82 14.071 -4.976 14.097 1.00 0.00 C ATOM 3109 NE ARG C 82 14.812 -6.191 14.538 1.00 0.00 N ATOM 3110 CZ ARG C 82 15.665 -6.765 13.734 1.00 0.00 C ATOM 3111 NH1 ARG C 82 15.871 -6.277 12.541 1.00 0.00 N ATOM 3112 NH2 ARG C 82 16.313 -7.829 14.123 1.00 0.00 N ATOM 0 H ARG C 82 10.537 -1.782 14.925 1.00 0.00 H new ATOM 0 HA ARG C 82 11.281 -3.807 17.022 1.00 0.00 H new ATOM 0 HB2 ARG C 82 11.444 -4.356 14.584 1.00 0.00 H new ATOM 0 HB3 ARG C 82 12.356 -2.888 14.291 1.00 0.00 H new ATOM 0 HG2 ARG C 82 14.158 -3.720 15.854 1.00 0.00 H new ATOM 0 HG3 ARG C 82 13.254 -5.203 16.085 1.00 0.00 H new ATOM 0 HD2 ARG C 82 13.302 -5.226 13.367 1.00 0.00 H new ATOM 0 HD3 ARG C 82 14.739 -4.257 13.623 1.00 0.00 H new ATOM 0 HE ARG C 82 14.652 -6.575 15.469 1.00 0.00 H new ATOM 0 HH11 ARG C 82 15.365 -5.446 12.236 1.00 0.00 H new ATOM 0 HH12 ARG C 82 16.538 -6.727 11.914 1.00 0.00 H new ATOM 0 HH21 ARG C 82 16.153 -8.212 15.055 1.00 0.00 H new ATOM 0 HH22 ARG C 82 16.980 -8.278 13.495 1.00 0.00 H new ATOM 3126 N TYR C 83 12.406 -0.852 16.909 1.00 0.00 N ATOM 3127 CA TYR C 83 13.368 0.083 17.558 1.00 0.00 C ATOM 3128 C TYR C 83 12.772 0.622 18.861 1.00 0.00 C ATOM 3129 O TYR C 83 13.480 1.072 19.739 1.00 0.00 O ATOM 3130 CB TYR C 83 13.564 1.213 16.547 1.00 0.00 C ATOM 3131 CG TYR C 83 14.585 0.797 15.516 1.00 0.00 C ATOM 3132 CD1 TYR C 83 14.498 -0.462 14.910 1.00 0.00 C ATOM 3133 CD2 TYR C 83 15.621 1.671 15.166 1.00 0.00 C ATOM 3134 CE1 TYR C 83 15.445 -0.847 13.954 1.00 0.00 C ATOM 3135 CE2 TYR C 83 16.570 1.287 14.210 1.00 0.00 C ATOM 3136 CZ TYR C 83 16.481 0.028 13.604 1.00 0.00 C ATOM 3137 OH TYR C 83 17.416 -0.351 12.662 1.00 0.00 O ATOM 0 H TYR C 83 11.626 -0.406 16.427 1.00 0.00 H new ATOM 0 HA TYR C 83 14.311 -0.400 17.814 1.00 0.00 H new ATOM 0 HB2 TYR C 83 12.617 1.449 16.061 1.00 0.00 H new ATOM 0 HB3 TYR C 83 13.895 2.118 17.057 1.00 0.00 H new ATOM 0 HD1 TYR C 83 13.699 -1.137 15.180 1.00 0.00 H new ATOM 0 HD2 TYR C 83 15.689 2.642 15.634 1.00 0.00 H new ATOM 0 HE1 TYR C 83 15.377 -1.818 13.487 1.00 0.00 H new ATOM 0 HE2 TYR C 83 17.369 1.961 13.941 1.00 0.00 H new ATOM 0 HH TYR C 83 16.979 -0.879 11.961 1.00 0.00 H new ATOM 3274 N PHE C 93 18.123 6.135 10.714 1.00 0.00 N ATOM 3275 CA PHE C 93 17.491 5.994 9.370 1.00 0.00 C ATOM 3276 C PHE C 93 18.414 6.566 8.291 1.00 0.00 C ATOM 3277 O PHE C 93 18.951 7.646 8.441 1.00 0.00 O ATOM 3278 CB PHE