USER MOD reduce.3.24.130724 H: found=0, std=0, add=1978, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1974 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 20 ASN : amide:sc= -0.105 K(o=-3.6,f=-4.3!) USER MOD Set 1.2: B 125 ASN : amide:sc= -3.53! K(o=-3.6!,f=-2.4) USER MOD Set 2.1: B 90 THR OG1 : rot -83:sc= 1.2 USER MOD Set 2.2: B 119 ASN : amide:sc= -0.827 K(o=0.37,f=-1.6) USER MOD Set 3.1: B 11 THR OG1 : rot 180:sc= -1.35 USER MOD Set 3.2: B 14 SER OG : rot 40:sc= 0.543 USER MOD Set 4.1: A 90 THR OG1 : rot -85:sc= 1.19 USER MOD Set 4.2: A 119 ASN : amide:sc= -0.836 K(o=0.36,f=-1.5) USER MOD Set 5.1: A 20 ASN : amide:sc= -0.0809 K(o=-3.1,f=-4.4!) USER MOD Set 5.2: A 125 ASN : amide:sc= -3.05 K(o=-3.1,f=-1.9) USER MOD Set 6.1: A 11 THR OG1 : rot 180:sc= -1.33 USER MOD Set 6.2: A 14 SER OG : rot 39:sc= 0.577 USER MOD Single : A 1 ALA N :NH3+ 140:sc= 0.0724 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.192 K(o=-0.19,f=-3!) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -4.21! C(o=-4.2!,f=-6.5!) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0.11) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot -15:sc= -0.997 USER MOD Single : A 26 LYS NZ :NH3+ -164:sc= -0.0253 (180deg=-0.208) USER MOD Single : A 27 HIS : no HD1:sc= -0.0641 X(o=-0.064,f=-0.24) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= -0.238 X(o=-0.24,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot -6:sc= -1.13! USER MOD Single : A 35 ASN : amide:sc= -5.63 K(o=-5.6,f=-8.5!) USER MOD Single : A 46 LYS NZ :NH3+ -153:sc= -0.0107 (180deg=-0.288) USER MOD Single : A 47 THR OG1 : rot 125:sc= 0.621 USER MOD Single : A 48 THR OG1 : rot 100:sc= -0.0437 USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 40:sc= 0.0617 USER MOD Single : A 59 CYS SG : rot 180:sc= -0.404 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -157:sc= -0.334 (180deg=-1.4) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 CYS SG : rot 20:sc= -1.44! USER MOD Single : A 76 THR OG1 : rot 67:sc= 0.0349 USER MOD Single : A 78 ASN : amide:sc=-0.00341 K(o=-0.0034,f=-1.3) USER MOD Single : A 81 THR OG1 : rot 61:sc= 0.415 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 ASN : amide:sc= -2.06! K(o=-2.1!,f=-1.3) USER MOD Single : A 94 THR OG1 : rot 69:sc= -0.0674 USER MOD Single : A 95 ASN : amide:sc= -0.309 K(o=-0.31,f=-4.2!) USER MOD Single : A 96 THR OG1 : rot -71:sc= -0.371 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.161 K(o=-0.16,f=-1.7!) USER MOD Single : A 110 GLN : amide:sc=-0.00105 X(o=-0.0011,f=0) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.274) USER MOD Single : A 124 TYR OH : rot -3:sc= -0.241 USER MOD Single : B 1 ALA N :NH3+ -103:sc= 0.0666 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -0.194 K(o=-0.19,f=-2.9!) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 10 ASN : amide:sc= -4.24! C(o=-4.2!,f=-6.1!) USER MOD Single : B 12 GLN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : B 15 GLN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 TYR OH : rot -18:sc= -1.06 USER MOD Single : B 26 LYS NZ :NH3+ -166:sc= -0.03 (180deg=-0.297) USER MOD Single : B 27 HIS : no HD1:sc= -0.0568 X(o=-0.057,f=-0.27) USER MOD Single : B 28 THR OG1 : rot 180:sc= 0 USER MOD Single : B 29 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.0023) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot -15:sc= -0.98 USER MOD Single : B 35 ASN : amide:sc= -5.59 K(o=-5.6,f=-8.3!) USER MOD Single : B 46 LYS NZ :NH3+ -153:sc=-0.00599 (180deg=-0.268) USER MOD Single : B 47 THR OG1 : rot 123:sc= 0.65 USER MOD Single : B 48 THR OG1 : rot 100:sc= -0.0229 USER MOD Single : B 49 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 54 SER OG : rot 41:sc= 0.054 USER MOD Single : B 59 CYS SG : rot 180:sc= -0.418 USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 MET CE :methyl -157:sc= -0.344 (180deg=-1.52) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 74 CYS SG : rot 20:sc= -1.34! USER MOD Single : B 76 THR OG1 : rot 67:sc= 0.0798 USER MOD Single : B 78 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : B 81 THR OG1 : rot 59:sc= 0.421 USER MOD Single : B 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 86 ASN : amide:sc= -2.18 K(o=-2.2,f=-1.2) USER MOD Single : B 94 THR OG1 : rot 70:sc= -0.081 USER MOD Single : B 95 ASN : amide:sc= -0.266 K(o=-0.27,f=-4.2!) USER MOD Single : B 96 THR OG1 : rot -73:sc= -0.462 USER MOD Single : B 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 GLN : amide:sc= -0.215 K(o=-0.21,f=-1.7!) USER MOD Single : B 110 GLN : amide:sc=-0.00272 X(o=-0.0027,f=0) USER MOD Single : B 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.285) USER MOD Single : B 124 TYR OH : rot -3:sc= -0.203 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -43.647 6.785 -14.202 1.00 0.00 N ATOM 2 CA ALA A 1 -42.831 5.570 -14.465 1.00 0.00 C ATOM 3 C ALA A 1 -41.349 5.847 -14.235 1.00 0.00 C ATOM 4 O ALA A 1 -40.905 6.994 -14.287 1.00 0.00 O ATOM 5 CB ALA A 1 -43.061 5.079 -15.886 1.00 0.00 C ATOM 0 H1 ALA A 1 -44.400 6.859 -14.916 1.00 0.00 H new ATOM 0 H2 ALA A 1 -44.073 6.719 -13.256 1.00 0.00 H new ATOM 0 H3 ALA A 1 -43.040 7.628 -14.250 1.00 0.00 H new ATOM 0 HA ALA A 1 -43.143 4.793 -13.767 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -42.458 4.189 -16.066 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -44.115 4.836 -16.021 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -42.775 5.859 -16.591 1.00 0.00 H new ATOM 13 N GLN A 2 -40.588 4.788 -13.981 1.00 0.00 N ATOM 14 CA GLN A 2 -39.155 4.916 -13.742 1.00 0.00 C ATOM 15 C GLN A 2 -38.883 5.780 -12.516 1.00 0.00 C ATOM 16 O GLN A 2 -39.180 6.975 -12.509 1.00 0.00 O ATOM 17 CB GLN A 2 -38.465 5.514 -14.969 1.00 0.00 C ATOM 18 CG GLN A 2 -38.789 4.788 -16.264 1.00 0.00 C ATOM 19 CD GLN A 2 -38.081 3.451 -16.377 1.00 0.00 C ATOM 20 OE1 GLN A 2 -37.509 2.955 -15.406 1.00 0.00 O ATOM 21 NE2 GLN A 2 -38.117 2.862 -17.566 1.00 0.00 N ATOM 0 H GLN A 2 -40.939 3.832 -13.935 1.00 0.00 H new ATOM 0 HA GLN A 2 -38.751 3.921 -13.557 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -38.757 6.560 -15.066 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -37.386 5.497 -14.813 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -39.866 4.631 -16.329 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -38.507 5.417 -17.109 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -38.603 3.310 -18.343 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -37.659 1.961 -17.703 1.00 0.00 H new ATOM 30 N SER A 3 -38.317 5.169 -11.481 1.00 0.00 N ATOM 31 CA SER A 3 -38.005 5.884 -10.249 1.00 0.00 C ATOM 32 C SER A 3 -36.620 6.516 -10.321 1.00 0.00 C ATOM 33 O SER A 3 -35.923 6.395 -11.329 1.00 0.00 O ATOM 34 CB SER A 3 -38.084 4.935 -9.051 1.00 0.00 C ATOM 35 OG SER A 3 -39.417 4.512 -8.823 1.00 0.00 O ATOM 0 H SER A 3 -38.065 4.181 -11.471 1.00 0.00 H new ATOM 0 HA SER A 3 -38.740 6.679 -10.124 1.00 0.00 H new ATOM 0 HB2 SER A 3 -37.449 4.067 -9.228 1.00 0.00 H new ATOM 0 HB3 SER A 3 -37.700 5.434 -8.161 1.00 0.00 H new ATOM 0 HG SER A 3 -39.441 3.905 -8.054 1.00 0.00 H new ATOM 41 N VAL A 4 -36.224 7.190 -9.246 1.00 0.00 N ATOM 42 CA VAL A 4 -34.921 7.840 -9.190 1.00 0.00 C ATOM 43 C VAL A 4 -33.823 6.840 -8.840 1.00 0.00 C ATOM 44 O VAL A 4 -34.027 5.944 -8.022 1.00 0.00 O ATOM 45 CB VAL A 4 -34.908 8.982 -8.156 1.00 0.00 C ATOM 46 CG1 VAL A 4 -35.721 10.166 -8.655 1.00 0.00 C ATOM 47 CG2 VAL A 4 -35.431 8.494 -6.815 1.00 0.00 C ATOM 0 H VAL A 4 -36.787 7.300 -8.403 1.00 0.00 H new ATOM 0 HA VAL A 4 -34.730 8.254 -10.180 1.00 0.00 H new ATOM 0 HB VAL A 4 -33.878 9.311 -8.020 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -35.699 10.962 -7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -35.295 10.532 -9.589 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -36.752 9.854 -8.823 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -35.414 9.314 -6.098 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -36.454 8.135 -6.932 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -34.801 7.682 -6.452 1.00 0.00 H new ATOM 57 N PRO A 5 -32.638 6.981 -9.459 1.00 0.00 N ATOM 58 CA PRO A 5 -31.506 6.085 -9.209 1.00 0.00 C ATOM 59 C PRO A 5 -30.868 6.324 -7.843 1.00 0.00 C ATOM 60 O PRO A 5 -31.156 7.320 -7.181 1.00 0.00 O ATOM 61 CB PRO A 5 -30.525 6.436 -10.327 1.00 0.00 C ATOM 62 CG PRO A 5 -30.828 7.856 -10.659 1.00 0.00 C ATOM 63 CD PRO A 5 -32.309 8.024 -10.450 1.00 0.00 C ATOM 0 HA PRO A 5 -31.808 5.038 -9.201 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -29.492 6.317 -10.000 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -30.662 5.788 -11.193 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -30.264 8.535 -10.019 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -30.551 8.084 -11.688 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -32.552 9.020 -10.080 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -32.864 7.885 -11.378 1.00 0.00 H new ATOM 71 N PRO A 6 -29.988 5.407 -7.403 1.00 0.00 N ATOM 72 CA PRO A 6 -29.307 5.523 -6.112 1.00 0.00 C ATOM 73 C PRO A 6 -28.237 6.609 -6.118 1.00 0.00 C ATOM 74 O PRO A 6 -27.736 6.995 -7.174 1.00 0.00 O ATOM 75 CB PRO A 6 -28.669 4.147 -5.924 1.00 0.00 C ATOM 76 CG PRO A 6 -28.453 3.641 -7.307 1.00 0.00 C ATOM 77 CD PRO A 6 -29.586 4.188 -8.133 1.00 0.00 C ATOM 0 HA PRO A 6 -29.993 5.803 -5.312 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -27.729 4.217 -5.376 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.320 3.482 -5.356 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -27.491 3.972 -7.697 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -28.447 2.551 -7.327 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -29.267 4.416 -9.150 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -30.408 3.476 -8.208 1.00 0.00 H new ATOM 85 N GLY A 7 -27.892 7.101 -4.933 1.00 0.00 N ATOM 86 CA GLY A 7 -26.884 8.138 -4.826 1.00 0.00 C ATOM 87 C GLY A 7 -25.473 7.582 -4.859 1.00 0.00 C ATOM 88 O GLY A 7 -25.148 6.651 -4.121 1.00 0.00 O ATOM 0 H GLY A 7 -28.293 6.800 -4.045 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.010 8.849 -5.643 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -27.032 8.690 -3.898 1.00 0.00 H new ATOM 92 N ASP A 8 -24.635 8.152 -5.718 1.00 0.00 N ATOM 93 CA ASP A 8 -23.251 7.709 -5.847 1.00 0.00 C ATOM 94 C ASP A 8 -22.569 7.643 -4.485 1.00 0.00 C ATOM 95 O ASP A 8 -22.619 8.598 -3.708 1.00 0.00 O ATOM 96 CB ASP A 8 -22.479 8.652 -6.771 1.00 0.00 C ATOM 97 CG ASP A 8 -23.211 8.914 -8.072 1.00 0.00 C ATOM 98 OD1 ASP A 8 -23.840 7.973 -8.601 1.00 0.00 O ATOM 99 OD2 ASP A 8 -23.157 10.062 -8.563 1.00 0.00 O ATOM 0 H ASP A 8 -24.890 8.922 -6.336 1.00 0.00 H new ATOM 0 HA ASP A 8 -23.255 6.708 -6.278 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -22.306 9.598 -6.258 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -21.501 8.223 -6.988 1.00 0.00 H new ATOM 104 N ILE A 9 -21.928 6.513 -4.202 1.00 0.00 N ATOM 105 CA ILE A 9 -21.233 6.329 -2.933 1.00 0.00 C ATOM 106 C ILE A 9 -19.736 6.576 -3.090 1.00 0.00 C ATOM 107 O ILE A 9 -19.066 5.899 -3.869 1.00 0.00 O ATOM 108 CB ILE A 9 -21.452 4.911 -2.368 1.00 0.00 C ATOM 109 CG1 ILE A 9 -20.959 3.858 -3.362 1.00 0.00 C ATOM 110 CG2 ILE A 9 -22.920 4.691 -2.037 1.00 0.00 C ATOM 111 CD1 ILE A 9 -19.866 2.968 -2.809 1.00 0.00 C ATOM 0 H ILE A 9 -21.876 5.713 -4.833 1.00 0.00 H new ATOM 0 HA ILE A 9 -21.650 7.055 -2.235 1.00 0.00 H new ATOM 0 HB ILE A 9 -20.875 4.811 -1.449 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -21.801 3.237 -3.669 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -20.590 4.359 -4.257 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -23.057 3.685 -1.639 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -23.239 5.421 -1.293 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -23.518 4.808 -2.941 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.566 2.246 -3.568 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -19.007 3.578 -2.528 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -20.237 2.439 -1.931 1.00 0.00 H new ATOM 123 N ASN A 10 -19.216 7.549 -2.347 1.00 0.00 N ATOM 124 CA ASN A 10 -17.797 7.878 -2.414 1.00 0.00 C ATOM 125 C ASN A 10 -16.976 6.924 -1.545 1.00 0.00 C ATOM 126 O ASN A 10 -17.411 6.524 -0.464 1.00 0.00 O ATOM 127 CB ASN A 10 -17.569 9.348 -2.009 1.00 0.00 C ATOM 128 CG ASN A 10 -17.403 9.562 -0.513 1.00 0.00 C ATOM 129 OD1 ASN A 10 -16.534 8.962 0.121 1.00 0.00 O ATOM 130 ND2 ASN A 10 -18.237 10.424 0.056 1.00 0.00 N ATOM 0 H ASN A 10 -19.753 8.120 -1.695 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.459 7.756 -3.443 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.681 9.720 -2.519 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -18.411 9.945 -2.359 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.173 10.611 1.057 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -18.942 10.899 -0.507 1.00 0.00 H new ATOM 137 N THR A 11 -15.790 6.560 -2.025 1.00 0.00 N ATOM 138 CA THR A 11 -14.918 5.651 -1.291 1.00 0.00 C ATOM 139 C THR A 11 -13.468 6.126 -1.326 1.00 0.00 C ATOM 140 O THR A 11 -13.062 6.852 -2.233 1.00 0.00 O ATOM 141 CB THR A 11 -15.016 4.238 -1.871 1.00 0.00 C ATOM 142 OG1 THR A 11 -14.940 4.269 -3.285 1.00 0.00 O ATOM 143 CG2 THR A 11 -16.299 3.528 -1.495 1.00 0.00 C ATOM 0 H THR A 11 -15.412 6.880 -2.917 1.00 0.00 H new ATOM 0 HA THR A 11 -15.248 5.638 -0.252 1.00 0.00 H new ATOM 0 HB THR A 11 -14.176 3.690 -1.444 1.00 0.00 H new ATOM 0 HG1 THR A 11 -15.003 3.356 -3.636 1.00 0.00 H new ATOM 0 HG21 THR A 11 -16.307 2.532 -1.937 1.00 0.00 H new ATOM 0 HG22 THR A 11 -16.364 3.444 -0.410 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.152 4.096 -1.866 1.00 0.00 H new ATOM 151 N GLN A 12 -12.695 5.705 -0.330 1.00 0.00 N ATOM 152 CA GLN A 12 -11.287 6.079 -0.235 1.00 0.00 C ATOM 153 C GLN A 12 -10.464 4.933 0.359 1.00 0.00 C ATOM 154 O GLN A 12 -10.548 4.669 1.559 1.00 0.00 O ATOM 155 CB GLN A 12 -11.132 7.332 0.630 1.00 0.00 C ATOM 156 CG GLN A 12 -11.677 7.171 2.039 1.00 0.00 C ATOM 157 CD GLN A 12 -12.194 8.473 2.618 1.00 0.00 C ATOM 158 OE1 GLN A 12 -13.401 8.708 2.669 1.00 0.00 O ATOM 159 NE2 GLN A 12 -11.279 9.331 3.055 1.00 0.00 N ATOM 0 H GLN A 12 -13.021 5.102 0.426 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.919 6.289 -1.239 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -10.076 7.596 0.686 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -11.643 8.164 0.145 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.482 6.436 2.031 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.892 6.777 2.685 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.288 9.095 2.994 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.567 10.225 3.452 1.00 0.00 H new ATOM 168 N PRO A 13 -9.656 4.225 -0.461 1.00 0.00 N ATOM 169 CA PRO A 13 -9.511 4.490 -1.902 1.00 0.00 C ATOM 170 C PRO A 13 -10.830 4.352 -2.657 1.00 0.00 C ATOM 171 O PRO A 13 -11.734 3.636 -2.225 1.00 0.00 O ATOM 172 CB PRO A 13 -8.517 3.423 -2.373 1.00 0.00 C ATOM 173 CG PRO A 13 -7.808 2.985 -1.140 1.00 0.00 C ATOM 174 CD PRO A 13 -8.810 3.101 -0.029 1.00 0.00 C ATOM 0 HA PRO A 13 -9.179 5.511 -2.089 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.031 2.588 -2.850 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -7.820 3.829 -3.106 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.450 1.960 -1.238 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -6.936 3.610 -0.947 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.387 2.184 0.091 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.329 3.302 0.928 1.00 0.00 H new ATOM 182 N SER A 14 -10.933 5.048 -3.785 1.00 0.00 N ATOM 183 CA SER A 14 -12.141 5.011 -4.600 1.00 0.00 C ATOM 184 C SER A 14 -12.205 3.735 -5.434 1.00 0.00 C ATOM 185 O SER A 14 -13.217 3.036 -5.437 1.00 0.00 O ATOM 186 CB SER A 14 -12.198 6.235 -5.517 1.00 0.00 C ATOM 187 OG SER A 14 -13.264 7.094 -5.155 1.00 0.00 O ATOM 0 H SER A 14 -10.193 5.645 -4.155 1.00 0.00 H new ATOM 0 HA SER A 14 -12.999 5.024 -3.928 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.255 6.778 -5.463 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.321 5.913 -6.551 1.00 0.00 H new ATOM 0 HG SER A 14 -13.340 7.128 -4.179 1.00 0.00 H new ATOM 193 N GLN A 15 -11.120 3.438 -6.143 1.00 0.00 N ATOM 194 CA GLN A 15 -11.061 2.248 -6.983 1.00 0.00 C ATOM 195 C GLN A 15 -9.618 1.855 -7.278 1.00 0.00 C ATOM 196 O GLN A 15 -9.284 1.487 -8.405 1.00 0.00 O ATOM 197 CB GLN A 15 -11.810 2.489 -8.296 1.00 0.00 C ATOM 198 CG GLN A 15 -13.316 2.618 -8.125 1.00 0.00 C ATOM 199 CD GLN A 15 -14.056 2.580 -9.447 1.00 0.00 C ATOM 200 OE1 GLN A 15 -14.418 1.509 -9.938 1.00 0.00 O ATOM 201 NE2 GLN A 15 -14.287 3.749 -10.032 1.00 0.00 N ATOM 0 H GLN A 15 -10.272 4.004 -6.152 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.537 1.431 -6.441 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.427 3.397 -8.761 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -11.600 1.667 -8.980 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.676 1.811 -7.487 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -13.541 3.553 -7.613 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -13.970 4.612 -9.590 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -14.782 3.784 -10.923 1.00 0.00 H new ATOM 210 N LYS A 16 -8.765 1.933 -6.262 1.00 0.00 N ATOM 211 CA LYS A 16 -7.358 1.582 -6.423 1.00 0.00 C ATOM 212 C LYS A 16 -6.746 1.123 -5.103 1.00 0.00 C ATOM 213 O LYS A 16 -6.258 1.935 -4.318 1.00 0.00 O ATOM 214 CB LYS A 16 -6.575 2.775 -6.972 1.00 0.00 C ATOM 215 CG LYS A 16 -6.818 3.034 -8.449 1.00 0.00 C ATOM 216 CD LYS A 16 -5.670 3.810 -9.075 1.00 0.00 C ATOM 217 CE LYS A 16 -5.972 5.299 -9.132 1.00 0.00 C ATOM 218 NZ LYS A 16 -4.882 6.060 -9.802 1.00 0.00 N ATOM 0 H LYS A 16 -9.021 2.235 -5.322 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.299 0.755 -7.131 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.844 3.667 -6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.510 2.605 -6.812 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -6.944 2.085 -8.970 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -7.746 3.592 -8.574 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.760 3.644 -8.499 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.483 3.436 -10.082 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.909 5.460 -9.666 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.113 5.680 -8.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.125 7.071 -9.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.993 5.928 -9.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.765 5.714 -10.776 1.00 0.00 H new ATOM 232 N ILE A 17 -6.767 -0.185 -4.872 1.00 0.00 N ATOM 233 CA ILE A 17 -6.206 -0.755 -3.652 1.00 0.00 C ATOM 234 C ILE A 17 -5.140 -1.795 -3.986 1.00 0.00 C ATOM 235 O ILE A 17 -5.362 -2.677 -4.816 1.00 0.00 O ATOM 236 CB ILE A 17 -7.297 -1.406 -2.779 1.00 0.00 C ATOM 237 CG1 ILE A 17 -6.682 -2.003 -1.513 1.00 0.00 C ATOM 238 CG2 ILE A 17 -8.041 -2.471 -3.568 1.00 0.00 C ATOM 239 CD1 ILE A 17 -7.674 -2.174 -0.383 1.00 0.00 C ATOM 0 H ILE A 17 -7.166 -0.871 -5.513 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.754 0.063 -3.091 1.00 0.00 H new ATOM 0 HB ILE A 17 -8.011 -0.637 -2.483 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -6.246 -2.973 -1.753 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.867 -1.361 -1.177 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.808 -2.921 -2.938 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.509 -2.016 -4.441 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.340 -3.240 -3.892 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -7.169 -2.602 0.483 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -8.092 -1.203 -0.116 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -8.476 -2.840 -0.701 1.00 0.00 H new ATOM 251 N VAL A 18 -3.980 -1.681 -3.347 1.00 0.00 N ATOM 252 CA VAL A 18 -2.883 -2.610 -3.594 1.00 0.00 C ATOM 253 C VAL A 18 -2.177 -2.999 -2.299 1.00 0.00 C ATOM 254 O VAL A 18 -1.535 -2.168 -1.657 1.00 0.00 O ATOM 255 CB VAL A 18 -1.853 -2.002 -4.566 1.00 0.00 C ATOM 256 CG1 VAL A 18 -1.336 -0.673 -4.035 1.00 0.00 C ATOM 257 CG2 VAL A 18 -0.701 -2.968 -4.816 1.00 0.00 C ATOM 0 H VAL A 18 -3.776 -0.958 -2.657 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.319 -3.504 -4.040 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.352 -1.821 -5.518 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.610 -0.259 -4.735 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.168 0.022 -3.922 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.859 -0.829 -3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.011 -2.514 -5.505 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.202 -3.191 -3.873 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.087 -3.891 -5.249 1.00 0.00 H new ATOM 267 N PHE A 19 -2.287 -4.272 -1.932 1.00 0.00 N ATOM 268 CA PHE A 19 -1.644 -4.775 -0.723 1.00 0.00 C ATOM 269 C PHE A 19 -0.132 -4.855 -0.919 1.00 0.00 C ATOM 270 O PHE A 19 0.367 -5.744 -1.607 1.00 0.00 O ATOM 271 CB PHE A 19 -2.198 -6.153 -0.356 1.00 0.00 C ATOM 272 CG PHE A 19 -3.688 -6.168 -0.160 1.00 0.00 C ATOM 273 CD1 PHE A 19 -4.304 -5.225 0.646 1.00 0.00 C ATOM 274 CD2 PHE A 19 -4.472 -7.127 -0.783 1.00 0.00 C ATOM 275 CE1 PHE A 19 -5.674 -5.238 0.827 1.00 0.00 C ATOM 276 CE2 PHE A 19 -5.842 -7.144 -0.605 1.00 0.00 C ATOM 277 CZ PHE A 19 -6.445 -6.199 0.201 1.00 0.00 C ATOM 0 H PHE A 19 -2.814 -4.973 -2.453 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.857 -4.084 0.092 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.936 -6.862 -1.141 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.716 -6.498 0.559 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.707 -4.471 1.138 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.006 -7.869 -1.415 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.142 -4.497 1.458 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.441 -7.896 -1.096 1.00 0.00 H new ATOM 0 HZ PHE A 19 -7.516 -6.211 0.342 1.00 0.00 H new ATOM 287 N ASN A 20 0.588 -3.910 -0.322 1.00 0.00 N ATOM 288 CA ASN A 20 2.042 -3.865 -0.443 1.00 0.00 C ATOM 289 C ASN A 20 2.706 -4.996 0.338 1.00 0.00 C ATOM 290 O ASN A 20 2.159 -5.495 1.321 1.00 0.00 O ATOM 291 CB ASN A 20 2.569 -2.515 0.048 1.00 0.00 C ATOM 292 CG ASN A 20 3.460 -1.836 -0.975 1.00 0.00 C ATOM 293 OD1 ASN A 20 3.042 -0.897 -1.651 1.00 0.00 O ATOM 294 ND2 ASN A 20 4.694 -2.310 -1.092 1.00 0.00 N ATOM 0 H ASN A 20 0.189 -3.166 0.250 1.00 0.00 H new ATOM 0 HA ASN A 20 2.291 -3.992 -1.496 1.00 0.00 H new ATOM 0 HB2 ASN A 20 1.728 -1.863 0.283 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.127 -2.660 0.973 1.00 0.00 H new ATOM 0 HD21 ASN A 20 5.339 -1.893 -1.764 1.00 0.00 H new ATOM 0 HD22 ASN A 20 4.998 -3.091 -0.510 1.00 0.00 H new ATOM 301 N ALA A 21 3.896 -5.387 -0.112 1.00 0.00 N ATOM 302 CA ALA A 21 4.654 -6.453 0.536 1.00 0.00 C ATOM 303 C ALA A 21 5.321 -5.941 1.813 1.00 0.00 C ATOM 304 O ALA A 21 5.325 -4.738 2.070 1.00 0.00 O ATOM 305 CB ALA A 21 5.696 -7.002 -0.428 1.00 0.00 C ATOM 0 H ALA A 21 4.357 -4.980 -0.926 1.00 0.00 H new ATOM 0 HA ALA A 21 3.969 -7.255 0.812 1.00 0.00 H new ATOM 0 HB1 ALA A 21 6.260 -7.797 0.060 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.199 -7.399 -1.313 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.377 -6.203 -0.722 1.00 0.00 H new ATOM 311 N PRO A 22 5.897 -6.839 2.641 1.00 0.00 N ATOM 312 CA PRO A 22 5.926 -8.287 2.391 1.00 0.00 C ATOM 313 C PRO A 22 4.612 -8.972 2.740 1.00 0.00 C ATOM 314 O PRO A 22 3.750 -8.392 3.400 1.00 0.00 O ATOM 315 CB PRO A 22 7.036 -8.769 3.323 1.00 0.00 C ATOM 316 CG PRO A 22 6.990 -7.824 4.472 1.00 0.00 C ATOM 317 CD PRO A 22 6.576 -6.491 3.905 1.00 0.00 C ATOM 0 HA PRO A 22 6.089 -8.516 1.338 1.00 0.00 H new ATOM 0 HB2 PRO A 22 6.866 -9.796 3.646 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.007 -8.747 2.829 1.00 0.00 H new ATOM 0 HG2 PRO A 22 6.280 -8.163 5.227 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.963 -7.755 4.958 1.00 0.00 H new ATOM 0 HD2 PRO A 22 5.910 -5.958 4.583 1.00 0.00 H new ATOM 0 HD3 PRO A 22 7.437 -5.846 3.732 1.00 0.00 H new ATOM 325 N TYR A 23 4.472 -10.213 2.290 1.00 0.00 N ATOM 326 CA TYR A 23 3.267 -10.991 2.549 1.00 0.00 C ATOM 327 C TYR A 23 3.534 -12.077 3.584 1.00 0.00 C ATOM 328 O TYR A 23 3.199 -13.243 3.379 1.00 0.00 O ATOM 329 CB TYR A 23 2.750 -11.617 1.254 1.00 0.00 C ATOM 330 CG TYR A 23 2.364 -10.596 0.209 1.00 0.00 C ATOM 331 CD1 TYR A 23 1.851 -9.359 0.579 1.00 0.00 C ATOM 332 CD2 TYR A 23 2.517 -10.865 -1.145 1.00 0.00 C ATOM 333 CE1 TYR A 23 1.500 -8.421 -0.369 1.00 0.00 C ATOM 334 CE2 TYR A 23 2.168 -9.930 -2.101 1.00 0.00 C ATOM 335 CZ TYR A 23 1.660 -8.710 -1.708 1.00 0.00 C ATOM 336 OH TYR A 23 1.314 -7.776 -2.655 1.00 0.00 O ATOM 0 H TYR A 23 5.180 -10.703 1.743 1.00 0.00 H new ATOM 0 HA TYR A 23 2.507 -10.317 2.945 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.518 -12.274 0.844 1.00 0.00 H new ATOM 0 HB3 TYR A 23 1.885 -12.240 1.480 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.725 -9.128 1.626 1.00 0.00 H new ATOM 0 HD2 TYR A 23 2.915 -11.820 -1.456 1.00 0.00 H new ATOM 0 HE1 TYR A 23 1.102 -7.465 -0.064 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.293 -10.154 -3.150 1.00 0.00 H new ATOM 0 HH TYR A 23 0.761 -7.080 -2.242 1.00 0.00 H new ATOM 346 N ASP A 24 4.135 -11.681 4.701 1.00 0.00 N ATOM 347 CA ASP A 24 4.445 -12.614 5.776 1.00 0.00 C ATOM 348 C ASP A 24 3.719 -12.234 7.069 1.00 0.00 C ATOM 349 O ASP A 24 3.814 -12.945 8.069 1.00 0.00 O ATOM 350 CB ASP A 24 5.955 -12.654 6.022 1.00 0.00 C ATOM 351 CG ASP A 24 6.668 -13.609 5.086 1.00 0.00 C ATOM 352 OD1 ASP A 24 6.654 -14.828 5.358 1.00 0.00 O ATOM 353 OD2 ASP A 24 7.240 -13.138 4.080 1.00 0.00 O ATOM 0 H ASP A 24 4.417 -10.718 4.885 1.00 0.00 H new ATOM 0 HA ASP A 24 4.102 -13.602 5.470 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.367 -11.653 5.898 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.145 -12.951 7.053 1.00 0.00 H new ATOM 358 N ASP A 25 2.995 -11.114 7.050 1.00 0.00 N ATOM 359 CA ASP A 25 2.264 -10.661 8.226 1.00 0.00 C ATOM 360 C ASP A 25 0.875 -10.160 7.844 1.00 0.00 C ATOM 361 O ASP A 25 0.666 -9.661 6.738 1.00 0.00 O ATOM 362 CB ASP A 25 3.040 -9.552 8.938 1.00 0.00 C ATOM 363 CG ASP A 25 3.842 -10.072 10.115 1.00 0.00 C ATOM 364 OD1 ASP A 25 4.121 -11.289 10.152 1.00 0.00 O ATOM 365 OD2 ASP A 25 4.189 -9.262 11.000 1.00 0.00 O ATOM 0 H ASP A 25 2.901 -10.508 6.235 1.00 0.00 H new ATOM 0 HA ASP A 25 2.152 -11.509 8.902 1.00 0.00 H new ATOM 0 HB2 ASP A 25 3.712 -9.070 8.228 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.343 -8.790 9.285 1.00 0.00 H new ATOM 370 N LYS A 26 -0.071 -10.297 8.766 1.00 0.00 N ATOM 371 CA LYS A 26 -1.440 -9.858 8.527 1.00 0.00 C ATOM 372 C LYS A 26 -1.510 -8.339 8.403 1.00 0.00 C ATOM 373 O LYS A 26 -1.312 -7.617 9.380 1.00 0.00 O ATOM 374 CB LYS A 26 -2.354 -10.333 9.658 1.00 0.00 C ATOM 375 CG LYS A 26 -2.146 -11.791 10.036 1.00 0.00 C ATOM 376 CD LYS A 26 -2.036 -11.966 11.542 1.00 0.00 C ATOM 377 CE LYS A 26 -1.612 -13.380 11.909 1.00 0.00 C ATOM 378 NZ LYS A 26 -2.401 -14.405 11.173 1.00 0.00 N ATOM 0 H LYS A 26 0.085 -10.709 9.686 1.00 0.00 H new ATOM 0 HA LYS A 26 -1.778 -10.296 7.588 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -2.185 -9.711 10.537 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.392 -10.188 9.360 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.977 -12.388 9.659 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.241 -12.166 9.558 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.314 -11.253 11.940 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.996 -11.741 12.007 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.553 -13.510 11.688 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.735 -13.529 12.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -2.283 -15.330 11.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.407 -14.140 11.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.065 -14.462 10.190 1.00 0.00 H new ATOM 392 N HIS A 27 -1.788 -7.860 7.195 1.00 0.00 N ATOM 393 CA HIS A 27 -1.882 -6.428 6.944 1.00 0.00 C ATOM 394 C HIS A 27 -3.322 -6.015 6.662 1.00 0.00 C ATOM 395 O HIS A 27 -3.732 -5.899 5.507 1.00 0.00 O ATOM 396 CB HIS A 27 -0.988 -6.036 5.766 1.00 0.00 C ATOM 397 CG HIS A 27 0.473 -6.052 6.092 1.00 0.00 C ATOM 398 ND1 HIS A 27 0.990 -5.713 7.322 1.00 0.00 N ATOM 399 CD2 HIS A 27 1.539 -6.379 5.315 1.00 0.00 C ATOM 400 CE1 HIS A 27 2.323 -5.840 7.257 1.00 0.00 C ATOM 401 NE2 HIS A 27 2.705 -6.243 6.061 1.00 0.00 N ATOM 0 H HIS A 27 -1.952 -8.444 6.375 1.00 0.00 H new ATOM 0 HA HIS A 27 -1.544 -5.907 7.839 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -1.174 -6.718 4.936 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -1.265 -5.038 5.426 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.489 -6.694 4.283 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.996 -5.639 8.077 1.00 0.00 H new ATOM 0 HE2 HIS A 27 3.660 -6.419 5.747 1.00 0.00 H new ATOM 409 N THR A 28 -4.087 -5.793 7.727 1.00 0.00 N ATOM 410 CA THR A 28 -5.482 -5.393 7.594 1.00 0.00 C ATOM 411 C THR A 28 -5.589 -3.953 7.102 1.00 0.00 C ATOM 412 O THR A 28 -5.189 -3.017 7.795 1.00 0.00 O ATOM 413 CB THR A 28 -6.208 -5.541 8.932 1.00 0.00 C ATOM 414 OG1 THR A 28 -6.143 -6.879 9.393 1.00 0.00 O ATOM 415 CG2 THR A 28 -7.668 -5.148 8.869 1.00 0.00 C ATOM 0 H THR A 28 -3.764 -5.884 8.690 1.00 0.00 H new ATOM 0 HA THR A 28 -5.953 -6.047 6.860 1.00 0.00 H new ATOM 0 HB THR A 28 -5.695 -4.863 9.614 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.611 -6.953 10.251 1.00 0.00 H new ATOM 0 HG21 THR A 28 -8.122 -5.277 9.851 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.751 -4.105 8.565 1.00 0.00 H new ATOM 0 HG23 THR A 28 -8.184 -5.779 8.145 1.00 0.00 H new ATOM 423 N TYR A 29 -6.135 -3.781 5.901 1.00 0.00 N ATOM 424 CA TYR A 29 -6.294 -2.454 5.317 1.00 0.00 C ATOM 425 C TYR A 29 -7.702 -1.921 5.560 1.00 0.00 C ATOM 426 O TYR A 29 -8.689 -2.627 5.353 1.00 0.00 O ATOM 427 CB TYR A 29 -6.001 -2.495 3.817 1.00 0.00 C ATOM 428 CG TYR A 29 -4.525 -2.531 3.492 1.00 0.00 C ATOM 429 CD1 TYR A 29 -3.831 -3.734 3.461 1.00 0.00 C ATOM 430 CD2 TYR A 29 -3.826 -1.363 3.218 1.00 0.00 C ATOM 431 CE1 TYR A 29 -2.481 -3.772 3.167 1.00 0.00 C ATOM 432 CE2 TYR A 29 -2.477 -1.392 2.922 1.00 0.00 C ATOM 433 CZ TYR A 29 -1.809 -2.598 2.897 1.00 0.00 C ATOM 434 OH TYR A 29 -0.466 -2.631 2.602 1.00 0.00 O ATOM 0 H TYR A 29 -6.474 -4.544 5.315 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.583 -1.783 5.798 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.482 -3.373 3.385 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -6.448 -1.621 3.343 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.355 -4.655 3.670 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.345 -0.416 3.237 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.955 -4.715 3.149 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.948 -0.474 2.711 1.00 0.00 H new ATOM 0 HH TYR A 29 -0.145 -1.720 2.436 1.00 0.00 H new ATOM 444 N HIS A 30 -7.787 -0.671 6.006 1.00 0.00 N ATOM 445 CA HIS A 30 -9.074 -0.044 6.283 1.00 0.00 C ATOM 446 C HIS A 30 -9.477 0.908 5.161 1.00 0.00 C ATOM 447 O HIS A 30 -8.650 1.656 4.639 1.00 0.00 O ATOM 448 CB HIS A 30 -9.020 0.715 7.610 1.00 0.00 C ATOM 449 CG HIS A 30 -8.938 -0.176 8.810 1.00 0.00 C ATOM 450 ND1 HIS A 30 -9.513 0.120 10.027 1.00 0.00 N ATOM 451 CD2 HIS A 30 -8.331 -1.380 8.966 1.00 0.00 C ATOM 452 CE1 HIS A 30 -9.244 -0.889 10.865 1.00 0.00 C ATOM 453 NE2 HIS A 30 -8.529 -1.826 10.271 1.00 0.00 N ATOM 0 H HIS A 30 -6.980 -0.073 6.183 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.822 -0.834 6.349 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -8.157 1.380 7.603 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -9.906 1.344 7.695 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -7.782 -1.908 8.200 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -9.570 -0.931 11.894 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -8.191 -2.696 10.682 1.00 0.00 H new ATOM 461 N ILE A 31 -10.757 0.880 4.804 1.00 0.00 N ATOM 462 CA ILE A 31 -11.280 1.746 3.754 1.00 0.00 C ATOM 463 C ILE A 31 -12.560 2.434 4.219 1.00 0.00 C ATOM 464 O ILE A 31 -13.350 1.856 4.967 1.00 0.00 O ATOM 465 CB ILE A 31 -11.563 0.960 2.459 1.00 0.00 C ATOM 466 CG1 ILE A 31 -10.287 0.275 1.966 1.00 0.00 C ATOM 467 CG2 ILE A 31 -12.123 1.882 1.386 1.00 0.00 C ATOM 468 CD1 ILE A 31 -10.058 -1.090 2.576 1.00 0.00 C ATOM 0 H ILE A 31 -11.452 0.266 5.228 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.518 2.496 3.542 1.00 0.00 H new ATOM 0 HB ILE A 31 -12.308 0.194 2.674 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -10.334 0.176 0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -9.432 0.913 2.191 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -12.317 1.309 0.479 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -13.053 2.328 1.739 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -11.401 2.670 1.170 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -9.136 -1.515 2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -9.979 -0.996 3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -10.894 -1.744 2.329 1.00 0.00 H new ATOM 480 N LYS A 32 -12.757 3.673 3.781 1.00 0.00 N ATOM 481 CA LYS A 32 -13.939 4.436 4.167 1.00 0.00 C ATOM 482 C LYS A 32 -14.969 4.476 3.044 1.00 0.00 C ATOM 483 O LYS A 32 -14.625 4.642 1.873 1.00 0.00 O ATOM 484 CB LYS A 32 -13.544 5.861 4.561 1.00 0.00 C ATOM 485 CG LYS A 32 -13.650 6.131 6.053 1.00 0.00 C ATOM 486 CD LYS A 32 -13.813 7.615 6.340 1.00 0.00 C ATOM 487 CE LYS A 32 -12.466 8.300 6.509 1.00 0.00 C ATOM 488 NZ LYS A 32 -12.126 8.512 7.943 1.00 0.00 N ATOM 0 H LYS A 32 -12.117 4.169 3.161 1.00 0.00 H new ATOM 0 HA LYS A 32 -14.391 3.936 5.023 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.520 6.048 4.238 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -14.180 6.566 4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -14.499 5.584 6.463 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.758 5.758 6.556 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -14.363 8.086 5.525 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -14.407 7.749 7.244 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.690 7.697 6.038 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -12.480 9.260 5.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.201 8.981 8.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.852 9.109 8.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.087 7.594 8.430 1.00 0.00 H new ATOM 502 N ILE A 33 -16.237 4.332 3.415 1.00 0.00 N ATOM 503 CA ILE A 33 -17.330 4.360 2.452 1.00 0.00 C ATOM 504 C ILE A 33 -18.310 5.476 2.785 1.00 0.00 C ATOM 505 O ILE A 33 -18.374 5.938 3.923 1.00 0.00 O ATOM 506 CB ILE A 33 -18.091 3.021 2.417 1.00 0.00 C ATOM 507 CG1 ILE A 33 -17.118 1.858 2.219 1.00 0.00 C ATOM 508 CG2 ILE A 33 -19.139 3.036 1.314 1.00 0.00 C ATOM 509 CD1 ILE A 33 -17.737 0.502 2.479 1.00 0.00 C ATOM 0 H ILE A 33 -16.533 4.194 4.381 1.00 0.00 H new ATOM 0 HA ILE A 33 -16.887 4.537 1.472 1.00 0.00 H new ATOM 0 HB ILE A 33 -18.598 2.885 3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.736 1.884 1.199 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -16.264 1.992 2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -19.668 2.083 1.302 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -19.849 3.843 1.497 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -18.652 3.193 0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -16.990 -0.276 2.320 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -18.094 0.456 3.508 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -18.573 0.347 1.797 1.00 0.00 H new ATOM 521 N THR A 34 -19.071 5.907 1.788 1.00 0.00 N ATOM 522 CA THR A 34 -20.046 6.973 1.986 1.00 0.00 C ATOM 523 C THR A 34 -21.074 6.993 0.865 1.00 0.00 C ATOM 524 O THR A 34 -20.766 6.653 -0.276 1.00 0.00 O ATOM 525 CB THR A 34 -19.342 8.328 2.058 1.00 0.00 C ATOM 526 OG1 THR A 34 -18.405 8.353 3.120 1.00 0.00 O ATOM 527 CG2 THR A 34 -20.295 9.487 2.257 1.00 0.00 C ATOM 0 H THR A 34 -19.033 5.538 0.838 1.00 0.00 H new ATOM 0 HA THR A 34 -20.562 6.781 2.927 1.00 0.00 H new ATOM 0 HB THR A 34 -18.847 8.447 1.094 1.00 0.00 H new ATOM 0 HG1 THR A 34 -18.482 7.528 3.643 1.00 0.00 H new ATOM 0 HG21 THR A 34 -19.731 10.419 2.299 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.999 9.526 1.425 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.843 9.352 3.190 1.00 0.00 H new ATOM 535 N ASN A 35 -22.293 7.402 1.194 1.00 0.00 N ATOM 536 CA ASN A 35 -23.365 7.477 0.210 1.00 0.00 C ATOM 537 C ASN A 35 -23.901 8.901 0.112 1.00 0.00 C ATOM 538 O ASN A 35 -24.890 9.254 0.754 1.00 0.00 O ATOM 539 CB ASN A 35 -24.492 6.505 0.567 1.00 0.00 C ATOM 540 CG ASN A 35 -25.171 6.849 1.878 1.00 0.00 C ATOM 541 OD1 ASN A 35 -24.518 7.239 2.845 1.00 0.00 O ATOM 542 ND2 ASN A 35 -26.491 6.707 1.915 1.00 0.00 N ATOM 0 H ASN A 35 -22.564 7.687 2.135 1.00 0.00 H new ATOM 0 HA ASN A 35 -22.960 7.192 -0.761 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -25.233 6.506 -0.232 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -24.089 5.494 0.626 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -27.004 6.925 2.770 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -26.992 6.380 1.089 1.00 0.00 H new ATOM 549 N ALA A 36 -23.233 9.718 -0.699 1.00 0.00 N ATOM 550 CA ALA A 36 -23.626 11.110 -0.891 1.00 0.00 C ATOM 551 C ALA A 36 -25.132 11.244 -1.099 1.00 0.00 C ATOM 552 O ALA A 36 -25.722 12.280 -0.787 1.00 0.00 O ATOM 553 CB ALA A 36 -22.872 11.707 -2.072 1.00 0.00 C ATOM 0 H ALA A 36 -22.413 9.437 -1.236 1.00 0.00 H new ATOM 0 HA ALA A 36 -23.368 11.660 0.014 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -23.172 12.746 -2.207 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.800 11.661 -1.880 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -23.104 11.142 -2.975 1.00 0.00 H new ATOM 559 N GLY A 37 -25.750 10.192 -1.626 1.00 0.00 N ATOM 560 CA GLY A 37 -27.182 10.213 -1.864 1.00 0.00 C ATOM 561 C GLY A 37 -27.966 10.719 -0.669 1.00 0.00 C ATOM 562 O GLY A 37 -27.512 10.613 0.470 1.00 0.00 O ATOM 0 H GLY A 37 -25.284 9.325 -1.893 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -27.394 10.845 -2.726 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -27.519 9.207 -2.115 1.00 0.00 H new ATOM 566 N GLY A 38 -29.148 11.270 -0.930 1.00 0.00 N ATOM 567 CA GLY A 38 -29.978 11.784 0.143 1.00 0.00 C ATOM 568 C GLY A 38 -31.076 10.818 0.538 1.00 0.00 C ATOM 569 O GLY A 38 -32.254 11.173 0.543 1.00 0.00 O ATOM 0 H GLY A 38 -29.545 11.369 -1.864 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -29.354 11.995 1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -30.424 12.729 -0.167 1.00 0.00 H new ATOM 573 N ARG A 39 -30.688 9.592 0.871 1.00 0.00 N ATOM 574 CA ARG A 39 -31.648 8.568 1.270 1.00 0.00 C ATOM 575 C ARG A 39 -30.933 7.337 1.818 1.00 0.00 C ATOM 576 O ARG A 39 -29.778 7.077 1.481 1.00 0.00 O ATOM 577 CB ARG A 39 -32.525 8.175 0.081 1.00 0.00 C ATOM 578 CG ARG A 39 -33.928 8.757 0.140 1.00 0.00 C ATOM 579 CD ARG A 39 -34.906 7.789 0.785 1.00 0.00 C ATOM 580 NE ARG A 39 -36.034 7.486 -0.093 1.00 0.00 N ATOM 581 CZ ARG A 39 -37.196 7.008 0.342 1.00 0.00 C ATOM 582 NH1 ARG A 39 -37.379 6.778 1.634 1.00 0.00 N ATOM 583 NH2 ARG A 39 -38.175 6.759 -0.517 1.00 0.00 N ATOM 0 H ARG A 39 -29.716 9.283 0.873 1.00 0.00 H new ATOM 0 HA ARG A 39 -32.278 8.981 2.058 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -32.043 8.504 -0.840 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -32.593 7.088 0.034 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -33.913 9.690 0.704 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -34.265 8.999 -0.868 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -34.387 6.865 1.041 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -35.276 8.215 1.717 1.00 0.00 H new ATOM 0 HE ARG A 39 -35.924 7.650 -1.094 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -36.628 6.968 2.297 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -38.271 6.411 1.965 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -38.037 6.934 -1.512 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -39.066 6.392 -0.182 1.00 0.00 H new ATOM 597 N ARG A 40 -31.627 6.582 2.662 1.00 0.00 N ATOM 598 CA ARG A 40 -31.058 5.377 3.253 1.00 0.00 C ATOM 599 C ARG A 40 -30.799 4.323 2.183 1.00 0.00 C ATOM 600 O ARG A 40 -31.519 4.247 1.187 1.00 0.00 O ATOM 601 CB ARG A 40 -31.994 4.817 4.324 1.00 0.00 C ATOM 602 CG ARG A 40 -32.054 5.669 5.581 1.00 0.00 C ATOM 603 CD ARG A 40 -33.484 5.851 6.062 1.00 0.00 C ATOM 604 NE ARG A 40 -33.975 4.676 6.775 1.00 0.00 N ATOM 605 CZ ARG A 40 -35.096 4.662 7.489 1.00 0.00 C ATOM 606 NH1 ARG A 40 -35.839 5.757 7.581 1.00 0.00 N ATOM 607 NH2 ARG A 40 -35.474 3.555 8.112 1.00 0.00 N ATOM 0 H ARG A 40 -32.584 6.783 2.952 1.00 0.00 H new ATOM 0 HA ARG A 40 -30.108 5.641 3.717 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -32.997 4.727 3.907 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -31.668 3.812 4.591 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -31.461 5.202 6.367 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -31.609 6.644 5.383 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -33.538 6.721 6.716 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -34.131 6.053 5.208 1.00 0.00 H new ATOM 0 HE ARG A 40 -33.427 3.817 6.722 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -35.550 6.611 7.104 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -36.699 5.745 8.129 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -34.904 2.712 8.044 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -36.335 3.546 8.659 1.00 0.00 H new ATOM 621 N ILE A 41 -29.766 3.513 2.391 1.00 0.00 N ATOM 622 CA ILE A 41 -29.416 2.468 1.436 1.00 0.00 C ATOM 623 C ILE A 41 -28.871 1.230 2.137 1.00 0.00 C ATOM 624 O ILE A 41 -28.505 1.274 3.310 1.00 0.00 O ATOM 625 CB ILE A 41 -28.357 2.958 0.429 1.00 0.00 C ATOM 626 CG1 ILE A 41 -27.129 3.493 1.168 1.00 0.00 C ATOM 627 CG2 ILE A 41 -28.937 4.025 -0.487 1.00 0.00 C ATOM 628 CD1 ILE A 41 -25.914 3.656 0.282 1.00 0.00 C ATOM 0 H ILE A 41 -29.159 3.560 3.209 1.00 0.00 H new ATOM 0 HA ILE A 41 -30.336 2.214 0.909 1.00 0.00 H new ATOM 0 HB ILE A 41 -28.051 2.113 -0.187 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -27.375 4.456 1.614 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -26.884 2.816 1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -28.172 4.356 -1.189 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -29.781 3.611 -1.038 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -29.274 4.873 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -25.082 4.039 0.873 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -25.642 2.690 -0.144 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -26.141 4.356 -0.522 1.00 0.00 H new ATOM 640 N GLY A 42 -28.807 0.131 1.394 1.00 0.00 N ATOM 641 CA GLY A 42 -28.286 -1.112 1.928 1.00 0.00 C ATOM 642 C GLY A 42 -27.161 -1.642 1.066 1.00 0.00 C ATOM 643 O GLY A 42 -27.398 -2.122 -0.043 1.00 0.00 O ATOM 0 H GLY A 42 -29.110 0.080 0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -27.926 -0.953 2.945 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -29.085 -1.851 1.985 1.00 0.00 H new ATOM 647 N TRP A 43 -25.930 -1.530 1.561 1.00 0.00 N ATOM 648 CA TRP A 43 -24.762 -1.975 0.809 1.00 0.00 C ATOM 649 C TRP A 43 -24.207 -3.293 1.335 1.00 0.00 C ATOM 650 O TRP A 43 -24.423 -3.661 2.490 1.00 0.00 O ATOM 651 CB TRP A 43 -23.671 -0.904 0.857 1.00 0.00 C ATOM 652 CG TRP A 43 -23.245 -0.554 2.251 1.00 0.00 C ATOM 653 CD1 TRP A 43 -23.833 0.353 3.084 1.00 0.00 C ATOM 654 CD2 TRP A 43 -22.140 -1.108 2.974 1.00 0.00 C ATOM 655 NE1 TRP A 43 -23.160 0.399 4.281 1.00 0.00 N ATOM 656 CE2 TRP A 43 -22.117 -0.490 4.239 1.00 0.00 C ATOM 657 CE3 TRP A 43 -21.166 -2.067 2.676 1.00 0.00 C ATOM 658 CZ2 TRP A 43 -21.160 -0.799 5.202 1.00 0.00 C ATOM 659 CZ3 TRP A 43 -20.217 -2.373 3.632 1.00 0.00 C ATOM 660 CH2 TRP A 43 -20.220 -1.741 4.883 1.00 0.00 C ATOM 0 H TRP A 43 -25.717 -1.136 2.477 1.00 0.00 H new ATOM 0 HA TRP A 43 -25.081 -2.137 -0.221 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -22.804 -1.253 0.296 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -24.032 -0.005 0.358 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -24.700 0.948 2.838 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -23.398 0.997 5.072 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -21.156 -2.560 1.715 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -21.160 -0.313 6.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -19.460 -3.111 3.412 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -19.465 -2.003 5.610 1.00 0.00 H new ATOM 671 N ALA A 44 -23.477 -3.990 0.470 1.00 0.00 N ATOM 672 CA ALA A 44 -22.863 -5.265 0.821 1.00 0.00 C ATOM 673 C ALA A 44 -21.527 -5.427 0.101 1.00 0.00 C ATOM 674 O ALA A 44 -21.313 -4.848 -0.964 1.00 0.00 O ATOM 675 CB ALA A 44 -23.795 -6.416 0.476 1.00 0.00 C ATOM 0 H ALA A 44 -23.295 -3.689 -0.488 1.00 0.00 H new ATOM 0 HA ALA A 44 -22.681 -5.278 1.896 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -23.322 -7.360 0.744 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -24.728 -6.307 1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -24.005 -6.406 -0.594 1.00 0.00 H new ATOM 681 N ILE A 45 -20.626 -6.207 0.687 1.00 0.00 N ATOM 682 CA ILE A 45 -19.310 -6.427 0.094 1.00 0.00 C ATOM 683 C ILE A 45 -19.070 -7.902 -0.208 1.00 0.00 C ATOM 684 O ILE A 45 -19.521 -8.781 0.527 1.00 0.00 O ATOM 685 CB ILE A 45 -18.186 -5.916 1.015 1.00 0.00 C ATOM 686 CG1 ILE A 45 -18.533 -4.527 1.554 1.00 0.00 C ATOM 687 CG2 ILE A 45 -16.861 -5.886 0.269 1.00 0.00 C ATOM 688 CD1 ILE A 45 -18.498 -3.443 0.499 1.00 0.00 C ATOM 0 H ILE A 45 -20.780 -6.696 1.569 1.00 0.00 H new ATOM 0 HA ILE A 45 -19.294 -5.865 -0.840 1.00 0.00 H new ATOM 0 HB ILE A 45 -18.088 -6.599 1.859 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -19.527 -4.557 2.000 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -17.834 -4.270 2.350 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -16.077 -5.523 0.934 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -16.612 -6.891 -0.070 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -16.943 -5.222 -0.592 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -18.754 -2.486 0.953 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -17.498 -3.385 0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -19.217 -3.676 -0.286 1.00 0.00 H new ATOM 700 N LYS A 46 -18.352 -8.163 -1.295 1.00 0.00 N ATOM 701 CA LYS A 46 -18.041 -9.528 -1.704 1.00 0.00 C ATOM 702 C LYS A 46 -16.680 -9.588 -2.390 1.00 0.00 C ATOM 703 O LYS A 46 -16.365 -8.752 -3.237 1.00 0.00 O ATOM 704 CB LYS A 46 -19.123 -10.062 -2.644 1.00 0.00 C ATOM 705 CG LYS A 46 -19.181 -9.335 -3.978 1.00 0.00 C ATOM 706 CD LYS A 46 -20.049 -10.080 -4.980 1.00 0.00 C ATOM 707 CE LYS A 46 -19.421 -11.402 -5.386 1.00 0.00 C ATOM 708 NZ LYS A 46 -20.118 -12.561 -4.763 1.00 0.00 N ATOM 0 H LYS A 46 -17.973 -7.444 -1.911 1.00 0.00 H new ATOM 0 HA LYS A 46 -18.009 -10.152 -0.811 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -18.945 -11.122 -2.825 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -20.092 -9.981 -2.153 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -19.576 -8.330 -3.829 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -18.173 -9.226 -4.378 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -21.033 -10.261 -4.547 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -20.199 -9.461 -5.864 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -19.451 -11.500 -6.471 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -18.371 -11.410 -5.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -19.453 -13.355 -4.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -20.472 -12.289 -3.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -20.916 -12.850 -5.364 1.00 0.00 H new ATOM 722 N THR A 47 -15.875 -10.578 -2.018 1.00 0.00 N ATOM 723 CA THR A 47 -14.547 -10.740 -2.598 1.00 0.00 C ATOM 724 C THR A 47 -14.471 -12.003 -3.450 1.00 0.00 C ATOM 725 O THR A 47 -15.210 -12.961 -3.226 1.00 0.00 O ATOM 726 CB THR A 47 -13.490 -10.791 -1.494 1.00 0.00 C ATOM 727 OG1 THR A 47 -13.617 -11.978 -0.732 1.00 0.00 O ATOM 728 CG2 THR A 47 -13.567 -9.621 -0.538 1.00 0.00 C ATOM 0 H THR A 47 -16.119 -11.279 -1.318 1.00 0.00 H new ATOM 0 HA THR A 47 -14.353 -9.881 -3.240 1.00 0.00 H new ATOM 0 HB THR A 47 -12.531 -10.755 -2.011 1.00 0.00 H new ATOM 0 HG1 THR A 47 -12.761 -12.455 -0.724 1.00 0.00 H new ATOM 0 HG21 THR A 47 -12.790 -9.719 0.220 1.00 0.00 H new ATOM 0 HG22 THR A 47 -13.422 -8.691 -1.088 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.545 -9.609 -0.056 1.00 0.00 H new ATOM 736 N THR A 48 -13.569 -11.996 -4.426 1.00 0.00 N ATOM 737 CA THR A 48 -13.390 -13.140 -5.312 1.00 0.00 C ATOM 738 C THR A 48 -13.157 -14.415 -4.507 1.00 0.00 C ATOM 739 O THR A 48 -13.450 -15.517 -4.971 1.00 0.00 O ATOM 740 CB THR A 48 -12.213 -12.896 -6.257 1.00 0.00 C ATOM 741 OG1 THR A 48 -11.210 -12.123 -5.619 1.00 0.00 O ATOM 742 CG2 THR A 48 -12.604 -12.179 -7.531 1.00 0.00 C ATOM 0 H THR A 48 -12.950 -11.210 -4.623 1.00 0.00 H new ATOM 0 HA THR A 48 -14.299 -13.263 -5.900 1.00 0.00 H new ATOM 0 HB THR A 48 -11.843 -13.887 -6.518 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.493 -12.713 -5.305 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.721 -12.039 -8.155 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.340 -12.774 -8.072 1.00 0.00 H new ATOM 0 HG23 THR A 48 -13.033 -11.208 -7.285 1.00 0.00 H new ATOM 750 N ASN A 49 -12.628 -14.255 -3.299 1.00 0.00 N ATOM 751 CA ASN A 49 -12.353 -15.389 -2.425 1.00 0.00 C ATOM 752 C ASN A 49 -12.598 -15.019 -0.966 1.00 0.00 C ATOM 753 O ASN A 49 -11.895 -14.181 -0.401 1.00 0.00 O ATOM 754 CB ASN A 49 -10.911 -15.864 -2.607 1.00 0.00 C ATOM 755 CG ASN A 49 -10.811 -17.075 -3.514 1.00 0.00 C ATOM 756 OD1 ASN A 49 -10.946 -18.214 -3.066 1.00 0.00 O ATOM 757 ND2 ASN A 49 -10.575 -16.834 -4.799 1.00 0.00 N ATOM 0 H ASN A 49 -12.381 -13.349 -2.902 1.00 0.00 H new ATOM 0 HA ASN A 49 -13.030 -16.199 -2.697 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -10.314 -15.052 -3.022 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -10.486 -16.107 -1.633 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -10.499 -17.609 -5.458 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -10.470 -15.874 -5.127 1.00 0.00 H new ATOM 764 N MET A 50 -13.600 -15.650 -0.360 1.00 0.00 N ATOM 765 CA MET A 50 -13.938 -15.385 1.035 1.00 0.00 C ATOM 766 C MET A 50 -13.195 -16.332 1.975 1.00 0.00 C ATOM 767 O MET A 50 -13.598 -16.519 3.123 1.00 0.00 O ATOM 768 CB MET A 50 -15.447 -15.519 1.248 1.00 0.00 C ATOM 769 CG MET A 50 -16.200 -14.206 1.103 1.00 0.00 C ATOM 770 SD MET A 50 -17.308 -13.886 2.488 1.00 0.00 S ATOM 771 CE MET A 50 -16.464 -12.522 3.287 1.00 0.00 C ATOM 0 H MET A 50 -14.191 -16.347 -0.812 1.00 0.00 H new ATOM 0 HA MET A 50 -13.630 -14.365 1.266 1.00 0.00 H new ATOM 0 HB2 MET A 50 -15.845 -16.237 0.531 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.631 -15.926 2.242 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.484 -13.388 1.019 1.00 0.00 H new ATOM 0 HG3 MET A 50 -16.776 -14.222 0.178 1.00 0.00 H new ATOM 0 HE1 MET A 50 -17.029 -12.209 4.165 1.00 0.00 H new ATOM 0 HE2 MET A 50 -15.466 -12.839 3.591 1.00 0.00 H new ATOM 0 HE3 MET A 50 -16.383 -11.687 2.591 1.00 0.00 H new ATOM 781 N ARG A 51 -12.110 -16.926 1.485 1.00 0.00 N ATOM 782 CA ARG A 51 -11.318 -17.849 2.290 1.00 0.00 C ATOM 783 C ARG A 51 -10.129 -17.130 2.922 1.00 0.00 C ATOM 784 O ARG A 51 -9.834 -17.317 4.102 1.00 0.00 O ATOM 785 CB ARG A 51 -10.828 -19.017 1.433 1.00 0.00 C ATOM 786 CG ARG A 51 -11.824 -19.450 0.370 1.00 0.00 C ATOM 787 CD ARG A 51 -13.112 -19.967 0.992 1.00 0.00 C ATOM 788 NE ARG A 51 -13.756 -20.977 0.157 1.00 0.00 N ATOM 789 CZ ARG A 51 -14.872 -21.612 0.498 1.00 0.00 C ATOM 790 NH1 ARG A 51 -15.466 -21.341 1.652 1.00 0.00 N ATOM 791 NH2 ARG A 51 -15.396 -22.519 -0.315 1.00 0.00 N ATOM 0 H ARG A 51 -11.761 -16.785 0.537 1.00 0.00 H new ATOM 0 HA ARG A 51 -11.953 -18.237 3.087 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -9.893 -18.735 0.950 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -10.609 -19.866 2.081 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -12.047 -18.608 -0.286 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -11.380 -20.228 -0.251 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -12.896 -20.391 1.973 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -13.798 -19.135 1.149 1.00 0.00 H new ATOM 0 HE ARG A 51 -13.325 -21.208 -0.738 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -15.066 -20.644 2.280 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -16.323 -21.830 1.912 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -14.942 -22.730 -1.204 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -16.253 -23.006 -0.052 1.00 0.00 H new ATOM 805 N ARG A 52 -9.453 -16.307 2.127 1.00 0.00 N ATOM 806 CA ARG A 52 -8.297 -15.557 2.608 1.00 0.00 C ATOM 807 C ARG A 52 -8.698 -14.143 3.013 1.00 0.00 C ATOM 808 O ARG A 52 -8.377 -13.686 4.111 1.00 0.00 O ATOM 809 CB ARG A 52 -7.214 -15.501 1.529 1.00 0.00 C ATOM 810 CG ARG A 52 -6.158 -16.585 1.671 1.00 0.00 C ATOM 811 CD ARG A 52 -6.307 -17.650 0.596 1.00 0.00 C ATOM 812 NE ARG A 52 -7.252 -18.692 0.987 1.00 0.00 N ATOM 813 CZ ARG A 52 -7.514 -19.765 0.247 1.00 0.00 C ATOM 814 NH1 ARG A 52 -6.903 -19.935 -0.917 1.00 0.00 N ATOM 815 NH2 ARG A 52 -8.387 -20.669 0.671 1.00 0.00 N ATOM 0 H ARG A 52 -9.685 -16.142 1.148 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.901 -16.070 3.485 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -7.684 -15.589 0.549 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -6.729 -14.526 1.563 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -5.166 -16.139 1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.238 -17.046 2.655 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.643 -17.185 -0.331 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.335 -18.099 0.393 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.738 -18.591 1.878 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.231 -19.242 -1.246 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.105 -20.759 -1.484 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.859 -20.542 1.566 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.587 -21.491 0.102 1.00 0.00 H new ATOM 829 N LEU A 53 -9.401 -13.454 2.120 1.00 0.00 N ATOM 830 CA LEU A 53 -9.848 -12.091 2.384 1.00 0.00 C ATOM 831 C LEU A 53 -11.082 -12.086 3.279 1.00 0.00 C ATOM 832 O LEU A 53 -11.850 -13.049 3.300 1.00 0.00 O ATOM 833 CB LEU A 53 -10.154 -11.368 1.072 1.00 0.00 C ATOM 834 CG LEU A 53 -9.137 -11.598 -0.047 1.00 0.00 C ATOM 835 CD1 LEU A 53 -9.475 -10.743 -1.258 1.00 0.00 C ATOM 836 CD2 LEU A 53 -7.728 -11.296 0.443 1.00 0.00 C ATOM 0 H LEU A 53 -9.674 -13.817 1.207 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.044 -11.567 2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -11.136 -11.685 0.721 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -10.217 -10.298 1.271 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.181 -12.646 -0.343 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.741 -10.919 -2.044 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.468 -11.005 -1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.459 -9.690 -0.976 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.017 -11.465 -0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.670 -10.256 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -7.486 -11.950 1.281 1.00 0.00 H new ATOM 848 N SER A 54 -11.268 -10.997 4.017 1.00 0.00 N ATOM 849 CA SER A 54 -12.411 -10.866 4.911 1.00 0.00 C ATOM 850 C SER A 54 -12.760 -9.400 5.141 1.00 0.00 C ATOM 851 O SER A 54 -11.893 -8.528 5.080 1.00 0.00 O ATOM 852 CB SER A 54 -12.120 -11.548 6.250 1.00 0.00 C ATOM 853 OG SER A 54 -12.697 -12.841 6.299 1.00 0.00 O ATOM 0 H SER A 54 -10.641 -10.192 4.013 1.00 0.00 H new ATOM 0 HA SER A 54 -13.264 -11.354 4.439 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.043 -11.621 6.398 1.00 0.00 H new ATOM 0 HB3 SER A 54 -12.513 -10.940 7.065 1.00 0.00 H new ATOM 0 HG SER A 54 -12.583 -13.283 5.432 1.00 0.00 H new ATOM 859 N VAL A 55 -14.034 -9.135 5.405 1.00 0.00 N ATOM 860 CA VAL A 55 -14.499 -7.772 5.645 1.00 0.00 C ATOM 861 C VAL A 55 -15.384 -7.713 6.883 1.00 0.00 C ATOM 862 O VAL A 55 -16.054 -8.687 7.228 1.00 0.00 O ATOM 863 CB VAL A 55 -15.289 -7.216 4.441 1.00 0.00 C ATOM 864 CG1 VAL A 55 -15.274 -5.695 4.450 1.00 0.00 C ATOM 865 CG2 VAL A 55 -14.734 -7.751 3.129 1.00 0.00 C ATOM 0 H VAL A 55 -14.764 -9.845 5.459 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.611 -7.159 5.796 1.00 0.00 H new ATOM 0 HB VAL A 55 -16.322 -7.552 4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -15.836 -5.321 3.594 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -15.731 -5.332 5.371 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -14.245 -5.341 4.392 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.309 -7.343 2.298 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -13.690 -7.455 3.028 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.805 -8.839 3.120 1.00 0.00 H new ATOM 875 N ASP A 56 -15.383 -6.565 7.552 1.00 0.00 N ATOM 876 CA ASP A 56 -16.188 -6.384 8.755 1.00 0.00 C ATOM 877 C ASP A 56 -16.240 -4.909 9.162 1.00 0.00 C ATOM 878 O ASP A 56 -15.213 -4.326 9.507 1.00 0.00 O ATOM 879 CB ASP A 56 -15.615 -7.219 9.901 1.00 0.00 C ATOM 880 CG ASP A 56 -16.538 -7.263 11.102 1.00 0.00 C ATOM 881 OD1 ASP A 56 -16.862 -6.184 11.642 1.00 0.00 O ATOM 882 OD2 ASP A 56 -16.938 -8.376 11.503 1.00 0.00 O ATOM 0 H ASP A 56 -14.835 -5.748 7.283 1.00 0.00 H new ATOM 0 HA ASP A 56 -17.203 -6.718 8.538 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -15.431 -8.235 9.550 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.652 -6.806 10.201 1.00 0.00 H new ATOM 887 N PRO A 57 -17.433 -4.275 9.131 1.00 0.00 N ATOM 888 CA PRO A 57 -18.693 -4.913 8.729 1.00 0.00 C ATOM 889 C PRO A 57 -18.757 -5.168 7.224 1.00 0.00 C ATOM 890 O PRO A 57 -18.336 -4.329 6.427 1.00 0.00 O ATOM 891 CB PRO A 57 -19.773 -3.898 9.140 1.00 0.00 C ATOM 892 CG PRO A 57 -19.068 -2.861 9.954 1.00 0.00 C ATOM 893 CD PRO A 57 -17.640 -2.870 9.493 1.00 0.00 C ATOM 0 HA PRO A 57 -18.813 -5.890 9.197 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -20.245 -3.453 8.264 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -20.562 -4.379 9.718 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -19.518 -1.879 9.809 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -19.136 -3.088 11.018 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -17.483 -2.205 8.644 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -16.957 -2.549 10.280 1.00 0.00 H new ATOM 901 N PRO A 58 -19.289 -6.332 6.810 1.00 0.00 N ATOM 902 CA PRO A 58 -19.408 -6.687 5.395 1.00 0.00 C ATOM 903 C PRO A 58 -20.613 -6.026 4.735 1.00 0.00 C ATOM 904 O PRO A 58 -20.580 -5.687 3.551 1.00 0.00 O ATOM 905 CB PRO A 58 -19.586 -8.202 