C 93 16.201 6.808 9.457 1.00 0.00 C ATOM 3279 CG PHE C 93 15.038 5.965 8.994 1.00 0.00 C ATOM 3280 CD1 PHE C 93 14.913 4.644 9.437 1.00 0.00 C ATOM 3281 CD2 PHE C 93 14.084 6.506 8.122 1.00 0.00 C ATOM 3282 CE1 PHE C 93 13.833 3.862 9.009 1.00 0.00 C ATOM 3283 CE2 PHE C 93 13.004 5.724 7.695 1.00 0.00 C ATOM 3284 CZ PHE C 93 12.879 4.402 8.138 1.00 0.00 C ATOM 0 HA PHE C 93 17.302 4.953 9.107 1.00 0.00 H new ATOM 0 HB2 PHE C 93 16.037 7.140 10.482 1.00 0.00 H new ATOM 0 HB3 PHE C 93 16.282 7.704 8.841 1.00 0.00 H new ATOM 0 HD1 PHE C 93 15.649 4.227 10.109 1.00 0.00 H new ATOM 0 HD2 PHE C 93 14.182 7.526 7.779 1.00 0.00 H new ATOM 0 HE1 PHE C 93 13.736 2.842 9.351 1.00 0.00 H new ATOM 0 HE2 PHE C 93 12.267 6.141 7.024 1.00 0.00 H new ATOM 0 HZ PHE C 93 12.046 3.798 7.808 1.00 0.00 H new ATOM 3294 N PRO C 94 18.568 5.817 7.234 1.00 0.00 N ATOM 3295 CA PRO C 94 19.437 6.250 6.113 1.00 0.00 C ATOM 3296 C PRO C 94 18.755 7.352 5.295 1.00 0.00 C ATOM 3297 O PRO C 94 17.602 7.244 4.927 1.00 0.00 O ATOM 3298 CB PRO C 94 19.605 4.982 5.280 1.00 0.00 C ATOM 3299 CG PRO C 94 18.401 4.149 5.592 1.00 0.00 C ATOM 3300 CD PRO C 94 17.955 4.508 6.986 1.00 0.00 C ATOM 0 HA PRO C 94 20.387 6.666 6.447 1.00 0.00 H new ATOM 0 HB2 PRO C 94 19.660 5.213 4.216 1.00 0.00 H new ATOM 0 HB3 PRO C 94 20.525 4.458 5.540 1.00 0.00 H new ATOM 0 HG2 PRO C 94 17.605 4.341 4.873 1.00 0.00 H new ATOM 0 HG3 PRO C 94 18.641 3.088 5.527 1.00 0.00 H new ATOM 0 HD2 PRO C 94 16.868 4.557 7.056 1.00 0.00 H new ATOM 0 HD3 PRO C 94 18.288 3.768 7.714 1.00 0.00 H new ATOM 3308 N ILE C 95 19.466 8.406 5.001 1.00 0.00 N ATOM 3309 CA ILE C 95 18.870 9.514 4.200 1.00 0.00 C ATOM 3310 C ILE C 95 19.889 10.003 3.165 1.00 0.00 C ATOM 3311 O ILE C 95 21.057 10.158 3.459 1.00 0.00 O ATOM 3312 CB ILE C 95 18.557 10.617 5.213 1.00 0.00 C ATOM 3313 CG1 ILE C 95 17.591 10.076 6.272 1.00 0.00 C ATOM 3314 CG2 ILE C 95 17.910 11.803 4.494 1.00 0.00 C ATOM 3315 CD1 ILE C 95 16.186 9.957 5.676 1.00 0.00 C ATOM 0 H ILE C 95 20.436 8.548 5.281 1.00 0.00 H new ATOM 0 HA ILE C 95 17.977 9.206 3.656 1.00 0.00 H new ATOM 0 HB ILE C 95 19.480 10.942 5.692 1.00 0.00 H new ATOM 0 HG12 ILE C 95 17.931 9.102 6.624 1.00 0.00 H new ATOM 0 HG13 ILE C 95 17.575 10.740 7.136 1.00 0.00 H new ATOM 0 HG21 ILE C 95 17.687 12.589 5.216 1.00 0.00 H new ATOM 0 HG22 ILE C 95 18.595 12.188 3.739 1.00 0.00 H new ATOM 0 HG23 ILE C 95 16.987 11.478 4.015 1.00 0.00 H new ATOM 0 HD11 ILE C 95 15.502 9.572 6.432 1.00 0.00 H new ATOM 0 HD12 ILE C 95 15.847 10.939 5.346 1.00 0.00 H new ATOM 0 HD13 ILE C 95 16.208 9.276 4.826 1.00 0.00 H new ATOM 3327 N ALA C 96 19.463 10.235 1.953 1.00 0.00 N ATOM 3328 CA ALA C 96 20.420 10.698 0.908 1.00 0.00 C ATOM 3329 C ALA C 96 19.735 11.659 -0.068 1.00 0.00 C ATOM 3330 O ALA C 96 18.537 11.852 -0.012 1.00 0.00 O ATOM 3331 CB ALA C 96 20.845 9.423 0.180 1.00 0.00 C ATOM 0 H ALA C 96 18.498 10.125 1.642 1.00 0.00 H new ATOM 0 HA ALA C 96 21.265 11.237 1.338 1.00 0.00 H new ATOM 0 HB1 ALA C 96 21.553 9.674 -0.610 1.00 0.00 H new ATOM 0 HB2 ALA C 96 21.317 8.740 0.887 1.00 0.00 H new ATOM 0 HB3 ALA C 96 19.969 8.944 -0.257 1.00 0.00 H new ATOM 3337 N PRO C 97 20.528 12.220 -0.941 1.00 0.00 N ATOM 3338 CA PRO C 97 20.000 13.162 -1.956 1.00 0.00 C ATOM 3339 C PRO C 97 19.224 12.389 -3.026 1.00 0.00 C ATOM 3340 O PRO C 97 19.695 12.186 -4.127 1.00 0.00 O ATOM 3341 CB PRO C 97 21.256 13.799 -2.544 1.00 0.00 C ATOM 3342 CG PRO C 97 22.344 12.800 -2.308 1.00 0.00 C ATOM 3343 CD PRO C 97 21.978 12.031 -1.063 1.00 0.00 C ATOM 0 HA PRO C 97 19.312 13.902 -1.547 1.00 0.00 H new ATOM 0 HB2 PRO C 97 21.133 14.005 -3.607 1.00 0.00 H new ATOM 0 HB3 PRO C 97 21.481 14.749 -2.059 1.00 0.00 H new ATOM 0 HG2 PRO C 97 22.442 12.128 -3.161 1.00 0.00 H new ATOM 0 HG3 PRO C 97 23.305 13.299 -2.184 1.00 0.00 H new ATOM 0 HD2 PRO C 97 22.236 10.976 -1.155 1.00 0.00 H new ATOM 0 HD3 PRO C 97 22.505 12.413 -0.189 1.00 0.00 H new ATOM 3351 N GLU C 98 18.040 11.950 -2.702 1.00 0.00 N ATOM 3352 CA GLU C 98 17.224 11.183 -3.682 1.00 0.00 C ATOM 3353 C GLU C 98 15.896 10.863 -3.019 1.00 0.00 C ATOM 3354 O GLU C 98 14.844 10.917 -3.625 1.00 0.00 O ATOM 3355 CB GLU C 98 18.018 9.907 -3.960 1.00 0.00 C ATOM 3356 CG GLU C 98 17.516 9.265 -5.255 1.00 0.00 C ATOM 3357 CD GLU C 98 18.231 9.897 -6.450 1.00 0.00 C ATOM 3358 OE1 GLU C 98 18.885 10.909 -6.257 1.00 0.00 O ATOM 3359 OE2 GLU C 98 18.115 9.358 -7.538 1.00 0.00 O ATOM 0 H GLU C 98 17.600 12.091 -1.793 1.00 0.00 H new ATOM 0 HA GLU C 98 17.028 11.721 -4.609 1.00 0.00 H new ATOM 0 HB2 GLU C 98 19.080 10.138 -4.044 1.00 0.00 H new ATOM 0 HB3 GLU C 98 17.908 9.210 -3.130 1.00 0.00 H new ATOM 0 HG2 GLU C 98 17.699 8.191 -5.235 1.00 0.00 H new ATOM 0 HG3 GLU C 98 16.439 9.403 -5.348 1.00 0.00 H new ATOM 3366 N ILE C 99 