5.439 1.00 0.00 C ATOM 906 CG PRO A 58 -20.291 -8.456 6.728 1.00 0.00 C ATOM 907 CD PRO A 58 -19.821 -7.393 7.689 1.00 0.00 C ATOM 0 HA PRO A 58 -18.549 -6.358 4.810 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -20.170 -8.558 4.590 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.625 -8.716 5.404 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -21.372 -8.408 6.595 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -20.060 -9.451 7.107 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -20.638 -7.026 8.310 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -19.055 -7.775 8.364 1.00 0.00 H new ATOM 915 N CYS A 59 -21.674 -5.846 5.513 1.00 0.00 N ATOM 916 CA CYS A 59 -22.897 -5.225 5.017 1.00 0.00 C ATOM 917 C CYS A 59 -23.480 -4.282 6.063 1.00 0.00 C ATOM 918 O CYS A 59 -23.229 -4.436 7.259 1.00 0.00 O ATOM 919 CB CYS A 59 -23.926 -6.296 4.650 1.00 0.00 C ATOM 920 SG CYS A 59 -23.263 -7.643 3.643 1.00 0.00 S ATOM 0 H CYS A 59 -21.712 -6.123 6.494 1.00 0.00 H new ATOM 0 HA CYS A 59 -22.651 -4.649 4.125 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -24.343 -6.713 5.567 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -24.748 -5.825 4.111 1.00 0.00 H new ATOM 0 HG CYS A 59 -24.208 -8.499 3.386 1.00 0.00 H new ATOM 926 N GLY A 60 -24.256 -3.306 5.609 1.00 0.00 N ATOM 927 CA GLY A 60 -24.859 -2.354 6.523 1.00 0.00 C ATOM 928 C GLY A 60 -25.691 -1.313 5.806 1.00 0.00 C ATOM 929 O GLY A 60 -25.515 -1.085 4.608 1.00 0.00 O ATOM 0 H GLY A 60 -24.479 -3.156 4.625 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -25.486 -2.887 7.237 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -24.075 -1.858 7.095 1.00 0.00 H new ATOM 933 N VAL A 61 -26.603 -0.679 6.535 1.00 0.00 N ATOM 934 CA VAL A 61 -27.464 0.341 5.954 1.00 0.00 C ATOM 935 C VAL A 61 -26.905 1.739 6.197 1.00 0.00 C ATOM 936 O VAL A 61 -26.822 2.197 7.338 1.00 0.00 O ATOM 937 CB VAL A 61 -28.896 0.260 6.519 1.00 0.00 C ATOM 938 CG1 VAL A 61 -28.918 0.638 7.993 1.00 0.00 C ATOM 939 CG2 VAL A 61 -29.834 1.148 5.715 1.00 0.00 C ATOM 0 H VAL A 61 -26.764 -0.854 7.527 1.00 0.00 H new ATOM 0 HA VAL A 61 -27.498 0.151 4.881 1.00 0.00 H new ATOM 0 HB VAL A 61 -29.243 -0.770 6.433 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -29.939 0.574 8.370 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -28.280 -0.046 8.553 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -28.551 1.657 8.113 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -30.841 1.080 6.126 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -29.490 2.181 5.766 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -29.844 0.820 4.676 1.00 0.00 H new ATOM 949 N LEU A 62 -26.520 2.413 5.118 1.00 0.00 N ATOM 950 CA LEU A 62 -25.968 3.759 5.212 1.00 0.00 C ATOM 951 C LEU A 62 -27.076 4.805 5.272 1.00 0.00 C ATOM 952 O LEU A 62 -28.237 4.512 4.986 1.00 0.00 O ATOM 953 CB LEU A 62 -25.052 4.040 4.017 1.00 0.00 C ATOM 954 CG LEU A 62 -23.558 4.073 4.339 1.00 0.00 C ATOM 955 CD1 LEU A 62 -22.737 4.006 3.061 1.00 0.00 C ATOM 956 CD2 LEU A 62 -23.214 5.326 5.130 1.00 0.00 C ATOM 0 H LEU A 62 -26.580 2.048 4.167 1.00 0.00 H new ATOM 0 HA LEU A 62 -25.388 3.821 6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -25.227 3.278 3.257 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -25.335 4.997 3.579 1.00 0.00 H new ATOM 0 HG LEU A 62 -23.316 3.203 4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -21.676 4.031 3.309 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -22.965 3.081 2.530 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -22.981 4.858 2.427 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -22.147 5.335 5.352 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -23.470 6.208 4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -23.778 5.334 6.063 1.00 0.00 H new ATOM 968 N ASP A 63 -26.709 6.027 5.644 1.00 0.00 N ATOM 969 CA ASP A 63 -27.670 7.121 5.739 1.00 0.00 C ATOM 970 C ASP A 63 -27.298 8.253 4.785 1.00 0.00 C ATOM 971 O ASP A 63 -26.187 8.291 4.259 1.00 0.00 O ATOM 972 CB ASP A 63 -27.735 7.646 7.174 1.00 0.00 C ATOM 973 CG ASP A 63 -28.954 7.140 7.920 1.00 0.00 C ATOM 974 OD1 ASP A 63 -29.731 6.362 7.328 1.00 0.00 O ATOM 975 OD2 ASP A 63 -29.131 7.521 9.096 1.00 0.00 O ATOM 0 H ASP A 63 -25.752 6.285 5.885 1.00 0.00 H new ATOM 0 HA ASP A 63 -28.651 6.739 5.456 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -26.834 7.345 7.709 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -27.748 8.736 7.159 1.00 0.00 H new ATOM 980 N PRO A 64 -28.227 9.195 4.549 1.00 0.00 N ATOM 981 CA PRO A 64 -27.994 10.332 3.653 1.00 0.00 C ATOM 982 C PRO A 64 -26.751 11.130 4.033 1.00 0.00 C ATOM 983 O PRO A 64 -26.741 11.842 5.037 1.00 0.00 O ATOM 984 CB PRO A 64 -29.254 11.197 3.813 1.00 0.00 C ATOM 985 CG PRO A 64 -29.940 10.682 5.035 1.00 0.00 C ATOM 986 CD PRO A 64 -29.574 9.230 5.135 1.00 0.00 C ATOM 0 HA PRO A 64 -27.820 10.002 2.629 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -28.995 12.250 3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -29.899 11.117 2.938 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -29.618 11.227 5.922 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -31.020 10.808 4.958 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -29.575 8.882 6.168 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -30.271 8.598 4.585 1.00 0.00 H new ATOM 994 N LYS A 65 -25.703 11.006 3.222 1.00 0.00 N ATOM 995 CA LYS A 65 -24.454 11.719 3.470 1.00 0.00 C ATOM 996 C LYS A 65 -23.732 11.155 4.690 1.00 0.00 C ATOM 997 O LYS A 65 -23.153 11.901 5.480 1.00 0.00 O ATOM 998 CB LYS A 65 -24.725 13.210 3.669 1.00 0.00 C ATOM 999 CG LYS A 65 -23.565 14.099 3.254 1.00 0.00 C ATOM 1000 CD LYS A 65 -23.953 15.022 2.111 1.00 0.00 C ATOM 1001 CE LYS A 65 -24.915 16.105 2.573 1.00 0.00 C ATOM 1002 NZ LYS A 65 -25.907 16.452 1.520 1.00 0.00 N ATOM 0 H LYS A 65 -25.695 10.419 2.388 1.00 0.00 H new ATOM 0 HA LYS A 65 -23.812 11.585 2.599 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -25.609 13.490 3.096 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -24.954 13.392 4.719 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -23.237 14.693 4.107 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -22.720 13.480 2.952 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -23.058 15.483 1.694 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -24.414 14.441 1.313 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -25.438 15.768 3.468 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -24.352 16.997 2.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -26.544 17.194 1.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -25.409 16.798 0.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -26.462 15.607 1.274 1.00 0.00 H new ATOM 1016 N GLU A 66 -23.771 9.835 4.838 1.00 0.00 N ATOM 1017 CA GLU A 66 -23.120 9.173 5.961 1.00 0.00 C ATOM 1018 C GLU A 66 -21.939 8.334 5.490 1.00 0.00 C ATOM 1019 O GLU A 66 -21.888 7.904 4.337 1.00 0.00 O ATOM 1020 CB GLU A 66 -24.120 8.293 6.709 1.00 0.00 C ATOM 1021 CG GLU A 66 -24.681 8.945 7.960 1.00 0.00 C ATOM 1022 CD GLU A 66 -24.271 8.222 9.229 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -24.551 7.009 9.336 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -23.670 8.867 10.113 1.00 0.00 O ATOM 0 H GLU A 66 -24.247 9.203 4.194 1.00 0.00 H new ATOM 0 HA GLU A 66 -22.747 9.943 6.637 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -24.943 8.041 6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.634 7.357 6.983 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -24.341 9.979 8.010 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -25.769 8.970 7.896 1.00 0.00 H new ATOM 1031 N LYS A 67 -20.992 8.103 6.391 1.00 0.00 N ATOM 1032 CA LYS A 67 -19.808 7.314 6.071 1.00 0.00 C ATOM 1033 C LYS A 67 -19.587 6.216 7.106 1.00 0.00 C ATOM 1034 O LYS A 67 -19.707 6.449 8.310 1.00 0.00 O ATOM 1035 CB LYS A 67 -18.574 8.216 5.995 1.00 0.00 C ATOM 1036 CG LYS A 67 -18.180 8.822 7.332 1.00 0.00 C ATOM 1037 CD LYS A 67 -16.763 9.372 7.298 1.00 0.00 C ATOM 1038 CE LYS A 67 -16.671 10.720 7.993 1.00 0.00 C ATOM 1039 NZ LYS A 67 -15.676 10.707 9.101 1.00 0.00 N ATOM 0 H LYS A 67 -21.021 8.451 7.349 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.967 6.844 5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -17.735 7.638 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -18.765 9.019 5.283 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -18.875 9.621 7.590 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -18.259 8.066 8.113 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -16.086 8.666 7.780 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.435 9.472 6.263 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -16.396 11.485 7.267 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -17.650 10.993 8.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -15.643 11.645 9.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -15.952 9.995 9.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -14.737 10.472 8.721 1.00 0.00 H new ATOM 1053 N VAL A 68 -19.260 5.019 6.630 1.00 0.00 N ATOM 1054 CA VAL A 68 -19.020 3.884 7.512 1.00 0.00 C ATOM 1055 C VAL A 68 -17.623 3.312 7.300 1.00 0.00 C ATOM 1056 O VAL A 68 -17.223 3.028 6.170 1.00 0.00 O ATOM 1057 CB VAL A 68 -20.058 2.768 7.288 1.00 0.00 C ATOM 1058 CG1 VAL A 68 -21.399 3.158 7.889 1.00 0.00 C ATOM 1059 CG2 VAL A 68 -20.199 2.460 5.804 1.00 0.00 C ATOM 0 H VAL A 68 -19.155 4.810 5.637 1.00 0.00 H new ATOM 0 HA VAL A 68 -19.110 4.253 8.534 1.00 0.00 H new ATOM 0 HB VAL A 68 -19.710 1.866 7.791 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -22.120 2.358 7.721 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -21.283 3.323 8.960 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -21.757 4.073 7.417 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -20.936 1.669 5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -20.524 3.356 5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -19.238 2.133 5.407 1.00 0.00 H new ATOM 1069 N LEU A 69 -16.885 3.144 8.392 1.00 0.00 N ATOM 1070 CA LEU A 69 -15.531 2.606 8.325 1.00 0.00 C ATOM 1071 C LEU A 69 -15.547 1.084 8.432 1.00 0.00 C ATOM 1072 O LEU A 69 -16.122 0.524 9.365 1.00 0.00 O ATOM 1073 CB LEU A 69 -14.668 3.199 9.441 1.00 0.00 C ATOM 1074 CG LEU A 69 -13.278 3.666 9.007 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -12.568 4.369 10.154 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -12.452 2.488 8.508 1.00 0.00 C ATOM 0 H LEU A 69 -17.202 3.373 9.334 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.103 2.881 7.361 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.198 4.045 9.879 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -14.555 2.452 10.227 1.00 0.00 H new ATOM 0 HG LEU A 69 -13.393 4.377 8.189 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.581 4.694 9.826 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.150 5.236 10.466 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -12.463 3.681 10.993 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.466 2.838 8.203 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -12.346 1.754 9.307 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.953 2.027 7.656 1.00 0.00 H new ATOM 1088 N MET A 70 -14.910 0.420 7.472 1.00 0.00 N ATOM 1089 CA MET A 70 -14.852 -1.037 7.460 1.00 0.00 C ATOM 1090 C MET A 70 -13.418 -1.522 7.285 1.00 0.00 C ATOM 1091 O MET A 70 -12.556 -0.785 6.808 1.00 0.00 O ATOM 1092 CB MET A 70 -15.739 -1.598 6.346 1.00 0.00 C ATOM 1093 CG MET A 70 -15.645 -0.819 5.046 1.00 0.00 C ATOM 1094 SD MET A 70 -14.006 -0.912 4.302 1.00 0.00 S ATOM 1095 CE MET A 70 -14.418 -1.451 2.645 1.00 0.00 C ATOM 0 H MET A 70 -14.427 0.868 6.693 1.00 0.00 H new ATOM 0 HA MET A 70 -15.222 -1.398 8.419 1.00 0.00 H new ATOM 0 HB2 MET A 70 -15.462 -2.635 6.159 1.00 0.00 H new ATOM 0 HB3 MET A 70 -16.775 -1.601 6.684 1.00 0.00 H new ATOM 0 HG2 MET A 70 -16.382 -1.204 4.342 1.00 0.00 H new ATOM 0 HG3 MET A 70 -15.897 0.225 5.233 1.00 0.00 H new ATOM 0 HE1 MET A 70 -13.553 -1.939 2.195 1.00 0.00 H new ATOM 0 HE2 MET A 70 -15.250 -2.154 2.687 1.00 0.00 H new ATOM 0 HE3 MET A 70 -14.703 -0.589 2.042 1.00 0.00 H new ATOM 1105 N ALA A 71 -13.171 -2.765 7.681 1.00 0.00 N ATOM 1106 CA ALA A 71 -11.840 -3.352 7.578 1.00 0.00 C ATOM 1107 C ALA A 71 -11.814 -4.503 6.578 1.00 0.00 C ATOM 1108 O ALA A 71 -12.834 -5.136 6.313 1.00 0.00 O ATOM 1109 CB ALA A 71 -11.374 -3.833 8.942 1.00 0.00 C ATOM 0 H ALA A 71 -13.876 -3.387 8.077 1.00 0.00 H new ATOM 0 HA ALA A 71 -11.160 -2.580 7.217 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -10.379 -4.270 8.854 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -11.341 -2.991 9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -12.068 -4.584 9.319 1.00 0.00 H new ATOM 1115 N VAL A 72 -10.631 -4.768 6.029 1.00 0.00 N ATOM 1116 CA VAL A 72 -10.456 -5.845 5.064 1.00 0.00 C ATOM 1117 C VAL A 72 -9.351 -6.796 5.509 1.00 0.00 C ATOM 1118 O VAL A 72 -8.205 -6.682 5.073 1.00 0.00 O ATOM 1119 CB VAL A 72 -10.113 -5.299 3.665 1.00 0.00 C ATOM 1120 CG1 VAL A 72 -9.955 -6.437 2.669 1.00 0.00 C ATOM 1121 CG2 VAL A 72 -11.178 -4.317 3.198 1.00 0.00 C ATOM 0 H VAL A 72 -9.778 -4.249 6.238 1.00 0.00 H new ATOM 0 HA VAL A 72 -11.403 -6.383 5.011 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.163 -4.768 3.727 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.713 -6.030 1.687 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.152 -7.098 2.996 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -10.886 -7.000 2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.918 -3.942 2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -12.143 -4.821 3.153 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -11.236 -3.483 3.898 1.00 0.00 H new ATOM 1131 N SER A 73 -9.703 -7.730 6.386 1.00 0.00 N ATOM 1132 CA SER A 73 -8.742 -8.699 6.901 1.00 0.00 C ATOM 1133 C SER A 73 -8.022 -9.419 5.765 1.00 0.00 C ATOM 1134 O SER A 73 -8.640 -9.830 4.784 1.00 0.00 O ATOM 1135 CB SER A 73 -9.448 -9.717 7.799 1.00 0.00 C ATOM 1136 OG SER A 73 -9.727 -9.166 9.074 1.00 0.00 O ATOM 0 H SER A 73 -10.648 -7.837 6.755 1.00 0.00 H new ATOM 0 HA SER A 73 -7.999 -8.157 7.486 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.376 -10.040 7.328 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.823 -10.603 7.911 1.00 0.00 H new ATOM 0 HG SER A 73 -10.180 -9.836 9.628 1.00 0.00 H new ATOM 1142 N CYS A 74 -6.709 -9.570 5.910 1.00 0.00 N ATOM 1143 CA CYS A 74 -5.897 -10.242 4.903 1.00 0.00 C ATOM 1144 C CYS A 74 -4.662 -10.871 5.538 1.00 0.00 C ATOM 1145 O CYS A 74 -3.574 -10.294 5.513 1.00 0.00 O ATOM 1146 CB CYS A 74 -5.479 -9.256 3.811 1.00 0.00 C ATOM 1147 SG CYS A 74 -6.794 -8.852 2.638 1.00 0.00 S ATOM 0 H CYS A 74 -6.184 -9.235 6.718 1.00 0.00 H new ATOM 0 HA CYS A 74 -6.498 -11.033 4.454 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -5.131 -8.336 4.281 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -4.634 -9.674 3.263 1.00 0.00 H new ATOM 0 HG CYS A 74 -7.948 -9.134 3.166 1.00 0.00 H new ATOM 1153 N ASP A 75 -4.839 -12.058 6.110 1.00 0.00 N ATOM 1154 CA ASP A 75 -3.742 -12.768 6.755 1.00 0.00 C ATOM 1155 C ASP A 75 -2.663 -13.145 5.746 1.00 0.00 C ATOM 1156 O ASP A 75 -2.948 -13.369 4.570 1.00 0.00 O ATOM 1157 CB ASP A 75 -4.262 -14.025 7.455 1.00 0.00 C ATOM 1158 CG ASP A 75 -4.783 -15.058 6.474 1.00 0.00 C ATOM 1159 OD1 ASP A 75 -5.663 -14.711 5.658 1.00 0.00 O ATOM 1160 OD2 ASP A 75 -4.311 -16.213 6.521 1.00 0.00 O ATOM 0 H ASP A 75 -5.733 -12.548 6.139 1.00 0.00 H new ATOM 0 HA ASP A 75 -3.301 -12.102 7.496 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.461 -14.464 8.050 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.059 -13.750 8.146 1.00 0.00 H new ATOM 1165 N THR A 76 -1.421 -13.215 6.216 1.00 0.00 N ATOM 1166 CA THR A 76 -0.296 -13.567 5.358 1.00 0.00 C ATOM 1167 C THR A 76 -0.545 -14.896 4.652 1.00 0.00 C ATOM 1168 O THR A 76 -1.404 -15.676 5.065 1.00 0.00 O ATOM 1169 CB THR A 76 0.992 -13.647 6.177 1.00 0.00 C ATOM 1170 OG1 THR A 76 1.975 -14.403 5.493 1.00 0.00 O ATOM 1171 CG2 THR A 76 0.798 -14.272 7.541 1.00 0.00 C ATOM 0 H THR A 76 -1.169 -13.032 7.187 1.00 0.00 H new ATOM 0 HA THR A 76 -0.191 -12.788 4.603 1.00 0.00 H new ATOM 0 HB THR A 76 1.312 -12.614 6.312 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.257 -13.920 4.688 1.00 0.00 H new ATOM 0 HG21 THR A 76 1.752 -14.297 8.068 1.00 0.00 H new ATOM 0 HG22 THR A 76 0.082 -13.682 8.113 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.420 -15.288 7.425 1.00 0.00 H new ATOM 1179 N PHE A 77 0.209 -15.148 3.588 1.00 0.00 N ATOM 1180 CA PHE A 77 0.068 -16.384 2.826 1.00 0.00 C ATOM 1181 C PHE A 77 1.234 -16.565 1.860 1.00 0.00 C ATOM 1182 O PHE A 77 2.225 -15.839 1.926 1.00 0.00 O ATOM 1183 CB PHE A 77 -1.252 -16.385 2.054 1.00 0.00 C ATOM 1184 CG PHE A 77 -1.305 -15.360 0.956 1.00 0.00 C ATOM 1185 CD1 PHE A 77 -1.655 -14.048 1.232 1.00 0.00 C ATOM 1186 CD2 PHE A 77 -1.003 -15.709 -0.350 1.00 0.00 C ATOM 1187 CE1 PHE A 77 -1.703 -13.103 0.225 1.00 0.00 C ATOM 1188 CE2 PHE A 77 -1.051 -14.769 -1.361 1.00 0.00 C ATOM 1189 CZ PHE A 77 -1.401 -13.464 -1.074 1.00 0.00 C ATOM 0 H PHE A 77 0.924 -14.513 3.233 1.00 0.00 H new ATOM 0 HA PHE A 77 0.070 -17.216 3.530 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.412 -17.374 1.625 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.071 -16.203 2.750 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.893 -13.761 2.246 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.727 -16.727 -0.580 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.976 -12.083 0.453 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.815 -15.054 -2.376 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.439 -12.728 -1.863 1.00 0.00 H new ATOM 1199 N ASN A 78 1.107 -17.538 0.964 1.00 0.00 N ATOM 1200 CA ASN A 78 2.149 -17.814 -0.018 1.00 0.00 C ATOM 1201 C ASN A 78 1.773 -17.251 -1.383 1.00 0.00 C ATOM 1202 O ASN A 78 0.810 -17.697 -2.006 1.00 0.00 O ATOM 1203 CB ASN A 78 2.392 -19.321 -0.123 1.00 0.00 C ATOM 1204 CG ASN A 78 3.151 -19.868 1.069 1.00 0.00 C ATOM 1205 OD1 ASN A 78 3.478 -19.134 2.002 1.00 0.00 O ATOM 1206 ND2 ASN A 78 3.437 -21.165 1.044 1.00 0.00 N ATOM 0 H ASN A 78 0.293 -18.149 0.898 1.00 0.00 H new ATOM 0 HA ASN A 78 3.066 -17.327 0.314 1.00 0.00 H new ATOM 0 HB2 ASN A 78 1.435 -19.836 -0.208 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.950 -19.534 -1.035 1.00 0.00 H new ATOM 0 HD21 ASN A 78 3.947 -21.590 1.818 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.147 -21.736 0.250 1.00 0.00 H new ATOM 1213 N ALA A 79 2.540 -16.268 -1.843 1.00 0.00 N ATOM 1214 CA ALA A 79 2.289 -15.642 -3.137 1.00 0.00 C ATOM 1215 C ALA A 79 3.096 -16.310 -4.244 1.00 0.00 C ATOM 1216 O ALA A 79 3.348 -15.710 -5.289 1.00 0.00 O ATOM 1217 CB ALA A 79 2.615 -14.160 -3.071 1.00 0.00 C ATOM 0 H ALA A 79 3.341 -15.887 -1.339 1.00 0.00 H new ATOM 0 HA ALA A 79 1.232 -15.767 -3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.424 -13.702 -4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.990 -13.683 -2.316 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.665 -14.030 -2.808 1.00 0.00 H new ATOM 1223 N ALA A 80 3.502 -17.552 -4.009 1.00 0.00 N ATOM 1224 CA ALA A 80 4.283 -18.300 -4.988 1.00 0.00 C ATOM 1225 C ALA A 80 3.392 -19.195 -5.841 1.00 0.00 C ATOM 1226 O ALA A 80 3.681 -19.442 -7.011 1.00 0.00 O ATOM 1227 CB ALA A 80 5.346 -19.132 -4.289 1.00 0.00 C ATOM 0 H ALA A 80 3.304 -18.063 -3.149 1.00 0.00 H new ATOM 0 HA ALA A 80 4.769 -17.582 -5.648 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.921 -19.685 -5.031 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.012 -18.475 -3.729 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.868 -19.833 -3.605 1.00 0.00 H new ATOM 1233 N THR A 81 2.311 -19.687 -5.244 1.00 0.00 N ATOM 1234 CA THR A 81 1.385 -20.562 -5.952 1.00 0.00 C ATOM 1235 C THR A 81 -0.058 -20.287 -5.542 1.00 0.00 C ATOM 1236 O THR A 81 -0.770 -21.188 -5.099 1.00 0.00 O ATOM 1237 CB THR A 81 1.738 -22.023 -5.680 1.00 0.00 C ATOM 1238 OG1 THR A 81 1.552 -22.340 -4.312 1.00 0.00 O ATOM 1239 CG2 THR A 81 3.167 -22.358 -6.041 1.00 0.00 C ATOM 0 H THR A 81 2.056 -19.495 -4.275 1.00 0.00 H new ATOM 0 HA THR A 81 1.476 -20.361 -7.019 1.00 0.00 H new ATOM 0 HB THR A 81 1.069 -22.609 -6.310 1.00 0.00 H new ATOM 0 HG1 THR A 81 0.611 -22.210 -4.071 1.00 0.00 H new ATOM 0 HG21 THR A 81 3.360 -23.409 -5.826 1.00 0.00 H new ATOM 0 HG22 THR A 81 3.328 -22.169 -7.102 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.845 -21.738 -5.455 1.00 0.00 H new ATOM 1247 N GLU A 82 -0.482 -19.038 -5.693 1.00 0.00 N ATOM 1248 CA GLU A 82 -1.841 -18.644 -5.340 1.00 0.00 C ATOM 1249 C GLU A 82 -2.550 -18.013 -6.532 1.00 0.00 C ATOM 1250 O GLU A 82 -1.977 -17.888 -7.614 1.00 0.00 O ATOM 1251 CB GLU A 82 -1.822 -17.666 -4.164 1.00 0.00 C ATOM 1252 CG GLU A 82 -1.932 -18.343 -2.809 1.00 0.00 C ATOM 1253 CD GLU A 82 -3.281 -19.002 -2.595 1.00 0.00 C ATOM 1254 OE1 GLU A 82 -4.071 -19.063 -3.561 1.00 0.00 O ATOM 1255 OE2 GLU A 82 -3.546 -19.458 -1.463 1.00 0.00 O ATOM 0 H GLU A 82 0.096 -18.280 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.389 -19.540 -5.048 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.899 -17.088 -4.198 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.645 -16.960 -4.276 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.146 -19.093 -2.717 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -1.763 -17.606 -2.024 1.00 0.00 H new ATOM 1262 N ASP A 83 -3.802 -17.616 -6.329 1.00 0.00 N ATOM 1263 CA ASP A 83 -4.589 -16.998 -7.389 1.00 0.00 C ATOM 1264 C ASP A 83 -4.625 -15.483 -7.230 1.00 0.00 C ATOM 1265 O ASP A 83 -5.581 -14.927 -6.689 1.00 0.00 O ATOM 1266 CB ASP A 83 -6.012 -17.558 -7.393 1.00 0.00 C ATOM 1267 CG ASP A 83 -6.579 -17.708 -5.994 1.00 0.00 C ATOM 1268 OD1 ASP A 83 -6.298 -18.738 -5.347 1.00 0.00 O ATOM 1269 OD2 ASP A 83 -7.303 -16.794 -5.547 1.00 0.00 O ATOM 0 H ASP A 83 -4.293 -17.711 -5.440 1.00 0.00 H new ATOM 0 HA ASP A 83 -4.113 -17.232 -8.341 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -6.657 -16.899 -7.975 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -6.016 -18.528 -7.890 1.00 0.00 H new ATOM 1274 N LEU A 84 -3.578 -14.819 -7.707 1.00 0.00 N ATOM 1275 CA LEU A 84 -3.490 -13.365 -7.622 1.00 0.00 C ATOM 1276 C LEU A 84 -3.457 -12.745 -9.015 1.00 0.00 C ATOM 1277 O LEU A 84 -2.446 -12.184 -9.431 1.00 0.00 O ATOM 1278 CB LEU A 84 -2.242 -12.953 -6.839 1.00 0.00 C ATOM 1279 CG LEU A 84 -1.942 -13.803 -5.603 1.00 0.00 C ATOM 1280 CD1 LEU A 84 -0.836 -13.166 -4.775 1.00 0.00 C ATOM 1281 CD2 LEU A 84 -3.199 -13.989 -4.767 1.00 0.00 C ATOM 0 H LEU A 84 -2.778 -15.264 -8.157 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.374 -13.000 -7.099 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.382 -12.995 -7.507 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.353 -11.914 -6.528 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.601 -14.785 -5.932 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.635 -13.784 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.069 -13.085 -5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.148 -12.172 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.967 -14.596 -3.892 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.570 -13.016 -4.446 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.962 -14.489 -5.364 1.00 0.00 H new ATOM 1293 N ASN A 85 -4.573 -12.853 -9.729 1.00 0.00 N ATOM 1294 CA ASN A 85 -4.671 -12.305 -11.076 1.00 0.00 C ATOM 1295 C ASN A 85 -5.074 -10.835 -11.036 1.00 0.00 C ATOM 1296 O ASN A 85 -4.736 -10.065 -11.936 1.00 0.00 O ATOM 1297 CB ASN A 85 -5.686 -13.100 -11.901 1.00 0.00 C ATOM 1298 CG ASN A 85 -5.050 -13.787 -13.093 1.00 0.00 C ATOM 1299 OD1 ASN A 85 -4.169 -14.633 -12.941 1.00 0.00 O ATOM 1300 ND2 ASN A 85 -5.496 -13.426 -14.291 1.00 0.00 N ATOM 0 H ASN A 85 -5.420 -13.314 -9.398 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.690 -12.383 -11.545 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -6.161 -13.847 -11.265 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -6.473 -12.430 -12.248 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -5.106 -13.855 -15.131 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -6.228 -12.720 -14.371 1.00 0.00 H new ATOM 1307 N ASN A 86 -5.798 -10.451 -9.991 1.00 0.00 N ATOM 1308 CA ASN A 86 -6.246 -9.071 -9.841 1.00 0.00 C ATOM 1309 C ASN A 86 -7.087 -8.895 -8.582 1.00 0.00 C ATOM 1310 O ASN A 86 -6.860 -7.976 -7.796 1.00 0.00 O ATOM 1311 CB ASN A 86 -7.057 -8.646 -11.066 1.00 0.00 C ATOM 1312 CG ASN A 86 -6.288 -7.711 -11.978 1.00 0.00 C ATOM 1313 OD1 ASN A 86 -6.019 -6.563 -11.625 1.00 0.00 O ATOM 1314 ND2 ASN A 86 -5.929 -8.200 -13.160 1.00 0.00 N ATOM 0 H ASN A 86 -6.087 -11.074 -9.237 1.00 0.00 H new ATOM 0 HA ASN A 86 -5.362 -8.440 -9.752 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.353 -9.533 -11.627 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -7.974 -8.156 -10.738 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.409 -7.618 -13.816 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.173 -9.158 -13.411 1.00 0.00 H new ATOM 1321 N ASP A 87 -8.070 -9.770 -8.406 1.00 0.00 N ATOM 1322 CA ASP A 87 -8.956 -9.696 -7.252 1.00 0.00 C ATOM 1323 C ASP A 87 -9.812 -8.439 -7.337 1.00 0.00 C ATOM 1324 O ASP A 87 -9.371 -7.420 -7.867 1.00 0.00 O ATOM 1325 CB ASP A 87 -8.148 -9.698 -5.953 1.00 0.00 C ATOM 1326 CG ASP A 87 -8.547 -10.832 -5.028 1.00 0.00 C ATOM 1327 OD1 ASP A 87 -8.030 -11.955 -5.209 1.00 0.00 O ATOM 1328 OD2 ASP A 87 -9.375 -10.598 -4.123 1.00 0.00 O ATOM 0 H ASP A 87 -8.273 -10.537 -9.047 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.606 -10.571 -7.253 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -7.087 -9.780 -6.188 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.288 -8.747 -5.439 1.00 0.00 H new ATOM 1333 N ARG A 88 -11.036 -8.510 -6.832 1.00 0.00 N ATOM 1334 CA ARG A 88 -11.929 -7.360 -6.882 1.00 0.00 C ATOM 1335 C ARG A 88 -12.985 -7.412 -5.787 1.00 0.00 C ATOM 1336 O ARG A 88 -13.642 -8.434 -5.583 1.00 0.00 O ATOM 1337 CB ARG A 88 -12.611 -7.284 -8.248 1.00 0.00 C ATOM 1338 CG ARG A 88 -11.749 -6.649 -9.326 1.00 0.00 C ATOM 1339 CD ARG A 88 -12.501 -6.527 -10.641 1.00 0.00 C ATOM 1340 NE ARG A 88 -12.803 -7.833 -11.223 1.00 0.00 N ATOM 1341 CZ ARG A 88 -11.891 -8.616 -11.790 1.00 0.00 C ATOM 1342 NH1 ARG A 88 -10.625 -8.229 -11.847 1.00 0.00 N ATOM 1343 NH2 ARG A 88 -12.244 -9.788 -12.300 1.00 0.00 N ATOM 0 H ARG A 88 -11.430 -9.340 -6.389 1.00 0.00 H new ATOM 0 HA ARG A 88 -11.322 -6.469 -6.721 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -12.888 -8.290 -8.562 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -13.535 -6.714 -8.152 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.424 -5.661 -8.999 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -10.850 -7.248 -9.474 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.429 -5.979 -10.478 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -11.907 -5.945 -11.346 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.768 -8.162 -11.192 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -10.349 -7.329 -11.455 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -9.927 -8.831 -12.283 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -13.217 -10.090 -12.258 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -11.542 -10.387 -12.735 1.00 0.00 H new ATOM 1357 N ILE A 89 -13.155 -6.287 -5.101 1.00 0.00 N ATOM 1358 CA ILE A 89 -14.147 -6.175 -4.041 1.00 0.00 C ATOM 1359 C ILE A 89 -15.378 -5.443 -4.564 1.00 0.00 C ATOM 1360 O ILE A 89 -15.369 -4.220 -4.707 1.00 0.00 O ATOM 1361 CB ILE A 89 -13.582 -5.427 -2.815 1.00 0.00 C ATOM 1362 CG1 ILE A 89 -12.390 -6.188 -2.232 1.00 0.00 C ATOM 1363 CG2 ILE A 89 -14.662 -5.236 -1.758 1.00 0.00 C ATOM 1364 CD1 ILE A 89 -11.491 -5.333 -1.366 1.00 0.00 C ATOM 0 H ILE A 89 -12.615 -5.437 -5.262 1.00 0.00 H new ATOM 0 HA ILE A 89 -14.419 -7.183 -3.727 1.00 0.00 H new ATOM 0 HB ILE A 89 -13.242 -4.443 -3.137 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -12.759 -7.027 -1.642 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -11.802 -6.607 -3.049 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -14.244 -4.707 -0.902 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -15.483 -4.655 -2.178 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -15.033 -6.209 -1.437 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.668 -5.939 -0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -11.093 -4.509 -1.958 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -12.064 -4.935 -0.528 1.00 0.00 H new ATOM 1376 N THR A 90 -16.426 -6.198 -4.868 1.00 0.00 N ATOM 1377 CA THR A 90 -17.651 -5.617 -5.398 1.00 0.00 C ATOM 1378 C THR A 90 -18.553 -5.096 -4.287 1.00 0.00 C ATOM 1379 O THR A 90 -18.728 -5.743 -3.254 1.00 0.00 O ATOM 1380 CB THR A 90 -18.406 -6.648 -6.237 1.00 0.00 C ATOM 1381 OG1 THR A 90 -17.541 -7.261 -7.178 1.00 0.00 O ATOM 1382 CG2 THR A 90 -19.573 -6.059 -7.001 1.00 0.00 C ATOM 0 H THR A 90 -16.452 -7.212 -4.757 1.00 0.00 H new ATOM 0 HA THR A 90 -17.369 -4.773 -6.027 1.00 0.00 H new ATOM 0 HB THR A 90 -18.790 -7.376 -5.522 1.00 0.00 H new ATOM 0 HG1 THR A 90 -17.484 -6.703 -7.982 1.00 0.00 H new ATOM 0 HG21 THR A 90 -20.065 -6.844 -7.575 1.00 0.00 H new ATOM 0 HG22 THR A 90 -20.284 -5.623 -6.300 1.00 0.00 H new ATOM 0 HG23 THR A 90 -19.211 -5.286 -7.679 1.00 0.00 H new ATOM 1390 N ILE A 91 -19.132 -3.925 -4.521 1.00 0.00 N ATOM 1391 CA ILE A 91 -20.031 -3.303 -3.563 1.00 0.00 C ATOM 1392 C ILE A 91 -21.388 -3.050 -4.200 1.00 0.00 C ATOM 1393 O ILE A 91 -21.488 -2.389 -5.232 1.00 0.00 O ATOM 1394 CB ILE A 91 -19.462 -1.974 -3.041 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -18.035 -2.179 -2.533 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -20.354 -1.412 -1.942 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -17.477 -0.981 -1.802 1.00 0.00 C ATOM 0 H ILE A 91 -18.992 -3.385 -5.375 1.00 0.00 H new ATOM 0 HA ILE A 91 -20.140 -3.989 -2.723 1.00 0.00 H new ATOM 0 HB ILE A 91 -19.436 -1.253 -3.858 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -18.015 -3.042 -1.868 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -17.387 -2.413 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -19.939 -0.471 -1.582 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -21.355 -1.239 -2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -20.408 -2.123 -1.118 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -16.462 -1.198 -1.470 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -17.464 -0.120 -2.471 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -18.102 -0.759 -0.937 1.00 0.00 H new ATOM 1409 N GLU A 92 -22.430 -3.587 -3.587 1.00 0.00 N ATOM 1410 CA GLU A 92 -23.782 -3.426 -4.105 1.00 0.00 C ATOM 1411 C GLU A 92 -24.679 -2.730 -3.092 1.00 0.00 C ATOM 1412 O GLU A 92 -24.994 -3.290 -2.041 1.00 0.00 O ATOM 1413 CB GLU A 92 -24.374 -4.787 -4.474 1.00 0.00 C ATOM 1414 CG GLU A 92 -23.526 -5.572 -5.462 1.00 0.00 C ATOM 1415 CD GLU A 92 -23.779 -7.065 -5.388 1.00 0.00 C ATOM 1416 OE1 GLU A 92 -24.698 -7.477 -4.649 1.00 0.00 O ATOM 1417 OE2 GLU A 92 -23.057 -7.824 -6.069 1.00 0.00 O ATOM 0 H GLU A 92 -22.368 -4.138 -2.731 1.00 0.00 H new ATOM 0 HA GLU A 92 -23.726 -2.804 -4.998 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -24.499 -5.377 -3.566 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -25.367 -4.639 -4.898 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -23.734 -5.221 -6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -22.472 -5.376 -5.267 1.00 0.00 H new ATOM 1424 N TRP A 93 -25.094 -1.510 -3.418 1.00 0.00 N ATOM 1425 CA TRP A 93 -25.966 -0.742 -2.541 1.00 0.00 C ATOM 1426 C TRP A 93 -27.200 -0.263 -3.297 1.00 0.00 C ATOM 1427 O TRP A 93 -27.092 0.322 -4.376 1.00 0.00 O ATOM 1428 CB TRP A 93 -25.214 0.448 -1.933 1.00 0.00 C ATOM 1429 CG TRP A 93 -24.965 1.568 -2.898 1.00 0.00 C ATOM 1430 CD1 TRP A 93 -25.629 2.760 -2.959 1.00 0.00 C ATOM 1431 CD2 TRP A 93 -23.979 1.602 -3.937 1.00 0.00 C ATOM 1432 NE1 TRP A 93 -25.115 3.533 -3.972 1.00 0.00 N ATOM 1433 CE2 TRP A 93 -24.101 2.844 -4.587 1.00 0.00 C ATOM 1434 CE3 TRP A 93 -23.004 0.703 -4.379 1.00 0.00 C ATOM 1435 CZ2 TRP A 93 -23.286 3.209 -5.655 1.00 0.00 C ATOM 1436 CZ3 TRP A 93 -22.195 1.067 -5.438 1.00 0.00 C ATOM 1437 CH2 TRP A 93 -22.339 2.310 -6.066 1.00 0.00 C ATOM 0 H TRP A 93 -24.840 -1.033 -4.283 1.00 0.00 H new ATOM 0 HA TRP A 93 -26.290 -1.393 -1.729 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -25.784 0.831 -1.087 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -24.258 0.099 -1.542 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -26.439 3.052 -2.307 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -25.436 4.468 -4.225 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -22.885 -0.258 -3.