15.949 10.573 -1.753 1.00 0.00 N ATOM 3367 CA ILE C 99 14.712 10.292 -0.995 1.00 0.00 C ATOM 3368 C ILE C 99 14.888 10.824 0.426 1.00 0.00 C ATOM 3369 O ILE C 99 15.933 10.679 1.023 1.00 0.00 O ATOM 3370 CB ILE C 99 14.566 8.766 -1.008 1.00 0.00 C ATOM 3371 CG1 ILE C 99 13.082 8.392 -1.108 1.00 0.00 C ATOM 3372 CG2 ILE C 99 15.153 8.172 0.276 1.00 0.00 C ATOM 3373 CD1 ILE C 99 12.257 9.298 -0.190 1.00 0.00 C ATOM 0 H ILE C 99 16.809 10.519 -1.208 1.00 0.00 H new ATOM 0 HA ILE C 99 13.826 10.765 -1.418 1.00 0.00 H new ATOM 0 HB ILE C 99 15.104 8.366 -1.867 1.00 0.00 H new ATOM 0 HG12 ILE C 99 12.740 8.494 -2.138 1.00 0.00 H new ATOM 0 HG13 ILE C 99 12.941 7.348 -0.827 1.00 0.00 H new ATOM 0 HG21 ILE C 99 15.045 7.088 0.258 1.00 0.00 H new ATOM 0 HG22 ILE C 99 16.210 8.430 0.346 1.00 0.00 H new ATOM 0 HG23 ILE C 99 14.623 8.575 1.139 1.00 0.00 H new ATOM 0 HD11 ILE C 99 11.203 9.029 -0.264 1.00 0.00 H new ATOM 0 HD12 ILE C 99 12.592 9.174 0.840 1.00 0.00 H new ATOM 0 HD13 ILE C 99 12.388 10.337 -0.491 1.00 0.00 H new ATOM 3385 N ALA C 100 13.867 11.443 0.945 1.00 0.00 N ATOM 3386 CA ALA C 100 13.902 12.028 2.327 1.00 0.00 C ATOM 3387 C ALA C 100 13.503 13.501 2.248 1.00 0.00 C ATOM 3388 O ALA C 100 12.869 14.035 3.137 1.00 0.00 O ATOM 3389 CB ALA C 100 15.342 11.904 2.835 1.00 0.00 C ATOM 0 H ALA C 100 12.980 11.575 0.459 1.00 0.00 H new ATOM 0 HA ALA C 100 13.216 11.511 2.998 1.00 0.00 H new ATOM 0 HB1 ALA C 100 15.410 12.319 3.840 1.00 0.00 H new ATOM 0 HB2 ALA C 100 15.631 10.853 2.856 1.00 0.00 H new ATOM 0 HB3 ALA C 100 16.011 12.451 2.170 1.00 0.00 H new ATOM 3395 N LEU C 101 13.868 14.160 1.181 1.00 0.00 N ATOM 3396 CA LEU C 101 13.506 15.597 1.033 1.00 0.00 C ATOM 3397 C LEU C 101 11.988 15.761 1.123 1.00 0.00 C ATOM 3398 O LEU C 101 11.486 16.604 1.839 1.00 0.00 O ATOM 3399 CB LEU C 101 14.007 15.993 -0.357 1.00 0.00 C ATOM 3400 CG LEU C 101 13.960 17.515 -0.503 1.00 0.00 C ATOM 3401 CD1 LEU C 101 12.505 17.984 -0.497 1.00 0.00 C ATOM 3402 CD2 LEU C 101 14.708 18.160 0.666 1.00 0.00 C ATOM 0 H LEU C 101 14.401 13.764 0.406 1.00 0.00 H new ATOM 0 HA LEU C 101 13.945 16.219 1.813 1.00 0.00 H new ATOM 0 HB2 LEU C 101 15.026 15.634 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU C 101 13.391 15.524 -1.124 1.00 0.00 H new ATOM 0 HG LEU C 101 14.430 17.805 -1.442 1.00 0.00 H new ATOM 0 HD11 LEU C 101 12.472 19.069 -0.601 1.00 0.00 H new ATOM 0 HD12 LEU C 101 11.971 17.523 -1.328 1.00 0.00 H new ATOM 0 HD13 LEU C 101 12.033 17.695 0.442 1.00 0.00 H new ATOM 0 HD21 LEU C 101 14.676 19.245 0.564 1.00 0.00 H new ATOM 0 HD22 LEU C 101 14.236 17.869 1.605 1.00 0.00 H new ATOM 0 HD23 LEU C 101 15.745 17.826 0.663 1.00 0.00 H new ATOM 3414 N GLU C 102 11.252 14.953 0.407 1.00 0.00 N ATOM 3415 CA GLU C 102 9.767 15.057 0.457 1.00 0.00 C ATOM 3416 C GLU C 102 9.284 14.828 1.891 1.00 0.00 C ATOM 3417 O GLU C 102 8.426 15.529 2.389 1.00 0.00 O ATOM 3418 CB GLU C 102 9.260 13.949 -0.465 1.00 0.00 C ATOM 3419 CG GLU C 102 9.958 14.056 -1.822 1.00 0.00 C ATOM 3420 CD GLU C 102 11.003 12.946 -1.949 1.00 0.00 C ATOM 3421 OE1 GLU C 102 11.247 12.272 -0.962 1.00 0.00 O ATOM 3422 OE2 GLU C 102 11.542 12.788 -3.033 1.00 0.00 O ATOM 0 H GLU C 102 11.616 14.226 -0.209 1.00 0.00 H new ATOM 0 HA GLU C 102 9.404 16.037 0.146 1.00 0.00 H new ATOM 0 HB2 GLU C 102 9.455 12.973 -0.020 1.00 0.00 H new ATOM 0 HB3 GLU C 102 8.181 14.032 -0.592 1.00 0.00 H new ATOM 0 HG2 GLU C 102 9.227 13.975 -2.626 1.00 0.00 H new ATOM 0 HG3 GLU C 102 10.434 15.031 -1.922 1.00 0.00 H new ATOM 3429 N LEU C 103 9.840 13.855 2.560 1.00 0.00 N ATOM 3430 CA LEU C 103 9.428 13.582 3.962 1.00 0.00 C ATOM 3431 C LEU C 103 9.713 14.807 4.834 1.00 0.00 C ATOM 3432 O LEU C 103 9.106 14.998 5.868 1.00 0.00 O ATOM 3433 CB LEU C 103 10.294 12.399 4.400 1.00 0.00 C ATOM 3434 CG LEU C 103 9.728 11.103 3.815 1.00 0.00 C ATOM 3435 CD1 LEU C 103 9.714 11.189 2.290 1.00 0.00 C ATOM 3436 CD2 LEU C 103 10.607 9.927 4.248 1.00 0.00 C ATOM 0 H LEU C 103 10.564 13.237 2.193 1.00 0.00 H new ATOM 0 HA LEU C 103 8.364 13.364 4.052 1.00 0.00 H new ATOM 0 HB2 LEU C 103 11.321 12.543 4.064 1.00 0.00 H new ATOM 0 HB3 LEU C 103 10.320 12.338 5.488 1.00 0.00 H new ATOM 0 HG LEU C 103 8.711 10.956 4.178 1.00 0.00 H new ATOM 0 HD11 LEU C 103 9.310 10.264 1.877 1.00 0.00 H new ATOM 0 HD12 LEU C 103 9.091 12.028 1.979 1.00 0.00 H new ATOM 0 HD13 LEU C 103 10.730 11.336 1.925 1.00 0.00 H new ATOM 0 HD21 LEU C 103 10.207 9.002 3.833 1.00 0.00 H new ATOM 0 HD22 LEU C 103 11.623 10.079 3.884 1.00 0.00 H new ATOM 0 HD23 LEU C 103 10.618 9.862 5.336 1.00 0.00 H new ATOM 3448 N LEU C 104 10.633 15.638 4.424 1.00 0.00 N ATOM 3449 CA LEU C 104 10.959 16.851 5.231 1.00 0.00 C ATOM 3450 C LEU C 104 9.682 17.453 5.818 1.00 0.00 C ATOM 3451 O LEU C 104 9.354 17.240 6.969 