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -23.397 4.167 -6.142 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -21.438 0.381 -5.788 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -21.690 2.565 -6.891 1.00 0.00 H new ATOM 1448 N THR A 94 -28.374 -0.526 -2.731 1.00 0.00 N ATOM 1449 CA THR A 94 -29.629 -0.128 -3.364 1.00 0.00 C ATOM 1450 C THR A 94 -30.512 0.659 -2.402 1.00 0.00 C ATOM 1451 O THR A 94 -30.483 0.437 -1.193 1.00 0.00 O ATOM 1452 CB THR A 94 -30.379 -1.362 -3.868 1.00 0.00 C ATOM 1453 OG1 THR A 94 -31.712 -1.030 -4.217 1.00 0.00 O ATOM 1454 CG2 THR A 94 -30.437 -2.484 -2.854 1.00 0.00 C ATOM 0 H THR A 94 -28.484 -1.010 -1.840 1.00 0.00 H new ATOM 0 HA THR A 94 -29.387 0.519 -4.208 1.00 0.00 H new ATOM 0 HB THR A 94 -29.817 -1.707 -4.736 1.00 0.00 H new ATOM 0 HG1 THR A 94 -31.709 -0.462 -5.015 1.00 0.00 H new ATOM 0 HG21 THR A 94 -30.983 -3.328 -3.276 1.00 0.00 H new ATOM 0 HG22 THR A 94 -29.424 -2.797 -2.600 1.00 0.00 H new ATOM 0 HG23 THR A 94 -30.946 -2.136 -1.955 1.00 0.00 H new ATOM 1462 N ASN A 95 -31.301 1.577 -2.951 1.00 0.00 N ATOM 1463 CA ASN A 95 -32.197 2.396 -2.145 1.00 0.00 C ATOM 1464 C ASN A 95 -33.063 1.527 -1.240 1.00 0.00 C ATOM 1465 O ASN A 95 -33.421 0.405 -1.597 1.00 0.00 O ATOM 1466 CB ASN A 95 -33.087 3.256 -3.045 1.00 0.00 C ATOM 1467 CG ASN A 95 -32.283 4.144 -3.975 1.00 0.00 C ATOM 1468 OD1 ASN A 95 -31.269 4.720 -3.580 1.00 0.00 O ATOM 1469 ND2 ASN A 95 -32.733 4.259 -5.219 1.00 0.00 N ATOM 0 H ASN A 95 -31.337 1.772 -3.952 1.00 0.00 H new ATOM 0 HA ASN A 95 -31.586 3.047 -1.520 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -33.735 2.609 -3.636 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -33.735 3.876 -2.425 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -32.234 4.843 -5.890 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -33.578 3.764 -5.504 1.00 0.00 H new ATOM 1476 N THR A 96 -33.395 2.053 -0.066 1.00 0.00 N ATOM 1477 CA THR A 96 -34.220 1.324 0.890 1.00 0.00 C ATOM 1478 C THR A 96 -35.703 1.510 0.580 1.00 0.00 C ATOM 1479 O THR A 96 -36.154 2.626 0.325 1.00 0.00 O ATOM 1480 CB THR A 96 -33.925 1.798 2.313 1.00 0.00 C ATOM 1481 OG1 THR A 96 -33.785 3.207 2.354 1.00 0.00 O ATOM 1482 CG2 THR A 96 -32.667 1.196 2.898 1.00 0.00 C ATOM 0 H THR A 96 -33.106 2.980 0.246 1.00 0.00 H new ATOM 0 HA THR A 96 -33.978 0.264 0.808 1.00 0.00 H new ATOM 0 HB THR A 96 -34.777 1.467 2.908 1.00 0.00 H new ATOM 0 HG1 THR A 96 -32.948 3.466 1.914 1.00 0.00 H new ATOM 0 HG21 THR A 96 -32.518 1.575 3.909 1.00 0.00 H new ATOM 0 HG22 THR A 96 -32.763 0.111 2.928 1.00 0.00 H new ATOM 0 HG23 THR A 96 -31.812 1.468 2.279 1.00 0.00 H new ATOM 1490 N PRO A 97 -36.487 0.418 0.603 1.00 0.00 N ATOM 1491 CA PRO A 97 -37.925 0.480 0.326 1.00 0.00 C ATOM 1492 C PRO A 97 -38.627 1.521 1.190 1.00 0.00 C ATOM 1493 O PRO A 97 -38.097 1.946 2.215 1.00 0.00 O ATOM 1494 CB PRO A 97 -38.420 -0.925 0.675 1.00 0.00 C ATOM 1495 CG PRO A 97 -37.223 -1.799 0.518 1.00 0.00 C ATOM 1496 CD PRO A 97 -36.041 -0.954 0.903 1.00 0.00 C ATOM 0 HA PRO A 97 -38.131 0.771 -0.704 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -38.809 -0.966 1.692 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -39.227 -1.236 0.012 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -37.297 -2.680 1.155 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -37.131 -2.154 -0.508 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -35.789 -1.073 1.957 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -35.153 -1.222 0.331 1.00 0.00 H new ATOM 1504 N ASP A 98 -39.819 1.926 0.770 1.00 0.00 N ATOM 1505 CA ASP A 98 -40.589 2.919 1.512 1.00 0.00 C ATOM 1506 C ASP A 98 -40.696 2.531 2.984 1.00 0.00 C ATOM 1507 O ASP A 98 -41.132 1.428 3.315 1.00 0.00 O ATOM 1508 CB ASP A 98 -41.987 3.065 0.910 1.00 0.00 C ATOM 1509 CG ASP A 98 -42.723 1.742 0.827 1.00 0.00 C ATOM 1510 OD1 ASP A 98 -42.060 0.688 0.923 1.00 0.00 O ATOM 1511 OD2 ASP A 98 -43.961 1.761 0.667 1.00 0.00 O ATOM 0 H ASP A 98 -40.273 1.584 -0.077 1.00 0.00 H new ATOM 0 HA ASP A 98 -40.069 3.874 1.441 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -42.568 3.763 1.513 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -41.906 3.496 -0.088 1.00 0.00 H new ATOM 1516 N GLY A 99 -40.292 3.442 3.864 1.00 0.00 N ATOM 1517 CA GLY A 99 -40.348 3.168 5.288 1.00 0.00 C ATOM 1518 C GLY A 99 -39.682 1.855 5.646 1.00 0.00 C ATOM 1519 O GLY A 99 -40.191 1.096 6.471 1.00 0.00 O ATOM 0 H GLY A 99 -39.928 4.362 3.617 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -39.863 3.979 5.831 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -41.389 3.145 5.611 1.00 0.00 H new ATOM 1523 N ALA A 100 -38.542 1.586 5.019 1.00 0.00 N ATOM 1524 CA ALA A 100 -37.802 0.356 5.267 1.00 0.00 C ATOM 1525 C ALA A 100 -37.249 0.321 6.687 1.00 0.00 C ATOM 1526 O ALA A 100 -36.830 1.344 7.227 1.00 0.00 O ATOM 1527 CB ALA A 100 -36.675 0.207 4.257 1.00 0.00 C ATOM 0 H ALA A 100 -38.110 2.206 4.334 1.00 0.00 H new ATOM 0 HA ALA A 100 -38.491 -0.481 5.155 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -36.130 -0.716 4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -37.091 0.176 3.250 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -35.995 1.055 4.343 1.00 0.00 H new ATOM 1533 N ALA A 101 -37.249 -0.866 7.285 1.00 0.00 N ATOM 1534 CA ALA A 101 -36.745 -1.038 8.642 1.00 0.00 C ATOM 1535 C ALA A 101 -35.329 -0.503 8.776 1.00 0.00 C ATOM 1536 O ALA A 101 -34.642 -0.269 7.782 1.00 0.00 O ATOM 1537 CB ALA A 101 -36.786 -2.504 9.040 1.00 0.00 C ATOM 0 H ALA A 101 -37.592 -1.723 6.851 1.00 0.00 H new ATOM 0 HA ALA A 101 -37.389 -0.468 9.311 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -36.407 -2.616 10.056 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -37.814 -2.865 8.995 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -36.167 -3.084 8.355 1.00 0.00 H new ATOM 1543 N LYS A 102 -34.902 -0.318 10.015 1.00 0.00 N ATOM 1544 CA LYS A 102 -33.563 0.184 10.293 1.00 0.00 C ATOM 1545 C LYS A 102 -32.570 -0.963 10.385 1.00 0.00 C ATOM 1546 O LYS A 102 -32.061 -1.281 11.460 1.00 0.00 O ATOM 1547 CB LYS A 102 -33.551 0.998 11.588 1.00 0.00 C ATOM 1548 CG LYS A 102 -34.234 0.299 12.752 1.00 0.00 C ATOM 1549 CD LYS A 102 -33.487 0.529 14.056 1.00 0.00 C ATOM 1550 CE LYS A 102 -33.724 -0.606 15.040 1.00 0.00 C ATOM 1551 NZ LYS A 102 -33.197 -0.285 16.395 1.00 0.00 N ATOM 0 H LYS A 102 -35.463 -0.508 10.846 1.00 0.00 H new ATOM 0 HA LYS A 102 -33.267 0.835 9.471 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -32.518 1.216 11.861 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -34.042 1.955 11.411 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -35.256 0.664 12.848 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -34.295 -0.770 12.550 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -32.420 0.620 13.854 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -33.809 1.471 14.500 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -34.792 -0.813 15.105 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -33.246 -1.513 14.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -33.378 -1.084 17.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -32.173 -0.113 16.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -33.671 0.566 16.759 1.00 0.00 H new ATOM 1565 N GLN A 103 -32.304 -1.579 9.242 1.00 0.00 N ATOM 1566 CA GLN A 103 -31.372 -2.699 9.172 1.00 0.00 C ATOM 1567 C GLN A 103 -31.269 -3.230 7.745 1.00 0.00 C ATOM 1568 O GLN A 103 -32.273 -3.361 7.046 1.00 0.00 O ATOM 1569 CB GLN A 103 -31.816 -3.818 10.114 1.00 0.00 C ATOM 1570 CG GLN A 103 -30.695 -4.359 10.986 1.00 0.00 C ATOM 1571 CD GLN A 103 -30.039 -5.592 10.395 1.00 0.00 C ATOM 1572 OE1 GLN A 103 -30.676 -6.365 9.680 1.00 0.00 O ATOM 1573 NE2 GLN A 103 -28.758 -5.780 10.691 1.00 0.00 N ATOM 0 H GLN A 103 -32.721 -1.322 8.347 1.00 0.00 H new ATOM 0 HA GLN A 103 -30.389 -2.343 9.481 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -32.616 -3.447 10.754 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -32.233 -4.634 9.524 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -29.942 -3.583 11.126 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -31.091 -4.600 11.972 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -28.269 -5.113 11.288 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -28.263 -6.591 10.321 1.00 0.00 H new ATOM 1582 N PHE A 104 -30.047 -3.531 7.320 1.00 0.00 N ATOM 1583 CA PHE A 104 -29.810 -4.047 5.977 1.00 0.00 C ATOM 1584 C PHE A 104 -30.654 -5.291 5.713 1.00 0.00 C ATOM 1585 O PHE A 104 -30.899 -6.091 6.617 1.00 0.00 O ATOM 1586 CB PHE A 104 -28.328 -4.374 5.787 1.00 0.00 C ATOM 1587 CG PHE A 104 -28.011 -4.962 4.442 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -28.259 -6.301 4.180 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -27.464 -4.177 3.439 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -27.968 -6.845 2.944 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -27.171 -4.716 2.201 1.00 0.00 C ATOM 1592 CZ PHE A 104 -27.423 -6.052 1.952 1.00 0.00 C ATOM 0 H PHE A 104 -29.205 -3.427 7.886 1.00 0.00 H new ATOM 0 HA PHE A 104 -30.100 -3.275 5.264 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -27.743 -3.464 5.924 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -28.016 -5.073 6.563 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -28.685 -6.926 4.951 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -27.265 -3.132 3.627 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -28.166 -7.889 2.753 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -26.745 -4.093 1.428 1.00 0.00 H new ATOM 0 HZ PHE A 104 -27.195 -6.475 0.985 1.00 0.00 H new ATOM 1602 N ARG A 105 -31.094 -5.449 4.468 1.00 0.00 N ATOM 1603 CA ARG A 105 -31.908 -6.595 4.085 1.00 0.00 C ATOM 1604 C ARG A 105 -31.373 -7.240 2.810 1.00 0.00 C ATOM 1605 O ARG A 105 -30.779 -6.569 1.966 1.00 0.00 O ATOM 1606 CB ARG A 105 -33.365 -6.169 3.883 1.00 0.00 C ATOM 1607 CG ARG A 105 -34.108 -5.912 5.183 1.00 0.00 C ATOM 1608 CD ARG A 105 -34.558 -7.210 5.834 1.00 0.00 C ATOM 1609 NE ARG A 105 -35.943 -7.141 6.292 1.00 0.00 N ATOM 1610 CZ ARG A 105 -36.660 -8.206 6.633 1.00 0.00 C ATOM 1611 NH1 ARG A 105 -36.123 -9.417 6.568 1.00 0.00 N ATOM 1612 NH2 ARG A 105 -37.913 -8.063 7.040 1.00 0.00 N ATOM 0 H ARG A 105 -30.900 -4.797 3.708 1.00 0.00 H new ATOM 0 HA ARG A 105 -31.860 -7.328 4.890 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -33.390 -5.265 3.275 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -33.887 -6.944 3.323 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -33.463 -5.364 5.870 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -34.976 -5.281 4.989 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -34.452 -8.028 5.122 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -33.908 -7.436 6.679 1.00 0.00 H new ATOM 0 HE ARG A 105 -36.385 -6.224 6.353 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -35.159 -9.531 6.256 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -36.674 -10.234 6.830 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -38.329 -7.133 7.092 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -38.461 -8.883 7.301 1.00 0.00 H new ATOM 1626 N ARG A 106 -31.586 -8.545 2.676 1.00 0.00 N ATOM 1627 CA ARG A 106 -31.125 -9.281 1.503 1.00 0.00 C ATOM 1628 C ARG A 106 -32.170 -9.247 0.393 1.00 0.00 C ATOM 1629 O ARG A 106 -31.842 -9.379 -0.786 1.00 0.00 O ATOM 1630 CB ARG A 106 -30.810 -10.731 1.877 1.00 0.00 C ATOM 1631 CG ARG A 106 -29.852 -11.413 0.912 1.00 0.00 C ATOM 1632 CD ARG A 106 -30.083 -12.916 0.869 1.00 0.00 C ATOM 1633 NE ARG A 106 -30.683 -13.342 -0.392 1.00 0.00 N ATOM 1634 CZ ARG A 106 -31.325 -14.495 -0.550 1.00 0.00 C ATOM 1635 NH1 ARG A 106 -31.449 -15.332 0.472 1.00 0.00 N ATOM 1636 NH2 ARG A 106 -31.844 -14.813 -1.728 1.00 0.00 N ATOM 0 H ARG A 106 -32.075 -9.116 3.366 1.00 0.00 H new ATOM 0 HA ARG A 106 -30.217 -8.801 1.138 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -30.381 -10.754 2.879 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -31.740 -11.298 1.915 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -29.980 -10.995 -0.086 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -28.824 -11.210 1.213 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -29.134 -13.433 1.012 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -30.732 -13.207 1.695 1.00 0.00 H new ATOM 0 HE ARG A 106 -30.605 -12.720 -1.197 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -31.051 -15.091 1.380 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -31.942 -16.217 0.350 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -31.751 -14.172 -2.516 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -32.336 -15.699 -1.846 1.00 0.00 H new ATOM 1650 N GLU A 107 -33.430 -9.072 0.778 1.00 0.00 N ATOM 1651 CA GLU A 107 -34.526 -9.024 -0.184 1.00 0.00 C ATOM 1652 C GLU A 107 -34.595 -7.668 -0.888 1.00 0.00 C ATOM 1653 O GLU A 107 -35.263 -7.529 -1.912 1.00 0.00 O ATOM 1654 CB GLU A 107 -35.855 -9.316 0.513 1.00 0.00 C ATOM 1655 CG GLU A 107 -36.501 -10.616 0.063 1.00 0.00 C ATOM 1656 CD GLU A 107 -37.837 -10.867 0.733 1.00 0.00 C ATOM 1657 OE1 GLU A 107 -37.843 -11.366 1.878 1.00 0.00 O ATOM 1658 OE2 GLU A 107 -38.879 -10.562 0.113 1.00 0.00 O ATOM 0 H GLU A 107 -33.718 -8.961 1.750 1.00 0.00 H new ATOM 0 HA GLU A 107 -34.338 -9.788 -0.939 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -35.691 -9.354 1.590 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -36.544 -8.493 0.325 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -36.640 -10.593 -1.018 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -35.828 -11.446 0.280 1.00 0.00 H new ATOM 1665 N TRP A 108 -33.903 -6.673 -0.338 1.00 0.00 N ATOM 1666 CA TRP A 108 -33.894 -5.337 -0.924 1.00 0.00 C ATOM 1667 C TRP A 108 -33.447 -5.375 -2.383 1.00 0.00 C ATOM 1668 O TRP A 108 -33.718 -4.448 -3.147 1.00 0.00 O ATOM 1669 CB TRP A 108 -32.973 -4.415 -0.122 1.00 0.00 C ATOM 1670 CG TRP A 108 -33.619 -3.852 1.109 1.00 0.00 C ATOM 1671 CD1 TRP A 108 -34.935 -3.946 1.460 1.00 0.00 C ATOM 1672 CD2 TRP A 108 -32.978 -3.106 2.150 1.00 0.00 C ATOM 1673 NE1 TRP A 108 -35.151 -3.306 2.655 1.00 0.00 N ATOM 1674 CE2 TRP A 108 -33.965 -2.782 3.099 1.00 0.00 C ATOM 1675 CE3 TRP A 108 -31.664 -2.681 2.372 1.00 0.00 C ATOM 1676 CZ2 TRP A 108 -33.680 -2.053 4.251 1.00 0.00 C ATOM 1677 CZ3 TRP A 108 -31.383 -1.958 3.516 1.00 0.00 C ATOM 1678 CH2 TRP A 108 -32.386 -1.651 4.443 1.00 0.00 C ATOM 0 H TRP A 108 -33.343 -6.767 0.510 1.00 0.00 H new ATOM 0 HA TRP A 108 -34.912 -4.950 -0.890 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -32.079 -4.968 0.166 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -32.648 -3.594 -0.761 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -35.695 -4.450 0.882 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -36.048 -3.232 3.135 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -30.883 -2.913 1.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -34.452 -1.814 4.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -30.372 -1.624 3.698 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -32.134 -1.085 5.328 1.00 0.00 H new ATOM 1689 N PHE A 109 -32.758 -6.447 -2.767 1.00 0.00 N ATOM 1690 CA PHE A 109 -32.275 -6.594 -4.135 1.00 0.00 C ATOM 1691 C PHE A 109 -33.248 -7.417 -4.975 1.00 0.00 C ATOM 1692 O PHE A 109 -32.834 -8.229 -5.802 1.00 0.00 O ATOM 1693 CB PHE A 109 -30.896 -7.255 -4.141 1.00 0.00 C ATOM 1694 CG PHE A 109 -29.832 -6.427 -3.480 1.00 0.00 C ATOM 1695 CD1 PHE A 109 -29.727 -6.386 -2.098 1.00 0.00 C ATOM 1696 CD2 PHE A 109 -28.937 -5.691 -4.238 1.00 0.00 C ATOM 1697 CE1 PHE A 109 -28.749 -5.626 -1.487 1.00 0.00 C ATOM 1698 CE2 PHE A 109 -27.955 -4.929 -3.632 1.00 0.00 C ATOM 1699 CZ PHE A 109 -27.861 -4.896 -2.255 1.00 0.00 C ATOM 0 H PHE A 109 -32.523 -7.225 -2.150 1.00 0.00 H new ATOM 0 HA PHE A 109 -32.198 -5.599 -4.574 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -30.962 -8.219 -3.636 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -30.602 -7.455 -5.171 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -30.418 -6.955 -1.493 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -29.007 -5.712 -5.316 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -28.678 -5.602 -0.410 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -27.263 -4.360 -4.235 1.00 0.00 H new ATOM 0 HZ PHE A 109 -27.096 -4.301 -1.779 1.00 0.00 H new ATOM 1709 N GLN A 110 -34.540 -7.201 -4.757 1.00 0.00 N ATOM 1710 CA GLN A 110 -35.568 -7.923 -5.496 1.00 0.00 C ATOM 1711 C GLN A 110 -36.874 -7.136 -5.523 1.00 0.00 C ATOM 1712 O GLN A 110 -37.959 -7.716 -5.570 1.00 0.00 O ATOM 1713 CB GLN A 110 -35.801 -9.301 -4.875 1.00 0.00 C ATOM 1714 CG GLN A 110 -34.686 -10.293 -5.160 1.00 0.00 C ATOM 1715 CD GLN A 110 -34.963 -11.666 -4.583 1.00 0.00 C ATOM 1716 OE1 GLN A 110 -34.208 -12.167 -3.750 1.00 0.00 O ATOM 1717 NE2 GLN A 110 -36.054 -12.283 -5.022 1.00 0.00 N ATOM 0 H GLN A 110 -34.900 -6.533 -4.076 1.00 0.00 H new ATOM 0 HA GLN A 110 -35.221 -8.049 -6.521 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -35.910 -9.190 -3.796 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -36.741 -9.706 -5.251 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -34.547 -10.378 -6.238 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -33.752 -9.912 -4.747 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -36.652 -11.831 -5.713 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -36.294 -13.209 -4.668 1.00 0.00 H new ATOM 1726 N GLY A 111 -36.761 -5.813 -5.492 1.00 0.00 N ATOM 1727 CA GLY A 111 -37.941 -4.969 -5.514 1.00 0.00 C ATOM 1728 C GLY A 111 -37.814 -3.817 -6.492 1.00 0.00 C ATOM 1729 O GLY A 111 -37.066 -3.901 -7.466 1.00 0.00 O ATOM 0 H GLY A 111 -35.874 -5.310 -5.452 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -38.810 -5.572 -5.779 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -38.120 -4.574 -4.514 1.00 0.00 H new ATOM 1733 N ASP A 112 -38.547 -2.740 -6.232 1.00 0.00 N ATOM 1734 CA ASP A 112 -38.515 -1.565 -7.096 1.00 0.00 C ATOM 1735 C ASP A 112 -37.306 -0.691 -6.781 1.00 0.00 C ATOM 1736 O ASP A 112 -36.776 -0.724 -5.671 1.00 0.00 O ATOM 1737 CB ASP A 112 -39.803 -0.754 -6.938 1.00 0.00 C ATOM 1738 CG ASP A 112 -40.777 -0.986 -8.077 1.00 0.00 C ATOM 1739 OD1 ASP A 112 -40.637 -2.011 -8.778 1.00 0.00 O ATOM 1740 OD2 ASP A 112 -41.678 -0.143 -8.268 1.00 0.00 O ATOM 0 H ASP A 112 -39.171 -2.656 -5.430 1.00 0.00 H new ATOM 0 HA ASP A 112 -38.434 -1.906 -8.128 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -40.282 -1.018 -5.995 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -39.557 0.307 -6.885 1.00 0.00 H new ATOM 1745 N GLY A 113 -36.879 0.090 -7.766 1.00 0.00 N ATOM 1746 CA GLY A 113 -35.737 0.963 -7.577 1.00 0.00 C ATOM 1747 C GLY A 113 -34.565 0.587 -8.462 1.00 0.00 C ATOM 1748 O GLY A 113 -34.744 -0.043 -9.505 1.00 0.00 O ATOM 0 H GLY A 113 -37.304 0.134 -8.692 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -36.031 1.991 -7.787 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -35.426 0.928 -6.533 1.00 0.00 H new ATOM 1752 N MET A 114 -33.364 0.974 -8.048 1.00 0.00 N ATOM 1753 CA MET A 114 -32.158 0.673 -8.811 1.00 0.00 C ATOM 1754 C MET A 114 -31.022 0.247 -7.886 1.00 0.00 C ATOM 1755 O MET A 114 -30.918 0.720 -6.755 1.00 0.00 O ATOM 1756 CB MET A 114 -31.734 1.891 -9.634 1.00 0.00 C ATOM 1757 CG MET A 114 -32.331 1.918 -11.032 1.00 0.00 C ATOM 1758 SD MET A 114 -32.980 3.540 -11.479 1.00 0.00 S ATOM 1759 CE MET A 114 -33.443 3.262 -13.187 1.00 0.00 C ATOM 0 H MET A 114 -33.199 1.497 -7.188 1.00 0.00 H new ATOM 0 HA MET A 114 -32.381 -0.153 -9.487 1.00 0.00 H new ATOM 0 HB2 MET A 114 -32.028 2.797 -9.105 1.00 0.00 H new ATOM 0 HB3 MET A 114 -30.647 1.906 -9.712 1.00 0.00 H new ATOM 0 HG2 MET A 114 -31.569 1.624 -11.754 1.00 0.00 H new ATOM 0 HG3 MET A 114 -33.131 1.181 -11.095 1.00 0.00 H new ATOM 0 HE1 MET A 114 -33.862 4.178 -13.604 1.00 0.00 H new ATOM 0 HE2 MET A 114 -32.562 2.972 -13.760 1.00 0.00 H new ATOM 0 HE3 MET A 114 -34.187 2.467 -13.238 1.00 0.00 H new ATOM 1769 N VAL A 115 -30.173 -0.652 -8.376 1.00 0.00 N ATOM 1770 CA VAL A 115 -29.045 -1.145 -7.594 1.00 0.00 C ATOM 1771 C VAL A 115 -27.725 -0.897 -8.316 1.00 0.00 C ATOM 1772 O VAL A 115 -27.580 -1.225 -9.493 1.00 0.00 O ATOM 1773 CB VAL A 115 -29.179 -2.651 -7.301 1.00 0.00 C ATOM 1774 CG1 VAL A 115 -28.085 -3.111 -6.350 1.00 0.00 C ATOM 1775 CG2 VAL A 115 -30.556 -2.964 -6.737 1.00 0.00 C ATOM 0 H VAL A 115 -30.245 -1.053 -9.311 1.00 0.00 H new ATOM 0 HA VAL A 115 -29.051 -0.596 -6.652 1.00 0.00 H new ATOM 0 HB VAL A 115 -29.064 -3.197 -8.238 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -28.197 -4.178 -6.155 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -27.110 -2.925 -6.800 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -28.163 -2.561 -5.412 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -30.633 -4.033 -6.536 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -30.705 -2.409 -5.811 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -31.319 -2.675 -7.459 1.00 0.00 H new ATOM 1785 N ARG A 116 -26.764 -0.318 -7.602 1.00 0.00 N ATOM 1786 CA ARG A 116 -25.455 -0.031 -8.179 1.00 0.00 C ATOM 1787 C ARG A 116 -24.422 -1.048 -7.707 1.00 0.00 C ATOM 1788 O ARG A 116 -24.390 -1.415 -6.531 1.00 0.00 O ATOM 1789 CB ARG A 116 -25.008 1.383 -7.805 1.00 0.00 C ATOM 1790 CG ARG A 116 -25.328 2.422 -8.867 1.00 0.00 C ATOM 1791 CD ARG A 116 -24.324 3.561 -8.853 1.00 0.00 C ATOM 1792 NE ARG A 116 -24.341 4.323 -10.099 1.00 0.00 N ATOM 1793 CZ ARG A 116 -23.416 5.220 -10.425 1.00 0.00 C ATOM 1794 NH1 ARG A 116 -22.407 5.464 -9.601 1.00 0.00 N ATOM 1795 NH2 ARG A 116 -23.500 5.873 -11.576 1.00 0.00 N ATOM 0 H ARG A 116 -26.867 -0.039 -6.626 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.538 -0.100 -9.264 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.488 1.672 -6.870 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -23.933 1.380 -7.624 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -25.331 1.950 -9.850 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.330 2.817 -8.700 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -24.543 4.227 -8.018 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -23.324 3.160 -8.687 1.00 0.00 H new ATOM 0 HE ARG A 116 -25.105 4.158 -10.755 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -22.339 4.963 -8.715 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -21.698 6.153 -9.853 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -24.275 5.687 -12.212 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -22.789 6.561 -11.825 1.00 0.00 H new ATOM 1809 N ARG A 117 -23.581 -1.506 -8.631 1.00 0.00 N ATOM 1810 CA ARG A 117 -22.552 -2.487 -8.304 1.00 0.00 C ATOM 1811 C ARG A 117 -21.187 -2.063 -8.840 1.00 0.00 C ATOM 1812 O ARG A 117 -20.902 -2.204 -10.029 1.00 0.00 O ATOM 1813 CB ARG A 117 -22.928 -3.858 -8.870 1.00 0.00 C ATOM 1814 CG ARG A 117 -23.431 -3.807 -10.303 1.00 0.00 C ATOM 1815 CD ARG A 117 -23.257 -5.144 -11.003 1.00 0.00 C ATOM 1816 NE ARG A 117 -23.818 -6.245 -10.225 1.00 0.00 N ATOM 1817 CZ ARG A 117 -23.628 -7.526 -10.520 1.00 0.00 C ATOM 1818 NH1 ARG A 117 -22.893 -7.868 -11.568 1.00 0.00 N ATOM 1819 NH2 ARG A 117 -24.176 -8.470 -9.765 1.00 0.00 N ATOM 0 H ARG A 117 -23.592 -1.214 -9.608 1.00 0.00 H new ATOM 0 HA ARG A 117 -22.487 -2.549 -7.218 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -22.058 -4.513 -8.822 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -23.697 -4.304 -8.239 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -24.484 -3.526 -10.310 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -22.891 -3.035 -10.852 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -23.739 -5.107 -11.980 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -22.197 -5.327 -11.178 1.00 0.00 H new ATOM 0 HE ARG A 117 -24.387 -6.018 -9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -22.470 -7.146 -12.152 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -22.750 -8.853 -11.791 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -24.743 -8.212 -8.958 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -24.030 -9.454 -9.992 1.00 0.00 H new ATOM 1833 N LYS A 118 -20.345 -1.554 -7.949 1.00 0.00 N ATOM 1834 CA LYS A 118 -19.003 -1.118 -8.314 1.00 0.00 C ATOM 1835 C LYS A 118 -17.989 -2.214 -8.029 1.00 0.00 C ATOM 1836 O LYS A 118 -18.307 -3.228 -7.412 1.00 0.00 O ATOM 1837 CB LYS A 118 -18.630 0.152 -7.545 1.00 0.00 C ATOM 1838 CG LYS A 118 -17.742 1.101 -8.333 1.00 0.00 C ATOM 1839 CD LYS A 118 -18.236 2.536 -8.236 1.00 0.00 C ATOM 1840 CE LYS A 118 -17.723 3.218 -6.978 1.00 0.00 C ATOM 1841 NZ LYS A 118 -16.316 3.683 -7.132 1.00 0.00 N ATOM 0 H LYS A 118 -20.570 -1.433 -6.962 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.992 -0.902 -9.382 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -19.543 0.675 -7.259 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.121 -0.128 -6.623 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -16.720 1.041 -7.958 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -17.717 0.794 -9.378 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -17.909 3.095 -9.113 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -19.326 2.548 -8.239 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -18.362 4.068 -6.740 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -17.787 2.526 -6.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.158 4.517 -6.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.666 2.923 -6.