1.00 0.00 O ATOM 3452 CB LEU C 104 11.604 17.825 4.244 1.00 0.00 C ATOM 3453 CG LEU C 104 11.797 19.183 4.921 1.00 0.00 C ATOM 3454 CD1 LEU C 104 12.933 19.089 5.941 1.00 0.00 C ATOM 3455 CD2 LEU C 104 12.146 20.234 3.865 1.00 0.00 C ATOM 0 H LEU C 104 11.173 15.530 3.566 1.00 0.00 H new ATOM 0 HA LEU C 104 11.619 16.623 6.068 1.00 0.00 H new ATOM 0 HB2 LEU C 104 12.564 17.435 3.907 1.00 0.00 H new ATOM 0 HB3 LEU C 104 10.976 17.933 3.360 1.00 0.00 H new ATOM 0 HG LEU C 104 10.876 19.469 5.429 1.00 0.00 H new ATOM 0 HD11 LEU C 104 13.070 20.057 6.423 1.00 0.00 H new ATOM 0 HD12 LEU C 104 12.685 18.341 6.694 1.00 0.00 H new ATOM 0 HD13 LEU C 104 13.854 18.802 5.434 1.00 0.00 H new ATOM 0 HD21 LEU C 104 12.284 21.202 4.347 1.00 0.00 H new ATOM 0 HD22 LEU C 104 13.067 19.947 3.357 1.00 0.00 H new ATOM 0 HD23 LEU C 104 11.337 20.302 3.138 1.00 0.00 H new ATOM 3467 N MET C 105 8.956 18.201 5.035 1.00 0.00 N ATOM 3468 CA MET C 105 7.698 18.815 5.548 1.00 0.00 C ATOM 3469 C MET C 105 6.610 17.746 5.685 1.00 0.00 C ATOM 3470 O MET C 105 5.679 17.889 6.451 1.00 0.00 O ATOM 3471 CB MET C 105 7.307 19.851 4.496 1.00 0.00 C ATOM 3472 CG MET C 105 7.320 21.246 5.125 1.00 0.00 C ATOM 3473 SD MET C 105 5.818 21.477 6.109 1.00 0.00 S ATOM 3474 CE MET C 105 5.907 23.279 6.239 1.00 0.00 C ATOM 0 H MET C 105 9.178 18.414 4.063 1.00 0.00 H new ATOM 0 HA MET C 105 7.826 19.265 6.532 1.00 0.00 H new ATOM 0 HB2 MET C 105 8.001 19.812 3.656 1.00 0.00 H new ATOM 0 HB3 MET C 105 6.316 19.628 4.101 1.00 0.00 H new ATOM 0 HG2 MET C 105 8.202 21.365 5.754 1.00 0.00 H new ATOM 0 HG3 MET C 105 7.379 22.007 4.347 1.00 0.00 H new ATOM 0 HE1 MET C 105 5.059 23.644 6.819 1.00 0.00 H new ATOM 0 HE2 MET C 105 6.835 23.563 6.735 1.00 0.00 H new ATOM 0 HE3 MET C 105 5.880 23.718 5.241 1.00 0.00 H new ATOM 3484 N ALA C 106 6.723 16.673 4.950 1.00 0.00 N ATOM 3485 CA ALA C 106 5.698 15.596 5.041 1.00 0.00 C ATOM 3486 C ALA C 106 5.793 14.896 6.400 1.00 0.00 C ATOM 3487 O ALA C 106 4.797 14.516 6.982 1.00 0.00 O ATOM 3488 CB ALA C 106 6.038 14.625 3.909 1.00 0.00 C ATOM 0 H ALA C 106 7.481 16.496 4.291 1.00 0.00 H new ATOM 0 HA ALA C 106 4.682 15.981 4.951 1.00 0.00 H new ATOM 0 HB1 ALA C 106 5.325 13.801 3.910 1.00 0.00 H new ATOM 0 HB2 ALA C 106 5.987 15.148 2.954 1.00 0.00 H new ATOM 0 HB3 ALA C 106 7.045 14.234 4.055 1.00 0.00 H new ATOM 3494 N ALA C 107 6.982 14.732 6.912 1.00 0.00 N ATOM 3495 CA ALA C 107 7.136 14.068 8.236 1.00 0.00 C ATOM 3496 C ALA C 107 6.723 15.032 9.346 1.00 0.00 C ATOM 3497 O ALA C 107 5.984 14.683 10.246 1.00 0.00 O ATOM 3498 CB ALA C 107 8.623 13.748 8.347 1.00 0.00 C ATOM 0 H ALA C 107 7.852 15.029 6.471 1.00 0.00 H new ATOM 0 HA ALA C 107 6.517 13.175 8.328 1.00 0.00 H new ATOM 0 HB1 ALA C 107 8.819 13.255 9.299 1.00 0.00 H new ATOM 0 HB2 ALA C 107 8.915 13.088 7.530 1.00 0.00 H new ATOM 0 HB3 ALA C 107 9.199 14.672 8.291 1.00 0.00 H new ATOM 3504 N ASN C 108 7.197 16.246 9.285 1.00 0.00 N ATOM 3505 CA ASN C 108 6.839 17.240 10.333 1.00 0.00 C ATOM 3506 C ASN C 108 5.318 17.373 10.433 1.00 0.00 C ATOM 3507 O ASN C 108 4.773 17.593 11.496 1.00 0.00 O ATOM 3508 CB ASN C 108 7.462 18.555 9.862 1.00 0.00 C ATOM 3509 CG ASN C 108 8.971 18.525 10.110 1.00 0.00 C ATOM 3510 OD1 ASN C 108 9.482 19.284 11.042 1.00 0.00 O flip ATOM 3511 ND2 ASN C 108 9.692 17.804 9.450 1.00 0.00 N flip ATOM 0 H ASN C 108 7.818 16.592 8.553 1.00 0.00 H new ATOM 0 HA ASN C 108 7.200 16.950 11.320 1.00 0.00 H new ATOM 0 HB2 ASN C 108 7.260 18.705 8.801 1.00 0.00 H new ATOM 0 HB3 ASN C 108 7.012 19.393 10.394 1.00 0.00 H new ATOM 0 HD21 ASN C 108 9.292 17.211 8.722 1.00 0.00 H new ATOM 0 HD22 ASN C 108 10.697 17.791 9.624 1.00 0.00 H new ATOM 3518 N PHE C 109 4.630 17.237 9.333 1.00 0.00 N ATOM 3519 CA PHE C 109 3.144 17.352 9.365 1.00 0.00 C ATOM 3520 C PHE C 109 2.540 16.156 10.104 1.00 0.00 C ATOM 3521 O PHE C 109 1.471 16.242 10.675 1.00 0.00 O ATOM 3522 CB PHE C 109 2.716 17.351 7.897 1.00 0.00 C ATOM 3523 CG PHE C 109 1.231 17.095 7.807 1.00 0.00 C ATOM 3524 CD1 PHE C 109 0.330 18.008 8.368 1.00 0.00 C ATOM 3525 CD2 PHE C 109 0.755 15.947 7.164 1.00 0.00 C ATOM 3526 CE1 PHE C 109 -1.047 17.773 8.285 1.00 0.00 C ATOM 3527 CE2 PHE C 109 -0.623 15.711 7.081 1.00 0.00 C ATOM 3528 CZ PHE C 109 -1.523 16.624 7.641 1.00 0.00 C ATOM 0 H PHE C 109 5.032 17.051 8.414 1.00 0.00 H new ATOM 0 HA PHE C 109 2.808 18.249 9.885 1.00 0.00 H new ATOM 0 HB2 PHE C 109 2.960 18.308 7.435 1.00 0.00 H new ATOM 0 HB3 PHE C 109 3.262 16.584 7.348 1.00 0.00 H new ATOM 0 HD1 PHE C 109 0.698 18.894 8.865 1.00 0.00 H new ATOM 0 HD2 PHE C 109 1.450 15.243 6.732 1.00 0.00 H new ATOM 0 HE1 PHE C 109 -1.742 18.477 8.717 1.00 0.00 H new ATOM 0 HE2 PHE C 109 -0.991 14.825 6.585 1.00 0.00 H new ATOM 0 HZ PHE C 109 -2.586 16.443 7.577 1.00 0.00 H new