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -16.140 3.935 -8.126 1.00 0.00 H new ATOM 1855 N ASN A 119 -16.769 -2.004 -8.493 1.00 0.00 N ATOM 1856 CA ASN A 119 -15.701 -2.977 -8.293 1.00 0.00 C ATOM 1857 C ASN A 119 -14.367 -2.280 -8.041 1.00 0.00 C ATOM 1858 O ASN A 119 -13.907 -1.484 -8.857 1.00 0.00 O ATOM 1859 CB ASN A 119 -15.588 -3.897 -9.510 1.00 0.00 C ATOM 1860 CG ASN A 119 -16.854 -4.695 -9.748 1.00 0.00 C ATOM 1861 OD1 ASN A 119 -16.907 -5.895 -9.475 1.00 0.00 O ATOM 1862 ND2 ASN A 119 -17.883 -4.032 -10.262 1.00 0.00 N ATOM 0 H ASN A 119 -16.490 -1.170 -9.011 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.948 -3.574 -7.415 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -15.366 -3.300 -10.394 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -14.751 -4.581 -9.369 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -18.761 -4.517 -10.446 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -17.795 -3.038 -10.473 1.00 0.00 H new ATOM 1869 N LEU A 120 -13.750 -2.591 -6.903 1.00 0.00 N ATOM 1870 CA LEU A 120 -12.467 -2.000 -6.541 1.00 0.00 C ATOM 1871 C LEU A 120 -11.321 -2.961 -6.860 1.00 0.00 C ATOM 1872 O LEU A 120 -11.132 -3.960 -6.166 1.00 0.00 O ATOM 1873 CB LEU A 120 -12.452 -1.645 -5.053 1.00 0.00 C ATOM 1874 CG LEU A 120 -13.112 -0.311 -4.701 1.00 0.00 C ATOM 1875 CD1 LEU A 120 -14.617 -0.480 -4.562 1.00 0.00 C ATOM 1876 CD2 LEU A 120 -12.518 0.256 -3.421 1.00 0.00 C ATOM 0 H LEU A 120 -14.119 -3.249 -6.217 1.00 0.00 H new ATOM 0 HA LEU A 120 -12.330 -1.091 -7.126 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -12.954 -2.439 -4.500 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -11.418 -1.623 -4.710 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.919 0.392 -5.511 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -15.069 0.480 -4.311 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -15.031 -0.841 -5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -14.831 -1.199 -3.772 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -12.999 1.205 -3.186 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -12.680 -0.446 -2.603 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -11.448 0.415 -3.556 1.00 0.00 H new ATOM 1888 N PRO A 121 -10.545 -2.679 -7.923 1.00 0.00 N ATOM 1889 CA PRO A 121 -9.423 -3.534 -8.330 1.00 0.00 C ATOM 1890 C PRO A 121 -8.359 -3.669 -7.245 1.00 0.00 C ATOM 1891 O PRO A 121 -8.004 -2.695 -6.580 1.00 0.00 O ATOM 1892 CB PRO A 121 -8.840 -2.817 -9.553 1.00 0.00 C ATOM 1893 CG PRO A 121 -9.930 -1.926 -10.037 1.00 0.00 C ATOM 1894 CD PRO A 121 -10.700 -1.518 -8.815 1.00 0.00 C ATOM 0 HA PRO A 121 -9.755 -4.552 -8.532 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -7.951 -2.244 -9.288 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -8.542 -3.529 -10.323 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -9.523 -1.055 -10.551 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -10.572 -2.445 -10.748 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -10.296 -0.609 -8.368 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -11.747 -1.322 -9.045 1.00 0.00 H new ATOM 1902 N ILE A 122 -7.849 -4.887 -7.080 1.00 0.00 N ATOM 1903 CA ILE A 122 -6.817 -5.159 -6.086 1.00 0.00 C ATOM 1904 C ILE A 122 -5.489 -5.478 -6.765 1.00 0.00 C ATOM 1905 O ILE A 122 -5.465 -5.995 -7.882 1.00 0.00 O ATOM 1906 CB ILE A 122 -7.207 -6.336 -5.167 1.00 0.00 C ATOM 1907 CG1 ILE A 122 -8.708 -6.309 -4.866 1.00 0.00 C ATOM 1908 CG2 ILE A 122 -6.402 -6.287 -3.878 1.00 0.00 C ATOM 1909 CD1 ILE A 122 -9.130 -5.150 -3.991 1.00 0.00 C ATOM 0 H ILE A 122 -8.135 -5.702 -7.623 1.00 0.00 H new ATOM 0 HA ILE A 122 -6.714 -4.260 -5.478 1.00 0.00 H new ATOM 0 HB ILE A 122 -6.979 -7.269 -5.682 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -9.258 -6.262 -5.806 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -8.989 -7.242 -4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -6.687 -7.123 -3.239 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.339 -6.354 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -6.602 -5.349 -3.360 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -10.206 -5.196 -3.820 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -8.608 -5.206 -3.036 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -8.881 -4.211 -4.486 1.00 0.00 H new ATOM 1921 N GLU A 123 -4.386 -5.166 -6.094 1.00 0.00 N ATOM 1922 CA GLU A 123 -3.063 -5.425 -6.652 1.00 0.00 C ATOM 1923 C GLU A 123 -2.091 -5.899 -5.581 1.00 0.00 C ATOM 1924 O GLU A 123 -2.105 -5.408 -4.457 1.00 0.00 O ATOM 1925 CB GLU A 123 -2.520 -4.167 -7.334 1.00 0.00 C ATOM 1926 CG GLU A 123 -3.102 -3.924 -8.716 1.00 0.00 C ATOM 1927 CD GLU A 123 -2.604 -2.634 -9.339 1.00 0.00 C ATOM 1928 OE1 GLU A 123 -1.550 -2.131 -8.897 1.00 0.00 O ATOM 1929 OE2 GLU A 123 -3.268 -2.127 -10.266 1.00 0.00 O ATOM 0 H GLU A 123 -4.380 -4.736 -5.169 1.00 0.00 H new ATOM 0 HA GLU A 123 -3.163 -6.219 -7.392 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -2.730 -3.303 -6.704 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.436 -4.247 -7.415 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -2.846 -4.760 -9.367 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -4.190 -3.895 -8.648 1.00 0.00 H new ATOM 1936 N TYR A 124 -1.245 -6.858 -5.941 1.00 0.00 N ATOM 1937 CA TYR A 124 -0.262 -7.400 -5.009 1.00 0.00 C ATOM 1938 C TYR A 124 1.119 -6.813 -5.278 1.00 0.00 C ATOM 1939 O TYR A 124 1.847 -7.287 -6.151 1.00 0.00 O ATOM 1940 CB TYR A 124 -0.210 -8.924 -5.119 1.00 0.00 C ATOM 1941 CG TYR A 124 -1.531 -9.601 -4.826 1.00 0.00 C ATOM 1942 CD1 TYR A 124 -2.566 -9.579 -5.753 1.00 0.00 C ATOM 1943 CD2 TYR A 124 -1.743 -10.262 -3.623 1.00 0.00 C ATOM 1944 CE1 TYR A 124 -3.773 -10.197 -5.489 1.00 0.00 C ATOM 1945 CE2 TYR A 124 -2.947 -10.882 -3.351 1.00 0.00 C ATOM 1946 CZ TYR A 124 -3.959 -10.847 -4.288 1.00 0.00 C ATOM 1947 OH TYR A 124 -5.160 -11.465 -4.022 1.00 0.00 O ATOM 0 H TYR A 124 -1.220 -7.276 -6.871 1.00 0.00 H new ATOM 0 HA TYR A 124 -0.565 -7.126 -3.998 1.00 0.00 H new ATOM 0 HB2 TYR A 124 0.112 -9.196 -6.124 1.00 0.00 H new ATOM 0 HB3 TYR A 124 0.544 -9.304 -4.429 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -2.424 -9.070 -6.695 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -0.953 -10.292 -2.887 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -4.567 -10.171 -6.220 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -3.095 -11.391 -2.410 1.00 0.00 H new ATOM 0 HH TYR A 124 -5.781 -11.307 -4.764 1.00 0.00 H new ATOM 1957 N ASN A 125 1.477 -5.780 -4.521 1.00 0.00 N ATOM 1958 CA ASN A 125 2.774 -5.131 -4.680 1.00 0.00 C ATOM 1959 C ASN A 125 3.884 -5.975 -4.065 1.00 0.00 C ATOM 1960 O ASN A 125 4.152 -5.891 -2.866 1.00 0.00 O ATOM 1961 CB ASN A 125 2.758 -3.743 -4.037 1.00 0.00 C ATOM 1962 CG ASN A 125 3.040 -2.639 -5.038 1.00 0.00 C ATOM 1963 OD1 ASN A 125 2.661 -2.732 -6.205 1.00 0.00 O ATOM 1964 ND2 ASN A 125 3.711 -1.586 -4.585 1.00 0.00 N ATOM 0 H ASN A 125 0.888 -5.375 -3.793 1.00 0.00 H new ATOM 0 HA ASN A 125 2.970 -5.027 -5.747 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.786 -3.571 -3.575 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.501 -3.706 -3.240 1.00 0.00 H new ATOM 0 HD21 ASN A 125 3.931 -0.813 -5.213 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.006 -1.550 -3.609 1.00 0.00 H new ATOM 1971 N LEU A 126 4.530 -6.789 -4.894 1.00 0.00 N ATOM 1972 CA LEU A 126 5.613 -7.648 -4.432 1.00 0.00 C ATOM 1973 C LEU A 126 6.956 -6.936 -4.544 1.00 0.00 C ATOM 1974 O LEU A 126 7.980 -7.629 -4.725 1.00 0.00 O ATOM 1975 CB LEU A 126 5.643 -8.947 -5.242 1.00 0.00 C ATOM 1976 CG LEU A 126 4.475 -9.900 -4.982 1.00 0.00 C ATOM 1977 CD1 LEU A 126 4.338 -10.901 -6.118 1.00 0.00 C ATOM 1978 CD2 LEU A 126 4.662 -10.621 -3.655 1.00 0.00 C ATOM 1979 OXT LEU A 126 6.975 -5.691 -4.450 1.00 0.00 O ATOM 0 H LEU A 126 4.322 -6.871 -5.889 1.00 0.00 H new ATOM 0 HA LEU A 126 5.433 -7.885 -3.383 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.658 -8.696 -6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 126 6.574 -9.471 -5.026 1.00 0.00 H new ATOM 0 HG LEU A 126 3.558 -9.313 -4.930 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.502 -11.570 -5.915 1.00 0.00 H new ATOM 0 HD12 LEU A 126 4.158 -10.369 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.256 -11.483 -6.203 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.822 -11.295 -3.486 1.00 0.00 H new ATOM 0 HD22 LEU A 126 5.588 -11.195 -3.680 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.709 -9.890 -2.847 1.00 0.00 H new TER 1991 LEU A 126 ATOM 1992 N ALA B 1 43.611 -6.808 -14.212 1.00 0.00 N ATOM 1993 CA ALA B 1 42.794 -5.596 -14.479 1.00 0.00 C ATOM 1994 C ALA B 1 41.313 -5.872 -14.244 1.00 0.00 C ATOM 1995 O ALA B 1 40.870 -7.020 -14.291 1.00 0.00 O ATOM 1996 CB ALA B 1 43.020 -5.110 -15.903 1.00 0.00 C ATOM 0 H1 ALA B 1 44.080 -6.714 -13.289 1.00 0.00 H new ATOM 0 H2 ALA B 1 42.996 -7.647 -14.204 1.00 0.00 H new ATOM 0 H3 ALA B 1 44.330 -6.913 -14.956 1.00 0.00 H new ATOM 0 HA ALA B 1 43.108 -4.816 -13.786 1.00 0.00 H new ATOM 0 HB1 ALA B 1 42.415 -4.222 -16.085 1.00 0.00 H new ATOM 0 HB2 ALA B 1 44.073 -4.866 -16.041 1.00 0.00 H new ATOM 0 HB3 ALA B 1 42.734 -5.893 -16.605 1.00 0.00 H new ATOM 2004 N GLN B 2 40.551 -4.813 -13.990 1.00 0.00 N ATOM 2005 CA GLN B 2 39.118 -4.942 -13.748 1.00 0.00 C ATOM 2006 C GLN B 2 38.851 -5.805 -12.519 1.00 0.00 C ATOM 2007 O GLN B 2 39.147 -7.000 -12.511 1.00 0.00 O ATOM 2008 CB GLN B 2 38.425 -5.546 -14.970 1.00 0.00 C ATOM 2009 CG GLN B 2 38.745 -4.825 -16.269 1.00 0.00 C ATOM 2010 CD GLN B 2 38.037 -3.489 -16.383 1.00 0.00 C ATOM 2011 OE1 GLN B 2 37.469 -2.989 -15.412 1.00 0.00 O ATOM 2012 NE2 GLN B 2 38.066 -2.903 -17.574 1.00 0.00 N ATOM 0 H GLN B 2 40.902 -3.856 -13.946 1.00 0.00 H new ATOM 0 HA GLN B 2 38.714 -3.946 -13.566 1.00 0.00 H new ATOM 0 HB2 GLN B 2 38.717 -6.592 -15.063 1.00 0.00 H new ATOM 0 HB3 GLN B 2 37.347 -5.529 -14.811 1.00 0.00 H new ATOM 0 HG2 GLN B 2 39.822 -4.669 -16.338 1.00 0.00 H new ATOM 0 HG3 GLN B 2 38.460 -5.456 -17.111 1.00 0.00 H new ATOM 0 HE21 GLN B 2 38.548 -3.353 -18.352 1.00 0.00 H new ATOM 0 HE22 GLN B 2 37.606 -2.003 -17.711 1.00 0.00 H new ATOM 2021 N SER B 3 38.290 -5.191 -11.482 1.00 0.00 N ATOM 2022 CA SER B 3 37.983 -5.902 -10.247 1.00 0.00 C ATOM 2023 C SER B 3 36.596 -6.534 -10.312 1.00 0.00 C ATOM 2024 O SER B 3 35.897 -6.418 -11.319 1.00 0.00 O ATOM 2025 CB SER B 3 38.066 -4.950 -9.052 1.00 0.00 C ATOM 2026 OG SER B 3 39.399 -4.524 -8.831 1.00 0.00 O ATOM 0 H SER B 3 38.039 -4.202 -11.473 1.00 0.00 H new ATOM 0 HA SER B 3 38.719 -6.696 -10.123 1.00 0.00 H new ATOM 0 HB2 SER B 3 37.429 -4.084 -9.228 1.00 0.00 H new ATOM 0 HB3 SER B 3 37.687 -5.448 -8.159 1.00 0.00 H new ATOM 0 HG SER B 3 39.425 -3.915 -8.063 1.00 0.00 H new ATOM 2032 N VAL B 4 36.204 -7.205 -9.234 1.00 0.00 N ATOM 2033 CA VAL B 4 34.902 -7.854 -9.171 1.00 0.00 C ATOM 2034 C VAL B 4 33.803 -6.854 -8.821 1.00 0.00 C ATOM 2035 O VAL B 4 34.009 -5.953 -8.007 1.00 0.00 O ATOM 2036 CB VAL B 4 34.893 -8.993 -8.133 1.00 0.00 C ATOM 2037 CG1 VAL B 4 35.707 -10.177 -8.630 1.00 0.00 C ATOM 2038 CG2 VAL B 4 35.420 -8.499 -6.794 1.00 0.00 C ATOM 0 H VAL B 4 36.770 -7.313 -8.393 1.00 0.00 H new ATOM 0 HA VAL B 4 34.708 -8.270 -10.160 1.00 0.00 H new ATOM 0 HB VAL B 4 33.864 -9.324 -7.993 1.00 0.00 H new ATOM 0 HG11 VAL B 4 35.688 -10.971 -7.883 1.00 0.00 H new ATOM 0 HG12 VAL B 4 35.280 -10.546 -9.562 1.00 0.00 H new ATOM 0 HG13 VAL B 4 36.737 -9.864 -8.801 1.00 0.00 H new ATOM 0 HG21 VAL B 4 35.406 -9.317 -6.073 1.00 0.00 H new ATOM 0 HG22 VAL B 4 36.442 -8.139 -6.915 1.00 0.00 H new ATOM 0 HG23 VAL B 4 34.790 -7.686 -6.432 1.00 0.00 H new ATOM 2048 N PRO B 5 32.617 -6.998 -9.434 1.00 0.00 N ATOM 2049 CA PRO B 5 31.484 -6.101 -9.185 1.00 0.00 C ATOM 2050 C PRO B 5 30.850 -6.336 -7.816 1.00 0.00 C ATOM 2051 O PRO B 5 31.138 -7.331 -7.152 1.00 0.00 O ATOM 2052 CB PRO B 5 30.499 -6.458 -10.298 1.00 0.00 C ATOM 2053 CG PRO B 5 30.804 -7.878 -10.630 1.00 0.00 C ATOM 2054 CD PRO B 5 32.286 -8.045 -10.420 1.00 0.00 C ATOM 0 HA PRO B 5 31.785 -5.053 -9.184 1.00 0.00 H new ATOM 0 HB2 PRO B 5 29.467 -6.341 -9.966 1.00 0.00 H new ATOM 0 HB3 PRO B 5 30.630 -5.811 -11.166 1.00 0.00 H new ATOM 0 HG2 PRO B 5 30.240 -8.558 -9.991 1.00 0.00 H new ATOM 0 HG3 PRO B 5 30.528 -8.106 -11.660 1.00 0.00 H new ATOM 0 HD2 PRO B 5 32.528 -9.040 -10.045 1.00 0.00 H new ATOM 0 HD3 PRO B 5 32.840 -7.911 -11.349 1.00 0.00 H new ATOM 2062 N PRO B 6 29.971 -5.419 -7.377 1.00 0.00 N ATOM 2063 CA PRO B 6 29.294 -5.531 -6.083 1.00 0.00 C ATOM 2064 C PRO B 6 28.225 -6.619 -6.083 1.00 0.00 C ATOM 2065 O PRO B 6 27.720 -7.007 -7.138 1.00 0.00 O ATOM 2066 CB PRO B 6 28.655 -4.155 -5.898 1.00 0.00 C ATOM 2067 CG PRO B 6 28.436 -3.653 -7.282 1.00 0.00 C ATOM 2068 CD PRO B 6 29.568 -4.202 -8.108 1.00 0.00 C ATOM 0 HA PRO B 6 29.982 -5.807 -5.284 1.00 0.00 H new ATOM 0 HB2 PRO B 6 27.716 -4.225 -5.348 1.00 0.00 H new ATOM 0 HB3 PRO B 6 29.306 -3.488 -5.333 1.00 0.00 H new ATOM 0 HG2 PRO B 6 27.473 -3.986 -7.670 1.00 0.00 H new ATOM 0 HG3 PRO B 6 28.429 -2.563 -7.305 1.00 0.00 H new ATOM 0 HD2 PRO B 6 29.248 -4.432 -9.124 1.00 0.00 H new ATOM 0 HD3 PRO B 6 30.390 -3.490 -8.186 1.00 0.00 H new ATOM 2076 N GLY B 7 27.884 -7.107 -4.897 1.00 0.00 N ATOM 2077 CA GLY B 7 26.877 -8.145 -4.784 1.00 0.00 C ATOM 2078 C GLY B 7 25.466 -7.590 -4.813 1.00 0.00 C ATOM 2079 O GLY B 7 25.143 -6.659 -4.077 1.00 0.00 O ATOM 0 H GLY B 7 28.287 -6.802 -4.011 1.00 0.00 H new ATOM 0 HA2 GLY B 7 27.001 -8.857 -5.600 1.00 0.00 H new ATOM 0 HA3 GLY B 7 27.029 -8.695 -3.855 1.00 0.00 H new ATOM 2083 N ASP B 8 24.626 -8.165 -5.667 1.00 0.00 N ATOM 2084 CA ASP B 8 23.243 -7.724 -5.793 1.00 0.00 C ATOM 2085 C ASP B 8 22.565 -7.655 -4.429 1.00 0.00 C ATOM 2086 O ASP B 8 22.618 -8.606 -3.649 1.00 0.00 O ATOM 2087 CB ASP B 8 22.467 -8.672 -6.710 1.00 0.00 C ATOM 2088 CG ASP B 8 23.197 -8.938 -8.013 1.00 0.00 C ATOM 2089 OD1 ASP B 8 23.825 -7.999 -8.545 1.00 0.00 O ATOM 2090 OD2 ASP B 8 23.139 -10.087 -8.501 1.00 0.00 O ATOM 0 H ASP B 8 24.880 -8.938 -6.282 1.00 0.00 H new ATOM 0 HA ASP B 8 23.246 -6.725 -6.228 1.00 0.00 H new ATOM 0 HB2 ASP B 8 22.296 -9.616 -6.192 1.00 0.00 H new ATOM 0 HB3 ASP B 8 21.488 -8.245 -6.925 1.00 0.00 H new ATOM 2095 N ILE B 9 21.924 -6.525 -4.147 1.00 0.00 N ATOM 2096 CA ILE B 9 21.232 -6.337 -2.877 1.00 0.00 C ATOM 2097 C ILE B 9 19.735 -6.586 -3.028 1.00 0.00 C ATOM 2098 O ILE B 9 19.062 -5.914 -3.810 1.00 0.00 O ATOM 2099 CB ILE B 9 21.451 -4.918 -2.317 1.00 0.00 C ATOM 2100 CG1 ILE B 9 20.954 -3.869 -3.313 1.00 0.00 C ATOM 2101 CG2 ILE B 9 22.919 -4.694 -1.991 1.00 0.00 C ATOM 2102 CD1 ILE B 9 19.866 -2.976 -2.759 1.00 0.00 C ATOM 0 H ILE B 9 21.869 -5.727 -4.780 1.00 0.00 H new ATOM 0 HA ILE B 9 21.652 -7.061 -2.179 1.00 0.00 H new ATOM 0 HB ILE B 9 20.877 -4.817 -1.396 1.00 0.00 H new ATOM 0 HG12 ILE B 9 21.795 -3.251 -3.627 1.00 0.00 H new ATOM 0 HG13 ILE B 9 20.580 -4.374 -4.203 1.00 0.00 H new ATOM 0 HG21 ILE B 9 23.055 -3.687 -1.597 1.00 0.00 H new ATOM 0 HG22 ILE B 9 23.241 -5.422 -1.246 1.00 0.00 H new ATOM 0 HG23 ILE B 9 23.515 -4.813 -2.896 1.00 0.00 H new ATOM 0 HD11 ILE B 9 19.563 -2.257 -3.520 1.00 0.00 H new ATOM 0 HD12 ILE B 9 19.008 -3.584 -2.471 1.00 0.00 H new ATOM 0 HD13 ILE B 9 20.242 -2.443 -1.886 1.00 0.00 H new ATOM 2114 N ASN B 10 19.218 -7.556 -2.280 1.00 0.00 N ATOM 2115 CA ASN B 10 17.799 -7.885 -2.341 1.00 0.00 C ATOM 2116 C ASN B 10 16.981 -6.929 -1.472 1.00 0.00 C ATOM 2117 O ASN B 10 17.421 -6.523 -0.397 1.00 0.00 O ATOM 2118 CB ASN B 10 17.574 -9.355 -1.931 1.00 0.00 C ATOM 2119 CG ASN B 10 17.412 -9.563 -0.434 1.00 0.00 C ATOM 2120 OD1 ASN B 10 16.545 -8.962 0.200 1.00 0.00 O ATOM 2121 ND2 ASN B 10 18.247 -10.424 0.135 1.00 0.00 N ATOM 0 H ASN B 10 19.758 -8.125 -1.628 1.00 0.00 H new ATOM 0 HA ASN B 10 17.456 -7.765 -3.369 1.00 0.00 H new ATOM 0 HB2 ASN B 10 16.685 -9.730 -2.438 1.00 0.00 H new ATOM 0 HB3 ASN B 10 18.416 -9.952 -2.281 1.00 0.00 H new ATOM 0 HD21 ASN B 10 18.185 -10.609 1.136 1.00 0.00 H new ATOM 0 HD22 ASN B 10 18.951 -10.900 -0.429 1.00 0.00 H new ATOM 2128 N THR B 11 15.793 -6.570 -1.949 1.00 0.00 N ATOM 2129 CA THR B 11 14.921 -5.659 -1.216 1.00 0.00 C ATOM 2130 C THR B 11 13.473 -6.136 -1.245 1.00 0.00 C ATOM 2131 O THR B 11 13.066 -6.868 -2.147 1.00 0.00 O ATOM 2132 CB THR B 11 15.018 -4.249 -1.800 1.00 0.00 C ATOM 2133 OG1 THR B 11 14.936 -4.287 -3.214 1.00 0.00 O ATOM 2134 CG2 THR B 11 16.299 -3.534 -1.432 1.00 0.00 C ATOM 0 H THR B 11 15.413 -6.895 -2.838 1.00 0.00 H new ATOM 0 HA THR B 11 15.252 -5.641 -0.178 1.00 0.00 H new ATOM 0 HB THR B 11 14.181 -3.700 -1.370 1.00 0.00 H new ATOM 0 HG1 THR B 11 14.998 -3.376 -3.570 1.00 0.00 H new ATOM 0 HG21 THR B 11 16.302 -2.540 -1.879 1.00 0.00 H new ATOM 0 HG22 THR B 11 16.367 -3.445 -0.348 1.00 0.00 H new ATOM 0 HG23 THR B 11 17.152 -4.102 -1.804 1.00 0.00 H new ATOM 2142 N GLN B 12 12.703 -5.710 -0.250 1.00 0.00 N ATOM 2143 CA GLN B 12 11.297 -6.084 -0.150 1.00 0.00 C ATOM 2144 C GLN B 12 10.474 -4.937 0.443 1.00 0.00 C ATOM 2145 O GLN B 12 10.562 -4.670 1.642 1.00 0.00 O ATOM 2146 CB GLN B 12 11.144 -7.334 0.719 1.00 0.00 C ATOM 2147 CG GLN B 12 11.696 -7.169 2.125 1.00 0.00 C ATOM 2148 CD GLN B 12 12.214 -8.471 2.703 1.00 0.00 C ATOM 2149 OE1 GLN B 12 13.421 -8.707 2.747 1.00 0.00 O ATOM 2150 NE2 GLN B 12 11.301 -9.325 3.149 1.00 0.00 N ATOM 0 H GLN B 12 13.030 -5.103 0.502 1.00 0.00 H new ATOM 0 HA GLN B 12 10.927 -6.297 -1.153 1.00 0.00 H new ATOM 0 HB2 GLN B 12 10.088 -7.596 0.781 1.00 0.00 H new ATOM 0 HB3 GLN B 12 11.652 -8.168 0.234 1.00 0.00 H new ATOM 0 HG2 GLN B 12 12.502 -6.435 2.111 1.00 0.00 H new ATOM 0 HG3 GLN B 12 10.915 -6.773 2.774 1.00 0.00 H new ATOM 0 HE21 GLN B 12 10.310 -9.088 3.093 1.00 0.00 H new ATOM 0 HE22 GLN B 12 11.590 -10.218 3.548 1.00 0.00 H new ATOM 2159 N PRO B 13 9.664 -4.232 -0.376 1.00 0.00 N ATOM 2160 CA PRO B 13 9.517 -4.501 -1.817 1.00 0.00 C ATOM 2161 C PRO B 13 10.832 -4.364 -2.576 1.00 0.00 C ATOM 2162 O PRO B 13 11.735 -3.643 -2.150 1.00 0.00 O ATOM 2163 CB PRO B 13 8.518 -3.438 -2.288 1.00 0.00 C ATOM 2164 CG PRO B 13 7.811 -3.000 -1.052 1.00 0.00 C ATOM 2165 CD PRO B 13 8.819 -3.107 0.054 1.00 0.00 C ATOM 0 HA PRO B 13 9.188 -5.524 -2.000 1.00 0.00 H new ATOM 0 HB2 PRO B 13 9.027 -2.603 -2.768 1.00 0.00 H new ATOM 0 HB3 PRO B 13 7.820 -3.848 -3.018 1.00 0.00 H new ATOM 0 HG2 PRO B 13 7.446 -1.978 -1.151 1.00 0.00 H new ATOM 0 HG3 PRO B 13 6.944 -3.630 -0.853 1.00 0.00 H new ATOM 0 HD2 PRO B 13 9.395 -2.189 0.165 1.00 0.00 H new ATOM 0 HD3 PRO B 13 8.344 -3.303 1.015 1.00 0.00 H new ATOM 2173 N SER B 14 10.932 -5.064 -3.701 1.00 0.00 N ATOM 2174 CA SER B 14 12.137 -5.029 -4.521 1.00 0.00 C ATOM 2175 C SER B 14 12.197 -3.755 -5.359 1.00 0.00 C ATOM 2176 O SER B 14 13.210 -3.056 -5.372 1.00 0.00 O ATOM 2177 CB SER B 14 12.190 -6.254 -5.436 1.00 0.00 C ATOM 2178 OG SER B 14 13.263 -7.110 -5.080 1.00 0.00 O ATOM 0 H SER B 14 10.192 -5.663 -4.066 1.00 0.00 H new ATOM 0 HA SER B 14 12.998 -5.041 -3.852 1.00 0.00 H new ATOM 0 HB2 SER B 14 11.249 -6.800 -5.373 1.00 0.00 H new ATOM 0 HB3 SER B 14 12.304 -5.934 -6.472 1.00 0.00 H new ATOM 0 HG SER B 14 13.333 -7.158 -4.104 1.00 0.00 H new ATOM 2184 N GLN B 15 11.108 -3.460 -6.063 1.00 0.00 N ATOM 2185 CA GLN B 15 11.046 -2.272 -6.906 1.00 0.00 C ATOM 2186 C GLN B 15 9.600 -1.882 -7.198 1.00 0.00 C ATOM 2187 O GLN B 15 9.262 -1.520 -8.325 1.00 0.00 O ATOM 2188 CB GLN B 15 11.789 -2.516 -8.221 1.00 0.00 C ATOM 2189 CG GLN B 15 13.295 -2.644 -8.057 1.00 0.00 C ATOM 2190 CD GLN B 15 14.030 -2.610 -9.384 1.00 0.00 C ATOM 2191 OE1 GLN B 15 14.385 -1.542 -9.882 1.00 0.00 O ATOM 2192 NE2 GLN B 15 14.260 -3.783 -9.964 1.00 0.00 N ATOM 0 H GLN B 15 10.259 -4.026 -6.066 1.00 0.00 H new ATOM 0 HA GLN B 15 11.524 -1.453 -6.368 1.00 0.00 H new ATOM 0 HB2 GLN B 15 11.404 -3.425 -8.682 1.00 0.00 H new ATOM 0 HB3 GLN B 15 11.575 -1.696 -8.906 1.00 0.00 H new ATOM 0 HG2 GLN B 15 13.658 -1.835 -7.424 1.00 0.00 H new ATOM 0 HG3 GLN B 15 13.523 -3.578 -7.543 1.00 0.00 H new ATOM 0 HE21 GLN B 15 13.948 -4.644 -9.515 1.00 0.00 H new ATOM 0 HE22 GLN B 15 14.749 -3.823 -10.858 1.00 0.00 H new ATOM 2201 N LYS B 16 8.749 -1.957 -6.181 1.00 0.00 N ATOM 2202 CA LYS B 16 7.342 -1.609 -6.341 1.00 0.00 C ATOM 2203 C LYS B 16 6.732 -1.145 -5.021 1.00 0.00 C ATOM 2204 O LYS B 16 6.244 -1.956 -4.234 1.00 0.00 O ATOM 2205 CB LYS B 16 6.557 -2.804 -6.884 1.00 0.00 C ATOM 2206 CG LYS B 16 6.799 -3.071 -8.360 1.00 0.00 C ATOM 2207 CD LYS B 16 5.650 -3.849 -8.981 1.00 0.00 C ATOM 2208 CE LYS B 16 5.953 -5.338 -9.040 1.00 0.00 C ATOM 2209 NZ LYS B 16 4.861 -6.102 -9.702 1.00 0.00 N ATOM 0 H LYS B 16 9.007 -2.255 -5.240 1.00 0.00 H new ATOM 0 HA LYS B 16 7.282 -0.786 -7.053 1.00 0.00 H new ATOM 0 HB2 LYS B 16 6.825 -3.693 -6.314 1.00 0.00 H new ATOM 0 HB3 LYS B 16 5.493 -2.632 -6.724 1.00 0.00 H new ATOM 0 HG2 LYS B 16 6.925 -2.125 -8.886 1.00 0.00 H new ATOM 0 HG3 LYS B 16 7.727 -3.630 -8.482 1.00 0.00 H new ATOM 0 HD2 LYS B 16 4.742 -3.684 -8.401 1.00 0.00 H new ATOM 0 HD3 LYS B 16 5.458 -3.476 -9.987 1.00 0.00 H new ATOM 0 HE2 LYS B 16 6.886 -5.497 -9.580 1.00 0.00 H new ATOM 0 HE3 LYS B 16 6.101 -5.718 -8.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 5.107 -7.112 -9.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 3.975 -5.971 -9.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 4.737 -5.757 -10.675 1.00 0.00 H new ATOM 2223 N ILE B 17 6.755 0.164 -4.792 1.00 0.00 N ATOM 2224 CA ILE B 17 6.196 0.736 -3.574 1.00 0.00 C ATOM 2225 C ILE B 17 5.130 1.775 -3.908 1.00 0.00 C ATOM 2226 O ILE B 17 5.348 2.653 -4.743 1.00 0.00 O ATOM 2227 CB ILE B 17 7.289 1.388 -2.705 1.00 0.00 C ATOM 2228 CG1 ILE B 17 6.677 1.989 -1.438 1.00 0.00 C ATOM 2229 CG2 ILE B 17 8.031 2.452 -3.499 1.00 0.00 C ATOM 2230 CD1 ILE B 17 7.673 2.166 -0.313 1.00 0.00 C ATOM 0 H ILE B 17 7.155 0.848 -5.434 1.00 0.00 H new ATOM 0 HA ILE B 17 5.744 -0.080 -3.011 1.00 0.00 H new ATOM 0 HB ILE B 17 8.003 0.619 -2.409 1.00 0.00 H new ATOM 0 HG12 ILE B 17 6.238 2.957 -1.680 1.00 0.00 H new ATOM 0 HG13 ILE B 17 5.865 1.347 -1.096 1.00 0.00 H new ATOM 0 HG21 ILE B 17 8.800 2.904 -2.872 1.00 0.00 H new ATOM 0 HG22 ILE B 17 8.497 1.996 -4.372 1.00 0.00 H new ATOM 0 HG23 ILE B 17 7.329 3.220 -3.822 1.00 0.00 H new ATOM 0 HD11 ILE B 17 7.171 2.596 0.553 1.00 0.00 H new ATOM 0 HD12 ILE B 17 8.094 1.197 -0.044 1.00 0.00 H new ATOM 0 HD13 ILE B 17 8.473 2.832 -0.637 1.00 0.00 H new ATOM 2242 N VAL B 18 3.972 1.663 -3.265 1.00 0.00 N ATOM 2243 CA VAL B 18 2.872 2.589 -3.511 1.00 0.00 C ATOM 2244 C VAL B 18 2.170 2.982 -2.216 1.00 0.00 C ATOM 2245 O VAL B 18 1.531 2.154 -1.569 1.00 0.00 O ATOM 2246 CB VAL B 18 1.839 1.977 -4.478 1.00 0.00 C ATOM 2247 CG1 VAL B 18 1.325 0.652 -3.938 1.00 0.00 C ATOM 2248 CG2 VAL B 18 0.684 2.940 -4.727 1.00 0.00 C ATOM 0 H VAL B 18 3.771 0.942 -2.572 1.00 0.00 H new ATOM 0 HA VAL B 18 3.306 3.482 -3.962 1.00 0.00 H new ATOM 0 HB VAL B 18 2.335 1.794 -5.431 1.00 0.00 H new ATOM 0 HG11 VAL B 18 0.597 0.234 -4.633 1.00 0.00 H new ATOM 0 HG12 VAL B 18 2.158 -0.042 -3.824 1.00 0.00 H new ATOM 0 HG13 VAL B 18 0.851 0.813 -2.970 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -0.030 2.483 -5.412 1.00 0.00 H new ATOM 0 HG22 VAL B 18 0.188 3.165 -3.783 1.00 0.00 H new ATOM 0 HG23 VAL B 18 1.067 3.862 -5.164 1.00 0.00 H new ATOM 2258 N PHE B 19 2.281 4.256 -1.853 1.00 0.00 N ATOM 2259 CA PHE B 19 1.640 4.761 -0.644 1.00 0.00 C ATOM 2260 C PHE B 19 0.128 4.838 -0.837 1.00 0.00 C ATOM 2261 O PHE B 19 -0.375 5.725 -1.527 1.00 0.00 O ATOM 2262 CB PHE B 19 2.195 6.142 -0.284 1.00 0.00 C ATOM 2263 CG PHE B 19 3.686 6.160 -0.093 1.00 0.00 C ATOM 2264 CD1 PHE B 19 4.305 5.220 0.716 1.00 0.00 C ATOM 2265 CD2 PHE B 19 4.467 7.116 -0.722 1.00 0.00 C ATOM 2266 CE1 PHE B 19 5.676 5.235 0.894 1.00 0.00 C ATOM 2267 CE2 PHE B 19 5.838 7.136 -0.547 1.00 0.00 C ATOM 2268 CZ PHE B 19 6.443 6.193 0.262 1.00 0.00 C ATOM 0 H PHE B 19 2.807 4.955 -2.377 1.00 0.00 H new ATOM 0 HA PHE B 19 1.854 4.073 0.174 1.00 0.00 H new ATOM 0 HB2 PHE B 19 1.929 6.848 -1.071 1.00 0.00 H new ATOM 0 HB3 PHE B 19 1.716 6.490 0.631 1.00 0.00 H new ATOM 0 HD1 PHE B 19 3.710 4.468 1.213 1.00 0.00 H new ATOM 0 HD2 PHE B 19 3.999 7.854 -1.356 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.147 4.498 1.527 1.00 0.00 H new ATOM 0 HE2 PHE B 19 6.435 7.887 -1.042 1.00 0.00 H new ATOM 0 HZ PHE B 19 7.514 6.206 0.400 1.00 0.00 H new ATOM 2278 N ASN B 20 -0.590 3.895 -0.235 1.00 0.00 N ATOM 2279 CA ASN B 20 -2.045 3.846 -0.352 1.00 0.00 C ATOM 2280 C ASN B 20 -2.708 4.979 0.427 1.00 0.00 C ATOM 2281 O ASN B 20 -2.160 5.479 1.409 1.00 0.00 O ATOM 2282 CB ASN B 20 -2.570 2.498 0.145 1.00 0.00 C ATOM 2283 CG ASN B 20 -3.464 1.816 -0.871 1.00 0.00 C ATOM 2284 OD1 ASN B 20 -3.050 0.873 -1.547 1.00 0.00 O ATOM 2285 ND2 ASN B 20 -4.699 2.290 -0.985 1.00 0.00 N ATOM 0 H ASN B 20 -0.189 3.154 0.339 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.297 3.967 -1.406 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -1.728 1.847 0.379 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -3.125 2.646 1.071 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -5.346 1.871 -1.653 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -5.000 3.073 -0.405 1.00 0.00 H new ATOM 2292 N ALA B 21 -3.898 5.371 -0.021 1.00 0.00 N ATOM 2293 CA ALA B 21 -4.655 6.438 0.627 1.00 0.00 C ATOM 2294 C ALA B 21 -5.317 5.929 1.908 1.00 0.00 C ATOM 2295 O ALA B 21 -5.320 4.725 2.169 1.00 0.00 O ATOM 2296 CB ALA B 21 -5.700 6.984 -0.336 1.00 0.00 C ATOM 0 H ALA B 21 -4.360 4.963 -0.834 1.00 0.00 H new ATOM 0 HA ALA B 21 -3.970 7.241 0.899 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -6.263 7.780 0.151 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -5.206 7.380 -1.223 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -6.381 6.184 -0.626 1.00 0.00 H new ATOM 2302 N PRO B 22 -5.890 6.829 2.735 1.00 0.00 N ATOM 2303 CA PRO B 22 -5.921 8.276 2.481 1.00 0.00 C ATOM 2304 C PRO B 22 -4.605 8.962 2.821 1.00 0.00 C ATOM 2305 O PRO B 22 -3.739 8.384 3.478 1.00 0.00 O ATOM 2306 CB PRO B 22 -7.025 8.762 3.417 1.00 0.00 C ATOM 2307 CG PRO B 22 -6.979 7.819 4.567 1.00 0.00 C ATOM 2308 CD PRO B 22 -6.565 6.484 4.003 1.00 0.00 C ATOM 0 HA PRO B 22 -6.090 8.501 1.428 1.00 0.00 H new ATOM 0 HB2 PRO B 22 -6.850 9.789 3.738 1.00 0.00 H new ATOM 0 HB3 PRO B 22 -7.998 8.743 2.927 1.00 0.00 H new ATOM 0 HG2 PRO B 22 -6.269 8.160 5.321 1.00 0.00 H new ATOM 0 HG3 PRO B 22 -7.952 7.751 5.053 1.00 0.00 H new ATOM 0 HD2 PRO B 22 -5.896 5.954 4.681 1.00 0.00 H new ATOM 0 HD3 PRO B 22 -7.426 5.837 3.834 1.00 0.00 H new ATOM 2316 N TYR B 23 -4.468 10.203 2.371 1.00 0.00 N ATOM 2317 CA TYR B 23 -3.262 10.983 2.624 1.00 0.00 C ATOM 2318 C TYR B 23 -3.526 12.071 3.658 1.00 0.00 C ATOM 2319 O TYR B 23 -3.192 13.238 3.448 1.00 0.00 O ATOM 2320 CB TYR B 23 -2.748 11.605 1.325 1.00 0.00 C ATOM 2321 CG TYR B 23 -2.367 10.582 0.282 1.00 0.00 C ATOM 2322 CD1 TYR B 23 -1.853 9.347 0.653 1.00 0.00 C ATOM 2323 CD2 TYR B 23 -2.525 10.848 -1.072 1.00 0.00 C ATOM 2324 CE1 TYR B 23 -1.506 8.406 -0.295 1.00 0.00 C ATOM 2325 CE2 TYR B 23 -2.180 9.910 -2.027 1.00 0.00 C ATOM 2326 CZ TYR B 23 -1.671 8.691 -1.633 1.00 0.00 C ATOM 2327 OH TYR B 23 -1.328 7.754 -2.579 1.00 0.00 O ATOM 0 H TYR B 23 -5.179 10.692 1.828 1.00 0.00 H new ATOM 0 HA TYR B 23 -2.500 10.311 3.019 1.00 0.00 H new ATOM 0 HB2 TYR B 23 -3.516 12.262 0.916 1.00 0.00 H new ATOM 0 HB3 TYR B 23 -1.881 12.228 1.547 1.00 0.00 H new ATOM 0 HD1 TYR B 23 -1.723 9.119 1.701 1.00 0.00 H new ATOM 0 HD2 TYR B 23 -2.923 11.802 -1.383 1.00 0.00 H new ATOM 0 HE1 TYR B 23 -1.107 7.450 0.011 1.00 0.00 H new ATOM 0 HE2 TYR B 23 -2.309 10.131 -3.076 1.00 0.00 H new ATOM 0 HH TYR B 23 -0.734 7.086 -2.177 1.00 0.00 H new ATOM 2337 N ASP B 24 -4.125 11.678 4.777 1.00 0.00 N ATOM 2338 CA ASP B 24 -4.433 12.615 5.851 1.00 0.00 C ATOM 2339 C ASP B 24 -3.704 12.239 7.143 1.00 0.00 C ATOM 2340 O ASP B 24 -3.798 12.953 8.141 1.00 0.00 O ATOM 2341 CB ASP B 24 -5.941 12.657 6.100 1.00 0.00 C ATOM 2342 CG ASP B 24 -6.656 13.612 5.164 1.00 0.00 C ATOM 2343 OD1 ASP B 24 -6.637 14.832 5.432 1.00 0.00 O ATOM 2344 OD2 ASP B 24 -7.236 13.140 4.162 1.00 0.00 O ATOM 0 H ASP B 24 -4.407 10.716 4.964 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.090 13.602 5.541 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -6.354 11.656 5.978 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -6.128 12.956 7.131 1.00 0.00 H new ATOM 2349 N ASP B 25 -2.977 11.121 7.125 1.00 0.00 N ATOM 2350 CA ASP B 25 -2.243 10.672 8.302 1.00 0.00 C ATOM 2351 C ASP B 25 -0.854 10.173 7.917 1.00 0.00 C ATOM 2352 O ASP B 25 -0.648 9.672 6.812 1.00 0.00 O ATOM 2353 CB ASP B 25 -3.016 9.564 9.020 1.00 0.00 C ATOM 2354 CG ASP B 25 -3.817 10.086 10.196 1.00 0.00 C ATOM 2355 OD1 ASP B 25 -4.096 11.303 10.231 1.00 0.00 O ATOM 2356 OD2 ASP B 25 -4.165 9.280 11.083 1.00 0.00 O ATOM 0 H ASP B 25 -2.883 10.514 6.311 1.00 0.00 H new ATOM 0 HA ASP B 25 -2.131 11.521 8.976 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -3.688 9.078 8.313 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -2.316 8.804 9.369 1.00 0.00 H new ATOM 2361 N LYS B 26 0.094 10.313 8.837 1.00 0.00 N ATOM 2362 CA LYS B 26 1.463 9.875 8.593 1.00 0.00 C ATOM 2363 C LYS B 26 1.535 8.356 8.473 1.00 0.00 C ATOM 2364 O LYS B 26 1.343 7.637 9.455 1.00 0.00 O ATOM 2365 CB LYS B 26 2.380 10.355 9.719 1.00 0.00 C ATOM 2366 CG LYS B 26 2.172 11.813 10.092 1.00 0.00 C ATOM 2367 CD LYS B 26 2.069 11.994 11.597 1.00 0.00 C ATOM 2368 CE LYS B 26 1.637 13.406 11.959 1.00 0.00 C ATOM 2369 NZ LYS B 26 2.424 14.434 11.222 1.00 0.00 N ATOM 0 H LYS B 26 -0.060 10.726 9.757 1.00 0.00 H new ATOM 0 HA LYS B 26 1.797 10.311 7.651 1.00 0.00 H new ATOM 0 HB2 LYS B 26 2.214 9.736 10.601 1.00 0.00 H new ATOM 0 HB3 LYS B 26 3.418 10.210 9.418 1.00 0.00 H new ATOM 0 HG2 LYS B 26 3.000 12.409 9.709 1.00 0.00 H new ATOM 0 HG3 LYS B 26 1.264 12.185 9.617 1.00 0.00 H new ATOM 0 HD2 LYS B 26 1.354 11.278 12.003 1.00 0.00 H new ATOM 0 HD3 LYS B 26 3.033 11.778 12.058 1.00 0.00 H new ATOM 0 HE2 LYS B 26 0.578 13.530 11.735 1.00 0.00 H new ATOM 0 HE3 LYS B 26 1.756 13.558 13.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 2.274 15.366 11.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 3.435 14.192 11.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 2.114 14.463 10.230 1.00 0.00 H new ATOM 2383 N HIS B 27 1.809 7.874 7.265 1.00 0.00 N ATOM 2384 CA HIS B 27 1.903 6.440 7.018 1.00 0.00 C ATOM 2385 C HIS B 27 3.344 6.030 6.734 1.00 0.00 C ATOM 2386 O HIS B 27 3.751 5.916 5.578 1.00 0.00 O ATOM 2387 CB HIS B 27 1.007 6.045 5.843 1.00 0.00 C ATOM 2388 CG HIS B 27 -0.454 6.060 6.174 1.00 0.00 C ATOM 2389 ND1 HIS B 27 -0.965 5.722 7.406 1.00 0.00 N ATOM 2390 CD2 HIS B 27 -1.521 6.383 5.400 1.00 0.00 C ATOM 2391 CE1 HIS B 27 -2.297 5.846 7.346 1.00 0.00 C ATOM 2392 NE2 HIS B 27 -2.686 6.246 6.150 1.00 0.00 N ATOM 0 H HIS B 27 1.970 8.455 6.442 1.00 0.00 H new ATOM 0 HA HIS B 27 1.566 5.919 7.914 1.00 0.00 H new ATOM 0 HB2 HIS B 27 1.190 6.726 5.012 1.00 0.00 H new ATOM 0 HB3 HIS B 27 1.284 5.047 5.504 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.474 6.696 4.367 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -2.966 5.645 8.170 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -3.642 6.419 5.839 1.00 0.00 H new ATOM 2400 N THR B 28 4.110 5.806 7.796 1.00 0.00 N ATOM 2401 CA THR B 28 5.505 5.407 7.661 1.00 0.00 C ATOM 2402 C THR B 28 5.613 3.966 7.173 1.00 0.00 C ATOM 2403 O THR B 28 5.217 3.032 7.870 1.00 0.00 O ATOM 2404 CB THR B 28 6.232 5.560 8.998 1.00 0.00 C ATOM 2405 OG1 THR B 28 6.165 6.899 9.455 1.00 0.00 O ATOM 2406 CG2 THR B 28 7.693 5.170 8.932 1.00 0.00 C ATOM 0 H THR B 28 3.788 5.894 8.760 1.00 0.00 H new ATOM 0 HA THR B 28 5.974 6.058 6.923 1.00 0.00 H new ATOM 0 HB THR B 28 5.722 4.883 9.683 1.00 0.00 H new ATOM 0 HG1 THR B 28 6.634 6.976 10.312 1.00 0.00 H new ATOM 0 HG21 THR B 28 8.149 5.302 9.913 1.00 0.00 H new ATOM 0 HG22 THR B 28 7.778 4.126 8.630 1.00 0.00 H new ATOM 0 HG23 THR B 28 8.205 5.801 8.206 1.00 0.00 H new ATOM 2414 N TYR B 29 6.153 3.793 5.971 1.00 0.00 N ATOM 2415 CA TYR B 29 6.313 2.464 5.391 1.00 0.00 C ATOM 2416 C TYR B 29 7.722 1.933 5.632 1.00 0.00 C ATOM 2417 O TYR B 29 8.708 2.639 5.421 1.00 0.00 O ATOM 2418 CB TYR B 29 6.015 2.502 3.892 1.00 0.00 C ATOM 2419 CG TYR B 29 4.539 2.535 3.571 1.00 0.00 C ATOM 2420 CD1 TYR B 29 3.842 3.736 3.540 1.00 0.00 C ATOM 2421 CD2 TYR B 29 3.841 1.365 3.302 1.00 0.00 C ATOM 2422 CE1 TYR B 29 2.491 3.771 3.250 1.00 0.00 C ATOM 2423 CE2 TYR B 29 2.490 1.390 3.010 1.00 0.00 C ATOM 2424 CZ TYR B 29 1.820 2.595 2.986 1.00 0.00 C ATOM 2425 OH TYR B 29 0.475 2.626 2.697 1.00 0.00 O ATOM 0 H TYR B 29 6.487 4.555 5.380 1.00 0.00 H new ATOM 0 HA TYR B 29 5.605 1.792 5.877 1.00 0.00 H new ATOM 0 HB2 TYR B 29 6.493 3.380 3.457 1.00 0.00 H new ATOM 0 HB3 TYR B 29 6.462 1.628 3.419 1.00 0.00 H new ATOM 0 HD1 TYR B 29 4.365 4.658 3.746 1.00 0.00 H new ATOM 0 HD2 TYR B 29 4.362 0.419 3.321 1.00 0.00 H new ATOM 0 HE1 TYR B 29 1.964 4.713 3.230 1.00 0.00 H new ATOM 0 HE2 TYR B 29 1.962 0.471 2.802 1.00 0.00 H new ATOM 0 HH TYR B 29 0.154 1.714 2.534 1.00 0.00 H new ATOM 2435 N HIS B 30 7.809 0.684 6.080 1.00 0.00 N ATOM 2436 CA HIS B 30 9.097 0.059 6.356 1.00 0.00 C ATOM 2437 C HIS B 30 9.497 -0.897 5.236 1.00 0.00 C ATOM 2438 O HIS B 30 8.669 -1.644 4.717 1.00 0.00 O ATOM 2439 CB HIS B 30 9.048 -0.696 7.685 1.00 0.00 C ATOM 2440 CG HIS B 30 8.971 0.201 8.882 1.00 0.00 C ATOM 2441 ND1 HIS B 30 9.550 -0.091 10.098 1.00 0.00 N ATOM 2442 CD2 HIS B 30 8.365 1.405 9.035 1.00 0.00 C ATOM 2443 CE1 HIS B 30 9.283 0.922 10.933 1.00 0.00 C ATOM 2444 NE2 HIS B 30 8.567 1.856 10.336 1.00 0.00 N ATOM 0 H HIS B 30 7.003 0.086 6.259 1.00 0.00 H new ATOM 0 HA HIS B 30 9.844 0.850 6.418 1.00 0.00 H new ATOM 0 HB2 HIS B 30 8.184 -1.361 7.684 1.00 0.00 H new ATOM 0 HB3 HIS B 30 9.934 -1.325 7.769 1.00 0.00 H new ATOM 0 HD2 HIS B 30 7.814 1.930 8.269 1.00 0.00 H new ATOM 0 HE1 HIS B 30 9.611 0.968 11.961 1.00 0.00 H new ATOM 0 HE2 HIS B 30 8.231 2.728 10.744 1.00 0.00 H new ATOM 2452 N ILE B 31 10.776 -0.871 4.875 1.00 0.00 N ATOM 2453 CA ILE B 31 11.297 -1.739 3.827 1.00 0.00 C ATOM 2454 C ILE B 31 12.577 -2.427 4.289 1.00 0.00 C ATOM 2455 O ILE B 31 13.366 -1.849 5.037 1.00 0.00 O ATOM 2456 CB ILE B 31 11.574 -0.956 2.527 1.00 0.00 C ATOM 2457 CG1 ILE B 31 10.295 -0.274 2.037 1.00 0.00 C ATOM 2458 CG2 ILE B 31 12.131 -1.880 1.456 1.00 0.00 C ATOM 2459 CD1 ILE B 31 10.065 1.093 2.643 1.00 0.00 C ATOM 0 H ILE B 31 11.472 -0.255 5.295 1.00 0.00 H new ATOM 0 HA ILE B 31 10.535 -2.490 3.620 1.00 0.00 H new ATOM 0 HB ILE B 31 12.319 -0.188 2.736 1.00 0.00 H new ATOM 0 HG12 ILE B 31 10.337 -0.178 0.952 1.00 0.00 H new ATOM 0 HG13 ILE B 31 9.442 -0.912 2.268 1.00 0.00 H new ATOM 0 HG21 ILE B 31 12.320 -1.310 0.546 1.00 0.00 H new ATOM 0 HG22 ILE B 31 13.063 -2.323 1.807 1.00 0.00 H new ATOM 0 HG23 ILE B 31 11.410 -2.670 1.246 1.00 0.00 H new ATOM 0 HD11 ILE B 31 9.140 1.515 2.249 1.00 0.00 H new ATOM 0 HD12 ILE B 31 9.990 1.003 3.727 1.00 0.00 H new ATOM 0 HD13 ILE B 31 10.899 1.748 2.391 1.00 0.00 H new ATOM 2471 N LYS B 32 12.774 -3.665 3.851 1.00 0.00 N ATOM 2472 CA LYS B 32 13.956 -4.428 4.237 1.00 0.00 C ATOM 2473 C LYS B 32 14.985 -4.472 3.111 1.00 0.00 C ATOM 2474 O LYS B 32 14.638 -4.647 1.943 1.00 0.00 O ATOM 2475 CB LYS B 32 13.561 -5.850 4.638 1.00 0.00 C ATOM 2476 CG LYS B 32 13.672 -6.114 6.132 1.00 0.00 C ATOM 2477 CD LYS B 32 13.842 -7.596 6.425 1.00 0.00 C ATOM 2478 CE LYS B 32 12.499 -8.286 6.599 1.00 0.00 C ATOM 2479 NZ LYS B 32 12.163 -8.492 8.036 1.00 0.00 N ATOM 0 H LYS B 32 12.134 -4.161 3.231 1.00 0.00 H new ATOM 0 HA LYS B 32 14.411 -3.926 5.091 1.00 0.00 H new ATOM 0 HB2 LYS B 32 12.535 -6.037 4.320 1.00 0.00 H new ATOM 0 HB3 LYS B 32 14.194 -6.558 4.104 1.00 0.00 H new ATOM 0 HG2 LYS B 32 14.520 -5.562 6.538 1.00 0.00 H new ATOM 0 HG3 LYS B 32 12.779 -5.743 6.635 1.00 0.00 H new ATOM 0 HD2 LYS B 32 14.392 -8.068 5.611 1.00 0.00 H new ATOM 0 HD3 LYS B 32 14.438 -7.723 7.329 1.00 0.00 H new ATOM 0 HE2 LYS B 32 11.720 -7.689 6.126 1.00 0.00 H new ATOM 0 HE3 LYS B 32 12.517 -9.249 6.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 11.240 -8.965 8.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 12.893 -9.083 8.482 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 12.121 -7.571 8.518 1.00 0.00 H new ATOM 2493 N ILE B 33 16.253 -4.321 3.478 1.00 0.00 N ATOM 2494 CA ILE B 33 17.345 -4.350 2.513 1.00 0.00 C ATOM 2495 C ILE B 33 18.328 -5.465 2.847 1.00 0.00 C ATOM 2496 O ILE B 33 18.397 -5.921 3.988 1.00 0.00 O ATOM 2497 CB ILE B 33 18.103 -3.010 2.473 1.00 0.00 C ATOM 2498 CG1 ILE B 33 17.128 -1.850 2.273 1.00 0.00 C ATOM 2499 CG2 ILE B 33 19.148 -3.026 1.366 1.00 0.00 C ATOM 2500 CD1 ILE B 33 17.745 -0.492 2.526 1.00 0.00 C ATOM 0 H ILE B 33 16.551 -4.176 4.443 1.00 0.00 H new ATOM 0 HA ILE B 33 16.901 -4.531 1.534 1.00 0.00 H new ATOM 0 HB ILE B 33 18.612 -2.870 3.427 1.00 0.00 H new ATOM 0 HG12 ILE B 33 16.743 -1.881 1.254 1.00 0.00 H new ATOM 0 HG13 ILE B 33 16.276 -1.983 2.940 1.00 0.00 H new ATOM 0 HG21 ILE B 33 19.676 -2.072 1.350 1.00 0.00 H new ATOM 0 HG22 ILE B 33 19.859 -3.831 1.549 1.00 0.00 H new ATOM 0 HG23 ILE B 33 18.658 -3.186 0.405 1.00 0.00 H new ATOM 0 HD11 ILE B 33 16.996 0.284 2.365 1.00 0.00 H new ATOM 0 HD12 ILE B 33 18.105 -0.442 3.554 1.00 0.00 H new ATOM 0 HD13 ILE B 33 18.579 -0.338 1.841 1.00 0.00 H new ATOM 2512 N THR B 34 19.084 -5.901 1.850 1.00 0.00 N ATOM 2513 CA THR B 34 20.061 -6.966 2.047 1.00 0.00 C ATOM 2514 C THR B 34 21.085 -6.987 0.923 1.00 0.00 C ATOM 2515 O THR B 34 20.773 -6.654 -0.219 1.00 0.00 O ATOM 2516 CB THR B 34 19.358 -8.321 2.124 1.00 0.00 C ATOM 2517 OG1 THR B 34 18.422 -8.343 3.187 1.00 0.00 O ATOM 2518 CG2 THR B 34 20.313 -9.478 2.326 1.00 0.00 C ATOM 0 H THR B 34 19.041 -5.536 0.898 1.00 0.00 H new ATOM 0 HA THR B 34 20.581 -6.772 2.985 1.00 0.00 H new ATOM 0 HB THR B 34 18.861 -8.444 1.162 1.00 0.00 H new ATOM 0 HG1 THR B 34 18.595 -7.591 3.791 1.00 0.00 H new ATOM 0 HG21 THR B 34 19.750 -10.410 2.372 1.00 0.00 H new ATOM 0 HG22 THR B 34 21.016 -9.519 1.494 1.00 0.00 H new ATOM 0 HG23 THR B 34 20.861 -9.339 3.258 1.00 0.00 H new ATOM 2526 N ASN B 35 22.306 -7.394 1.250 1.00 0.00 N ATOM 2527 CA ASN B 35 23.375 -7.472 0.263 1.00 0.00 C ATOM 2528 C ASN B 35 23.911 -8.897 0.167 1.00 0.00 C ATOM 2529 O ASN B 35 24.903 -9.246 0.806 1.00 0.00 O ATOM 2530 CB ASN B 35 24.503 -6.498 0.613 1.00 0.00 C ATOM 2531 CG ASN B 35 25.185 -6.838 1.924 1.00 0.00 C ATOM 2532 OD1 ASN B 35 24.534 -7.224 2.895 1.00 0.00 O ATOM 2533 ND2 ASN B 35 26.505 -6.696 1.956 1.00 0.00 N ATOM 0 H ASN B 35 22.580 -7.675 2.191 1.00 0.00 H new ATOM 0 HA ASN B 35 22.967 -7.191 -0.708 1.00 0.00 H new ATOM 0 HB2 ASN B 35 25.242 -6.502 -0.188 1.00 0.00 H new ATOM 0 HB3 ASN B 35 24.100 -5.487 0.670 1.00 0.00 H new ATOM 0 HD21 ASN B 35 27.020 -6.910 2.810 1.00 0.00 H new ATOM 0 HD22 ASN B 35 27.003 -6.373 1.127 1.00 0.00 H new ATOM 2540 N ALA B 36 23.242 -9.717 -0.638 1.00 0.00 N ATOM 2541 CA ALA B 36 23.635 -11.111 -0.826 1.00 0.00 C ATOM 2542 C ALA B 36 25.141 -11.244 -1.039 1.00 0.00 C ATOM 2543 O ALA B 36 25.733 -12.277 -0.725 1.00 0.00 O ATOM 2544 CB ALA B 36 22.879 -11.712 -2.001 1.00 0.00 C ATOM 0 H ALA B 36 22.420 -9.438 -1.174 1.00 0.00 H new ATOM 0 HA ALA B 36 23.380 -11.658 0.082 1.00 0.00 H new ATOM 0 HB1 ALA B 36 23.179 -12.752 -2.133 1.00 0.00 H new ATOM 0 HB2 ALA B 36 21.808 -11.665 -1.806 1.00 0.00 H new ATOM 0 HB3 ALA B 36 23.108 -11.150 -2.907 1.00 0.00 H new ATOM 2550 N GLY B 37 25.756 -10.193 -1.573 1.00 0.00 N ATOM 2551 CA GLY B 37 27.187 -10.213 -1.817 1.00 0.00 C ATOM 2552 C GLY B 37 27.977 -10.711 -0.621 1.00 0.00 C ATOM 2553 O GLY B 37 27.528 -10.596 0.520 1.00 0.00 O ATOM 0 H GLY B 37 25.288 -9.327 -1.841 1.00 0.00 H new ATOM 0 HA2 GLY B 37 27.396 -10.850 -2.676 1.00 0.00 H new ATOM 0 HA3 GLY B 37 27.522 -9.208 -2.076 1.00 0.00 H new ATOM 2557 N GLY B 38 29.156 -11.267 -0.882 1.00 0.00 N ATOM 2558 CA GLY B 38 29.991 -11.774 0.191 1.00 0.00 C ATOM 2559 C GLY B 38 31.091 -10.805 0.578 1.00 0.00 C ATOM 2560 O GLY B 38 32.269 -11.160 0.577 1.00 0.00 O ATOM 0 H GLY B 38 29.548 -11.375 -1.818 1.00 0.00 H new ATOM 0 HA2 GLY B 38 29.371 -11.981 1.063 1.00 0.00 H new ATOM 0 HA3 GLY B 38 30.436 -12.720 -0.116 1.00 0.00 H new ATOM 2564 N ARG B 39 30.703 -9.577 0.910 1.00 0.00 N ATOM 2565 CA ARG B 39 31.663 -8.552 1.301 1.00 0.00 C ATOM 2566 C ARG B 39 30.949 -7.321 1.848 1.00 0.00 C ATOM 2567 O ARG B 39 29.791 -7.064 1.516 1.00 0.00 O ATOM 2568 CB ARG B 39 32.536 -8.158 0.109 1.00 0.00 C ATOM 2569 CG ARG B 39 33.939 -8.741 0.164 1.00 0.00 C ATOM 2570 CD ARG B 39 34.918 -7.770 0.804 1.00 0.00 C ATOM 2571 NE ARG B 39 36.044 -7.470 -0.077 1.00 0.00 N ATOM 2572 CZ ARG B 39 37.207 -6.991 0.352 1.00 0.00 C ATOM 2573 NH1 ARG B 39 37.393 -6.756 1.643 1.00 0.00 N ATOM 2574 NH2 ARG B 39 38.183 -6.745 -0.510 1.00 0.00 N ATOM 0 H ARG B 39 29.731 -9.269 0.916 1.00 0.00 H new ATOM 0 HA ARG B 39 32.297 -8.965 2.086 1.00 0.00 H new ATOM 0 HB2 ARG B 39 32.051 -8.486 -0.810 1.00 0.00 H new ATOM 0 HB3 ARG B 39 32.605 -7.071 0.063 1.00 0.00 H new ATOM 0 HG2 ARG B 39 33.926 -9.673 0.730 1.00 0.00 H new ATOM 0 HG3 ARG B 39 34.273 -8.985 -0.844 1.00 0.00 H new ATOM 0 HD2 ARG B 39 34.399 -6.846 1.057 1.00 0.00 H new ATOM 0 HD3 ARG B 39 35.290 -8.192 1.737 1.00 0.00 H new ATOM 0 HE ARG B 39 35.931 -7.637 -1.077 1.00 0.00 H new ATOM 0 HH11 ARG B 39 36.643 -6.943 2.309 1.00 0.00 H new ATOM 0 HH12 ARG B 39 38.286 -6.388 1.971 1.00 0.00 H new ATOM 0 HH21 ARG B 39 38.042 -6.923 -1.504 1.00 0.00 H new ATOM 0 HH22 ARG B 39 39.075 -6.377 -0.179 1.00 0.00 H new ATOM 2588 N ARG B 40 31.645 -6.560 2.686 1.00 0.00 N ATOM 2589 CA ARG B 40 31.076 -5.354 3.275 1.00 0.00 C ATOM 2590 C ARG B 40 30.811 -4.303 2.203 1.00 0.00 C ATOM 2591 O ARG B 40 31.530 -4.228 1.205 1.00 0.00 O ATOM 2592 CB ARG B 40 32.014 -4.789 4.343 1.00 0.00 C ATOM 2593 CG ARG B 40 32.080 -5.636 5.603 1.00 0.00 C ATOM 2594 CD ARG B 40 33.512 -5.816 6.079 1.00 0.00 C ATOM 2595 NE ARG B 40 34.005 -4.639 6.788 1.00 0.00 N ATOM 2596 CZ ARG B 40 35.128 -4.624 7.499 1.00 0.00 C ATOM 2597 NH1 ARG B 40 35.871 -5.718 7.591 1.00 0.00 N ATOM 2598 NH2 ARG B 40 35.508 -3.514 8.118 1.00 0.00 N ATOM 0 H ARG B 40 32.604 -6.757 2.972 1.00 0.00 H new ATOM 0 HA ARG B 40 30.128 -5.619 3.743 1.00 0.00 H new ATOM 0 HB2 ARG B 40 33.016 -4.698 3.923 1.00 0.00 H new ATOM 0 HB3 ARG B 40 31.686 -3.784 4.608 1.00 0.00 H new ATOM 0 HG2 ARG B 40 31.490 -5.166 6.390 1.00 0.00 H new ATOM 0 HG3 ARG B 40 31.634 -6.612 5.410 1.00 0.00 H new ATOM 0 HD2 ARG B 40 33.569 -6.685 6.735 1.00 0.00 H new ATOM 0 HD3 ARG B 40 34.156 -6.020 5.223 1.00 0.00 H new ATOM 0 HE ARG B 40 33.457 -3.780 6.735 1.00 0.00 H new ATOM 0 HH11 ARG B 40 35.581 -6.573 7.116 1.00 0.00 H new ATOM 0 HH12 ARG B 40 36.733 -5.705 8.137 1.00 0.00 H new ATOM 0 HH21 ARG B 40 34.938 -2.671 8.049 1.00 0.00 H new ATOM 0 HH22 ARG B 40 36.370 -3.504 8.663 1.00 0.00 H new ATOM 2612 N ILE B 41 29.777 -3.497 2.411 1.00 0.00 N ATOM 2613 CA ILE B 41 29.421 -2.456 1.454 1.00 0.00 C ATOM 2614 C ILE B 41 28.880 -1.214 2.152 1.00 0.00 C ATOM 2615 O ILE B 41 28.520 -1.253 3.327 1.00 0.00 O ATOM 2616 CB ILE B 41 28.360 -2.949 0.452 1.00 0.00 C ATOM 2617 CG1 ILE B 41 27.135 -3.482 1.197 1.00 0.00 C ATOM 2618 CG2 ILE B 41 28.937 -4.020 -0.460 1.00 0.00 C ATOM 2619 CD1 ILE B 41 25.916 -3.648 0.316 1.00 0.00 C ATOM 0 H ILE B 41 29.172 -3.543 3.231 1.00 0.00 H new ATOM 0 HA ILE B 41 30.338 -2.205 0.922 1.00 0.00 H new ATOM 0 HB ILE B 41 28.052 -2.106 -0.167 1.00 0.00 H new ATOM 0 HG12 ILE B 41 27.383 -4.444 1.645 1.00 0.00 H new ATOM 0 HG13 ILE B 41 26.893 -2.802 2.014 1.00 0.00 H new ATOM 0 HG21 ILE B 41 28.171 -4.354 -1.159 1.00 0.00 H new ATOM 0 HG22 ILE B 41 29.781 -3.610 -1.015 1.00 0.00 H new ATOM 0 HG23 ILE B 41 29.274 -4.866 0.140 1.00 0.00 H new ATOM 0 HD11 ILE B 41 25.086 -4.029 0.911 1.00 0.00 H new ATOM 0 HD12 ILE B 41 25.642 -2.684 -0.112 1.00 0.00 H new ATOM 0 HD13 ILE B 41 26.140 -4.351 -0.487 1.00 0.00 H new ATOM 2631 N GLY B 42 28.811 -0.119 1.404 1.00 0.00 N ATOM 2632 CA GLY B 42 28.294 1.128 1.934 1.00 0.00 C ATOM 2633 C GLY B 42 27.164 1.655 1.075 1.00 0.00 C ATOM 2634 O GLY B 42 27.397 2.130 -0.037 1.00 0.00 O ATOM 0 H GLY B 42 29.108 -0.074 0.429 1.00 0.00 H new ATOM 0 HA2 GLY B 42 27.940 0.975 2.953 1.00 0.00 H new ATOM 0 HA3 GLY B 42 29.094 1.867 1.982 1.00 0.00 H new ATOM 2638 N TRP B 43 25.936 1.542 1.574 1.00 0.00 N ATOM 2639 CA TRP B 43 24.765 1.983 0.826 1.00 0.00 C ATOM 2640 C TRP B 43 24.209 3.302 1.351 1.00 0.00 C ATOM 2641 O TRP B 43 24.425 3.671 2.505 1.00 0.00 O ATOM 2642 CB TRP B 43 23.676 0.910 0.882 1.00 0.00 C ATOM 2643 CG TRP B 43 23.254 0.567 2.277 1.00 0.00 C ATOM 2644 CD1 TRP B 43 23.846 -0.338 3.113 1.00 0.00 C ATOM 2645 CD2 TRP B 43 22.150 1.122 3.002 1.00 0.00 C ATOM 2646 NE1 TRP B 43 23.177 -0.378 4.313 1.00 0.00 N ATOM 2647 CE2 TRP B 43 22.133 0.509 4.270 1.00 0.00 C ATOM 2648 CE3 TRP B 43 21.176 2.078 2.704 1.00 0.00 C ATOM 2649 CZ2 TRP B 43 21.179 0.822 5.235 1.00 0.00 C ATOM 2650 CZ3 TRP B 43 20.230 2.388 3.663 1.00 0.00 C ATOM 2651 CH2 TRP B 43 20.238 1.761 4.915 1.00 0.00 C ATOM 0 H TRP B 43 25.727 1.149 2.492 1.00 0.00 H new ATOM 0 HA TRP B 43 25.080 2.143 -0.205 1.00 0.00 H new ATOM 0 HB2 TRP B 43 22.807 1.254 0.321 1.00 0.00 H new ATOM 0 HB3 TRP B 43 24.038 0.009 0.387 1.00 0.00 H new ATOM 0 HD1 TRP B 43 24.712 -0.934 2.867 1.00 0.00 H new ATOM 0 HE1 TRP B 43 23.418 -0.971 5.107 1.00 0.00 H new ATOM 0 HE3 TRP B 43 21.162 2.566 1.741 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 21.182 0.340 6.202 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 19.472 3.126 3.443 1.00 0.00 H new ATOM 0 HH2 TRP B 43 19.485 2.025 5.643 1.00 0.00 H new ATOM 2662 N ALA B 44 23.478 3.997 0.485 1.00 0.00 N ATOM 2663 CA ALA B 44 22.863 5.273 0.833 1.00 0.00 C ATOM 2664 C ALA B 44 21.525 5.432 0.117 1.00 0.00 C ATOM 2665 O ALA B 44 21.310 4.849 -0.946 1.00 0.00 O ATOM 2666 CB ALA B 44 23.795 6.423 0.484 1.00 0.00 C ATOM 0 H ALA B 44 23.296 3.694 -0.472 1.00 0.00 H new ATOM 0 HA ALA B 44 22.682 5.290 1.908 1.00 0.00 H new ATOM 0 HB1 ALA B 44 23.322 7.368 0.750 1.00 0.00 H new ATOM 0 HB2 ALA B 44 24.728 6.316 1.037 1.00 0.00 H new ATOM 0 HB3 ALA B 44 24.004 6.410 -0.586 1.00 0.00 H new ATOM 2672 N ILE B 45 20.625 6.212 0.703 1.00 0.00 N ATOM 2673 CA ILE B 45 19.307 6.429 0.112 1.00 0.00 C ATOM 2674 C ILE B 45 19.065 7.903 -0.194 1.00 0.00 C ATOM 2675 O ILE B 45 19.519 8.784 0.536 1.00 0.00 O ATOM 2676 CB ILE B 45 18.188 5.919 1.040 1.00 0.00 C ATOM 2677 CG1 ILE B 45 18.536 4.532 1.584 1.00 0.00 C ATOM 2678 CG2 ILE B 45 16.860 5.887 0.301 1.00 0.00 C ATOM 2679 CD1 ILE B 45 18.504 3.444 0.533 1.00 0.00 C ATOM 0 H ILE B 45 20.781 6.704 1.583 1.00 0.00 H new ATOM 0 HA ILE B 45 19.287 5.865 -0.821 1.00 0.00 H new ATOM 0 HB ILE B 45 18.096 6.605 1.882 1.00 0.00 H new ATOM 0 HG12 ILE B 45 19.530 4.565 2.031 1.00 0.00 H new ATOM 0 HG13 ILE B 45 17.837 4.277 2.380 1.00 0.00 H new ATOM 0 HG21 ILE B 45 16.080 5.524 0.970 1.00 0.00 H new ATOM 0 HG22 ILE B 45 16.608 6.892 -0.039 1.00 0.00 H new ATOM 0 HG23 ILE B 45 16.938 5.222 -0.559 1.00 0.00 H new ATOM 0 HD11 ILE B 45 18.761 2.489 0.990 1.00 0.00 H new ATOM 0 HD12 ILE B 45 17.504 3.383 0.103 1.00 0.00 H new ATOM 0 HD13 ILE B 45 19.224 3.675 -0.252 1.00 0.00 H new ATOM 2691 N LYS B 46 18.341 8.159 -1.280 1.00 0.00 N ATOM 2692 CA LYS B 46 18.028 9.523 -1.692 1.00 0.00 C ATOM 2693 C LYS B 46 16.664 9.580 -2.375 1.00 0.00 C ATOM 2694 O LYS B 46 16.347 8.742 -3.219 1.00 0.00 O ATOM 2695 CB LYS B 46 19.109 10.053 -2.636 1.00 0.00 C ATOM 2696 CG LYS B 46 19.163 9.324 -3.968 1.00 0.00 C ATOM 2697 CD LYS B 46 20.030 10.065 -4.974 1.00 0.00 C ATOM 2698 CE LYS B 46 19.400 11.386 -5.385 1.00 0.00 C ATOM 2699 NZ LYS B 46 20.098 12.549 -4.770 1.00 0.00 N ATOM 0 H LYS B 46 17.959 7.437 -1.892 1.00 0.00 H new ATOM 0 HA LYS B 46 17.997 10.151 -0.801 1.00 0.00 H new ATOM 0 HB2 LYS B 46 18.933 11.113 -2.818 1.00 0.00 H new ATOM 0 HB3 LYS B 46 20.079 9.971 -2.147 1.00 0.00 H new ATOM 0 HG2 LYS B 46 19.556 8.319 -3.818 1.00 0.00 H new ATOM 0 HG3 LYS B 46 18.154 9.216 -4.366 1.00 0.00 H new ATOM 0 HD2 LYS B 46 21.014 10.248 -4.543 1.00 0.00 H new ATOM 0 HD3 LYS B 46 20.180 9.442 -5.856 1.00 0.00 H new ATOM 0 HE2 LYS B 46 19.427 11.479 -6.471 1.00 0.00 H new ATOM 0 HE3 LYS B 46 18.351 11.395 -5.090 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 19.433 13.343 -4.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 20.455 12.282 -3.830 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 20.895 12.835 -5.374 1.00 0.00 H new ATOM 2713 N THR B 47 15.860 10.570 -2.001 1.00 0.00 N ATOM 2714 CA THR B 47 14.530 10.731 -2.577 1.00 0.00 C ATOM 2715 C THR B 47 14.450 11.991 -3.431 1.00 0.00 C ATOM 2716 O THR B 47 15.187 12.951 -3.210 1.00 0.00 O ATOM 2717 CB THR B 47 13.478 10.786 -1.469 1.00 0.00 C ATOM 2718 OG1 THR B 47 13.608 11.976 -0.712 1.00 0.00 O ATOM 2719 CG2 THR B 47 13.559 9.619 -0.507 1.00 0.00 C ATOM 0 H THR B 47 16.106 11.272 -1.303 1.00 0.00 H new ATOM 0 HA THR B 47 14.334 9.871 -3.217 1.00 0.00 H new ATOM 0 HB THR B 47 12.517 10.747 -1.982 1.00 0.00 H new ATOM 0 HG1 THR B 47 12.761 12.468 -0.729 1.00 0.00 H new ATOM 0 HG21 THR B 47 12.785 9.720 0.254 1.00 0.00 H new ATOM 0 HG22 THR B 47 13.412 8.687 -1.053 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.538 9.609 -0.029 1.00 0.00 H new ATOM 2727 N THR B 48 13.547 11.980 -4.407 1.00 0.00 N ATOM 2728 CA THR B 48 13.364 13.122 -5.295 1.00 0.00 C ATOM 2729 C THR B 48 13.133 14.398 -4.493 1.00 0.00 C ATOM 2730 O THR B 48 13.423 15.499 -4.961 1.00 0.00 O ATOM 2731 CB THR B 48 12.184 12.873 -6.236 1.00 0.00 C ATOM 2732 OG1 THR B 48 11.186 12.102 -5.594 1.00 0.00 O ATOM 2733 CG2 THR B 48 12.573 12.154 -7.510 1.00 0.00 C ATOM 0 H THR B 48 12.930 11.192 -4.603 1.00 0.00 H new ATOM 0 HA THR B 48 14.271 13.246 -5.886 1.00 0.00 H new ATOM 0 HB THR B 48 11.811 13.863 -6.498 1.00 0.00 H new ATOM 0 HG1 THR B 48 10.469 12.691 -5.280 1.00 0.00 H new ATOM 0 HG21 THR B 48 11.689 12.010 -8.131 1.00 0.00 H new ATOM 0 HG22 THR B 48 13.306 12.749 -8.055 1.00 0.00 H new ATOM 0 HG23 THR B 48 13.005 11.184 -7.263 1.00 0.00 H new ATOM 2741 N ASN B 49 12.607 14.241 -3.282 1.00 0.00 N ATOM 2742 CA ASN B 49 12.335 15.379 -2.411 1.00 0.00 C ATOM 2743 C ASN B 49 12.585 15.014 -0.952 1.00 0.00 C ATOM 2744 O ASN B 49 11.884 14.177 -0.384 1.00 0.00 O ATOM 2745 CB ASN B 49 10.891 15.852 -2.593 1.00 0.00 C ATOM 2746 CG ASN B 49 10.788 17.060 -3.503 1.00 0.00 C ATOM 2747 OD1 ASN B 49 10.921 18.200 -3.059 1.00 0.00 O ATOM 2748 ND2 ASN B 49 10.549 16.813 -4.787 1.00 0.00 N ATOM 0 H ASN B 49 12.361 13.336 -2.882 1.00 0.00 H new ATOM 0 HA ASN B 49 13.011 16.189 -2.686 1.00 0.00 H new ATOM 0 HB2 ASN B 49 10.294 15.038 -3.005 1.00 0.00 H new ATOM 0 HB3 ASN B 49 10.466 16.097 -1.619 1.00 0.00 H new ATOM 0 HD21 ASN B 49 10.469 17.585 -5.449 1.00 0.00 H new ATOM 0 HD22 ASN B 49 10.446 15.851 -5.111 1.00 0.00 H new ATOM 2755 N MET B 50 13.588 15.646 -0.353 1.00 0.00 N ATOM 2756 CA MET B 50 13.932 15.387 1.042 1.00 0.00 C ATOM 2757 C MET B 50 13.193 16.336 1.982 1.00 0.00 C ATOM 2758 O MET B 50 13.599 16.528 3.127 1.00 0.00 O ATOM 2759 CB MET B 50 15.441 15.523 1.248 1.00 0.00 C ATOM 2760 CG MET B 50 16.195 14.211 1.106 1.00 0.00 C ATOM 2761 SD MET B 50 17.306 13.897 2.491 1.00 0.00 S ATOM 2762 CE MET B 50 16.467 12.534 3.296 1.00 0.00 C ATOM 0 H MET B 50 14.178 16.341 -0.811 1.00 0.00 H new ATOM 0 HA MET B 50 13.625 14.368 1.277 1.00 0.00 H new ATOM 0 HB2 MET B 50 15.835 16.239 0.526 1.00 0.00 H new ATOM 0 HB3 MET B 50 15.628 15.935 2.240 1.00 0.00 H new ATOM 0 HG2 MET B 50 15.480 13.392 1.026 1.00 0.00 H new ATOM 0 HG3 MET B 50 16.770 14.225 0.180 1.00 0.00 H new ATOM 0 HE1 MET B 50 17.034 12.225 4.174 1.00 0.00 H new ATOM 0 HE2 MET B 50 15.469 12.850 3.601 1.00 0.00 H new ATOM 0 HE3 MET B 50 16.387 11.696 2.603 1.00 0.00 H new ATOM 2772 N ARG B 51 12.105 16.927 1.495 1.00 0.00 N ATOM 2773 CA ARG B 51 11.314 17.851 2.299 1.00 0.00 C ATOM 2774 C ARG B 51 10.130 17.134 2.937 1.00 0.00 C ATOM 2775 O ARG B 51 9.837 17.324 4.117 1.00 0.00 O ATOM 2776 CB ARG B 51 10.818 19.015 1.439 1.00 0.00 C ATOM 2777 CG ARG B 51 11.810 19.449 0.372 1.00 0.00 C ATOM 2778 CD ARG B 51 13.098 19.971 0.989 1.00 0.00 C ATOM 2779 NE ARG B 51 13.740 20.977 0.148 1.00 0.00 N ATOM 2780 CZ ARG B 51 14.859 21.611 0.481 1.00 0.00 C ATOM 2781 NH1 ARG B 51 15.458 21.342 1.633 1.00 0.00 N ATOM 2782 NH2 ARG B 51 15.380 22.514 -0.337 1.00 0.00 N ATOM 0 H ARG B 51 11.752 16.782 0.549 1.00 0.00 H new ATOM 0 HA ARG B 51 11.951 18.243 3.092 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.883 18.728 0.958 1.00 0.00 H new ATOM 0 HB3 ARG B 51 10.597 19.865 2.085 1.00 0.00 H new ATOM 0 HG2 ARG B 51 12.034 18.607 -0.282 1.00 0.00 H new ATOM 0 HG3 ARG B 51 11.362 20.225 -0.249 1.00 0.00 H new ATOM 0 HD2 ARG B 51 12.883 20.400 1.968 1.00 0.00 H new ATOM 0 HD3 ARG B 51 13.786 19.141 1.149 1.00 0.00 H new ATOM 0 HE ARG B 51 13.305 21.206 -0.746 1.00 0.00 H new ATOM 0 HH11 ARG B 51 15.060 20.647 2.265 1.00 0.00 H new ATOM 0 HH12 ARG B 51 16.317 21.830 1.887 1.00 0.00 H new ATOM 0 HH21 ARG B 51 14.922 22.723 -1.224 1.00 0.00 H new ATOM 0 HH22 ARG B 51 16.239 23.000 -0.080 1.00 0.00 H new ATOM 2796 N ARG B 52 9.451 16.308 2.146 1.00 0.00 N ATOM 2797 CA ARG B 52 8.298 15.559 2.632 1.00 0.00 C ATOM 2798 C ARG B 52 8.701 14.146 3.040 1.00 0.00 C ATOM 2799 O ARG B 52 8.386 13.693 4.141 1.00 0.00 O ATOM 2800 CB ARG B 52 7.212 15.499 1.556 1.00 0.00 C ATOM 2801 CG ARG B 52 6.156 16.584 1.698 1.00 0.00 C ATOM 2802 CD ARG B 52 6.300 17.646 0.620 1.00 0.00 C ATOM 2803 NE ARG B 52 7.245 18.692 1.004 1.00 0.00 N ATOM 2804 CZ ARG B 52 7.501 19.762 0.259 1.00 0.00 C ATOM 2805 NH1 ARG B 52 6.886 19.928 -0.904 1.00 0.00 N ATOM 2806 NH2 ARG B 52 8.375 20.669 0.678 1.00 0.00 N ATOM 0 H ARG B 52 9.680 16.141 1.166 1.00 0.00 H new ATOM 0 HA ARG B 52 7.905 16.074 3.508 1.00 0.00 H new ATOM 0 HB2 ARG B 52 7.679 15.584 0.575 1.00 0.00 H new ATOM 0 HB3 ARG B 52 6.727 14.524 1.595 1.00 0.00 H new ATOM 0 HG2 ARG B 52 5.164 16.137 1.640 1.00 0.00 H new ATOM 0 HG3 ARG B 52 6.239 17.048 2.681 1.00 0.00 H new ATOM 0 HD2 ARG B 52 6.633 17.179 -0.307 1.00 0.00 H new ATOM 0 HD3 ARG B 52 5.326 18.093 0.419 1.00 0.00 H new ATOM 0 HE ARG B 52 7.735 18.596 1.893 1.00 0.00 H new ATOM 0 HH11 ARG B 52 6.214 19.233 -1.229 1.00 0.00 H new ATOM 0 HH12 ARG B 52 7.085 20.751 -1.473 1.00 0.00 H new ATOM 0 HH21 ARG B 52 8.850 20.545 1.572 1.00 0.00 H new ATOM 0 HH22 ARG B 52 8.571 21.490 0.106 1.00 0.00 H new ATOM 2820 N LEU B 53 9.401 13.453 2.146 1.00 0.00 N ATOM 2821 CA LEU B 53 9.849 12.092 2.414 1.00 0.00 C ATOM 2822 C LEU B 53 11.086 12.093 3.306 1.00 0.00 C ATOM 2823 O LEU B 53 11.851 13.056 3.321 1.00 0.00 O ATOM 2824 CB LEU B 53 10.151 11.365 1.103 1.00 0.00 C ATOM 2825 CG LEU B 53 9.129 11.592 -0.013 1.00 0.00 C ATOM 2826 CD1 LEU B 53 9.466 10.737 -1.225 1.00 0.00 C ATOM 2827 CD2 LEU B 53 7.724 11.289 0.484 1.00 0.00 C ATOM 0 H LEU B 53 9.670 13.813 1.230 1.00 0.00 H new ATOM 0 HA LEU B 53 9.048 11.568 2.935 1.00 0.00 H new ATOM 0 HB2 LEU B 53 11.131 11.682 0.747 1.00 0.00 H new ATOM 0 HB3 LEU B 53 10.215 10.296 1.304 1.00 0.00 H new ATOM 0 HG LEU B 53 9.169 12.640 -0.312 1.00 0.00 H new ATOM 0 HD11 LEU B 53 8.729 10.911 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU B 53 10.457 11.002 -1.593 1.00 0.00 H new ATOM 0 HD13 LEU B 53 9.454 9.684 -0.942 1.00 0.00 H new ATOM 0 HD21 LEU B 53 7.009 11.455 -0.322 1.00 0.00 H new ATOM 0 HD22 LEU B 53 7.669 10.250 0.809 1.00 0.00 H new ATOM 0 HD23 LEU B 53 7.485 11.944 1.322 1.00 0.00 H new ATOM 2839 N SER B 54 11.276 11.004 4.044 1.00 0.00 N ATOM 2840 CA SER B 54 12.421 10.879 4.937 1.00 0.00 C ATOM 2841 C SER B 54 12.772 9.414 5.171 1.00 0.00 C ATOM 2842 O SER B 54 11.905 8.541 5.118 1.00 0.00 O ATOM 2843 CB SER B 54 12.130 11.563 6.274 1.00 0.00 C ATOM 2844 OG SER B 54 12.709 12.857 6.322 1.00 0.00 O ATOM 0 H SER B 54 10.652 10.197 4.041 1.00 0.00 H new ATOM 0 HA SER B 54 13.272 11.368 4.463 1.00 0.00 H new ATOM 0 HB2 SER B 54 11.053 11.638 6.421 1.00 0.00 H new ATOM 0 HB3 SER B 54 12.522 10.955 7.090 1.00 0.00 H new ATOM 0 HG SER B 54 12.594 13.299 5.455 1.00 0.00 H new ATOM 2850 N VAL B 55 14.048 9.152 5.431 1.00 0.00 N ATOM 2851 CA VAL B 55 14.515 7.791 5.675 1.00 0.00 C ATOM 2852 C VAL B 55 15.404 7.737 6.912 1.00 0.00 C ATOM 2853 O VAL B 55 16.075 8.714 7.249 1.00 0.00 O ATOM 2854 CB VAL B 55 15.301 7.229 4.473 1.00 0.00 C ATOM 2855 CG1 VAL B 55 15.287 5.709 4.489 1.00 0.00 C ATOM 2856 CG2 VAL B 55 14.742 7.757 3.159 1.00 0.00 C ATOM 0 H VAL B 55 14.778 9.863 5.478 1.00 0.00 H new ATOM 0 HA VAL B 55 13.627 7.179 5.830 1.00 0.00 H new ATOM 0 HB VAL B 55 16.334 7.566 4.558 1.00 0.00 H new ATOM 0 HG11 VAL B 55 15.847 5.331 3.633 1.00 0.00 H new ATOM 0 HG12 VAL B 55 15.747 5.351 5.410 1.00 0.00 H new ATOM 0 HG13 VAL B 55 14.258 5.354 4.435 1.00 0.00 H new ATOM 0 HG21 VAL B 55 15.315 7.345 2.328 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.698 7.460 3.062 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.813 8.845 3.144 1.00 0.00 H new ATOM 2866 N ASP B 56 15.405 6.592 7.585 1.00 0.00 N ATOM 2867 CA ASP B 56 16.215 6.415 8.784 1.00 0.00 C ATOM 2868 C ASP B 56 16.268 4.940 9.195 1.00 0.00 C ATOM 2869 O ASP B 56 15.243 4.357 9.544 1.00 0.00 O ATOM 2870 CB ASP B 56 15.643 7.250 9.932 1.00 0.00 C ATOM 2871 CG ASP B 56 16.569 7.293 11.131 1.00 0.00 C ATOM 2872 OD1 ASP B 56 16.892 6.214 11.671 1.00 0.00 O ATOM 2873 OD2 ASP B 56 16.972 8.405 11.530 1.00 0.00 O ATOM 0 H ASP B 56 14.855 5.774 7.321 1.00 0.00 H new ATOM 0 HA ASP B 56 17.228 6.750 8.562 1.00 0.00 H new ATOM 0 HB2 ASP B 56 15.458 8.266 9.582 1.00 0.00 H new ATOM 0 HB3 ASP B 56 14.681 6.837 10.234 1.00 0.00 H new ATOM 2878 N PRO B 57 17.461 4.307 9.163 1.00 0.00 N ATOM 2879 CA PRO B 57 18.721 4.944 8.757 1.00 0.00 C ATOM 2880 C PRO B 57 18.779 5.195 7.251 1.00 0.00 C ATOM 2881 O PRO B 57 18.355 4.352 6.459 1.00 0.00 O ATOM 2882 CB PRO B 57 19.801 3.930 9.168 1.00 0.00 C ATOM 2883 CG PRO B 57 19.098 2.896 9.986 1.00 0.00 C ATOM 2884 CD PRO B 57 17.670 2.903 9.528 1.00 0.00 C ATOM 0 HA PRO B 57 18.844 5.922 9.222 1.00 0.00 H new ATOM 0 HB2 PRO B 57 20.271 3.483 8.292 1.00 0.00 H new ATOM 0 HB3 PRO B 57 20.592 4.412 9.743 1.00 0.00 H new ATOM 0 HG2 PRO B 57 19.548 1.914 9.843 1.00 0.00 H new ATOM 0 HG3 PRO B 57 19.167 3.127 11.049 1.00 0.00 H new ATOM 0 HD2 PRO B 57 17.512 2.236 8.681 1.00 0.00 H new ATOM 0 HD3 PRO B 57 16.989 2.583 10.317 1.00 0.00 H new ATOM 2892 N PRO B 58 19.310 6.357 6.831 1.00 0.00 N ATOM 2893 CA PRO B 58 19.421 6.705 5.415 1.00 0.00 C ATOM 2894 C PRO B 58 20.626 6.043 4.754 1.00 0.00 C ATOM 2895 O PRO B 58 20.588 5.698 3.572 1.00 0.00 O ATOM 2896 CB PRO B 58 19.597 8.221 5.452 1.00 0.00 C ATOM 2897 CG PRO B 58 20.311 8.481 6.734 1.00 0.00 C ATOM 2898 CD PRO B 58 19.845 7.422 7.703 1.00 0.00 C ATOM 0 HA PRO B 58 18.561 6.372 4.835 1.00 0.00 H new ATOM 0 HB2 PRO B 58 20.174 8.575 4.597 1.00 0.00 H new ATOM 0 HB3 PRO B 58 18.635 8.733 5.422 1.00 0.00 H new ATOM 0 HG2 PRO B 58 21.391 8.431 6.594 1.00 0.00 H new ATOM 0 HG3 PRO B 58 20.084 9.479 7.110 1.00 0.00 H new ATOM 0 HD2 PRO B 58 20.665 7.058 8.322 1.00 0.00 H new ATOM 0 HD3 PRO B 58 19.081 7.807 8.379 1.00 0.00 H new ATOM 2906 N CYS B 59 21.690 5.868 5.528 1.00 0.00 N ATOM 2907 CA CYS B 59 22.911 5.246 5.030 1.00 0.00 C ATOM 2908 C CYS B 59 23.498 4.308 6.079 1.00 0.00 C ATOM 2909 O CYS B 59 23.251 4.465 7.274 1.00 0.00 O ATOM 2910 CB CYS B 59 23.937 6.317 4.657 1.00 0.00 C ATOM 2911 SG CYS B 59 23.266 7.660 3.647 1.00 0.00 S ATOM 0 H CYS B 59 21.732 6.149 6.508 1.00 0.00 H new ATOM 0 HA CYS B 59 22.664 4.667 4.140 1.00 0.00 H new ATOM 0 HB2 CYS B 59 24.356 6.738 5.571 1.00 0.00 H new ATOM 0 HB3 CYS B 59 24.759 5.846 4.117 1.00 0.00 H new ATOM 0 HG CYS B 59 24.207 8.517 3.384 1.00 0.00 H new ATOM 2917 N GLY B 60 24.273 3.330 5.624 1.00 0.00 N ATOM 2918 CA GLY B 60 24.880 2.383 6.539 1.00 0.00 C ATOM 2919 C GLY B 60 25.712 1.341 5.823 1.00 0.00 C ATOM 2920 O GLY B 60 25.534 1.112 4.627 1.00 0.00 O ATOM 0 H GLY B 60 24.491 3.177 4.640 1.00 0.00 H new ATOM 0 HA2 GLY B 60 25.508 2.920 7.250 1.00 0.00 H new ATOM 0 HA3 GLY B 60 24.099 1.887 7.115 1.00 0.00 H new ATOM 2924 N VAL B 61 26.624 0.708 6.551 1.00 0.00 N ATOM 2925 CA VAL B 61 27.484 -0.313 5.971 1.00 0.00 C ATOM 2926 C VAL B 61 26.927 -1.711 6.221 1.00 0.00 C ATOM 2927 O VAL B 61 26.847 -2.164 7.363 1.00 0.00 O ATOM 2928 CB VAL B 61 28.918 -0.228 6.529 1.00 0.00 C ATOM 2929 CG1 VAL B 61 28.948 -0.601 8.004 1.00 0.00 C ATOM 2930 CG2 VAL B 61 29.855 -1.117 5.726 1.00 0.00 C ATOM 0 H VAL B 61 26.786 0.884 7.543 1.00 0.00 H new ATOM 0 HA VAL B 61 27.514 -0.127 4.897 1.00 0.00 H new ATOM 0 HB VAL B 61 29.261 0.802 6.437 1.00 0.00 H new ATOM 0 HG11 VAL B 61 29.970 -0.534 8.376 1.00 0.00 H new ATOM 0 HG12 VAL B 61 28.312 0.083 8.565 1.00 0.00 H new ATOM 0 HG13 VAL B 61 28.583 -1.620 8.129 1.00 0.00 H new ATOM 0 HG21 VAL B 61 30.863 -1.045 6.134 1.00 0.00 H new ATOM 0 HG22 VAL B 61 29.514 -2.151 5.783 1.00 0.00 H new ATOM 0 HG23 VAL B 61 29.860 -0.794 4.685 1.00 0.00 H new ATOM 2940 N LEU B 62 26.543 -2.390 5.144 1.00 0.00 N ATOM 2941 CA LEU B 62 25.990 -3.736 5.244 1.00 0.00 C ATOM 2942 C LEU B 62 27.100 -4.779 5.306 1.00 0.00 C ATOM 2943 O LEU B 62 28.260 -4.485 5.017 1.00 0.00 O ATOM 2944 CB LEU B 62 25.072 -4.020 4.053 1.00 0.00 C ATOM 2945 CG LEU B 62 23.579 -4.055 4.380 1.00 0.00 C ATOM 2946 CD1 LEU B 62 22.752 -3.989 3.106 1.00 0.00 C ATOM 2947 CD2 LEU B 62 23.238 -5.306 5.177 1.00 0.00 C ATOM 0 H LEU B 62 26.605 -2.030 4.192 1.00 0.00 H new ATOM 0 HA LEU B 62 25.410 -3.797 6.165 1.00 0.00 H new ATOM 0 HB2 LEU B 62 25.244 -3.259 3.292 1.00 0.00 H new ATOM 0 HB3 LEU B 62 25.355 -4.978 3.616 1.00 0.00 H new ATOM 0 HG LEU B 62 23.338 -3.184 4.989 1.00 0.00 H new ATOM 0 HD11 LEU B 62 21.692 -4.015 3.359 1.00 0.00 H new ATOM 0 HD12 LEU B 62 22.976 -3.064 2.574 1.00 0.00 H new ATOM 0 HD13 LEU B 62 22.995 -4.841 2.470 1.00 0.00 H new ATOM 0 HD21 LEU B 62 22.171 -5.315 5.401 1.00 0.00 H new ATOM 0 HD22 LEU B 62 23.493 -6.190 4.593 1.00 0.00 H new ATOM 0 HD23 LEU B 62 23.805 -5.310 6.108 1.00 0.00 H new ATOM 2959 N ASP B 63 26.735 -6.001 5.681 1.00 0.00 N ATOM 2960 CA ASP B 63 27.696 -7.092 5.778 1.00 0.00 C ATOM 2961 C ASP B 63 27.324 -8.228 4.829 1.00 0.00 C ATOM 2962 O ASP B 63 26.210 -8.270 4.305 1.00 0.00 O ATOM 2963 CB ASP B 63 27.766 -7.614 7.215 1.00 0.00 C ATOM 2964 CG ASP B 63 28.990 -7.107 7.953 1.00 0.00 C ATOM 2965 OD1 ASP B 63 29.762 -6.326 7.357 1.00 0.00 O ATOM 2966 OD2 ASP B 63 29.178 -7.491 9.127 1.00 0.00 O ATOM 0 H ASP B 63 25.779 -6.260 5.923 1.00 0.00 H new ATOM 0 HA ASP B 63 28.675 -6.708 5.492 1.00 0.00 H new ATOM 0 HB2 ASP B 63 26.868 -7.310 7.754 1.00 0.00 H new ATOM 0 HB3 ASP B 63 27.777 -8.704 7.203 1.00 0.00 H new ATOM 2971 N PRO B 64 28.253 -9.170 4.594 1.00 0.00 N ATOM 2972 CA PRO B 64 28.017 -10.310 3.702 1.00 0.00 C ATOM 2973 C PRO B 64 26.775 -11.106 4.089 1.00 0.00 C ATOM 2974 O PRO B 64 26.768 -11.812 5.097 1.00 0.00 O ATOM 2975 CB PRO B 64 29.278 -11.174 3.863 1.00 0.00 C ATOM 2976 CG PRO B 64 29.965 -10.653 5.083 1.00 0.00 C ATOM 2977 CD PRO B 64 29.602 -9.202 5.175 1.00 0.00 C ATOM 0 HA PRO B 64 27.840 -9.985 2.677 1.00 0.00 H new ATOM 0 HB2 PRO B 64 29.020 -12.227 3.977 1.00 0.00 H new ATOM 0 HB3 PRO B 64 29.922 -11.096 2.987 1.00 0.00 H new ATOM 0 HG2 PRO B 64 29.642 -11.193 5.973 1.00 0.00 H new ATOM 0 HG3 PRO B 64 31.045 -10.781 5.007 1.00 0.00 H new ATOM 0 HD2 PRO B 64 29.608 -8.848 6.206 1.00 0.00 H new ATOM 0 HD3 PRO B 64 30.298 -8.574 4.618 1.00 0.00 H new ATOM 2985 N LYS B 65 25.727 -10.989 3.279 1.00 0.00 N ATOM 2986 CA LYS B 65 24.478 -11.701 3.534 1.00 0.00 C ATOM 2987 C LYS B 65 23.762 -11.134 4.755 1.00 0.00 C ATOM 2988 O LYS B 65 23.188 -11.877 5.552 1.00 0.00 O ATOM 2989 CB LYS B 65 24.750 -13.192 3.736 1.00 0.00 C ATOM 2990 CG LYS B 65 23.588 -14.084 3.328 1.00 0.00 C ATOM 2991 CD LYS B 65 23.971 -15.013 2.189 1.00 0.00 C ATOM 2992 CE LYS B 65 24.936 -16.093 2.650 1.00 0.00 C ATOM 2993 NZ LYS B 65 25.925 -16.444 1.595 1.00 0.00 N ATOM 0 H LYS B 65 25.717 -10.408 2.441 1.00 0.00 H new ATOM 0 HA LYS B 65 23.832 -11.569 2.666 1.00 0.00 H new ATOM 0 HB2 LYS B 65 25.632 -13.473 3.161 1.00 0.00 H new ATOM 0 HB3 LYS B 65 24.984 -13.371 4.786 1.00 0.00 H new ATOM 0 HG2 LYS B 65 23.262 -14.673 4.185 1.00 0.00 H new ATOM 0 HG3 LYS B 65 22.742 -13.466 3.026 1.00 0.00 H new ATOM 0 HD2 LYS B 65 23.074 -15.477 1.779 1.00 0.00 H new ATOM 0 HD3 LYS B 65 24.427 -14.435 1.385 1.00 0.00 H new ATOM 0 HE2 LYS B 65 25.462 -15.752 3.542 1.00 0.00 H new ATOM 0 HE3 LYS B 65 24.375 -16.984 2.