ATOM 3538 N LEU C 110 3.219 15.043 10.100 1.00 0.00 N ATOM 3539 CA LEU C 110 2.688 13.841 10.805 1.00 0.00 C ATOM 3540 C LEU C 110 3.102 13.870 12.279 1.00 0.00 C ATOM 3541 O LEU C 110 3.375 12.847 12.876 1.00 0.00 O ATOM 3542 CB LEU C 110 3.326 12.649 10.092 1.00 0.00 C ATOM 3543 CG LEU C 110 2.426 12.200 8.942 1.00 0.00 C ATOM 3544 CD1 LEU C 110 2.068 13.405 8.070 1.00 0.00 C ATOM 3545 CD2 LEU C 110 3.164 11.161 8.094 1.00 0.00 C ATOM 0 H LEU C 110 4.119 14.913 9.639 1.00 0.00 H new ATOM 0 HA LEU C 110 1.599 13.794 10.781 1.00 0.00 H new ATOM 0 HB2 LEU C 110 4.310 12.924 9.712 1.00 0.00 H new ATOM 0 HB3 LEU C 110 3.473 11.828 10.794 1.00 0.00 H new ATOM 0 HG LEU C 110 1.514 11.761 9.346 1.00 0.00 H new ATOM 0 HD11 LEU C 110 1.426 13.083 7.250 1.00 0.00 H new ATOM 0 HD12 LEU C 110 1.543 14.147 8.672 1.00 0.00 H new ATOM 0 HD13 LEU C 110 2.980 13.845 7.666 1.00 0.00 H new ATOM 0 HD21 LEU C 110 2.523 10.840 7.273 1.00 0.00 H new ATOM 0 HD22 LEU C 110 4.076 11.601 7.691 1.00 0.00 H new ATOM 0 HD23 LEU C 110 3.419 10.301 8.713 1.00 0.00 H new ATOM 3557 N ASP C 111 3.152 15.033 12.870 1.00 0.00 N ATOM 3558 CA ASP C 111 3.552 15.124 14.303 1.00 0.00 C ATOM 3559 C ASP C 111 4.980 14.602 14.487 1.00 0.00 C ATOM 3560 O ASP C 111 5.502 13.890 13.654 1.00 0.00 O ATOM 3561 CB ASP C 111 2.554 14.237 15.049 1.00 0.00 C ATOM 3562 CG ASP C 111 2.145 14.918 16.356 1.00 0.00 C ATOM 3563 OD1 ASP C 111 2.971 14.985 17.251 1.00 0.00 O ATOM 3564 OD2 ASP C 111 1.011 15.360 16.440 1.00 0.00 O ATOM 0 H ASP C 111 2.933 15.923 12.423 1.00 0.00 H new ATOM 0 HA ASP C 111 3.540 16.149 14.672 1.00 0.00 H new ATOM 0 HB2 ASP C 111 1.675 14.058 14.429 1.00 0.00 H new ATOM 0 HB3 ASP C 111 3.000 13.265 15.257 1.00 0.00 H new ATOM 3569 N CYS C 112 5.614 14.954 15.572 1.00 0.00 N ATOM 3570 CA CYS C 112 7.008 14.479 15.808 1.00 0.00 C ATOM 3571 C CYS C 112 6.998 13.218 16.676 1.00 0.00 C ATOM 3572 O CYS C 112 7.564 13.262 17.756 1.00 0.00 O ATOM 3573 CB CYS C 112 7.699 15.630 16.540 1.00 0.00 C ATOM 3574 SG CYS C 112 9.494 15.417 16.444 1.00 0.00 S ATOM 3575 OXT CYS C 112 6.425 12.231 16.246 1.00 0.00 O ATOM 0 H CYS C 112 5.228 15.549 16.305 1.00 0.00 H new ATOM 0 HA CYS C 112 7.519 14.220 14.881 1.00 0.00 H new ATOM 0 HB2 CYS C 112 7.411 16.583 16.095 1.00 0.00 H new ATOM 0 HB3 CYS C 112 7.381 15.655 17.582 1.00 0.00 H new ATOM 0 HG CYS C 112 9.957 16.087 15.431 1.00 0.00 H new