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 26.564 -17.184 1.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 25.425 -16.794 0.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 26.478 -15.600 1.343 1.00 0.00 H new ATOM 3007 N GLU B 66 23.797 -9.812 4.897 1.00 0.00 N ATOM 3008 CA GLU B 66 23.150 -9.148 6.022 1.00 0.00 C ATOM 3009 C GLU B 66 21.967 -8.309 5.552 1.00 0.00 C ATOM 3010 O GLU B 66 21.912 -7.883 4.399 1.00 0.00 O ATOM 3011 CB GLU B 66 24.154 -8.266 6.763 1.00 0.00 C ATOM 3012 CG GLU B 66 24.717 -8.913 8.016 1.00 0.00 C ATOM 3013 CD GLU B 66 24.310 -8.183 9.281 1.00 0.00 C ATOM 3014 OE1 GLU B 66 24.589 -6.970 9.382 1.00 0.00 O ATOM 3015 OE2 GLU B 66 23.711 -8.824 10.170 1.00 0.00 O ATOM 0 H GLU B 66 24.266 -9.181 4.247 1.00 0.00 H new ATOM 0 HA GLU B 66 22.779 -9.915 6.701 1.00 0.00 H new ATOM 0 HB2 GLU B 66 24.975 -8.019 6.090 1.00 0.00 H new ATOM 0 HB3 GLU B 66 23.671 -7.327 7.034 1.00 0.00 H new ATOM 0 HG2 GLU B 66 24.376 -9.947 8.072 1.00 0.00 H new ATOM 0 HG3 GLU B 66 25.805 -8.939 7.950 1.00 0.00 H new ATOM 3022 N LYS B 67 21.021 -8.078 6.457 1.00 0.00 N ATOM 3023 CA LYS B 67 19.835 -7.291 6.138 1.00 0.00 C ATOM 3024 C LYS B 67 19.616 -6.189 7.171 1.00 0.00 C ATOM 3025 O LYS B 67 19.741 -6.417 8.373 1.00 0.00 O ATOM 3026 CB LYS B 67 18.601 -8.192 6.068 1.00 0.00 C ATOM 3027 CG LYS B 67 18.210 -8.795 7.407 1.00 0.00 C ATOM 3028 CD LYS B 67 16.792 -9.342 7.378 1.00 0.00 C ATOM 3029 CE LYS B 67 16.702 -10.690 8.075 1.00 0.00 C ATOM 3030 NZ LYS B 67 15.714 -10.675 9.189 1.00 0.00 N ATOM 0 H LYS B 67 21.053 -8.424 7.416 1.00 0.00 H new ATOM 0 HA LYS B 67 19.992 -6.825 5.165 1.00 0.00 H new ATOM 0 HB2 LYS B 67 17.762 -7.615 5.680 1.00 0.00 H new ATOM 0 HB3 LYS B 67 18.789 -8.997 5.358 1.00 0.00 H new ATOM 0 HG2 LYS B 67 18.905 -9.595 7.664 1.00 0.00 H new ATOM 0 HG3 LYS B 67 18.293 -8.038 8.187 1.00 0.00 H new ATOM 0 HD2 LYS B 67 16.118 -8.635 7.862 1.00 0.00 H new ATOM 0 HD3 LYS B 67 16.460 -9.442 6.345 1.00 0.00 H new ATOM 0 HE2 LYS B 67 16.421 -11.455 7.351 1.00 0.00 H new ATOM 0 HE3 LYS B 67 17.683 -10.964 8.464 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 15.683 -11.613 9.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 15.995 -9.963 9.893 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 14.773 -10.439 8.815 1.00 0.00 H new ATOM 3044 N VAL B 68 19.288 -4.993 6.691 1.00 0.00 N ATOM 3045 CA VAL B 68 19.050 -3.854 7.568 1.00 0.00 C ATOM 3046 C VAL B 68 17.651 -3.282 7.358 1.00 0.00 C ATOM 3047 O VAL B 68 17.250 -2.997 6.229 1.00 0.00 O ATOM 3048 CB VAL B 68 20.085 -2.739 7.336 1.00 0.00 C ATOM 3049 CG1 VAL B 68 21.430 -3.125 7.933 1.00 0.00 C ATOM 3050 CG2 VAL B 68 20.218 -2.435 5.852 1.00 0.00 C ATOM 0 H VAL B 68 19.181 -4.789 5.697 1.00 0.00 H new ATOM 0 HA VAL B 68 19.143 -4.219 8.591 1.00 0.00 H new ATOM 0 HB VAL B 68 19.738 -1.836 7.838 1.00 0.00 H new ATOM 0 HG11 VAL B 68 22.149 -2.324 7.759 1.00 0.00 H new ATOM 0 HG12 VAL B 68 21.319 -3.286 9.005 1.00 0.00 H new ATOM 0 HG13 VAL B 68 21.787 -4.041 7.463 1.00 0.00 H new ATOM 0 HG21 VAL B 68 20.954 -1.644 5.707 1.00 0.00 H new ATOM 0 HG22 VAL B 68 20.541 -3.332 5.324 1.00 0.00 H new ATOM 0 HG23 VAL B 68 19.254 -2.110 5.459 1.00 0.00 H new ATOM 3060 N LEU B 69 16.915 -3.117 8.451 1.00 0.00 N ATOM 3061 CA LEU B 69 15.561 -2.579 8.386 1.00 0.00 C ATOM 3062 C LEU B 69 15.575 -1.057 8.490 1.00 0.00 C ATOM 3063 O LEU B 69 16.150 -0.494 9.422 1.00 0.00 O ATOM 3064 CB LEU B 69 14.702 -3.172 9.506 1.00 0.00 C ATOM 3065 CG LEU B 69 13.311 -3.643 9.077 1.00 0.00 C ATOM 3066 CD1 LEU B 69 12.606 -4.341 10.230 1.00 0.00 C ATOM 3067 CD2 LEU B 69 12.484 -2.469 8.576 1.00 0.00 C ATOM 0 H LEU B 69 17.233 -3.348 9.392 1.00 0.00 H new ATOM 0 HA LEU B 69 15.131 -2.854 7.423 1.00 0.00 H new ATOM 0 HB2 LEU B 69 15.235 -4.016 9.944 1.00 0.00 H new ATOM 0 HB3 LEU B 69 14.589 -2.424 10.291 1.00 0.00 H new ATOM 0 HG LEU B 69 13.424 -4.357 8.261 1.00 0.00 H new ATOM 0 HD11 LEU B 69 11.618 -4.669 9.907 1.00 0.00 H new ATOM 0 HD12 LEU B 69 13.191 -5.205 10.544 1.00 0.00 H new ATOM 0 HD13 LEU B 69 12.503 -3.649 11.066 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.497 -2.821 8.275 1.00 0.00 H new ATOM 0 HD22 LEU B 69 12.379 -1.732 9.372 1.00 0.00 H new ATOM 0 HD23 LEU B 69 12.982 -2.011 7.721 1.00 0.00 H new ATOM 3079 N MET B 70 14.938 -0.396 7.527 1.00 0.00 N ATOM 3080 CA MET B 70 14.879 1.062 7.511 1.00 0.00 C ATOM 3081 C MET B 70 13.444 1.546 7.338 1.00 0.00 C ATOM 3082 O MET B 70 12.580 0.807 6.864 1.00 0.00 O ATOM 3083 CB MET B 70 15.761 1.619 6.393 1.00 0.00 C ATOM 3084 CG MET B 70 15.664 0.835 5.095 1.00 0.00 C ATOM 3085 SD MET B 70 14.023 0.924 4.354 1.00 0.00 S ATOM 3086 CE MET B 70 14.431 1.455 2.695 1.00 0.00 C ATOM 0 H MET B 70 14.456 -0.846 6.749 1.00 0.00 H new ATOM 0 HA MET B 70 15.251 1.426 8.468 1.00 0.00 H new ATOM 0 HB2 MET B 70 15.482 2.656 6.204 1.00 0.00 H new ATOM 0 HB3 MET B 70 16.798 1.624 6.728 1.00 0.00 H new ATOM 0 HG2 MET B 70 16.400 1.218 4.388 1.00 0.00 H new ATOM 0 HG3 MET B 70 15.917 -0.208 5.285 1.00 0.00 H new ATOM 0 HE1 MET B 70 13.565 1.940 2.245 1.00 0.00 H new ATOM 0 HE2 MET B 70 15.263 2.159 2.732 1.00 0.00 H new ATOM 0 HE3 MET B 70 14.715 0.590 2.095 1.00 0.00 H new ATOM 3096 N ALA B 71 13.197 2.789 7.732 1.00 0.00 N ATOM 3097 CA ALA B 71 11.865 3.376 7.631 1.00 0.00 C ATOM 3098 C ALA B 71 11.834 4.522 6.627 1.00 0.00 C ATOM 3099 O ALA B 71 12.852 5.157 6.357 1.00 0.00 O ATOM 3100 CB ALA B 71 11.403 3.861 8.996 1.00 0.00 C ATOM 0 H ALA B 71 13.903 3.412 8.125 1.00 0.00 H new ATOM 0 HA ALA B 71 11.184 2.603 7.275 1.00 0.00 H new ATOM 0 HB1 ALA B 71 10.408 4.297 8.909 1.00 0.00 H new ATOM 0 HB2 ALA B 71 11.372 3.021 9.689 1.00 0.00 H new ATOM 0 HB3 ALA B 71 12.098 4.613 9.369 1.00 0.00 H new ATOM 3106 N VAL B 72 10.649 4.785 6.082 1.00 0.00 N ATOM 3107 CA VAL B 72 10.469 5.858 5.112 1.00 0.00 C ATOM 3108 C VAL B 72 9.365 6.810 5.558 1.00 0.00 C ATOM 3109 O VAL B 72 8.218 6.696 5.124 1.00 0.00 O ATOM 3110 CB VAL B 72 10.123 5.305 3.716 1.00 0.00 C ATOM 3111 CG1 VAL B 72 9.961 6.441 2.716 1.00 0.00 C ATOM 3112 CG2 VAL B 72 11.187 4.323 3.250 1.00 0.00 C ATOM 0 H VAL B 72 9.797 4.267 6.298 1.00 0.00 H new ATOM 0 HA VAL B 72 11.414 6.397 5.052 1.00 0.00 H new ATOM 0 HB VAL B 72 9.175 4.772 3.783 1.00 0.00 H new ATOM 0 HG11 VAL B 72 9.717 6.031 1.736 1.00 0.00 H new ATOM 0 HG12 VAL B 72 9.158 7.102 3.043 1.00 0.00 H new ATOM 0 HG13 VAL B 72 10.892 7.005 2.652 1.00 0.00 H new ATOM 0 HG21 VAL B 72 10.925 3.944 2.262 1.00 0.00 H new ATOM 0 HG22 VAL B 72 12.152 4.828 3.200 1.00 0.00 H new ATOM 0 HG23 VAL B 72 11.248 3.492 3.953 1.00 0.00 H new ATOM 3122 N SER B 73 9.719 7.745 6.433 1.00 0.00 N ATOM 3123 CA SER B 73 8.760 8.717 6.948 1.00 0.00 C ATOM 3124 C SER B 73 8.035 9.431 5.811 1.00 0.00 C ATOM 3125 O SER B 73 8.649 9.838 4.826 1.00 0.00 O ATOM 3126 CB SER B 73 9.467 9.740 7.838 1.00 0.00 C ATOM 3127 OG SER B 73 9.753 9.196 9.114 1.00 0.00 O ATOM 0 H SER B 73 10.664 7.851 6.801 1.00 0.00 H new ATOM 0 HA SER B 73 8.021 8.177 7.540 1.00 0.00 H new ATOM 0 HB2 SER B 73 10.393 10.063 7.361 1.00 0.00 H new ATOM 0 HB3 SER B 73 8.840 10.625 7.949 1.00 0.00 H new ATOM 0 HG SER B 73 10.206 9.870 9.663 1.00 0.00 H new ATOM 3133 N CYS B 74 6.722 9.582 5.961 1.00 0.00 N ATOM 3134 CA CYS B 74 5.907 10.248 4.953 1.00 0.00 C ATOM 3135 C CYS B 74 4.673 10.880 5.590 1.00 0.00 C ATOM 3136 O CYS B 74 3.586 10.301 5.571 1.00 0.00 O ATOM 3137 CB CYS B 74 5.485 9.258 3.867 1.00 0.00 C ATOM 3138 SG CYS B 74 6.796 8.849 2.690 1.00 0.00 S ATOM 0 H CYS B 74 6.200 9.251 6.773 1.00 0.00 H new ATOM 0 HA CYS B 74 6.507 11.036 4.498 1.00 0.00 H new ATOM 0 HB2 CYS B 74 5.139 8.340 4.342 1.00 0.00 H new ATOM 0 HB3 CYS B 74 4.638 9.673 3.321 1.00 0.00 H new ATOM 0 HG CYS B 74 7.952 9.134 3.212 1.00 0.00 H new ATOM 3144 N ASP B 75 4.850 12.068 6.155 1.00 0.00 N ATOM 3145 CA ASP B 75 3.754 12.781 6.802 1.00 0.00 C ATOM 3146 C ASP B 75 2.670 13.155 5.796 1.00 0.00 C ATOM 3147 O ASP B 75 2.953 13.374 4.617 1.00 0.00 O ATOM 3148 CB ASP B 75 4.276 14.041 7.496 1.00 0.00 C ATOM 3149 CG ASP B 75 4.788 15.073 6.510 1.00 0.00 C ATOM 3150 OD1 ASP B 75 5.663 14.725 5.688 1.00 0.00 O ATOM 3151 OD2 ASP B 75 4.315 16.227 6.559 1.00 0.00 O ATOM 0 H ASP B 75 5.744 12.559 6.179 1.00 0.00 H new ATOM 0 HA ASP B 75 3.316 12.116 7.547 1.00 0.00 H new ATOM 0 HB2 ASP B 75 3.478 14.479 8.095 1.00 0.00 H new ATOM 0 HB3 ASP B 75 5.078 13.769 8.182 1.00 0.00 H new ATOM 3156 N THR B 76 1.431 13.225 6.269 1.00 0.00 N ATOM 3157 CA THR B 76 0.303 13.573 5.413 1.00 0.00 C ATOM 3158 C THR B 76 0.549 14.900 4.702 1.00 0.00 C ATOM 3159 O THR B 76 1.409 15.683 5.108 1.00 0.00 O ATOM 3160 CB THR B 76 -0.984 13.653 6.235 1.00 0.00 C ATOM 3161 OG1 THR B 76 -1.970 14.407 5.553 1.00 0.00 O ATOM 3162 CG2 THR B 76 -0.787 14.281 7.599 1.00 0.00 C ATOM 0 H THR B 76 1.182 13.045 7.242 1.00 0.00 H new ATOM 0 HA THR B 76 0.196 12.792 4.660 1.00 0.00 H new ATOM 0 HB THR B 76 -1.302 12.620 6.372 1.00 0.00 H new ATOM 0 HG1 THR B 76 -2.254 13.923 4.749 1.00 0.00 H new ATOM 0 HG21 THR B 76 -1.739 14.307 8.129 1.00 0.00 H new ATOM 0 HG22 THR B 76 -0.069 13.692 8.170 1.00 0.00 H new ATOM 0 HG23 THR B 76 -0.410 15.297 7.481 1.00 0.00 H new ATOM 3170 N PHE B 77 -0.209 15.147 3.639 1.00 0.00 N ATOM 3171 CA PHE B 77 -0.070 16.381 2.872 1.00 0.00 C ATOM 3172 C PHE B 77 -1.239 16.558 1.909 1.00 0.00 C ATOM 3173 O PHE B 77 -2.232 15.833 1.981 1.00 0.00 O ATOM 3174 CB PHE B 77 1.248 16.378 2.097 1.00 0.00 C ATOM 3175 CG PHE B 77 1.298 15.350 1.001 1.00 0.00 C ATOM 3176 CD1 PHE B 77 1.649 14.039 1.280 1.00 0.00 C ATOM 3177 CD2 PHE B 77 0.992 15.696 -0.305 1.00 0.00 C ATOM 3178 CE1 PHE B 77 1.696 13.092 0.274 1.00 0.00 C ATOM 3179 CE2 PHE B 77 1.037 14.752 -1.315 1.00 0.00 C ATOM 3180 CZ PHE B 77 1.389 13.449 -1.025 1.00 0.00 C ATOM 0 H PHE B 77 -0.925 14.511 3.289 1.00 0.00 H new ATOM 0 HA PHE B 77 -0.070 17.216 3.572 1.00 0.00 H new ATOM 0 HB2 PHE B 77 1.408 17.366 1.665 1.00 0.00 H new ATOM 0 HB3 PHE B 77 2.068 16.197 2.792 1.00 0.00 H new ATOM 0 HD1 PHE B 77 1.888 13.754 2.294 1.00 0.00 H new ATOM 0 HD2 PHE B 77 0.715 16.714 -0.537 1.00 0.00 H new ATOM 0 HE1 PHE B 77 1.973 12.074 0.503 1.00 0.00 H new ATOM 0 HE2 PHE B 77 0.797 15.034 -2.330 1.00 0.00 H new ATOM 0 HZ PHE B 77 1.424 12.710 -1.812 1.00 0.00 H new ATOM 3190 N ASN B 78 -1.115 17.527 1.009 1.00 0.00 N ATOM 3191 CA ASN B 78 -2.161 17.799 0.030 1.00 0.00 C ATOM 3192 C ASN B 78 -1.788 17.232 -1.336 1.00 0.00 C ATOM 3193 O ASN B 78 -0.825 17.675 -1.962 1.00 0.00 O ATOM 3194 CB ASN B 78 -2.408 19.305 -0.080 1.00 0.00 C ATOM 3195 CG ASN B 78 -3.163 19.855 1.115 1.00 0.00 C ATOM 3196 OD1 ASN B 78 -3.484 19.124 2.051 1.00 0.00 O ATOM 3197 ND2 ASN B 78 -3.450 21.151 1.086 1.00 0.00 N ATOM 0 H ASN B 78 -0.301 18.137 0.937 1.00 0.00 H new ATOM 0 HA ASN B 78 -3.076 17.312 0.368 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -1.453 19.822 -0.172 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -2.972 19.513 -0.990 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -3.957 21.579 1.861 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -3.164 21.719 0.289 1.00 0.00 H new ATOM 3204 N ALA B 79 -2.556 16.249 -1.790 1.00 0.00 N ATOM 3205 CA ALA B 79 -2.308 15.617 -3.082 1.00 0.00 C ATOM 3206 C ALA B 79 -3.120 16.281 -4.190 1.00 0.00 C ATOM 3207 O ALA B 79 -3.376 15.676 -5.231 1.00 0.00 O ATOM 3208 CB ALA B 79 -2.633 14.136 -3.009 1.00 0.00 C ATOM 0 H ALA B 79 -3.356 15.871 -1.283 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.252 15.741 -3.321 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.445 13.674 -3.978 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -2.006 13.663 -2.253 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.682 14.006 -2.743 1.00 0.00 H new ATOM 3214 N ALA B 80 -3.525 17.524 -3.958 1.00 0.00 N ATOM 3215 CA ALA B 80 -4.311 18.267 -4.936 1.00 0.00 C ATOM 3216 C ALA B 80 -3.423 19.161 -5.793 1.00 0.00 C ATOM 3217 O ALA B 80 -3.717 19.405 -6.963 1.00 0.00 O ATOM 3218 CB ALA B 80 -5.372 19.101 -4.235 1.00 0.00 C ATOM 0 H ALA B 80 -3.322 18.039 -3.101 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.800 17.546 -5.592 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -5.952 19.651 -4.977 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -6.035 18.446 -3.669 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -4.891 19.805 -3.556 1.00 0.00 H new ATOM 3224 N THR B 81 -2.339 19.653 -5.202 1.00 0.00 N ATOM 3225 CA THR B 81 -1.417 20.527 -5.916 1.00 0.00 C ATOM 3226 C THR B 81 0.027 20.255 -5.508 1.00 0.00 C ATOM 3227 O THR B 81 0.739 21.157 -5.070 1.00 0.00 O ATOM 3228 CB THR B 81 -1.771 21.988 -5.647 1.00 0.00 C ATOM 3229 OG1 THR B 81 -1.581 22.310 -4.280 1.00 0.00 O ATOM 3230 CG2 THR B 81 -3.201 22.321 -6.005 1.00 0.00 C ATOM 0 H THR B 81 -2.079 19.462 -4.234 1.00 0.00 H new ATOM 0 HA THR B 81 -1.511 20.323 -6.983 1.00 0.00 H new ATOM 0 HB THR B 81 -1.104 22.573 -6.281 1.00 0.00 H new ATOM 0 HG1 THR B 81 -0.646 22.151 -4.033 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.394 23.372 -5.792 1.00 0.00 H new ATOM 0 HG22 THR B 81 -3.365 22.129 -7.065 1.00 0.00 H new ATOM 0 HG23 THR B 81 -3.877 21.702 -5.416 1.00 0.00 H new ATOM 3238 N GLU B 82 0.453 19.004 -5.657 1.00 0.00 N ATOM 3239 CA GLU B 82 1.813 18.615 -5.305 1.00 0.00 C ATOM 3240 C GLU B 82 2.520 17.979 -6.498 1.00 0.00 C ATOM 3241 O GLU B 82 1.942 17.851 -7.577 1.00 0.00 O ATOM 3242 CB GLU B 82 1.799 17.640 -4.126 1.00 0.00 C ATOM 3243 CG GLU B 82 1.915 18.324 -2.773 1.00 0.00 C ATOM 3244 CD GLU B 82 3.264 18.984 -2.568 1.00 0.00 C ATOM 3245 OE1 GLU B 82 4.051 19.041 -3.536 1.00 0.00 O ATOM 3246 OE2 GLU B 82 3.533 19.445 -1.438 1.00 0.00 O ATOM 0 H GLU B 82 -0.124 18.244 -6.019 1.00 0.00 H new ATOM 0 HA GLU B 82 2.359 19.513 -5.017 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.876 17.061 -4.154 1.00 0.00 H new ATOM 0 HB3 GLU B 82 2.621 16.934 -4.239 1.00 0.00 H new ATOM 0 HG2 GLU B 82 1.130 19.074 -2.681 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.750 17.591 -1.984 1.00 0.00 H new ATOM 3253 N ASP B 83 3.772 17.584 -6.296 1.00 0.00 N ATOM 3254 CA ASP B 83 4.556 16.963 -7.358 1.00 0.00 C ATOM 3255 C ASP B 83 4.594 15.447 -7.194 1.00 0.00 C ATOM 3256 O ASP B 83 5.554 14.894 -6.656 1.00 0.00 O ATOM 3257 CB ASP B 83 5.979 17.524 -7.367 1.00 0.00 C ATOM 3258 CG ASP B 83 6.551 17.679 -5.972 1.00 0.00 C ATOM 3259 OD1 ASP B 83 6.272 18.712 -5.328 1.00 0.00 O ATOM 3260 OD2 ASP B 83 7.277 16.767 -5.523 1.00 0.00 O ATOM 0 H ASP B 83 4.265 17.682 -5.409 1.00 0.00 H new ATOM 0 HA ASP B 83 4.077 17.194 -8.309 1.00 0.00 H new ATOM 0 HB2 ASP B 83 6.623 16.864 -7.949 1.00 0.00 H new ATOM 0 HB3 ASP B 83 5.981 18.493 -7.867 1.00 0.00 H new ATOM 3265 N LEU B 84 3.545 14.782 -7.666 1.00 0.00 N ATOM 3266 CA LEU B 84 3.458 13.329 -7.577 1.00 0.00 C ATOM 3267 C LEU B 84 3.421 12.705 -8.966 1.00 0.00 C ATOM 3268 O LEU B 84 2.408 12.143 -9.379 1.00 0.00 O ATOM 3269 CB LEU B 84 2.215 12.916 -6.786 1.00 0.00 C ATOM 3270 CG LEU B 84 1.916 13.772 -5.555 1.00 0.00 C ATOM 3271 CD1 LEU B 84 0.812 13.142 -4.720 1.00 0.00 C ATOM 3272 CD2 LEU B 84 3.175 13.961 -4.723 1.00 0.00 C ATOM 0 H LEU B 84 2.743 15.226 -8.114 1.00 0.00 H new ATOM 0 HA LEU B 84 4.345 12.967 -7.057 1.00 0.00 H new ATOM 0 HB2 LEU B 84 1.352 12.950 -7.451 1.00 0.00 H new ATOM 0 HB3 LEU B 84 2.333 11.880 -6.469 1.00 0.00 H new ATOM 0 HG LEU B 84 1.573 14.751 -5.890 1.00 0.00 H new ATOM 0 HD11 LEU B 84 0.614 13.766 -3.849 1.00 0.00 H new ATOM 0 HD12 LEU B 84 -0.094 13.057 -5.319 1.00 0.00 H new ATOM 0 HD13 LEU B 84 1.124 12.150 -4.393 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.946 14.572 -3.850 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.546 12.989 -4.398 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.937 14.457 -5.324 1.00 0.00 H new ATOM 3284 N ASN B 85 4.534 12.810 -9.684 1.00 0.00 N ATOM 3285 CA ASN B 85 4.629 12.257 -11.030 1.00 0.00 C ATOM 3286 C ASN B 85 5.033 10.789 -10.988 1.00 0.00 C ATOM 3287 O ASN B 85 4.692 10.015 -11.882 1.00 0.00 O ATOM 3288 CB ASN B 85 5.639 13.053 -11.859 1.00 0.00 C ATOM 3289 CG ASN B 85 4.998 13.735 -13.053 1.00 0.00 C ATOM 3290 OD1 ASN B 85 4.114 14.577 -12.900 1.00 0.00 O ATOM 3291 ND2 ASN B 85 5.443 13.371 -14.251 1.00 0.00 N ATOM 0 H ASN B 85 5.382 13.272 -9.357 1.00 0.00 H new ATOM 0 HA ASN B 85 3.647 12.330 -11.497 1.00 0.00 H new ATOM 0 HB2 ASN B 85 6.113 13.804 -11.226 1.00 0.00 H new ATOM 0 HB3 ASN B 85 6.427 12.385 -12.206 1.00 0.00 H new ATOM 0 HD21 ASN B 85 5.050 13.794 -15.091 1.00 0.00 H new ATOM 0 HD22 ASN B 85 6.178 12.668 -14.330 1.00 0.00 H new ATOM 3298 N ASN B 86 5.763 10.409 -9.943 1.00 0.00 N ATOM 3299 CA ASN B 86 6.211 9.031 -9.793 1.00 0.00 C ATOM 3300 C ASN B 86 7.057 8.859 -8.535 1.00 0.00 C ATOM 3301 O ASN B 86 6.832 7.943 -7.744 1.00 0.00 O ATOM 3302 CB ASN B 86 7.019 8.602 -11.020 1.00 0.00 C ATOM 3303 CG ASN B 86 6.246 7.664 -11.925 1.00 0.00 C ATOM 3304 OD1 ASN B 86 5.979 6.517 -11.568 1.00 0.00 O ATOM 3305 ND2 ASN B 86 5.884 8.148 -13.108 1.00 0.00 N ATOM 0 H ASN B 86 6.055 11.034 -9.192 1.00 0.00 H new ATOM 0 HA ASN B 86 5.327 8.400 -9.702 1.00 0.00 H new ATOM 0 HB2 ASN B 86 7.313 9.487 -11.585 1.00 0.00 H new ATOM 0 HB3 ASN B 86 7.937 8.113 -10.694 1.00 0.00 H new ATOM 0 HD21 ASN B 86 5.364 7.562 -13.761 1.00 0.00 H new ATOM 0 HD22 ASN B 86 6.126 9.105 -13.363 1.00 0.00 H new ATOM 3312 N ASP B 87 8.040 9.735 -8.363 1.00 0.00 N ATOM 3313 CA ASP B 87 8.930 9.668 -7.211 1.00 0.00 C ATOM 3314 C ASP B 87 9.785 8.411 -7.294 1.00 0.00 C ATOM 3315 O ASP B 87 9.343 7.390 -7.818 1.00 0.00 O ATOM 3316 CB ASP B 87 8.124 9.672 -5.910 1.00 0.00 C ATOM 3317 CG ASP B 87 8.524 10.808 -4.988 1.00 0.00 C ATOM 3318 OD1 ASP B 87 8.009 11.931 -5.170 1.00 0.00 O ATOM 3319 OD2 ASP B 87 9.354 10.574 -4.083 1.00 0.00 O ATOM 0 H ASP B 87 8.241 10.500 -9.007 1.00 0.00 H new ATOM 0 HA ASP B 87 9.579 10.544 -7.217 1.00 0.00 H new ATOM 0 HB2 ASP B 87 7.062 9.753 -6.143 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.265 8.722 -5.395 1.00 0.00 H new ATOM 3324 N ARG B 88 11.011 8.484 -6.793 1.00 0.00 N ATOM 3325 CA ARG B 88 11.904 7.333 -6.843 1.00 0.00 C ATOM 3326 C ARG B 88 12.965 7.390 -5.751 1.00 0.00 C ATOM 3327 O ARG B 88 13.623 8.412 -5.555 1.00 0.00 O ATOM 3328 CB ARG B 88 12.582 7.250 -8.211 1.00 0.00 C ATOM 3329 CG ARG B 88 11.715 6.617 -9.285 1.00 0.00 C ATOM 3330 CD ARG B 88 12.466 6.486 -10.600 1.00 0.00 C ATOM 3331 NE ARG B 88 12.765 7.790 -11.189 1.00 0.00 N ATOM 3332 CZ ARG B 88 11.850 8.569 -11.753 1.00 0.00 C ATOM 3333 NH1 ARG B 88 10.584 8.178 -11.806 1.00 0.00 N ATOM 3334 NH2 ARG B 88 12.198 9.743 -12.265 1.00 0.00 N ATOM 0 H ARG B 88 11.406 9.315 -6.353 1.00 0.00 H new ATOM 0 HA ARG B 88 11.297 6.443 -6.678 1.00 0.00 H new ATOM 0 HB2 ARG B 88 12.863 8.254 -8.529 1.00 0.00 H new ATOM 0 HB3 ARG B 88 13.504 6.676 -8.116 1.00 0.00 H new ATOM 0 HG2 ARG B 88 11.384 5.633 -8.954 1.00 0.00 H new ATOM 0 HG3 ARG B 88 10.820 7.221 -9.434 1.00 0.00 H new ATOM 0 HD2 ARG B 88 13.395 5.941 -10.435 1.00 0.00 H new ATOM 0 HD3 ARG B 88 11.872 5.899 -11.300 1.00 0.00 H new ATOM 0 HE ARG B 88 13.730 8.120 -11.165 1.00 0.00 H new ATOM 0 HH11 ARG B 88 10.312 7.277 -11.413 1.00 0.00 H new ATOM 0 HH12 ARG B 88 9.883 8.778 -12.240 1.00 0.00 H new ATOM 0 HH21 ARG B 88 13.170 10.048 -12.226 1.00 0.00 H new ATOM 0 HH22 ARG B 88 11.493 10.340 -12.698 1.00 0.00 H new ATOM 3348 N ILE B 89 13.137 6.270 -5.061 1.00 0.00 N ATOM 3349 CA ILE B 89 14.133 6.162 -4.004 1.00 0.00 C ATOM 3350 C ILE B 89 15.363 5.427 -4.528 1.00 0.00 C ATOM 3351 O ILE B 89 15.354 4.204 -4.666 1.00 0.00 O ATOM 3352 CB ILE B 89 13.573 5.417 -2.773 1.00 0.00 C ATOM 3353 CG1 ILE B 89 12.381 6.179 -2.191 1.00 0.00 C ATOM 3354 CG2 ILE B 89 14.655 5.233 -1.718 1.00 0.00 C ATOM 3355 CD1 ILE B 89 11.484 5.326 -1.321 1.00 0.00 C ATOM 0 H ILE B 89 12.596 5.419 -5.216 1.00 0.00 H new ATOM 0 HA ILE B 89 14.406 7.171 -3.696 1.00 0.00 H new ATOM 0 HB ILE B 89 13.235 4.430 -3.090 1.00 0.00 H new ATOM 0 HG12 ILE B 89 12.750 7.020 -1.604 1.00 0.00 H new ATOM 0 HG13 ILE B 89 11.792 6.595 -3.008 1.00 0.00 H new ATOM 0 HG21 ILE B 89 14.240 4.706 -0.859 1.00 0.00 H new ATOM 0 HG22 ILE B 89 15.477 4.653 -2.137 1.00 0.00 H new ATOM 0 HG23 ILE B 89 15.024 6.209 -1.401 1.00 0.00 H new ATOM 0 HD11 ILE B 89 10.661 5.932 -0.943 1.00 0.00 H new ATOM 0 HD12 ILE B 89 11.086 4.499 -1.909 1.00 0.00 H new ATOM 0 HD13 ILE B 89 12.058 4.931 -0.483 1.00 0.00 H new ATOM 3367 N THR B 90 16.410 6.181 -4.839 1.00 0.00 N ATOM 3368 CA THR B 90 17.635 5.601 -5.371 1.00 0.00 C ATOM 3369 C THR B 90 18.541 5.086 -4.261 1.00 0.00 C ATOM 3370 O THR B 90 18.721 5.737 -3.231 1.00 0.00 O ATOM 3371 CB THR B 90 18.385 6.632 -6.217 1.00 0.00 C ATOM 3372 OG1 THR B 90 17.515 7.239 -7.155 1.00 0.00 O ATOM 3373 CG2 THR B 90 19.549 6.042 -6.983 1.00 0.00 C ATOM 0 H THR B 90 16.435 7.195 -4.732 1.00 0.00 H new ATOM 0 HA THR B 90 17.353 4.754 -5.996 1.00 0.00 H new ATOM 0 HB THR B 90 18.771 7.364 -5.508 1.00 0.00 H new ATOM 0 HG1 THR B 90 17.431 6.663 -7.944 1.00 0.00 H new ATOM 0 HG21 THR B 90 20.038 6.825 -7.562 1.00 0.00 H new ATOM 0 HG22 THR B 90 20.263 5.609 -6.283 1.00 0.00 H new ATOM 0 HG23 THR B 90 19.185 5.266 -7.657 1.00 0.00 H new ATOM 3381 N ILE B 91 19.118 3.913 -4.492 1.00 0.00 N ATOM 3382 CA ILE B 91 20.020 3.294 -3.534 1.00 0.00 C ATOM 3383 C ILE B 91 21.375 3.039 -4.175 1.00 0.00 C ATOM 3384 O ILE B 91 21.472 2.372 -5.204 1.00 0.00 O ATOM 3385 CB ILE B 91 19.453 1.966 -3.007 1.00 0.00 C ATOM 3386 CG1 ILE B 91 18.029 2.173 -2.493 1.00 0.00 C ATOM 3387 CG2 ILE B 91 20.349 1.404 -1.912 1.00 0.00 C ATOM 3388 CD1 ILE B 91 17.472 0.977 -1.757 1.00 0.00 C ATOM 0 H ILE B 91 18.974 3.369 -5.343 1.00 0.00 H new ATOM 0 HA ILE B 91 20.131 3.982 -2.696 1.00 0.00 H new ATOM 0 HB ILE B 91 19.424 1.244 -3.823 1.00 0.00 H new ATOM 0 HG12 ILE B 91 18.013 3.037 -1.829 1.00 0.00 H new ATOM 0 HG13 ILE B 91 17.378 2.406 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE B 91 19.934 0.464 -1.549 1.00 0.00 H new ATOM 0 HG22 ILE B 91 21.347 1.229 -2.313 1.00 0.00 H new ATOM 0 HG23 ILE B 91 20.408 2.116 -1.089 1.00 0.00 H new ATOM 0 HD11 ILE B 91 16.458 1.196 -1.421 1.00 0.00 H new ATOM 0 HD12 ILE B 91 17.455 0.115 -2.424 1.00 0.00 H new ATOM 0 HD13 ILE B 91 18.100 0.756 -0.894 1.00 0.00 H new ATOM 3400 N GLU B 92 22.419 3.581 -3.568 1.00 0.00 N ATOM 3401 CA GLU B 92 23.769 3.418 -4.090 1.00 0.00 C ATOM 3402 C GLU B 92 24.670 2.726 -3.077 1.00 0.00 C ATOM 3403 O GLU B 92 24.989 3.290 -2.031 1.00 0.00 O ATOM 3404 CB GLU B 92 24.358 4.777 -4.466 1.00 0.00 C ATOM 3405 CG GLU B 92 23.507 5.558 -5.454 1.00 0.00 C ATOM 3406 CD GLU B 92 23.757 7.052 -5.385 1.00 0.00 C ATOM 3407 OE1 GLU B 92 24.675 7.468 -4.649 1.00 0.00 O ATOM 3408 OE2 GLU B 92 23.034 7.807 -6.069 1.00 0.00 O ATOM 0 H GLU B 92 22.359 4.137 -2.715 1.00 0.00 H new ATOM 0 HA GLU B 92 23.711 2.792 -4.981 1.00 0.00 H new ATOM 0 HB2 GLU B 92 24.486 5.371 -3.561 1.00 0.00 H new ATOM 0 HB3 GLU B 92 25.350 4.628 -4.892 1.00 0.00 H new ATOM 0 HG2 GLU B 92 23.714 5.205 -6.464 1.00 0.00 H new ATOM 0 HG3 GLU B 92 22.453 5.360 -5.256 1.00 0.00 H new ATOM 3415 N TRP B 93 25.084 1.506 -3.401 1.00 0.00 N ATOM 3416 CA TRP B 93 25.959 0.741 -2.524 1.00 0.00 C ATOM 3417 C TRP B 93 27.192 0.261 -3.283 1.00 0.00 C ATOM 3418 O TRP B 93 27.081 -0.326 -4.360 1.00 0.00 O ATOM 3419 CB TRP B 93 25.210 -0.446 -1.910 1.00 0.00 C ATOM 3420 CG TRP B 93 24.959 -1.569 -2.871 1.00 0.00 C ATOM 3421 CD1 TRP B 93 25.623 -2.762 -2.930 1.00 0.00 C ATOM 3422 CD2 TRP B 93 23.971 -1.609 -3.906 1.00 0.00 C ATOM 3423 NE1 TRP B 93 25.107 -3.540 -3.939 1.00 0.00 N ATOM 3424 CE2 TRP B 93 24.092 -2.853 -4.553 1.00 0.00 C ATOM 3425 CE3 TRP B 93 22.994 -0.711 -4.349 1.00 0.00 C ATOM 3426 CZ2 TRP B 93 23.273 -3.222 -5.618 1.00 0.00 C ATOM 3427 CZ3 TRP B 93 22.183 -1.079 -5.406 1.00 0.00 C ATOM 3428 CH2 TRP B 93 22.327 -2.325 -6.030 1.00 0.00 C ATOM 0 H TRP B 93 24.827 1.027 -4.264 1.00 0.00 H new ATOM 0 HA TRP B 93 26.285 1.394 -1.715 1.00 0.00 H new ATOM 0 HB2 TRP B 93 25.783 -0.826 -1.064 1.00 0.00 H new ATOM 0 HB3 TRP B 93 24.255 -0.097 -1.517 1.00 0.00 H new ATOM 0 HD1 TRP B 93 26.435 -3.051 -2.279 1.00 0.00 H new ATOM 0 HE1 TRP B 93 25.427 -4.475 -4.190 1.00 0.00 H new ATOM 0 HE3 TRP B 93 22.876 0.252 -3.874 1.00 0.00 H new ATOM 0 HZ2 TRP B 93 23.382 -4.182 -6.101 1.00 0.00 H new ATOM 0 HZ3 TRP B 93 21.425 -0.394 -5.757 1.00 0.00 H new ATOM 0 HH2 TRP B 93 21.677 -2.582 -6.853 1.00 0.00 H new ATOM 3439 N THR B 94 28.368 0.526 -2.720 1.00 0.00 N ATOM 3440 CA THR B 94 29.620 0.127 -3.356 1.00 0.00 C ATOM 3441 C THR B 94 30.508 -0.655 -2.394 1.00 0.00 C ATOM 3442 O THR B 94 30.483 -0.429 -1.186 1.00 0.00 O ATOM 3443 CB THR B 94 30.370 1.358 -3.867 1.00 0.00 C ATOM 3444 OG1 THR B 94 31.702 1.025 -4.214 1.00 0.00 O ATOM 3445 CG2 THR B 94 30.426 2.486 -2.860 1.00 0.00 C ATOM 0 H THR B 94 28.480 1.012 -1.830 1.00 0.00 H new ATOM 0 HA THR B 94 29.373 -0.522 -4.196 1.00 0.00 H new ATOM 0 HB THR B 94 29.808 1.698 -4.737 1.00 0.00 H new ATOM 0 HG1 THR B 94 31.700 0.468 -5.020 1.00 0.00 H new ATOM 0 HG21 THR B 94 30.972 3.328 -3.286 1.00 0.00 H new ATOM 0 HG22 THR B 94 29.413 2.800 -2.609 1.00 0.00 H new ATOM 0 HG23 THR B 94 30.934 2.144 -1.958 1.00 0.00 H new ATOM 3453 N ASN B 95 31.295 -1.576 -2.942 1.00 0.00 N ATOM 3454 CA ASN B 95 32.195 -2.391 -2.134 1.00 0.00 C ATOM 3455 C ASN B 95 33.061 -1.517 -1.236 1.00 0.00 C ATOM 3456 O ASN B 95 33.417 -0.396 -1.600 1.00 0.00 O ATOM 3457 CB ASN B 95 33.082 -3.252 -3.034 1.00 0.00 C ATOM 3458 CG ASN B 95 32.276 -4.146 -3.956 1.00 0.00 C ATOM 3459 OD1 ASN B 95 31.265 -4.721 -3.555 1.00 0.00 O ATOM 3460 ND2 ASN B 95 32.721 -4.265 -5.202 1.00 0.00 N ATOM 0 H ASN B 95 31.327 -1.776 -3.942 1.00 0.00 H new ATOM 0 HA ASN B 95 31.589 -3.041 -1.503 1.00 0.00 H new ATOM 0 HB2 ASN B 95 33.726 -2.606 -3.631 1.00 0.00 H new ATOM 0 HB3 ASN B 95 33.734 -3.867 -2.415 1.00 0.00 H new ATOM 0 HD21 ASN B 95 32.219 -4.852 -5.869 1.00 0.00 H new ATOM 0 HD22 ASN B 95 33.564 -3.770 -5.492 1.00 0.00 H new ATOM 3467 N THR B 96 33.400 -2.038 -0.062 1.00 0.00 N ATOM 3468 CA THR B 96 34.226 -1.305 0.889 1.00 0.00 C ATOM 3469 C THR B 96 35.709 -1.490 0.574 1.00 0.00 C ATOM 3470 O THR B 96 36.160 -2.607 0.320 1.00 0.00 O ATOM 3471 CB THR B 96 33.939 -1.778 2.315 1.00 0.00 C ATOM 3472 OG1 THR B 96 33.801 -3.188 2.358 1.00 0.00 O ATOM 3473 CG2 THR B 96 32.681 -1.177 2.906 1.00 0.00 C ATOM 0 H THR B 96 33.115 -2.965 0.254 1.00 0.00 H new ATOM 0 HA THR B 96 33.980 -0.246 0.806 1.00 0.00 H new ATOM 0 HB THR B 96 34.793 -1.445 2.905 1.00 0.00 H new ATOM 0 HG1 THR B 96 32.947 -3.446 1.952 1.00 0.00 H new ATOM 0 HG21 THR B 96 32.538 -1.555 3.918 1.00 0.00 H new ATOM 0 HG22 THR B 96 32.775 -0.091 2.934 1.00 0.00 H new ATOM 0 HG23 THR B 96 31.823 -1.451 2.292 1.00 0.00 H new ATOM 3481 N PRO B 97 36.493 -0.398 0.591 1.00 0.00 N ATOM 3482 CA PRO B 97 37.930 -0.459 0.310 1.00 0.00 C ATOM 3483 C PRO B 97 38.634 -1.496 1.176 1.00 0.00 C ATOM 3484 O PRO B 97 38.107 -1.922 2.201 1.00 0.00 O ATOM 3485 CB PRO B 97 38.423 0.948 0.654 1.00 0.00 C ATOM 3486 CG PRO B 97 37.226 1.818 0.494 1.00 0.00 C ATOM 3487 CD PRO B 97 36.046 0.975 0.891 1.00 0.00 C ATOM 0 HA PRO B 97 38.135 -0.752 -0.720 1.00 0.00 H new ATOM 0 HB2 PRO B 97 38.812 0.993 1.671 1.00 0.00 H new ATOM 0 HB3 PRO B 97 39.230 1.258 -0.010 1.00 0.00 H new ATOM 0 HG2 PRO B 97 37.301 2.705 1.123 1.00 0.00 H new ATOM 0 HG3 PRO B 97 37.130 2.164 -0.535 1.00 0.00 H new ATOM 0 HD2 PRO B 97 35.802 1.097 1.946 1.00 0.00 H new ATOM 0 HD3 PRO B 97 35.153 1.240 0.324 1.00 0.00 H new ATOM 3495 N ASP B 98 39.827 -1.900 0.756 1.00 0.00 N ATOM 3496 CA ASP B 98 40.599 -2.890 1.499 1.00 0.00 C ATOM 3497 C ASP B 98 40.709 -2.501 2.970 1.00 0.00 C ATOM 3498 O ASP B 98 41.144 -1.397 3.298 1.00 0.00 O ATOM 3499 CB ASP B 98 41.996 -3.040 0.895 1.00 0.00 C ATOM 3500 CG ASP B 98 42.732 -1.717 0.802 1.00 0.00 C ATOM 3501 OD1 ASP B 98 42.070 -0.662 0.889 1.00 0.00 O ATOM 3502 OD2 ASP B 98 43.971 -1.737 0.643 1.00 0.00 O ATOM 0 H ASP B 98 40.280 -1.559 -0.092 1.00 0.00 H new ATOM 0 HA ASP B 98 40.078 -3.845 1.430 1.00 0.00 H new ATOM 0 HB2 ASP B 98 42.578 -3.734 1.501 1.00 0.00 H new ATOM 0 HB3 ASP B 98 41.913 -3.477 -0.100 1.00 0.00 H new ATOM 3507 N GLY B 99 40.308 -3.410 3.853 1.00 0.00 N ATOM 3508 CA GLY B 99 40.366 -3.135 5.275 1.00 0.00 C ATOM 3509 C GLY B 99 39.699 -1.822 5.632 1.00 0.00 C ATOM 3510 O GLY B 99 40.208 -1.062 6.458 1.00 0.00 O ATOM 0 H GLY B 99 39.944 -4.331 3.608 1.00 0.00 H new ATOM 0 HA2 GLY B 99 39.883 -3.946 5.820 1.00 0.00 H new ATOM 0 HA3 GLY B 99 41.407 -3.111 5.596 1.00 0.00 H new ATOM 3514 N ALA B 100 38.560 -1.554 5.005 1.00 0.00 N ATOM 3515 CA ALA B 100 37.820 -0.323 5.253 1.00 0.00 C ATOM 3516 C ALA B 100 37.269 -0.284 6.672 1.00 0.00 C ATOM 3517 O ALA B 100 36.848 -1.305 7.215 1.00 0.00 O ATOM 3518 CB ALA B 100 36.690 -0.175 4.244 1.00 0.00 C ATOM 0 H ALA B 100 38.128 -2.174 4.320 1.00 0.00 H new ATOM 0 HA ALA B 100 38.511 0.513 5.139 1.00 0.00 H new ATOM 0 HB1 ALA B 100 36.145 0.748 4.441 1.00 0.00 H new ATOM 0 HB2 ALA B 100 37.104 -0.145 3.236 1.00 0.00 H new ATOM 0 HB3 ALA B 100 36.010 -1.023 4.332 1.00 0.00 H new ATOM 3524 N ALA B 101 37.274 0.904 7.269 1.00 0.00 N ATOM 3525 CA ALA B 101 36.773 1.082 8.625 1.00 0.00 C ATOM 3526 C ALA B 101 35.359 0.543 8.766 1.00 0.00 C ATOM 3527 O ALA B 101 34.669 0.302 7.775 1.00 0.00 O ATOM 3528 CB ALA B 101 36.811 2.550 9.018 1.00 0.00 C ATOM 0 H ALA B 101 37.620 1.758 6.833 1.00 0.00 H new ATOM 0 HA ALA B 101 37.422 0.517 9.295 1.00 0.00 H new ATOM 0 HB1 ALA B 101 36.433 2.665 10.034 1.00 0.00 H new ATOM 0 HB2 ALA B 101 37.838 2.913 8.969 1.00 0.00 H new ATOM 0 HB3 ALA B 101 36.190 3.126 8.333 1.00 0.00 H new ATOM 3534 N LYS B 102 34.935 0.365 10.007 1.00 0.00 N ATOM 3535 CA LYS B 102 33.597 -0.138 10.292 1.00 0.00 C ATOM 3536 C LYS B 102 32.605 1.009 10.384 1.00 0.00 C ATOM 3537 O LYS B 102 32.098 1.330 11.458 1.00 0.00 O ATOM 3538 CB LYS B 102 33.591 -0.948 11.590 1.00 0.00 C ATOM 3539 CG LYS B 102 34.281 -0.247 12.749 1.00 0.00 C ATOM 3540 CD LYS B 102 33.535 -0.468 14.055 1.00 0.00 C ATOM 3541 CE LYS B 102 33.773 0.670 15.034 1.00 0.00 C ATOM 3542 NZ LYS B 102 33.253 0.351 16.393 1.00 0.00 N ATOM 0 H LYS B 102 35.497 0.561 10.835 1.00 0.00 H new ATOM 0 HA LYS B 102 33.297 -0.793 9.474 1.00 0.00 H new ATOM 0 HB2 LYS B 102 32.560 -1.163 11.869 1.00 0.00 H new ATOM 0 HB3 LYS B 102 34.080 -1.906 11.413 1.00 0.00 H new ATOM 0 HG2 LYS B 102 35.302 -0.617 12.844 1.00 0.00 H new ATOM 0 HG3 LYS B 102 34.347 0.821 12.542 1.00 0.00 H new ATOM 0 HD2 LYS B 102 32.468 -0.559 13.854 1.00 0.00 H new ATOM 0 HD3 LYS B 102 33.856 -1.408 14.504 1.00 0.00 H new ATOM 0 HE2 LYS B 102 34.841 0.880 15.094 1.00 0.00 H new ATOM 0 HE3 LYS B 102 33.290 1.575 14.664 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 33.435 1.152 17.031 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 32.229 0.175 16.341 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 33.732 -0.497 16.757 1.00 0.00 H new ATOM 3556 N GLN B 103 32.335 1.621 9.240 1.00 0.00 N ATOM 3557 CA GLN B 103 31.402 2.739 9.167 1.00 0.00 C ATOM 3558 C GLN B 103 31.295 3.263 7.739 1.00 0.00 C ATOM 3559 O GLN B 103 32.298 3.391 7.036 1.00 0.00 O ATOM 3560 CB GLN B 103 31.847 3.864 10.103 1.00 0.00 C ATOM 3561 CG GLN B 103 30.728 4.406 10.976 1.00 0.00 C ATOM 3562 CD GLN B 103 30.069 5.637 10.383 1.00 0.00 C ATOM 3563 OE1 GLN B 103 30.703 6.409 9.663 1.00 0.00 O ATOM 3564 NE2 GLN B 103 28.790 5.827 10.686 1.00 0.00 N ATOM 0 H GLN B 103 32.750 1.362 8.345 1.00 0.00 H new ATOM 0 HA GLN B 103 30.421 2.383 9.480 1.00 0.00 H new ATOM 0 HB2 GLN B 103 32.650 3.497 10.742 1.00 0.00 H new ATOM 0 HB3 GLN B 103 32.260 4.679 9.508 1.00 0.00 H new ATOM 0 HG2 GLN B 103 29.976 3.630 11.120 1.00 0.00 H new ATOM 0 HG3 GLN B 103 31.126 4.651 11.961 1.00 0.00 H new ATOM 0 HE21 GLN B 103 28.304 5.161 11.287 1.00 0.00 H new ATOM 0 HE22 GLN B 103 28.294 6.639 10.318 1.00 0.00 H new ATOM 3573 N PHE B 104 30.072 3.566 7.316 1.00 0.00 N ATOM 3574 CA PHE B 104 29.832 4.076 5.972 1.00 0.00 C ATOM 3575 C PHE B 104 30.671 5.320 5.702 1.00 0.00 C ATOM 3576 O PHE B 104 30.920 6.122 6.603 1.00 0.00 O ATOM 3577 CB PHE B 104 28.348 4.398 5.785 1.00 0.00 C ATOM 3578 CG PHE B 104 28.024 4.984 4.439 1.00 0.00 C ATOM 3579 CD1 PHE B 104 28.274 6.321 4.173 1.00 0.00 C ATOM 3580 CD2 PHE B 104 27.471 4.197 3.442 1.00 0.00 C ATOM 3581 CE1 PHE B 104 27.977 6.861 2.936 1.00 0.00 C ATOM 3582 CE2 PHE B 104 27.171 4.733 2.203 1.00 0.00 C ATOM 3583 CZ PHE B 104 27.425 6.067 1.951 1.00 0.00 C ATOM 0 H PHE B 104 29.232 3.467 7.885 1.00 0.00 H new ATOM 0 HA PHE B 104 30.123 3.303 5.261 1.00 0.00 H new ATOM 0 HB2 PHE B 104 27.767 3.487 5.925 1.00 0.00 H new ATOM 0 HB3 PHE B 104 28.036 5.097 6.561 1.00 0.00 H new ATOM 0 HD1 PHE B 104 28.705 6.947 4.940 1.00 0.00 H new ATOM 0 HD2 PHE B 104 27.272 3.153 3.635 1.00 0.00 H new ATOM 0 HE1 PHE B 104 28.177 7.904 2.740 1.00 0.00 H new ATOM 0 HE2 PHE B 104 26.739 4.110 1.434 1.00 0.00 H new ATOM 0 HZ PHE B 104 27.192 6.488 0.984 1.00 0.00 H new ATOM 3593 N ARG B 105 31.104 5.475 4.456 1.00 0.00 N ATOM 3594 CA ARG B 105 31.917 6.622 4.064 1.00 0.00 C ATOM 3595 C ARG B 105 31.378 7.260 2.788 1.00 0.00 C ATOM 3596 O ARG B 105 30.784 6.585 1.948 1.00 0.00 O ATOM 3597 CB ARG B 105 33.373 6.196 3.862 1.00 0.00 C ATOM 3598 CG ARG B 105 34.119 5.944 5.163 1.00 0.00 C ATOM 3599 CD ARG B 105 34.573 7.244 5.806 1.00 0.00 C ATOM 3600 NE ARG B 105 35.960 7.178 6.257 1.00 0.00 N ATOM 3601 CZ ARG B 105 36.676 8.244 6.594 1.00 0.00 C ATOM 3602 NH1 ARG B 105 36.139 9.455 6.531 1.00 0.00 N ATOM 3603 NH2 ARG B 105 37.933 8.100 6.994 1.00 0.00 N ATOM 0 H ARG B 105 30.906 4.821 3.699 1.00 0.00 H new ATOM 0 HA ARG B 105 31.870 7.360 4.864 1.00 0.00 H new ATOM 0 HB2 ARG B 105 33.397 5.289 3.257 1.00 0.00 H new ATOM 0 HB3 ARG B 105 33.894 6.969 3.298 1.00 0.00 H new ATOM 0 HG2 ARG B 105 33.474 5.401 5.854 1.00 0.00 H new ATOM 0 HG3 ARG B 105 34.985 5.310 4.970 1.00 0.00 H new ATOM 0 HD2 ARG B 105 34.463 8.059 5.091 1.00 0.00 H new ATOM 0 HD3 ARG B 105 33.927 7.474 6.653 1.00 0.00 H new ATOM 0 HE ARG B 105 36.404 6.262 6.317 1.00 0.00 H new ATOM 0 HH11 ARG B 105 35.173 9.569 6.223 1.00 0.00 H new ATOM 0 HH12 ARG B 105 36.692 10.272 6.791 1.00 0.00 H new ATOM 0 HH21 ARG B 105 38.349 7.170 7.043 1.00 0.00 H new ATOM 0 HH22 ARG B 105 38.483 8.919 7.253 1.00 0.00 H new ATOM 3617 N ARG B 106 31.591 8.565 2.650 1.00 0.00 N ATOM 3618 CA ARG B 106 31.127 9.296 1.476 1.00 0.00 C ATOM 3619 C ARG B 106 32.170 9.262 0.363 1.00 0.00 C ATOM 3620 O ARG B 106 31.838 9.393 -0.814 1.00 0.00 O ATOM 3621 CB ARG B 106 30.808 10.746 1.847 1.00 0.00 C ATOM 3622 CG ARG B 106 29.849 11.425 0.881 1.00 0.00 C ATOM 3623 CD ARG B 106 30.077 12.926 0.832 1.00 0.00 C ATOM 3624 NE ARG B 106 30.673 13.350 -0.432 1.00 0.00 N ATOM 3625 CZ ARG B 106 31.312 14.503 -0.594 1.00 0.00 C ATOM 3626 NH1 ARG B 106 31.440 15.342 0.425 1.00 0.00 N ATOM 3627 NH2 ARG B 106 31.826 14.819 -1.776 1.00 0.00 N ATOM 0 H ARG B 106 32.082 9.138 3.337 1.00 0.00 H new ATOM 0 HA ARG B 106 30.221 8.811 1.113 1.00 0.00 H new ATOM 0 HB2 ARG B 106 30.379 10.770 2.849 1.00 0.00 H new ATOM 0 HB3 ARG B 106 31.737 11.315 1.884 1.00 0.00 H new ATOM 0 HG2 ARG B 106 29.977 11.004 -0.116 1.00 0.00 H new ATOM 0 HG3 ARG B 106 28.822 11.222 1.184 1.00 0.00 H new ATOM 0 HD2 ARG B 106 29.127 13.441 0.975 1.00 0.00 H new ATOM 0 HD3 ARG B 106 30.727 13.221 1.656 1.00 0.00 H new ATOM 0 HE ARG B 106 30.594 12.726 -1.235 1.00 0.00 H new ATOM 0 HH11 ARG B 106 31.047 15.102 1.335 1.00 0.00 H new ATOM 0 HH12 ARG B 106 31.931 16.227 0.298 1.00 0.00 H new ATOM 0 HH21 ARG B 106 31.731 14.176 -2.562 1.00 0.00 H new ATOM 0 HH22 ARG B 106 32.316 15.705 -1.898 1.00 0.00 H new ATOM 3641 N GLU B 107 33.430 9.087 0.746 1.00 0.00 N ATOM 3642 CA GLU B 107 34.523 9.038 -0.221 1.00 0.00 C ATOM 3643 C GLU B 107 34.589 7.681 -0.922 1.00 0.00 C ATOM 3644 O GLU B 107 35.251 7.539 -1.950 1.00 0.00 O ATOM 3645 CB GLU B 107 35.855 9.333 0.470 1.00 0.00 C ATOM 3646 CG GLU B 107 36.496 10.634 0.017 1.00 0.00 C ATOM 3647 CD GLU B 107 37.834 10.889 0.684 1.00 0.00 C ATOM 3648 OE1 GLU B 107 37.840 11.392 1.827 1.00 0.00 O ATOM 3649 OE2 GLU B 107 38.874 10.585 0.064 1.00 0.00 O ATOM 0 H GLU B 107 33.721 8.977 1.717 1.00 0.00 H new ATOM 0 HA GLU B 107 34.332 9.800 -0.977 1.00 0.00 H new ATOM 0 HB2 GLU B 107 35.696 9.371 1.548 1.00 0.00 H new ATOM 0 HB3 GLU B 107 36.545 8.511 0.279 1.00 0.00 H new ATOM 0 HG2 GLU B 107 36.632 10.610 -1.064 1.00 0.00 H new ATOM 0 HG3 GLU B 107 35.822 11.462 0.235 1.00 0.00 H new ATOM 3656 N TRP B 108 33.902 6.686 -0.365 1.00 0.00 N ATOM 3657 CA TRP B 108 33.890 5.348 -0.944 1.00 0.00 C ATOM 3658 C TRP B 108 33.437 5.380 -2.404 1.00 0.00 C ATOM 3659 O TRP B 108 33.707 4.450 -3.165 1.00 0.00 O ATOM 3660 CB TRP B 108 32.973 4.429 -0.136 1.00 0.00 C ATOM 3661 CG TRP B 108 33.623 3.871 1.094 1.00 0.00 C ATOM 3662 CD1 TRP B 108 34.940 3.969 1.440 1.00 0.00 C ATOM 3663 CD2 TRP B 108 32.987 3.127 2.139 1.00 0.00 C ATOM 3664 NE1 TRP B 108 35.162 3.332 2.637 1.00 0.00 N ATOM 3665 CE2 TRP B 108 33.977 2.807 3.085 1.00 0.00 C ATOM 3666 CE3 TRP B 108 31.675 2.701 2.366 1.00 0.00 C ATOM 3667 CZ2 TRP B 108 33.697 2.080 4.240 1.00 0.00 C ATOM 3668 CZ3 TRP B 108 31.397 1.981 3.512 1.00 0.00 C ATOM 3669 CH2 TRP B 108 32.405 1.676 4.436 1.00 0.00 C ATOM 0 H TRP B 108 33.347 6.783 0.486 1.00 0.00 H new ATOM 0 HA TRP B 108 34.908 4.961 -0.910 1.00 0.00 H new ATOM 0 HB2 TRP B 108 32.080 4.983 0.153 1.00 0.00 H new ATOM 0 HB3 TRP B 108 32.646 3.605 -0.771 1.00 0.00 H new ATOM 0 HD1 TRP B 108 35.697 4.474 0.858 1.00 0.00 H new ATOM 0 HE1 TRP B 108 36.061 3.261 3.114 1.00 0.00 H new ATOM 0 HE3 TRP B 108 30.892 2.931 1.658 1.00 0.00 H new ATOM 0 HZ2 TRP B 108 34.472 1.844 4.954 1.00 0.00 H new ATOM 0 HZ3 TRP B 108 30.387 1.648 3.698 1.00 0.00 H new ATOM 0 HH2 TRP B 108 32.157 1.110 5.322 1.00 0.00 H new ATOM 3680 N PHE B 109 32.747 6.451 -2.790 1.00 0.00 N ATOM 3681 CA PHE B 109 32.261 6.593 -4.158 1.00 0.00 C ATOM 3682 C PHE B 109 33.229 7.415 -5.002 1.00 0.00 C ATOM 3683 O PHE B 109 32.811 8.226 -5.829 1.00 0.00 O ATOM 3684 CB PHE B 109 30.880 7.251 -4.162 1.00 0.00 C ATOM 3685 CG PHE B 109 29.820 6.425 -3.493 1.00 0.00 C ATOM 3686 CD1 PHE B 109 29.720 6.388 -2.111 1.00 0.00 C ATOM 3687 CD2 PHE B 109 28.921 5.685 -4.246 1.00 0.00 C ATOM 3688 CE1 PHE B 109 28.745 5.629 -1.494 1.00 0.00 C ATOM 3689 CE2 PHE B 109 27.944 4.925 -3.634 1.00 0.00 C ATOM 3690 CZ PHE B 109 27.855 4.896 -2.256 1.00 0.00 C ATOM 0 H PHE B 109 32.513 7.231 -2.176 1.00 0.00 H new ATOM 0 HA PHE B 109 32.186 5.597 -4.594 1.00 0.00 H new ATOM 0 HB2 PHE B 109 30.946 8.217 -3.662 1.00 0.00 H new ATOM 0 HB3 PHE B 109 30.582 7.445 -5.192 1.00 0.00 H new ATOM 0 HD1 PHE B 109 30.412 6.959 -1.510 1.00 0.00 H new ATOM 0 HD2 PHE B 109 28.986 5.703 -5.324 1.00 0.00 H new ATOM 0 HE1 PHE B 109 28.678 5.608 -0.416 1.00 0.00 H new ATOM 0 HE2 PHE B 109 27.250 4.354 -4.232 1.00 0.00 H new ATOM 0 HZ PHE B 109 27.092 4.302 -1.775 1.00 0.00 H new ATOM 3700 N GLN B 110 34.522 7.200 -4.791 1.00 0.00 N ATOM 3701 CA GLN B 110 35.548 7.923 -5.536 1.00 0.00 C ATOM 3702 C GLN B 110 36.854 7.137 -5.564 1.00 0.00 C ATOM 3703 O GLN B 110 37.938 7.717 -5.615 1.00 0.00 O ATOM 3704 CB GLN B 110 35.780 9.302 -4.917 1.00 0.00 C ATOM 3705 CG GLN B 110 34.663 10.292 -5.205 1.00 0.00 C ATOM 3706 CD GLN B 110 34.940 11.667 -4.630 1.00 0.00 C ATOM 3707 OE1 GLN B 110 34.186 12.167 -3.796 1.00 0.00 O ATOM 3708 NE2 GLN B 110 36.027 12.286 -5.075 1.00 0.00 N ATOM 0 H GLN B 110 34.886 6.532 -4.111 1.00 0.00 H new ATOM 0 HA GLN B 110 35.199 8.048 -6.561 1.00 0.00 H new ATOM 0 HB2 GLN B 110 35.889 9.193 -3.838 1.00 0.00 H new ATOM 0 HB3 GLN B 110 36.719 9.707 -5.293 1.00 0.00 H new ATOM 0 HG2 GLN B 110 34.524 10.374 -6.283 1.00 0.00 H new ATOM 0 HG3 GLN B 110 33.729 9.911 -4.792 1.00 0.00 H new ATOM 0 HE21 GLN B 110 36.624 11.834 -5.767 1.00 0.00 H new ATOM 0 HE22 GLN B 110 36.265 13.214 -4.725 1.00 0.00 H new ATOM 3717 N GLY B 111 36.743 5.813 -5.529 1.00 0.00 N ATOM 3718 CA GLY B 111 37.923 4.969 -5.550 1.00 0.00 C ATOM 3719 C GLY B 111 37.793 3.813 -6.523 1.00 0.00 C ATOM 3720 O GLY B 111 37.042 3.893 -7.496 1.00 0.00 O ATOM 0 H GLY B 111 35.857 5.310 -5.486 1.00 0.00 H new ATOM 0 HA2 GLY B 111 38.791 5.570 -5.819 1.00 0.00 H new ATOM 0 HA3 GLY B 111 38.104 4.578 -4.549 1.00 0.00 H new ATOM 3724 N ASP B 112 38.529 2.738 -6.261 1.00 0.00 N ATOM 3725 CA ASP B 112 38.495 1.559 -7.119 1.00 0.00 C ATOM 3726 C ASP B 112 37.288 0.685 -6.797 1.00 0.00 C ATOM 3727 O ASP B 112 36.760 0.722 -5.686 1.00 0.00 O ATOM 3728 CB ASP B 112 39.783 0.750 -6.960 1.00 0.00 C ATOM 3729 CG ASP B 112 40.755 0.981 -8.101 1.00 0.00 C ATOM 3730 OD1 ASP B 112 40.611 2.002 -8.805 1.00 0.00 O ATOM 3731 OD2 ASP B 112 41.658 0.140 -8.290 1.00 0.00 O ATOM 0 H ASP B 112 39.157 2.659 -5.461 1.00 0.00 H new ATOM 0 HA ASP B 112 38.411 1.895 -8.152 1.00 0.00 H new ATOM 0 HB2 ASP B 112 40.262 1.017 -6.018 1.00 0.00 H new ATOM 0 HB3 ASP B 112 39.538 -0.311 -6.904 1.00 0.00 H new ATOM 3736 N GLY B 113 36.858 -0.100 -7.778 1.00 0.00 N ATOM 3737 CA GLY B 113 35.719 -0.973 -7.583 1.00 0.00 C ATOM 3738 C GLY B 113 34.544 -0.600 -8.466 1.00 0.00 C ATOM 3739 O GLY B 113 34.719 0.027 -9.511 1.00 0.00 O ATOM 0 H GLY B 113 37.279 -0.146 -8.706 1.00 0.00 H new ATOM 0 HA2 GLY B 113 36.014 -2.002 -7.791 1.00 0.00 H new ATOM 0 HA3 GLY B 113 35.411 -0.935 -6.538 1.00 0.00 H new ATOM 3743 N MET B 114 33.344 -0.987 -8.046 1.00 0.00 N ATOM 3744 CA MET B 114 32.135 -0.689 -8.807 1.00 0.00 C ATOM 3745 C MET B 114 31.001 -0.260 -7.881 1.00 0.00 C ATOM 3746 O MET B 114 30.900 -0.731 -6.749 1.00 0.00 O ATOM 3747 CB MET B 114 31.709 -1.909 -9.625 1.00 0.00 C ATOM 3748 CG MET B 114 32.300 -1.941 -11.025 1.00 0.00 C ATOM 3749 SD MET B 114 32.945 -3.564 -11.471 1.00 0.00 S ATOM 3750 CE MET B 114 33.407 -3.289 -13.179 1.00 0.00 C ATOM 0 H MET B 114 33.182 -1.507 -7.184 1.00 0.00 H new ATOM 0 HA MET B 114 32.356 0.135 -9.486 1.00 0.00 H new ATOM 0 HB2 MET B 114 32.006 -2.813 -9.094 1.00 0.00 H new ATOM 0 HB3 MET B 114 30.622 -1.925 -9.698 1.00 0.00 H new ATOM 0 HG2 MET B 114 31.535 -1.648 -11.744 1.00 0.00 H new ATOM 0 HG3 MET B 114 33.101 -1.205 -11.094 1.00 0.00 H new ATOM 0 HE1 MET B 114 33.824 -4.206 -13.595 1.00 0.00 H new ATOM 0 HE2 MET B 114 32.526 -2.998 -13.752 1.00 0.00 H new ATOM 0 HE3 MET B 114 34.152 -2.495 -13.231 1.00 0.00 H new ATOM 3760 N VAL B 115 30.151 0.637 -8.370 1.00 0.00 N ATOM 3761 CA VAL B 115 29.025 1.129 -7.586 1.00 0.00 C ATOM 3762 C VAL B 115 27.704 0.877 -8.303 1.00 0.00 C ATOM 3763 O VAL B 115 27.555 1.199 -9.482 1.00 0.00 O ATOM 3764 CB VAL B 115 29.157 2.637 -7.298 1.00 0.00 C ATOM 3765 CG1 VAL B 115 28.066 3.098 -6.345 1.00 0.00 C ATOM 3766 CG2 VAL B 115 30.536 2.956 -6.739 1.00 0.00 C ATOM 0 H VAL B 115 30.221 1.038 -9.305 1.00 0.00 H new ATOM 0 HA VAL B 115 29.035 0.583 -6.643 1.00 0.00 H new ATOM 0 HB VAL B 115 29.037 3.178 -8.236 1.00 0.00 H new ATOM 0 HG11 VAL B 115 28.177 4.165 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL B 115 27.090 2.908 -6.791 1.00 0.00 H new ATOM 0 HG13 VAL B 115 28.148 2.551 -5.406 1.00 0.00 H new ATOM 0 HG21 VAL B 115 30.610 4.025 -6.542 1.00 0.00 H new ATOM 0 HG22 VAL B 115 30.689 2.405 -5.811 1.00 0.00 H new ATOM 0 HG23 VAL B 115 31.298 2.667 -7.463 1.00 0.00 H new ATOM 3776 N ARG B 116 26.744 0.302 -7.585 1.00 0.00 N ATOM 3777 CA ARG B 116 25.435 0.012 -8.157 1.00 0.00 C ATOM 3778 C ARG B 116 24.402 1.031 -7.686 1.00 0.00 C ATOM 3779 O ARG B 116 24.377 1.404 -6.513 1.00 0.00 O ATOM 3780 CB ARG B 116 24.988 -1.401 -7.777 1.00 0.00 C ATOM 3781 CG ARG B 116 25.305 -2.444 -8.837 1.00 0.00 C ATOM 3782 CD ARG B 116 24.298 -3.582 -8.818 1.00 0.00 C ATOM 3783 NE ARG B 116 24.313 -4.348 -10.062 1.00 0.00 N ATOM 3784 CZ ARG B 116 23.391 -5.250 -10.382 1.00 0.00 C ATOM 3785 NH1 ARG B 116 22.384 -5.493 -9.554 1.00 0.00 N ATOM 3786 NH2 ARG B 116 23.473 -5.906 -11.531 1.00 0.00 N ATOM 0 H ARG B 116 26.848 0.028 -6.608 1.00 0.00 H new ATOM 0 HA ARG B 116 25.516 0.077 -9.242 1.00 0.00 H new ATOM 0 HB2 ARG B 116 25.470 -1.687 -6.842 1.00 0.00 H new ATOM 0 HB3 ARG B 116 23.914 -1.396 -7.593 1.00 0.00 H new ATOM 0 HG2 ARG B 116 25.307 -1.975 -9.821 1.00 0.00 H new ATOM 0 HG3 ARG B 116 26.307 -2.840 -8.671 1.00 0.00 H new ATOM 0 HD2 ARG B 116 24.517 -4.245 -7.981 1.00 0.00 H new ATOM 0 HD3 ARG B 116 23.299 -3.179 -8.653 1.00 0.00 H new ATOM 0 HE ARG B 116 25.073 -4.181 -10.721 1.00 0.00 H new ATOM 0 HH11 ARG B 116 22.317 -4.987 -8.671 1.00 0.00 H new ATOM 0 HH12 ARG B 116 21.677 -6.185 -9.800 1.00 0.00 H new ATOM 0 HH21 ARG B 116 24.245 -5.719 -12.171 1.00 0.00 H new ATOM 0 HH22 ARG B 116 22.764 -6.598 -11.775 1.00 0.00 H new ATOM 3800 N ARG B 117 23.557 1.483 -8.608 1.00 0.00 N ATOM 3801 CA ARG B 117 22.529 2.465 -8.281 1.00 0.00 C ATOM 3802 C ARG B 117 21.163 2.039 -8.811 1.00 0.00 C ATOM 3803 O ARG B 117 20.875 2.175 -9.999 1.00 0.00 O ATOM 3804 CB ARG B 117 22.903 3.833 -8.852 1.00 0.00 C ATOM 3805 CG ARG B 117 23.402 3.777 -10.286 1.00 0.00 C ATOM 3806 CD ARG B 117 23.224 5.113 -10.991 1.00 0.00 C ATOM 3807 NE ARG B 117 23.788 6.217 -10.218 1.00 0.00 N ATOM 3808 CZ ARG B 117 23.593 7.497 -10.517 1.00 0.00 C ATOM 3809 NH1 ARG B 117 22.852 7.831 -11.565 1.00 0.00 N ATOM 3810 NH2 ARG B 117 24.141 8.446 -9.767 1.00 0.00 N ATOM 0 H ARG B 117 23.564 1.186 -9.584 1.00 0.00 H new ATOM 0 HA ARG B 117 22.467 2.531 -7.195 1.00 0.00 H new ATOM 0 HB2 ARG B 117 22.033 4.488 -8.804 1.00 0.00 H new ATOM 0 HB3 ARG B 117 23.674 4.281 -8.225 1.00 0.00 H new ATOM 0 HG2 ARG B 117 24.455 3.497 -10.295 1.00 0.00 H new ATOM 0 HG3 ARG B 117 22.862 3.002 -10.830 1.00 0.00 H new ATOM 0 HD2 ARG B 117 23.702 5.074 -11.970 1.00 0.00 H new ATOM 0 HD3 ARG B 117 22.163 5.295 -11.162 1.00 0.00 H new ATOM 0 HE ARG B 117 24.362 5.993 -9.405 1.00 0.00 H new ATOM 0 HH11 ARG B 117 22.430 7.105 -12.144 1.00 0.00 H new ATOM 0 HH12 ARG B 117 22.704 8.814 -11.792 1.00 0.00 H new ATOM 0 HH21 ARG B 117 24.712 8.193 -8.961 1.00 0.00 H new ATOM 0 HH22 ARG B 117 23.991 9.428 -9.997 1.00 0.00 H new ATOM 3824 N LYS B 118 20.325 1.530 -7.914 1.00 0.00 N ATOM 3825 CA LYS B 118 18.983 1.091 -8.275 1.00 0.00 C ATOM 3826 C LYS B 118 17.968 2.187 -7.992 1.00 0.00 C ATOM 3827 O LYS B 118 18.287 3.202 -7.377 1.00 0.00 O ATOM 3828 CB LYS B 118 18.614 -0.176 -7.502 1.00 0.00 C ATOM 3829 CG LYS B 118 17.723 -1.128 -8.282 1.00 0.00 C ATOM 3830 CD LYS B 118 18.217 -2.563 -8.182 1.00 0.00 C ATOM 3831 CE LYS B 118 17.705 -3.241 -6.921 1.00 0.00 C ATOM 3832 NZ LYS B 118 16.298 -3.704 -7.070 1.00 0.00 N ATOM 0 H LYS B 118 20.554 1.411 -6.927 1.00 0.00 H new ATOM 0 HA LYS B 118 18.969 0.871 -9.342 1.00 0.00 H new ATOM 0 HB2 LYS B 118 19.528 -0.698 -7.219 1.00 0.00 H new ATOM 0 HB3 LYS B 118 18.109 0.106 -6.578 1.00 0.00 H new ATOM 0 HG2 LYS B 118 16.703 -1.066 -7.903 1.00 0.00 H new ATOM 0 HG3 LYS B 118 17.693 -0.825 -9.329 1.00 0.00 H new ATOM 0 HD2 LYS B 118 17.889 -3.124 -9.057 1.00 0.00 H new ATOM 0 HD3 LYS B 118 19.307 -2.575 -8.186 1.00 0.00 H new ATOM 0 HE2 LYS B 118 18.343 -4.092 -6.682 1.00 0.00 H new ATOM 0 HE3 LYS B 118 17.772 -2.547 -6.083 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 16.145 -4.546 -6.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 15.650 -2.948 -6.770 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 16.115 -3.942 -8.066 1.00 0.00 H new ATOM 3846 N ASN B 119 16.748 1.974 -8.451 1.00 0.00 N ATOM 3847 CA ASN B 119 15.679 2.947 -8.250 1.00 0.00 C ATOM 3848 C ASN B 119 14.347 2.250 -7.991 1.00 0.00 C ATOM 3849 O ASN B 119 13.886 1.448 -8.802 1.00 0.00 O ATOM 3850 CB ASN B 119 15.559 3.864 -9.467 1.00 0.00 C ATOM 3851 CG ASN B 119 16.822 4.664 -9.716 1.00 0.00 C ATOM 3852 OD1 ASN B 119 16.874 5.864 -9.446 1.00 0.00 O ATOM 3853 ND2 ASN B 119 17.850 4.002 -10.233 1.00 0.00 N ATOM 0 H ASN B 119 16.469 1.139 -8.965 1.00 0.00 H new ATOM 0 HA ASN B 119 15.930 3.547 -7.375 1.00 0.00 H new ATOM 0 HB2 ASN B 119 15.332 3.265 -10.349 1.00 0.00 H new ATOM 0 HB3 ASN B 119 14.722 4.547 -9.322 1.00 0.00 H new ATOM 0 HD21 ASN B 119 18.727 4.488 -10.422 1.00 0.00 H new ATOM 0 HD22 ASN B 119 17.763 3.007 -10.442 1.00 0.00 H new ATOM 3860 N LEU B 120 13.732 2.566 -6.854 1.00 0.00 N ATOM 3861 CA LEU B 120 12.450 1.976 -6.486 1.00 0.00 C ATOM 3862 C LEU B 120 11.303 2.935 -6.805 1.00 0.00 C ATOM 3863 O LEU B 120 11.113 3.936 -6.112 1.00 0.00 O ATOM 3864 CB LEU B 120 12.440 1.626 -4.997 1.00 0.00 C ATOM 3865 CG LEU B 120 13.102 0.293 -4.642 1.00 0.00 C ATOM 3866 CD1 LEU B 120 14.607 0.465 -4.509 1.00 0.00 C ATOM 3867 CD2 LEU B 120 12.512 -0.269 -3.358 1.00 0.00 C ATOM 0 H LEU B 120 14.102 3.228 -6.172 1.00 0.00 H new ATOM 0 HA LEU B 120 12.311 1.065 -7.068 1.00 0.00 H new ATOM 0 HB2 LEU B 120 12.944 2.422 -4.449 1.00 0.00 H new ATOM 0 HB3 LEU B 120 11.407 1.605 -4.651 1.00 0.00 H new ATOM 0 HG LEU B 120 12.907 -0.415 -5.448 1.00 0.00 H new ATOM 0 HD11 LEU B 120 15.062 -0.493 -4.256 1.00 0.00 H new ATOM 0 HD12 LEU B 120 15.017 0.824 -5.453 1.00 0.00 H new ATOM 0 HD13 LEU B 120 14.822 1.188 -3.722 1.00 0.00 H new ATOM 0 HD21 LEU B 120 12.994 -1.217 -3.120 1.00 0.00 H new ATOM 0 HD22 LEU B 120 12.676 0.436 -2.543 1.00 0.00 H new ATOM 0 HD23 LEU B 120 11.442 -0.429 -3.489 1.00 0.00 H new ATOM 3879 N PRO B 121 10.523 2.652 -7.865 1.00 0.00 N ATOM 3880 CA PRO B 121 9.400 3.505 -8.271 1.00 0.00 C ATOM 3881 C PRO B 121 8.339 3.643 -7.182 1.00 0.00 C ATOM 3882 O PRO B 121 7.988 2.671 -6.511 1.00 0.00 O ATOM 3883 CB PRO B 121 8.813 2.782 -9.490 1.00 0.00 C ATOM 3884 CG PRO B 121 9.902 1.889 -9.974 1.00 0.00 C ATOM 3885 CD PRO B 121 10.678 1.488 -8.754 1.00 0.00 C ATOM 0 HA PRO B 121 9.730 4.523 -8.478 1.00 0.00 H new ATOM 0 HB2 PRO B 121 7.925 2.210 -9.219 1.00 0.00 H new ATOM 0 HB3 PRO B 121 8.512 3.491 -10.262 1.00 0.00 H new ATOM 0 HG2 PRO B 121 9.494 1.015 -10.482 1.00 0.00 H new ATOM 0 HG3 PRO B 121 10.541 2.405 -10.691 1.00 0.00 H new ATOM 0 HD2 PRO B 121 10.279 0.580 -8.303 1.00 0.00 H new ATOM 0 HD3 PRO B 121 11.725 1.295 -8.987 1.00 0.00 H new ATOM 3893 N ILE B 122 7.826 4.860 -7.021 1.00 0.00 N ATOM 3894 CA ILE B 122 6.798 5.133 -6.024 1.00 0.00 C ATOM 3895 C ILE B 122 5.467 5.450 -6.701 1.00 0.00 C ATOM 3896 O ILE B 122 5.438 5.958 -7.820 1.00 0.00 O ATOM 3897 CB ILE B 122 7.191 6.312 -5.109 1.00 0.00 C ATOM 3898 CG1 ILE B 122 8.692 6.287 -4.814 1.00 0.00 C ATOM 3899 CG2 ILE B 122 6.392 6.267 -3.816 1.00 0.00 C ATOM 3900 CD1 ILE B 122 9.117 5.130 -3.935 1.00 0.00 C ATOM 0 H ILE B 122 8.107 5.673 -7.570 1.00 0.00 H new ATOM 0 HA ILE B 122 6.697 4.236 -5.413 1.00 0.00 H new ATOM 0 HB ILE B 122 6.960 7.243 -5.627 1.00 0.00 H new ATOM 0 HG12 ILE B 122 9.238 6.237 -5.756 1.00 0.00 H new ATOM 0 HG13 ILE B 122 8.975 7.222 -4.331 1.00 0.00 H new ATOM 0 HG21 ILE B 122 6.680 7.105 -3.181 1.00 0.00 H new ATOM 0 HG22 ILE B 122 5.328 6.333 -4.043 1.00 0.00 H new ATOM 0 HG23 ILE B 122 6.594 5.331 -3.296 1.00 0.00 H new ATOM 0 HD11 ILE B 122 10.193 5.176 -3.768 1.00 0.00 H new ATOM 0 HD12 ILE B 122 8.598 5.190 -2.978 1.00 0.00 H new ATOM 0 HD13 ILE B 122 8.866 4.189 -4.425 1.00 0.00 H new ATOM 3912 N GLU B 123 4.365 5.141 -6.023 1.00 0.00 N ATOM 3913 CA GLU B 123 3.041 5.395 -6.578 1.00 0.00 C ATOM 3914 C GLU B 123 2.069 5.870 -5.505 1.00 0.00 C ATOM 3915 O GLU B 123 2.083 5.378 -4.380 1.00 0.00 O ATOM 3916 CB GLU B 123 2.497 4.134 -7.253 1.00 0.00 C ATOM 3917 CG GLU B 123 3.074 3.886 -8.638 1.00 0.00 C ATOM 3918 CD GLU B 123 2.573 2.595 -9.255 1.00 0.00 C ATOM 3919 OE1 GLU B 123 1.521 2.092 -8.807 1.00 0.00 O ATOM 3920 OE2 GLU B 123 3.231 2.087 -10.186 1.00 0.00 O ATOM 0 H GLU B 123 4.363 4.717 -5.095 1.00 0.00 H new ATOM 0 HA GLU B 123 3.139 6.187 -7.321 1.00 0.00 H new ATOM 0 HB2 GLU B 123 2.711 3.273 -6.620 1.00 0.00 H new ATOM 0 HB3 GLU B 123 1.412 4.212 -7.329 1.00 0.00 H new ATOM 0 HG2 GLU B 123 2.816 4.720 -9.290 1.00 0.00 H new ATOM 0 HG3 GLU B 123 4.162 3.856 -8.575 1.00 0.00 H new ATOM 3927 N TYR B 124 1.224 6.830 -5.865 1.00 0.00 N ATOM 3928 CA TYR B 124 0.241 7.372 -4.933 1.00 0.00 C ATOM 3929 C TYR B 124 -1.141 6.784 -5.197 1.00 0.00 C ATOM 3930 O TYR B 124 -1.871 7.256 -6.068 1.00 0.00 O ATOM 3931 CB TYR B 124 0.188 8.897 -5.047 1.00 0.00 C ATOM 3932 CG TYR B 124 1.510 9.573 -4.761 1.00 0.00 C ATOM 3933 CD1 TYR B 124 2.543 9.547 -5.691 1.00 0.00 C ATOM 3934 CD2 TYR B 124 1.725 10.240 -3.561 1.00 0.00 C ATOM 3935 CE1 TYR B 124 3.752 10.164 -5.433 1.00 0.00 C ATOM 3936 CE2 TYR B 124 2.931 10.860 -3.296 1.00 0.00 C ATOM 3937 CZ TYR B 124 3.940 10.820 -4.234 1.00 0.00 C ATOM 3938 OH TYR B 124 5.141 11.437 -3.973 1.00 0.00 O ATOM 0 H TYR B 124 1.200 7.249 -6.795 1.00 0.00 H new ATOM 0 HA TYR B 124 0.546 7.099 -3.923 1.00 0.00 H new ATOM 0 HB2 TYR B 124 -0.138 9.167 -6.051 1.00 0.00 H new ATOM 0 HB3 TYR B 124 -0.563 9.279 -4.355 1.00 0.00 H new ATOM 0 HD1 TYR B 124 2.398 9.036 -6.631 1.00 0.00 H new ATOM 0 HD2 TYR B 124 0.937 10.274 -2.824 1.00 0.00 H new ATOM 0 HE1 TYR B 124 4.545 10.133 -6.165 1.00 0.00 H new ATOM 0 HE2 TYR B 124 3.082 11.374 -2.358 1.00 0.00 H new ATOM 0 HH TYR B 124 5.760 11.275 -4.715 1.00 0.00 H new ATOM 3948 N ASN B 125 -1.494 5.751 -4.438 1.00 0.00 N ATOM 3949 CA ASN B 125 -2.790 5.100 -4.591 1.00 0.00 C ATOM 3950 C ASN B 125 -3.900 5.947 -3.974 1.00 0.00 C ATOM 3951 O ASN B 125 -4.159 5.869 -2.775 1.00 0.00 O ATOM 3952 CB ASN B 125 -2.771 3.715 -3.943 1.00 0.00 C ATOM 3953 CG ASN B 125 -3.057 2.606 -4.938 1.00 0.00 C ATOM 3954 OD1 ASN B 125 -2.681 2.694 -6.106 1.00 0.00 O ATOM 3955 ND2 ASN B 125 -3.726 1.555 -4.478 1.00 0.00 N ATOM 0 H ASN B 125 -0.902 5.348 -3.712 1.00 0.00 H new ATOM 0 HA ASN B 125 -2.989 4.991 -5.657 1.00 0.00 H new ATOM 0 HB2 ASN B 125 -1.797 3.545 -3.484 1.00 0.00 H new ATOM 0 HB3 ASN B 125 -3.511 3.681 -3.143 1.00 0.00 H new ATOM 0 HD21 ASN B 125 -3.947 0.779 -5.101 1.00 0.00 H new ATOM 0 HD22 ASN B 125 -4.018 1.524 -3.501 1.00 0.00 H new ATOM 3962 N LEU B 126 -4.550 6.756 -4.804 1.00 0.00 N ATOM 3963 CA LEU B 126 -5.631 7.617 -4.341 1.00 0.00 C ATOM 3964 C LEU B 126 -6.975 6.905 -4.445 1.00 0.00 C ATOM 3965 O LEU B 126 -7.998 7.598 -4.628 1.00 0.00 O ATOM 3966 CB LEU B 126 -5.662 8.914 -5.153 1.00 0.00 C ATOM 3967 CG LEU B 126 -4.493 9.867 -4.898 1.00 0.00 C ATOM 3968 CD1 LEU B 126 -4.358 10.863 -6.040 1.00 0.00 C ATOM 3969 CD2 LEU B 126 -4.678 10.593 -3.573 1.00 0.00 C ATOM 3970 OXT LEU B 126 -6.994 5.661 -4.343 1.00 0.00 O ATOM 0 H LEU B 126 -4.347 6.833 -5.801 1.00 0.00 H new ATOM 0 HA LEU B 126 -5.448 7.857 -3.294 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -5.679 8.661 -6.213 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -6.592 9.439 -4.935 1.00 0.00 H new ATOM 0 HG LEU B 126 -3.575 9.281 -4.844 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -3.521 11.533 -5.842 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -4.180 10.326 -6.972 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -5.276 11.444 -6.126 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -3.838 11.267 -3.407 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -5.604 11.167 -3.599 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -4.725 9.865 -2.763 1.00 0.00 H new TER 3982 LEU B 126